Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26314 | 2khv RC | 16255 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 -15.084 2.934 5.955
2 H2 MET 1 H2 MET 1 -16.127 2.129 4.889
3 H3 MET 1 H3 MET 1 -16.160 3.823 4.989
4 HA MET 1 HA MET 1 -15.017 2.999 3.000
5 HB2 MET 1 2HB MET 1 -14.440 5.196 4.001
6 HB3 MET 1 1HB MET 1 -13.195 4.407 4.962
7 HG2 MET 1 2HG MET 1 -12.128 5.401 3.088
8 HG3 MET 1 1HG MET 1 -12.131 3.662 2.835
9 HE1 MET 1 2HE MET 1 -15.108 6.495 0.734
10 HE2 MET 1 3HE MET 1 -13.915 7.044 1.910
11 HE3 MET 1 1HE MET 1 -15.252 6.016 2.425
12 H THR 2 HN THR 2 -13.944 1.333 2.202
13 HA THR 2 HA THR 2 -12.305 -0.284 4.007
14 HB THR 2 HB THR 2 -12.323 -1.969 2.182
15 HG1 THR 2 1HG THR 2 -14.285 -0.382 0.888
16 HG21 THR 2 3HG2 THR 2 -15.048 -0.946 2.985
17 HG22 THR 2 1HG2 THR 2 -14.043 -2.067 3.906
18 HG23 THR 2 2HG2 THR 2 -14.707 -2.552 2.345
19 H PHE 3 HN PHE 3 -10.298 -1.270 2.919
20 HA PHE 3 HA PHE 3 -8.558 0.864 2.249
21 HB2 PHE 3 2HB PHE 3 -7.820 -1.204 3.399
22 HB3 PHE 3 1HB PHE 3 -8.105 -2.111 1.917
23 HD1 PHE 3 1HD PHE 3 -6.111 0.695 3.314
24 HD2 PHE 3 2HD PHE 3 -6.420 -2.308 0.314
25 HE1 PHE 3 1HE PHE 3 -3.819 1.203 2.572
26 HE2 PHE 3 2HE PHE 3 -4.128 -1.809 -0.427
27 HZ PHE 3 HZ PHE 3 -2.825 -0.051 0.701
28 H SER 4 HN SER 4 -10.251 -1.564 0.372
29 HA SER 4 HA SER 4 -9.004 -1.098 -2.110
30 HB2 SER 4 2HB SER 4 -10.489 -3.062 -1.490
31 HB3 SER 4 1HB SER 4 -11.869 -1.983 -1.688
32 HG SER 4 HG SER 4 -10.448 -3.296 -3.561
33 H GLU 5 HN GLU 5 -11.899 0.313 -0.608
34 HA GLU 5 HA GLU 5 -12.640 1.980 -2.755
35 HB2 GLU 5 2HB GLU 5 -13.095 2.198 0.216
36 HB3 GLU 5 1HB GLU 5 -13.813 3.288 -0.950
37 HG2 GLU 5 2HG GLU 5 -15.068 1.512 -1.934
38 HG3 GLU 5 1HG GLU 5 -14.235 0.321 -0.938
39 H CYS 6 HN CYS 6 -10.699 2.592 0.148
40 HA CYS 6 HA CYS 6 -10.340 5.352 -0.325
41 HB2 CYS 6 2HB CYS 6 -10.024 4.023 1.838
42 HB3 CYS 6 1HB CYS 6 -8.435 3.625 1.227
43 HG CYS 6 HG CYS 6 -8.087 6.601 0.841
44 H ALA 7 HN ALA 7 -8.366 2.527 -1.058
45 HA ALA 7 HA ALA 7 -6.144 3.805 -2.161
46 HB1 ALA 7 1HB ALA 7 -5.740 1.739 -3.391
47 HB2 ALA 7 2HB ALA 7 -7.384 1.202 -3.045
48 HB3 ALA 7 3HB ALA 7 -6.226 1.398 -1.729
49 H ALA 8 HN ALA 8 -9.184 2.821 -3.697
50 HA ALA 8 HA ALA 8 -8.554 3.697 -6.299
51 HB1 ALA 8 1HB ALA 8 -10.388 2.148 -5.801
52 HB2 ALA 8 2HB ALA 8 -10.943 3.536 -6.739
53 HB3 ALA 8 3HB ALA 8 -11.270 3.453 -5.008
54 H LEU 9 HN LEU 9 -9.868 5.362 -3.495
55 HA LEU 9 HA LEU 9 -10.625 7.738 -4.850
56 HB2 LEU 9 2HB LEU 9 -9.837 7.347 -1.962
57 HB3 LEU 9 1HB LEU 9 -10.594 8.785 -2.615
58 HG LEU 9 HG LEU 9 -11.846 6.040 -2.505
59 HD11 LEU 9 1HD1 LEU 9 -12.404 8.548 -0.928
60 HD12 LEU 9 2HD1 LEU 9 -11.657 7.075 -0.313
61 HD13 LEU 9 3HD1 LEU 9 -13.336 7.054 -0.850
62 HD21 LEU 9 3HD2 LEU 9 -13.891 7.204 -3.222
63 HD22 LEU 9 1HD2 LEU 9 -12.620 7.270 -4.445
64 HD23 LEU 9 2HD2 LEU 9 -12.956 8.683 -3.446
65 H TYR 10 HN TYR 10 -7.655 6.742 -3.180
66 HA TYR 10 HA TYR 10 -6.162 9.075 -3.509
67 HB2 TYR 10 2HB TYR 10 -5.264 7.285 -2.181
68 HB3 TYR 10 1HB TYR 10 -5.325 6.167 -3.535
69 HD1 TYR 10 2HD TYR 10 -3.546 9.115 -2.172
70 HD2 TYR 10 1HD TYR 10 -3.553 6.059 -5.129
71 HE1 TYR 10 2HE TYR 10 -1.236 9.703 -2.781
72 HE2 TYR 10 1HE TYR 10 -1.246 6.641 -5.745
73 HH TYR 10 HH TYR 10 0.692 8.797 -3.861
74 H ILE 11 HN ILE 11 -6.571 6.307 -5.628
75 HA ILE 11 HA ILE 11 -4.960 7.129 -7.755
76 HB ILE 11 HB ILE 11 -7.427 5.389 -7.739
77 HG12 ILE 11 2HG1 ILE 11 -4.498 4.627 -7.790
78 HG13 ILE 11 1HG1 ILE 11 -5.470 4.704 -6.322
79 HG21 ILE 11 1HG2 ILE 11 -5.341 5.695 -9.894
80 HG22 ILE 11 2HG2 ILE 11 -7.020 6.223 -9.990
81 HG23 ILE 11 3HG2 ILE 11 -6.639 4.504 -9.880
82 HD11 ILE 11 3HD1 ILE 11 -5.229 2.428 -7.177
83 HD12 ILE 11 1HD1 ILE 11 -6.018 2.915 -8.677
84 HD13 ILE 11 2HD1 ILE 11 -6.910 2.955 -7.156
85 H LYS 12 HN LYS 12 -8.466 7.586 -7.256
86 HA LYS 12 HA LYS 12 -8.965 9.009 -9.627
87 HB2 LYS 12 2HB LYS 12 -10.353 8.951 -6.958
88 HB3 LYS 12 1HB LYS 12 -10.929 9.965 -8.277
89 HG2 LYS 12 2HG LYS 12 -11.238 8.016 -9.682
90 HG3 LYS 12 1HG LYS 12 -10.581 6.976 -8.415
91 HD2 LYS 12 2HD LYS 12 -12.426 7.414 -6.984
92 HD3 LYS 12 1HD LYS 12 -13.006 8.713 -8.029
93 HE2 LYS 12 2HE LYS 12 -12.837 5.816 -8.841
94 HE3 LYS 12 1HE LYS 12 -14.298 6.598 -8.236
95 HZ1 LYS 12 3HZ LYS 12 -14.221 8.126 -10.094
96 HZ2 LYS 12 1HZ LYS 12 -14.249 6.528 -10.659
97 HZ3 LYS 12 2HZ LYS 12 -12.801 7.408 -10.673
98 H ALA 13 HN ALA 13 -7.955 10.149 -6.433
99 HA ALA 13 HA ALA 13 -8.170 12.916 -7.057
100 HB1 ALA 13 1HB ALA 13 -8.210 12.071 -4.767
101 HB2 ALA 13 2HB ALA 13 -6.944 13.279 -4.990
102 HB3 ALA 13 3HB ALA 13 -6.527 11.565 -4.923
103 H HIS 14 HN HIS 14 -6.065 10.643 -8.242
104 HA HIS 14 HA HIS 14 -4.088 12.727 -8.879
105 HB2 HIS 14 2HB HIS 14 -3.554 9.854 -8.106
106 HB3 HIS 14 1HB HIS 14 -2.357 10.871 -8.904
107 HD1 HIS 14 1HD HIS 14 -4.137 10.411 -5.642
108 HD2 HIS 14 2HD HIS 14 -1.174 12.806 -7.300
109 HE1 HIS 14 1HE HIS 14 -3.096 11.642 -3.706
110 HE2 HIS 14 2HE HIS 14 -1.434 13.218 -4.760
111 H ARG 15 HN ARG 15 -6.491 11.119 -10.151
112 HA ARG 15 HA ARG 15 -5.511 9.697 -12.348
113 HB2 ARG 15 2HB ARG 15 -8.081 11.131 -11.775
114 HB3 ARG 15 1HB ARG 15 -7.794 10.447 -13.366
115 HG2 ARG 15 2HG ARG 15 -7.489 8.818 -10.882
116 HG3 ARG 15 1HG ARG 15 -9.050 9.036 -11.668
117 HD2 ARG 15 2HD ARG 15 -6.592 8.005 -13.071
118 HD3 ARG 15 1HD ARG 15 -7.806 6.962 -12.331
119 HE ARG 15 HE ARG 15 -9.329 8.423 -13.947
120 HH11 ARG 15 1HH1 ARG 15 -6.224 6.961 -14.593
121 HH12 ARG 15 2HH1 ARG 15 -6.590 6.597 -16.252
122 HH21 ARG 15 1HH2 ARG 15 -9.830 7.945 -16.124
123 HH22 ARG 15 2HH2 ARG 15 -8.638 7.157 -17.118
124 H SER 16 HN SER 16 -6.195 13.142 -11.955
125 HA SER 16 HA SER 16 -5.872 13.969 -14.588
126 HB2 SER 16 2HB SER 16 -5.005 15.567 -12.178
127 HB3 SER 16 1HB SER 16 -5.698 16.151 -13.688
128 HG SER 16 HG SER 16 -7.597 14.782 -13.012
129 H SER 17 HN SER 17 -3.515 13.274 -12.095
130 HA SER 17 HA SER 17 -1.294 14.345 -13.574
131 HB2 SER 17 2HB SER 17 -1.249 12.567 -11.130
132 HB3 SER 17 1HB SER 17 0.002 13.674 -11.678
133 HG SER 17 HG SER 17 -1.471 15.409 -11.269
134 H TRP 18 HN TRP 18 -3.056 11.463 -13.558
135 HA TRP 18 HA TRP 18 -0.779 9.899 -14.563
136 HB2 TRP 18 2HB TRP 18 -3.297 9.027 -13.155
137 HB3 TRP 18 1HB TRP 18 -2.215 7.904 -13.966
138 HD1 TRP 18 1HD TRP 18 0.323 9.906 -12.696
139 HE1 TRP 18 1HE TRP 18 1.066 9.257 -10.314
140 HE3 TRP 18 3HE TRP 18 -3.739 7.148 -11.324
141 HZ2 TRP 18 2HZ TRP 18 0.055 7.752 -8.143
142 HZ3 TRP 18 3HZ TRP 18 -3.775 6.123 -9.089
143 HH2 TRP 18 2HH TRP 18 -1.920 6.426 -7.529
144 H LYS 19 HN LYS 19 -2.457 11.688 -16.231
145 HA LYS 19 HA LYS 19 -2.965 11.607 -18.402
146 HB2 LYS 19 2HB LYS 19 -2.386 8.682 -18.151
147 HB3 LYS 19 1HB LYS 19 -2.678 9.531 -19.664
148 HG2 LYS 19 2HG LYS 19 -0.520 10.387 -17.771
149 HG3 LYS 19 1HG LYS 19 -0.257 9.128 -18.978
150 HD2 LYS 19 2HD LYS 19 -0.894 10.708 -20.747
151 HD3 LYS 19 1HD LYS 19 -1.126 11.964 -19.528
152 HE2 LYS 19 2HE LYS 19 1.185 11.950 -18.962
153 HE3 LYS 19 1HE LYS 19 1.476 10.502 -19.926
154 HZ1 LYS 19 3HZ LYS 19 2.232 12.500 -21.056
155 HZ2 LYS 19 1HZ LYS 19 0.666 13.151 -21.002
156 HZ3 LYS 19 2HZ LYS 19 0.973 11.758 -21.915
157 H ASN 20 HN ASN 20 -5.909 10.502 -19.375
158 HA ASN 20 HA ASN 20 -5.830 7.919 -18.583
159 HB2 ASN 20 2HB ASN 20 -6.104 9.169 -21.275
160 HB3 ASN 20 1HB ASN 20 -6.215 7.428 -21.042
161 HD21 ASN 20 1HD2 ASN 20 -8.016 6.565 -20.105
162 HD22 ASN 20 2HD2 ASN 20 -9.427 7.492 -19.711
163 H THR 21 HN THR 21 -4.000 7.155 -17.872
164 HA THR 21 HA THR 21 -2.813 5.535 -19.995
165 HB THR 21 HB THR 21 -0.676 5.343 -18.584
166 HG1 THR 21 1HG THR 21 -1.901 7.571 -17.426
167 HG21 THR 21 3HG2 THR 21 -1.186 7.863 -20.156
168 HG22 THR 21 1HG2 THR 21 -0.683 6.303 -20.809
169 HG23 THR 21 2HG2 THR 21 0.401 7.209 -19.753
170 H LYS 22 HN LYS 22 -1.748 3.518 -18.938
171 HA LYS 22 HA LYS 22 -3.817 2.463 -17.200
172 HB2 LYS 22 2HB LYS 22 -1.536 1.134 -18.651
173 HB3 LYS 22 1HB LYS 22 -2.640 0.279 -17.587
174 HG2 LYS 22 2HG LYS 22 -4.436 1.447 -19.169
175 HG3 LYS 22 1HG LYS 22 -3.082 1.374 -20.299
176 HD2 LYS 22 2HD LYS 22 -4.436 -0.618 -20.540
177 HD3 LYS 22 1HD LYS 22 -2.881 -1.055 -19.827
178 HE2 LYS 22 2HE LYS 22 -3.886 -1.091 -17.612
179 HE3 LYS 22 1HE LYS 22 -5.431 -0.587 -18.289
180 HZ1 LYS 22 3HZ LYS 22 -5.605 -2.651 -19.463
181 HZ2 LYS 22 1HZ LYS 22 -5.294 -2.983 -17.832
182 HZ3 LYS 22 2HZ LYS 22 -4.053 -3.127 -18.974
183 H HIS 23 HN HIS 23 -1.256 4.178 -16.454
184 HA HIS 23 HA HIS 23 0.092 2.666 -14.493
185 HB2 HIS 23 2HB HIS 23 -0.345 5.634 -14.798
186 HB3 HIS 23 1HB HIS 23 0.539 4.965 -13.432
187 HD1 HIS 23 1HD HIS 23 2.922 4.138 -13.847
188 HD2 HIS 23 2HD HIS 23 0.975 5.408 -17.303
189 HE1 HIS 23 1HE HIS 23 4.695 4.255 -15.622
190 HE2 HIS 23 2HE HIS 23 3.520 5.087 -17.690
191 H ALA 24 HN ALA 24 -2.797 4.700 -14.334
192 HA ALA 24 HA ALA 24 -3.346 4.390 -11.591
193 HB1 ALA 24 1HB ALA 24 -5.296 4.765 -13.870
194 HB2 ALA 24 2HB ALA 24 -4.457 6.055 -13.009
195 HB3 ALA 24 3HB ALA 24 -5.629 5.046 -12.162
196 H ASP 25 HN ASP 25 -4.121 2.428 -14.410
197 HA ASP 25 HA ASP 25 -5.796 0.545 -13.140
198 HB2 ASP 25 2HB ASP 25 -5.727 0.678 -15.556
199 HB3 ASP 25 1HB ASP 25 -4.017 0.281 -15.570
200 H GLN 26 HN GLN 26 -2.328 0.578 -13.800
201 HA GLN 26 HA GLN 26 -1.678 -1.891 -12.721
202 HB2 GLN 26 2HB GLN 26 -0.122 0.670 -12.971
203 HB3 GLN 26 1HB GLN 26 0.592 -0.812 -12.361
204 HG2 GLN 26 2HG GLN 26 -0.679 -0.477 -15.065
205 HG3 GLN 26 1HG GLN 26 1.051 -0.473 -14.735
206 HE21 GLN 26 1HE2 GLN 26 -1.825 -2.409 -14.967
207 HE22 GLN 26 2HE2 GLN 26 -1.024 -3.946 -14.956
208 H TRP 27 HN TRP 27 -1.895 1.276 -11.102
209 HA TRP 27 HA TRP 27 -1.121 0.407 -8.546
210 HB2 TRP 27 2HB TRP 27 -2.871 2.652 -9.509
211 HB3 TRP 27 1HB TRP 27 -2.703 2.332 -7.788
212 HD1 TRP 27 1HD TRP 27 -0.354 3.054 -10.803
213 HE1 TRP 27 1HE TRP 27 1.613 4.479 -9.954
214 HE3 TRP 27 3HE TRP 27 -1.546 3.184 -5.835
215 HZ2 TRP 27 2HZ TRP 27 2.542 5.512 -7.488
216 HZ3 TRP 27 3HZ TRP 27 -0.069 4.408 -4.300
217 HH2 TRP 27 2HH TRP 27 1.933 5.548 -5.109
218 H THR 28 HN THR 28 -4.354 0.677 -9.982
219 HA THR 28 HA THR 28 -5.815 -0.280 -7.791
220 HB THR 28 HB THR 28 -6.578 -0.654 -10.692
221 HG1 THR 28 1HG THR 28 -6.051 1.513 -10.483
222 HG21 THR 28 3HG2 THR 28 -8.870 -0.354 -9.828
223 HG22 THR 28 1HG2 THR 28 -8.224 -0.247 -8.189
224 HG23 THR 28 2HG2 THR 28 -8.061 -1.745 -9.106
225 H ASN 29 HN ASN 29 -4.526 -1.959 -10.634
226 HA ASN 29 HA ASN 29 -5.751 -4.445 -10.147
227 HB2 ASN 29 2HB ASN 29 -4.647 -3.504 -12.294
228 HB3 ASN 29 1HB ASN 29 -3.148 -4.138 -11.626
229 HD21 ASN 29 1HD2 ASN 29 -4.564 -4.887 -14.036
230 HD22 ASN 29 2HD2 ASN 29 -4.919 -6.577 -13.895
231 H THR 30 HN THR 30 -2.490 -3.251 -9.407
232 HA THR 30 HA THR 30 -1.478 -5.649 -8.357
233 HB THR 30 HB THR 30 -0.680 -2.865 -7.499
234 HG1 THR 30 1HG THR 30 -0.542 -3.019 -9.758
235 HG21 THR 30 3HG2 THR 30 0.831 -5.475 -7.536
236 HG22 THR 30 1HG2 THR 30 0.263 -4.619 -6.104
237 HG23 THR 30 2HG2 THR 30 1.518 -3.907 -7.117
238 H ILE 31 HN ILE 31 -3.021 -2.880 -6.738
239 HA ILE 31 HA ILE 31 -2.772 -3.931 -4.129
240 HB ILE 31 HB ILE 31 -4.708 -1.883 -5.212
241 HG12 ILE 31 2HG1 ILE 31 -2.134 -1.565 -3.649
242 HG13 ILE 31 1HG1 ILE 31 -2.311 -1.282 -5.377
243 HG21 ILE 31 1HG2 ILE 31 -4.057 -2.557 -2.343
244 HG22 ILE 31 2HG2 ILE 31 -5.579 -2.896 -3.167
245 HG23 ILE 31 3HG2 ILE 31 -5.081 -1.227 -2.888
246 HD11 ILE 31 3HD1 ILE 31 -3.873 0.534 -4.917
247 HD12 ILE 31 1HD1 ILE 31 -2.312 0.798 -4.136
248 HD13 ILE 31 2HD1 ILE 31 -3.692 0.250 -3.186
249 H LYS 32 HN LYS 32 -5.417 -4.009 -6.492
250 HA LYS 32 HA LYS 32 -7.328 -5.291 -4.902
251 HB2 LYS 32 2HB LYS 32 -7.697 -4.238 -7.164
252 HB3 LYS 32 1HB LYS 32 -6.967 -5.668 -7.879
253 HG2 LYS 32 2HG LYS 32 -8.739 -7.032 -6.749
254 HG3 LYS 32 1HG LYS 32 -9.515 -5.515 -6.289
255 HD2 LYS 32 2HD LYS 32 -10.637 -6.033 -8.232
256 HD3 LYS 32 1HD LYS 32 -9.355 -4.989 -8.844
257 HE2 LYS 32 2HE LYS 32 -9.217 -8.002 -8.797
258 HE3 LYS 32 1HE LYS 32 -9.740 -7.060 -10.189
259 HZ1 LYS 32 3HZ LYS 32 -7.387 -7.749 -10.276
260 HZ2 LYS 32 1HZ LYS 32 -7.076 -6.804 -8.909
261 HZ3 LYS 32 2HZ LYS 32 -7.584 -6.064 -10.344
262 H THR 33 HN THR 33 -4.623 -6.550 -6.717
263 HA THR 33 HA THR 33 -5.520 -9.286 -6.520
264 HB THR 33 HB THR 33 -2.866 -8.193 -7.485
265 HG1 THR 33 1HG THR 33 -4.186 -7.475 -9.014
266 HG21 THR 33 3HG2 THR 33 -2.741 -10.566 -6.916
267 HG22 THR 33 1HG2 THR 33 -2.688 -10.351 -8.665
268 HG23 THR 33 2HG2 THR 33 -4.175 -10.893 -7.888
269 H TYR 34 HN TYR 34 -2.766 -7.421 -5.195
270 HA TYR 34 HA TYR 34 -1.893 -9.682 -3.644
271 HB2 TYR 34 2HB TYR 34 -0.918 -6.840 -3.871
272 HB3 TYR 34 1HB TYR 34 -0.212 -7.990 -2.740
273 HD1 TYR 34 2HD TYR 34 -0.865 -7.411 -6.359
274 HD2 TYR 34 1HD TYR 34 1.407 -9.527 -3.446
275 HE1 TYR 34 2HE TYR 34 0.606 -8.266 -8.134
276 HE2 TYR 34 1HE TYR 34 2.882 -10.390 -5.213
277 HH TYR 34 HH TYR 34 2.808 -9.175 -8.432
278 H CYS 35 HN CYS 35 -3.320 -6.514 -2.867
279 HA CYS 35 HA CYS 35 -3.375 -7.265 -0.043
280 HB2 CYS 35 2HB CYS 35 -4.063 -4.622 -1.346
281 HB3 CYS 35 1HB CYS 35 -3.882 -4.920 0.380
282 HG CYS 35 HG CYS 35 -1.092 -5.837 -0.271
283 H GLY 36 HN GLY 36 -5.396 -7.224 -2.740
284 HA2 GLY 36 2HA GLY 36 -7.852 -6.345 -1.814
285 HA3 GLY 36 1HA GLY 36 -7.635 -7.545 -3.074
286 HA PRO 37 HA PRO 37 -9.303 -10.783 -0.672
287 HB2 PRO 37 2HB PRO 37 -6.818 -12.375 -0.566
288 HB3 PRO 37 1HB PRO 37 -8.376 -12.763 -1.304
289 HG2 PRO 37 2HG PRO 37 -6.242 -12.156 -2.800
290 HG3 PRO 37 1HG PRO 37 -7.873 -11.641 -3.265
291 HD2 PRO 37 2HD PRO 37 -5.681 -10.057 -1.980
292 HD3 PRO 37 1HD PRO 37 -6.806 -9.585 -3.272
293 H VAL 38 HN VAL 38 -6.634 -9.158 0.659
294 HA VAL 38 HA VAL 38 -6.944 -10.572 3.220
295 HB VAL 38 HB VAL 38 -4.685 -8.733 2.428
296 HG11 VAL 38 1HG1 VAL 38 -5.020 -10.623 4.757
297 HG12 VAL 38 2HG1 VAL 38 -5.027 -8.862 4.827
298 HG13 VAL 38 3HG1 VAL 38 -3.552 -9.720 4.380
299 HG21 VAL 38 3HG2 VAL 38 -3.339 -10.787 2.184
300 HG22 VAL 38 1HG2 VAL 38 -4.646 -10.694 1.002
301 HG23 VAL 38 2HG2 VAL 38 -4.798 -11.750 2.405
302 H ILE 39 HN ILE 39 -6.026 -7.243 2.283
303 HA ILE 39 HA ILE 39 -7.598 -6.313 4.591
304 HB ILE 39 HB ILE 39 -6.183 -4.277 4.525
305 HG12 ILE 39 2HG1 ILE 39 -4.568 -5.827 2.486
306 HG13 ILE 39 1HG1 ILE 39 -5.557 -4.416 2.128
307 HG21 ILE 39 1HG2 ILE 39 -4.184 -5.330 5.460
308 HG22 ILE 39 2HG2 ILE 39 -4.688 -6.879 4.783
309 HG23 ILE 39 3HG2 ILE 39 -5.661 -6.106 6.034
310 HD11 ILE 39 3HD1 ILE 39 -3.113 -4.490 3.882
311 HD12 ILE 39 1HD1 ILE 39 -4.128 -3.073 3.613
312 HD13 ILE 39 2HD1 ILE 39 -3.239 -3.788 2.268
313 H GLY 40 HN GLY 40 -7.866 -6.568 1.355
314 HA2 GLY 40 2HA GLY 40 -8.567 -4.104 0.320
315 HA3 GLY 40 1HA GLY 40 -9.266 -5.629 -0.193
316 HA PRO 41 HA PRO 41 -13.114 -4.483 1.615
317 HB2 PRO 41 2HB PRO 41 -14.079 -6.675 2.821
318 HB3 PRO 41 1HB PRO 41 -13.825 -6.618 1.072
319 HG2 PRO 41 2HG PRO 41 -12.109 -7.843 3.196
320 HG3 PRO 41 1HG PRO 41 -12.555 -8.491 1.607
321 HD2 PRO 41 2HD PRO 41 -10.163 -7.267 2.135
322 HD3 PRO 41 1HD PRO 41 -10.917 -7.310 0.529
323 H LEU 42 HN LEU 42 -10.565 -4.870 3.652
324 HA LEU 42 HA LEU 42 -12.064 -4.512 6.116
325 HB2 LEU 42 2HB LEU 42 -9.091 -4.483 5.575
326 HB3 LEU 42 1HB LEU 42 -9.817 -4.326 7.163
327 HG LEU 42 HG LEU 42 -9.972 -6.755 5.368
328 HD11 LEU 42 1HD1 LEU 42 -8.530 -6.276 7.975
329 HD12 LEU 42 2HD1 LEU 42 -7.784 -6.466 6.389
330 HD13 LEU 42 3HD1 LEU 42 -8.637 -7.819 7.129
331 HD21 LEU 42 3HD2 LEU 42 -11.073 -6.329 8.144
332 HD22 LEU 42 1HD2 LEU 42 -11.104 -7.837 7.232
333 HD23 LEU 42 2HD2 LEU 42 -12.028 -6.446 6.666
334 H SER 43 HN SER 43 -11.765 -2.595 7.446
335 HA SER 43 HA SER 43 -12.128 -0.222 5.964
336 HB2 SER 43 2HB SER 43 -13.087 -0.543 8.210
337 HB3 SER 43 1HB SER 43 -11.466 -0.542 8.903
338 HG SER 43 HG SER 43 -12.998 1.568 7.914
339 H VAL 44 HN VAL 44 -10.769 1.403 5.417
340 HA VAL 44 HA VAL 44 -7.987 0.906 5.297
341 HB VAL 44 HB VAL 44 -9.191 2.320 3.657
342 HG11 VAL 44 1HG1 VAL 44 -9.737 4.640 4.203
343 HG12 VAL 44 2HG1 VAL 44 -9.308 4.342 5.888
344 HG13 VAL 44 3HG1 VAL 44 -10.680 3.501 5.166
345 HG21 VAL 44 3HG2 VAL 44 -6.778 2.494 3.798
346 HG22 VAL 44 1HG2 VAL 44 -6.913 3.697 5.080
347 HG23 VAL 44 2HG2 VAL 44 -7.476 4.076 3.453
348 H GLN 45 HN GLN 45 -10.018 2.232 7.706
349 HA GLN 45 HA GLN 45 -7.888 3.624 9.081
350 HB2 GLN 45 2HB GLN 45 -10.236 4.440 9.136
351 HB3 GLN 45 1HB GLN 45 -10.693 2.992 10.022
352 HG2 GLN 45 2HG GLN 45 -9.423 3.636 11.910
353 HG3 GLN 45 1HG GLN 45 -8.618 4.924 11.014
354 HE21 GLN 45 1HE2 GLN 45 -9.741 6.807 10.549
355 HE22 GLN 45 2HE2 GLN 45 -11.162 7.269 11.409
356 H ASP 46 HN ASP 46 -9.505 0.534 9.165
357 HA ASP 46 HA ASP 46 -8.229 -0.207 11.672
358 HB2 ASP 46 2HB ASP 46 -10.318 -1.474 9.933
359 HB3 ASP 46 1HB ASP 46 -9.464 -2.435 11.136
360 H VAL 47 HN VAL 47 -7.050 0.007 8.702
361 HA VAL 47 HA VAL 47 -5.772 -2.516 8.358
362 HB VAL 47 HB VAL 47 -4.938 0.221 7.358
363 HG11 VAL 47 1HG1 VAL 47 -3.529 -0.986 5.760
364 HG12 VAL 47 2HG1 VAL 47 -3.959 -2.512 6.534
365 HG13 VAL 47 3HG1 VAL 47 -3.030 -1.303 7.423
366 HG21 VAL 47 3HG2 VAL 47 -6.382 -2.041 5.977
367 HG22 VAL 47 1HG2 VAL 47 -5.872 -0.533 5.222
368 HG23 VAL 47 2HG2 VAL 47 -7.101 -0.512 6.486
369 H ASP 48 HN ASP 48 -4.195 -3.374 9.542
370 HA ASP 48 HA ASP 48 -2.669 -1.581 11.316
371 HB2 ASP 48 2HB ASP 48 -4.168 -3.000 12.586
372 HB3 ASP 48 1HB ASP 48 -3.543 -4.436 11.793
373 H THR 49 HN THR 49 -0.576 -2.447 11.998
374 HA THR 49 HA THR 49 1.115 -2.856 9.787
375 HB THR 49 HB THR 49 1.842 -3.503 12.646
376 HG1 THR 49 1HG THR 49 1.293 -1.500 13.073
377 HG21 THR 49 3HG2 THR 49 4.038 -2.644 11.975
378 HG22 THR 49 1HG2 THR 49 3.425 -2.329 10.353
379 HG23 THR 49 2HG2 THR 49 3.539 -3.986 10.946
380 H LYS 50 HN LYS 50 -0.255 -5.038 12.181
381 HA LYS 50 HA LYS 50 1.197 -7.369 11.632
382 HB2 LYS 50 2HB LYS 50 -0.442 -6.967 13.515
383 HB3 LYS 50 1HB LYS 50 -1.734 -7.216 12.353
384 HG2 LYS 50 2HG LYS 50 -0.395 -9.476 11.945
385 HG3 LYS 50 1HG LYS 50 0.094 -9.168 13.612
386 HD2 LYS 50 2HD LYS 50 -2.679 -9.552 12.519
387 HD3 LYS 50 1HD LYS 50 -1.853 -10.490 13.761
388 HE2 LYS 50 2HE LYS 50 -2.698 -7.608 14.045
389 HE3 LYS 50 1HE LYS 50 -3.604 -8.985 14.664
390 HZ1 LYS 50 3HZ LYS 50 -1.698 -9.541 16.064
391 HZ2 LYS 50 1HZ LYS 50 -2.285 -7.985 16.394
392 HZ3 LYS 50 2HZ LYS 50 -0.866 -8.177 15.495
393 H LEU 51 HN LEU 51 -1.758 -6.086 10.210
394 HA LEU 51 HA LEU 51 -2.367 -8.276 8.559
395 HB2 LEU 51 2HB LEU 51 -3.081 -5.358 8.238
396 HB3 LEU 51 1HB LEU 51 -3.853 -6.686 7.406
397 HG LEU 51 HG LEU 51 -3.932 -6.150 10.366
398 HD11 LEU 51 1HD1 LEU 51 -5.336 -4.660 9.029
399 HD12 LEU 51 2HD1 LEU 51 -6.303 -5.765 10.002
400 HD13 LEU 51 3HD1 LEU 51 -6.098 -6.059 8.275
401 HD21 LEU 51 3HD2 LEU 51 -5.474 -8.045 10.491
402 HD22 LEU 51 1HD2 LEU 51 -3.879 -8.549 9.933
403 HD23 LEU 51 2HD2 LEU 51 -5.203 -8.379 8.782
404 H ILE 52 HN ILE 52 -0.520 -5.316 8.007
405 HA ILE 52 HA ILE 52 -0.127 -5.718 5.233
406 HB ILE 52 HB ILE 52 1.554 -4.101 7.159
407 HG12 ILE 52 2HG1 ILE 52 -0.791 -3.266 5.434
408 HG13 ILE 52 1HG1 ILE 52 -0.836 -3.467 7.182
409 HG21 ILE 52 1HG2 ILE 52 2.197 -2.823 5.153
410 HG22 ILE 52 2HG2 ILE 52 1.299 -3.968 4.155
411 HG23 ILE 52 3HG2 ILE 52 2.710 -4.509 5.067
412 HD11 ILE 52 3HD1 ILE 52 0.729 -1.644 7.456
413 HD12 ILE 52 1HD1 ILE 52 -0.664 -1.123 6.507
414 HD13 ILE 52 2HD1 ILE 52 0.866 -1.476 5.706
415 H MET 53 HN MET 53 1.825 -6.495 8.097
416 HA MET 53 HA MET 53 4.067 -7.461 6.680
417 HB2 MET 53 2HB MET 53 3.092 -7.997 9.484
418 HB3 MET 53 1HB MET 53 4.599 -8.649 8.856
419 HG2 MET 53 2HG MET 53 5.350 -6.331 8.406
420 HG3 MET 53 1HG MET 53 3.883 -5.746 9.182
421 HE1 MET 53 3HE MET 53 3.538 -7.847 11.555
422 HE2 MET 53 1HE MET 53 3.328 -6.105 11.750
423 HE3 MET 53 2HE MET 53 4.365 -6.999 12.861
424 H LYS 54 HN LYS 54 1.092 -8.991 7.748
425 HA LYS 54 HA LYS 54 1.784 -11.662 7.251
426 HB2 LYS 54 2HB LYS 54 -0.881 -10.258 7.130
427 HB3 LYS 54 1HB LYS 54 -0.708 -11.992 6.897
428 HG2 LYS 54 2HG LYS 54 0.295 -12.159 9.149
429 HG3 LYS 54 1HG LYS 54 0.004 -10.432 9.375
430 HD2 LYS 54 2HD LYS 54 -1.774 -11.695 10.424
431 HD3 LYS 54 1HD LYS 54 -2.410 -10.831 9.022
432 HE2 LYS 54 2HE LYS 54 -2.257 -12.883 7.692
433 HE3 LYS 54 1HE LYS 54 -1.619 -13.744 9.093
434 HZ1 LYS 54 3HZ LYS 54 -3.703 -13.271 10.255
435 HZ2 LYS 54 1HZ LYS 54 -3.967 -14.169 8.839
436 HZ3 LYS 54 2HZ LYS 54 -4.314 -12.507 8.872
437 H VAL 55 HN VAL 55 0.656 -9.123 5.097
438 HA VAL 55 HA VAL 55 0.294 -10.883 2.854
439 HB VAL 55 HB VAL 55 0.560 -7.872 2.834
440 HG11 VAL 55 1HG1 VAL 55 -0.685 -9.765 0.846
441 HG12 VAL 55 2HG1 VAL 55 0.843 -8.909 0.644
442 HG13 VAL 55 3HG1 VAL 55 -0.669 -8.004 0.728
443 HG21 VAL 55 3HG2 VAL 55 -1.230 -8.559 4.340
444 HG22 VAL 55 1HG2 VAL 55 -1.925 -9.563 3.069
445 HG23 VAL 55 2HG2 VAL 55 -1.884 -7.811 2.883
446 H LEU 56 HN LEU 56 2.749 -8.501 3.819
447 HA LEU 56 HA LEU 56 4.182 -8.652 1.380
448 HB2 LEU 56 2HB LEU 56 5.000 -7.600 4.080
449 HB3 LEU 56 1HB LEU 56 5.956 -7.413 2.623
450 HG LEU 56 HG LEU 56 3.203 -6.269 3.102
451 HD11 LEU 56 1HD1 LEU 56 4.352 -4.114 3.018
452 HD12 LEU 56 2HD1 LEU 56 5.900 -4.944 2.873
453 HD13 LEU 56 3HD1 LEU 56 4.944 -5.116 4.342
454 HD21 LEU 56 3HD2 LEU 56 3.460 -6.876 0.769
455 HD22 LEU 56 1HD2 LEU 56 5.018 -6.048 0.701
456 HD23 LEU 56 2HD2 LEU 56 3.537 -5.123 0.954
457 H ASP 57 HN ASP 57 4.530 -10.393 4.432
458 HA ASP 57 HA ASP 57 7.196 -11.172 4.160
459 HB2 ASP 57 2HB ASP 57 5.655 -11.421 6.192
460 HB3 ASP 57 1HB ASP 57 5.148 -12.932 5.478
461 HA PRO 58 HA PRO 58 5.540 -15.266 1.854
462 HB2 PRO 58 2HB PRO 58 3.177 -13.939 0.639
463 HB3 PRO 58 1HB PRO 58 3.382 -15.611 1.163
464 HG2 PRO 58 2HG PRO 58 1.940 -13.819 2.566
465 HG3 PRO 58 1HG PRO 58 2.842 -15.133 3.339
466 HD2 PRO 58 2HD PRO 58 3.421 -12.233 3.282
467 HD3 PRO 58 1HD PRO 58 3.893 -13.470 4.453
468 H ILE 59 HN ILE 59 4.933 -11.953 0.758
469 HA ILE 59 HA ILE 59 5.445 -12.457 -1.984
470 HB ILE 59 HB ILE 59 5.586 -9.807 -0.537
471 HG12 ILE 59 2HG1 ILE 59 3.255 -11.108 -1.971
472 HG13 ILE 59 1HG1 ILE 59 3.414 -10.957 -0.222
473 HG21 ILE 59 1HG2 ILE 59 5.124 -8.841 -2.740
474 HG22 ILE 59 2HG2 ILE 59 5.180 -10.451 -3.458
475 HG23 ILE 59 3HG2 ILE 59 6.632 -9.754 -2.738
476 HD11 ILE 59 3HD1 ILE 59 3.370 -8.519 -0.441
477 HD12 ILE 59 1HD1 ILE 59 1.918 -9.270 -1.103
478 HD13 ILE 59 2HD1 ILE 59 3.181 -8.684 -2.187
479 H TRP 60 HN TRP 60 7.514 -11.507 0.715
480 HA TRP 60 HA TRP 60 9.748 -10.637 -0.714
481 HB2 TRP 60 2HB TRP 60 9.539 -12.054 1.941
482 HB3 TRP 60 1HB TRP 60 11.067 -11.469 1.297
483 HD1 TRP 60 1HD TRP 60 8.243 -10.400 3.408
484 HE1 TRP 60 1HE TRP 60 8.346 -7.866 3.850
485 HE3 TRP 60 3HE TRP 60 11.736 -9.096 -0.099
486 HZ2 TRP 60 2HZ TRP 60 9.723 -5.614 2.848
487 HZ3 TRP 60 3HZ TRP 60 12.391 -6.732 -0.290
488 HH2 TRP 60 2HH TRP 60 11.404 -5.029 1.154
489 H GLU 61 HN GLU 61 8.634 -13.888 -0.034
490 HA GLU 61 HA GLU 61 10.985 -15.257 -0.736
491 HB2 GLU 61 2HB GLU 61 8.081 -16.040 -0.605
492 HB3 GLU 61 1HB GLU 61 9.353 -17.176 -0.991
493 HG2 GLU 61 2HG GLU 61 9.235 -15.567 1.539
494 HG3 GLU 61 1HG GLU 61 8.643 -17.221 1.378
495 H GLN 62 HN GLN 62 8.096 -14.352 -2.580
496 HA GLN 62 HA GLN 62 9.153 -15.653 -4.958
497 HB2 GLN 62 2HB GLN 62 6.911 -14.859 -5.926
498 HB3 GLN 62 1HB GLN 62 6.885 -16.124 -4.716
499 HG2 GLN 62 2HG GLN 62 6.298 -14.488 -3.004
500 HG3 GLN 62 1HG GLN 62 6.331 -13.211 -4.219
501 HE21 GLN 62 1HE2 GLN 62 4.150 -14.185 -2.496
502 HE22 GLN 62 2HE2 GLN 62 2.861 -14.621 -3.568
503 H LYS 63 HN LYS 63 8.020 -12.417 -4.018
504 HA LYS 63 HA LYS 63 9.600 -11.296 -6.232
505 HB2 LYS 63 2HB LYS 63 6.763 -10.500 -5.539
506 HB3 LYS 63 1HB LYS 63 7.762 -9.770 -6.784
507 HG2 LYS 63 2HG LYS 63 6.930 -12.657 -6.810
508 HG3 LYS 63 1HG LYS 63 6.016 -11.375 -7.594
509 HD2 LYS 63 2HD LYS 63 8.223 -10.813 -8.786
510 HD3 LYS 63 1HD LYS 63 8.756 -12.405 -8.244
511 HE2 LYS 63 2HE LYS 63 6.377 -11.779 -9.991
512 HE3 LYS 63 1HE LYS 63 7.876 -12.558 -10.489
513 HZ1 LYS 63 3HZ LYS 63 6.171 -14.198 -10.203
514 HZ2 LYS 63 1HZ LYS 63 5.838 -13.666 -8.627
515 HZ3 LYS 63 2HZ LYS 63 7.323 -14.410 -8.979
516 HA PRO 64 HA PRO 64 10.405 -9.119 -2.195
517 HB2 PRO 64 2HB PRO 64 13.057 -8.671 -2.731
518 HB3 PRO 64 1HB PRO 64 12.448 -10.122 -1.928
519 HG2 PRO 64 2HG PRO 64 13.211 -9.720 -4.790
520 HG3 PRO 64 1HG PRO 64 13.521 -11.109 -3.732
521 HD2 PRO 64 2HD PRO 64 11.554 -11.114 -5.577
522 HD3 PRO 64 1HD PRO 64 11.400 -11.969 -4.030
523 H GLU 65 HN GLU 65 11.387 -8.369 -5.490
524 HA GLU 65 HA GLU 65 11.819 -5.626 -5.190
525 HB2 GLU 65 2HB GLU 65 10.830 -7.113 -7.617
526 HB3 GLU 65 1HB GLU 65 11.656 -5.575 -7.594
527 HG2 GLU 65 2HG GLU 65 13.672 -6.630 -6.759
528 HG3 GLU 65 1HG GLU 65 12.847 -8.188 -6.725
529 H THR 66 HN THR 66 8.958 -7.519 -6.033
530 HA THR 66 HA THR 66 7.257 -5.307 -6.502
531 HB THR 66 HB THR 66 6.423 -8.102 -5.712
532 HG1 THR 66 1HG THR 66 7.475 -7.045 -8.103
533 HG21 THR 66 3HG2 THR 66 4.593 -6.502 -5.719
534 HG22 THR 66 1HG2 THR 66 4.442 -7.593 -7.096
535 HG23 THR 66 2HG2 THR 66 5.047 -5.952 -7.333
536 H ALA 67 HN ALA 67 7.946 -7.307 -3.678
537 HA ALA 67 HA ALA 67 5.995 -6.269 -1.954
538 HB1 ALA 67 1HB ALA 67 8.753 -7.284 -1.262
539 HB2 ALA 67 2HB ALA 67 7.295 -8.263 -1.420
540 HB3 ALA 67 3HB ALA 67 7.417 -7.069 -0.129
541 H SER 68 HN SER 68 9.295 -5.197 -2.634
542 HA SER 68 HA SER 68 9.355 -3.061 -0.809
543 HB2 SER 68 2HB SER 68 10.828 -3.297 -3.445
544 HB3 SER 68 1HB SER 68 11.285 -2.282 -2.077
545 HG SER 68 HG SER 68 11.251 -5.123 -2.201
546 H ARG 69 HN ARG 69 8.460 -3.221 -4.232
547 HA ARG 69 HA ARG 69 7.961 -0.472 -4.575
548 HB2 ARG 69 2HB ARG 69 7.139 -2.940 -6.072
549 HB3 ARG 69 1HB ARG 69 6.657 -1.340 -6.582
550 HG2 ARG 69 2HG ARG 69 9.512 -2.033 -6.134
551 HG3 ARG 69 1HG ARG 69 8.710 -2.341 -7.665
552 HD2 ARG 69 2HD ARG 69 8.133 0.035 -7.833
553 HD3 ARG 69 1HD ARG 69 8.957 0.336 -6.303
554 HE ARG 69 HE ARG 69 10.954 0.331 -7.422
555 HH11 ARG 69 1HH1 ARG 69 8.559 -1.226 -9.455
556 HH12 ARG 69 2HH1 ARG 69 9.602 -1.307 -10.842
557 HH21 ARG 69 1HH2 ARG 69 12.307 0.244 -9.237
558 HH22 ARG 69 2HH2 ARG 69 11.734 -0.473 -10.712
559 H LEU 70 HN LEU 70 5.870 -3.191 -3.705
560 HA LEU 70 HA LEU 70 3.429 -1.757 -3.864
561 HB2 LEU 70 2HB LEU 70 3.561 -4.215 -3.931
562 HB3 LEU 70 1HB LEU 70 4.099 -4.230 -2.262
563 HG LEU 70 HG LEU 70 1.923 -3.258 -1.581
564 HD11 LEU 70 1HD1 LEU 70 0.080 -3.212 -3.183
565 HD12 LEU 70 2HD1 LEU 70 1.190 -3.665 -4.478
566 HD13 LEU 70 3HD1 LEU 70 1.373 -2.111 -3.664
567 HD21 LEU 70 3HD2 LEU 70 1.681 -5.787 -3.203
568 HD22 LEU 70 1HD2 LEU 70 0.632 -5.282 -1.878
569 HD23 LEU 70 2HD2 LEU 70 2.319 -5.686 -1.562
570 H ARG 71 HN ARG 71 5.740 -2.341 -1.270
571 HA ARG 71 HA ARG 71 4.225 -1.388 0.885
572 HB2 ARG 71 2HB ARG 71 6.552 -2.566 0.818
573 HB3 ARG 71 1HB ARG 71 7.192 -0.938 0.675
574 HG2 ARG 71 2HG ARG 71 5.381 -1.782 2.920
575 HG3 ARG 71 1HG ARG 71 7.136 -1.925 2.993
576 HD2 ARG 71 2HD ARG 71 5.616 0.639 2.531
577 HD3 ARG 71 1HD ARG 71 6.280 0.122 4.079
578 HE ARG 71 HE ARG 71 8.171 0.312 1.887
579 HH11 ARG 71 1HH1 ARG 71 6.723 1.861 4.670
580 HH12 ARG 71 2HH1 ARG 71 8.028 2.985 4.881
581 HH21 ARG 71 1HH2 ARG 71 9.884 1.813 2.151
582 HH22 ARG 71 2HH2 ARG 71 9.811 2.966 3.440
583 H GLY 72 HN GLY 72 6.297 0.280 -1.437
584 HA2 GLY 72 2HA GLY 72 6.134 2.854 -0.295
585 HA3 GLY 72 1HA GLY 72 6.504 2.505 -1.978
586 H ARG 73 HN ARG 73 4.085 1.193 -2.645
587 HA ARG 73 HA ARG 73 2.436 3.404 -3.254
588 HB2 ARG 73 2HB ARG 73 2.009 0.429 -3.453
589 HB3 ARG 73 1HB ARG 73 0.751 1.576 -3.896
590 HG2 ARG 73 2HG ARG 73 2.296 2.580 -5.541
591 HG3 ARG 73 1HG ARG 73 3.488 1.341 -5.135
592 HD2 ARG 73 2HD ARG 73 2.030 -0.396 -5.913
593 HD3 ARG 73 1HD ARG 73 0.707 0.746 -6.137
594 HE ARG 73 HE ARG 73 2.575 1.746 -7.776
595 HH11 ARG 73 1HH1 ARG 73 1.359 -1.501 -7.357
596 HH12 ARG 73 2HH1 ARG 73 1.607 -1.959 -9.012
597 HH21 ARG 73 1HH2 ARG 73 2.905 1.148 -9.983
598 HH22 ARG 73 2HH2 ARG 73 2.513 -0.468 -10.497
599 H ILE 74 HN ILE 74 2.160 0.823 -0.842
600 HA ILE 74 HA ILE 74 -0.357 1.528 0.180
601 HB ILE 74 HB ILE 74 1.949 0.268 1.679
602 HG12 ILE 74 2HG1 ILE 74 -0.342 -1.054 0.209
603 HG13 ILE 74 1HG1 ILE 74 1.302 -0.931 -0.408
604 HG21 ILE 74 1HG2 ILE 74 0.212 -0.661 3.138
605 HG22 ILE 74 2HG2 ILE 74 -1.015 0.232 2.242
606 HG23 ILE 74 3HG2 ILE 74 0.206 1.105 3.166
607 HD11 ILE 74 3HD1 ILE 74 2.100 -2.266 1.479
608 HD12 ILE 74 1HD1 ILE 74 0.891 -3.122 0.524
609 HD13 ILE 74 2HD1 ILE 74 0.444 -2.403 2.072
610 H GLU 75 HN GLU 75 2.899 2.610 1.043
611 HA GLU 75 HA GLU 75 2.271 4.183 3.276
612 HB2 GLU 75 2HB GLU 75 4.540 3.602 1.759
613 HB3 GLU 75 1HB GLU 75 4.358 5.343 1.617
614 HG2 GLU 75 2HG GLU 75 4.549 3.783 4.182
615 HG3 GLU 75 1HG GLU 75 5.829 4.747 3.450
616 H SER 76 HN SER 76 2.472 5.048 -0.164
617 HA SER 76 HA SER 76 1.901 7.773 0.126
618 HB2 SER 76 2HB SER 76 1.416 5.954 -2.223
619 HB3 SER 76 1HB SER 76 1.416 7.713 -2.290
620 HG SER 76 HG SER 76 3.487 7.581 -2.522
621 H VAL 77 HN VAL 77 -0.230 4.998 -0.372
622 HA VAL 77 HA VAL 77 -2.585 6.540 -0.790
623 HB VAL 77 HB VAL 77 -2.298 3.661 0.086
624 HG11 VAL 77 1HG1 VAL 77 -4.623 3.386 -0.620
625 HG12 VAL 77 2HG1 VAL 77 -4.729 5.112 -0.972
626 HG13 VAL 77 3HG1 VAL 77 -4.496 4.561 0.688
627 HG21 VAL 77 3HG2 VAL 77 -2.845 4.848 -2.632
628 HG22 VAL 77 1HG2 VAL 77 -2.764 3.132 -2.243
629 HG23 VAL 77 2HG2 VAL 77 -1.321 4.136 -2.105
630 H LEU 78 HN LEU 78 -1.267 4.854 2.054
631 HA LEU 78 HA LEU 78 -3.438 5.503 3.761
632 HB2 LEU 78 2HB LEU 78 -0.602 4.688 4.370
633 HB3 LEU 78 1HB LEU 78 -1.841 4.885 5.595
634 HG LEU 78 HG LEU 78 -1.918 2.900 3.324
635 HD11 LEU 78 1HD1 LEU 78 -1.554 2.463 6.277
636 HD12 LEU 78 2HD1 LEU 78 -0.270 2.378 5.074
637 HD13 LEU 78 3HD1 LEU 78 -1.600 1.219 5.027
638 HD21 LEU 78 3HD2 LEU 78 -3.897 2.010 4.455
639 HD22 LEU 78 1HD2 LEU 78 -4.150 3.673 3.926
640 HD23 LEU 78 2HD2 LEU 78 -3.821 3.327 5.625
641 H ASP 79 HN ASP 79 -0.399 7.117 3.017
642 HA ASP 79 HA ASP 79 -0.492 9.105 5.009
643 HB2 ASP 79 2HB ASP 79 1.423 8.552 3.380
644 HB3 ASP 79 1HB ASP 79 0.561 9.542 2.210
645 H TRP 80 HN TRP 80 -1.731 9.012 1.704
646 HA TRP 80 HA TRP 80 -2.950 11.538 1.635
647 HB2 TRP 80 2HB TRP 80 -2.533 10.179 -0.363
648 HB3 TRP 80 1HB TRP 80 -3.684 8.973 0.195
649 HD1 TRP 80 1HD TRP 80 -3.534 12.500 -1.309
650 HE1 TRP 80 1HE TRP 80 -5.840 13.059 -2.315
651 HE3 TRP 80 3HE TRP 80 -6.144 8.440 0.373
652 HZ2 TRP 80 2HZ TRP 80 -8.425 11.914 -2.377
653 HZ3 TRP 80 3HZ TRP 80 -8.527 8.251 -0.198
654 HH2 TRP 80 2HH TRP 80 -9.642 9.951 -1.544
655 H ALA 81 HN ALA 81 -4.198 8.351 2.563
656 HA ALA 81 HA ALA 81 -6.862 9.070 3.029
657 HB1 ALA 81 1HB ALA 81 -7.000 7.036 4.368
658 HB2 ALA 81 2HB ALA 81 -5.240 6.934 4.401
659 HB3 ALA 81 3HB ALA 81 -6.104 6.757 2.875
660 H THR 82 HN THR 82 -4.035 9.237 5.123
661 HA THR 82 HA THR 82 -5.404 9.932 7.496
662 HB THR 82 HB THR 82 -2.561 10.577 6.693
663 HG1 THR 82 1HG THR 82 -2.598 8.411 6.752
664 HG21 THR 82 3HG2 THR 82 -3.867 10.482 9.414
665 HG22 THR 82 1HG2 THR 82 -3.303 11.931 8.585
666 HG23 THR 82 2HG2 THR 82 -2.143 10.713 9.116
667 H VAL 83 HN VAL 83 -3.933 11.882 4.919
668 HA VAL 83 HA VAL 83 -4.442 14.411 6.085
669 HB VAL 83 HB VAL 83 -4.177 13.708 3.156
670 HG11 VAL 83 1HG1 VAL 83 -3.531 16.051 2.853
671 HG12 VAL 83 2HG1 VAL 83 -3.857 16.359 4.560
672 HG13 VAL 83 3HG1 VAL 83 -5.173 15.902 3.479
673 HG21 VAL 83 3HG2 VAL 83 -2.083 14.558 5.157
674 HG22 VAL 83 1HG2 VAL 83 -1.821 14.372 3.422
675 HG23 VAL 83 2HG2 VAL 83 -2.236 12.970 4.408
676 H ARG 84 HN ARG 84 -6.254 12.400 3.816
677 HA ARG 84 HA ARG 84 -8.366 14.244 3.384
678 HB2 ARG 84 2HB ARG 84 -8.080 11.279 2.958
679 HB3 ARG 84 1HB ARG 84 -9.563 12.136 2.571
680 HG2 ARG 84 2HG ARG 84 -6.866 12.823 1.429
681 HG3 ARG 84 1HG ARG 84 -8.052 11.782 0.637
682 HD2 ARG 84 2HD ARG 84 -8.410 14.682 1.382
683 HD3 ARG 84 1HD ARG 84 -8.203 14.028 -0.243
684 HE ARG 84 HE ARG 84 -10.524 13.313 1.434
685 HH11 ARG 84 1HH1 ARG 84 -9.207 14.542 -1.571
686 HH12 ARG 84 2HH1 ARG 84 -10.739 14.513 -2.392
687 HH21 ARG 84 1HH2 ARG 84 -12.523 13.323 0.379
688 HH22 ARG 84 2HH2 ARG 84 -12.632 13.856 -1.273
689 H GLY 85 HN GLY 85 -7.716 11.927 5.873
690 HA2 GLY 85 2HA GLY 85 -8.762 11.961 7.982
691 HA3 GLY 85 1HA GLY 85 -10.113 12.834 7.271
692 H TYR 86 HN TYR 86 -8.520 9.712 6.599
693 HA TYR 86 HA TYR 86 -11.156 8.435 6.943
694 HB2 TYR 86 2HB TYR 86 -8.986 7.811 4.940
695 HB3 TYR 86 1HB TYR 86 -10.296 6.695 5.303
696 HD1 TYR 86 2HD TYR 86 -12.711 7.715 5.098
697 HD2 TYR 86 1HD TYR 86 -9.259 9.317 3.200
698 HE1 TYR 86 2HE TYR 86 -14.144 8.842 3.452
699 HE2 TYR 86 1HE TYR 86 -10.686 10.450 1.550
700 HH TYR 86 HH TYR 86 -14.028 10.797 1.952
701 H ARG 87 HN ARG 87 -8.475 8.826 8.597
702 HA ARG 87 HA ARG 87 -8.671 6.386 10.012
703 HB2 ARG 87 2HB ARG 87 -6.387 5.505 9.595
704 HB3 ARG 87 1HB ARG 87 -7.461 5.373 8.211
705 HG2 ARG 87 2HG ARG 87 -6.369 7.177 7.101
706 HG3 ARG 87 1HG ARG 87 -5.439 7.573 8.549
707 HD2 ARG 87 2HD ARG 87 -5.240 4.923 7.130
708 HD3 ARG 87 1HD ARG 87 -4.191 6.295 6.767
709 HE ARG 87 HE ARG 87 -3.250 6.116 8.940
710 HH11 ARG 87 1HH1 ARG 87 -5.440 3.490 8.147
711 HH12 ARG 87 2HH1 ARG 87 -4.837 2.447 9.392
712 HH21 ARG 87 1HH2 ARG 87 -2.435 4.733 10.561
713 HH22 ARG 87 2HH2 ARG 87 -3.126 3.149 10.766
714 H GLU 88 HN GLU 88 -6.761 9.195 9.258
715 HA GLU 88 HA GLU 88 -5.488 10.622 10.452
716 HB2 GLU 88 2HB GLU 88 -7.309 9.664 12.655
717 HB3 GLU 88 1HB GLU 88 -6.153 10.972 12.859
718 HG2 GLU 88 2HG GLU 88 -8.248 11.975 12.429
719 HG3 GLU 88 1HG GLU 88 -7.297 12.149 10.957
720 H GLY 89 HN GLY 89 -4.136 10.835 12.605
721 HA2 GLY 89 2HA GLY 89 -2.511 9.958 14.018
722 HA3 GLY 89 1HA GLY 89 -2.993 8.340 13.527
723 H ASP 90 HN ASP 90 -1.300 7.328 12.702
724 HA ASP 90 HA ASP 90 0.106 8.607 10.476
725 HB2 ASP 90 2HB ASP 90 1.448 8.669 12.695
726 HB3 ASP 90 1HB ASP 90 1.630 6.932 12.471
727 H ASN 91 HN ASN 91 1.705 6.524 9.673
728 HA ASN 91 HA ASN 91 -0.405 4.670 8.883
729 HB2 ASN 91 2HB ASN 91 2.213 5.422 7.592
730 HB3 ASN 91 1HB ASN 91 1.123 4.199 6.979
731 HD21 ASN 91 1HD2 ASN 91 1.980 6.528 5.618
732 HD22 ASN 91 2HD2 ASN 91 0.572 7.501 5.324
733 HA PRO 92 HA PRO 92 1.785 1.325 10.854
734 HB2 PRO 92 2HB PRO 92 0.448 -0.728 9.734
735 HB3 PRO 92 1HB PRO 92 -0.283 0.308 10.965
736 HG2 PRO 92 2HG PRO 92 -0.644 0.337 7.999
737 HG3 PRO 92 1HG PRO 92 -1.848 0.568 9.280
738 HD2 PRO 92 2HD PRO 92 -0.687 2.619 7.864
739 HD3 PRO 92 1HD PRO 92 -1.369 2.792 9.492
740 H ALA 93 HN ALA 93 1.692 1.988 7.516
741 HA ALA 93 HA ALA 93 3.613 -0.118 6.846
742 HB1 ALA 93 1HB ALA 93 2.189 1.824 5.024
743 HB2 ALA 93 2HB ALA 93 1.664 0.177 5.365
744 HB3 ALA 93 3HB ALA 93 3.189 0.460 4.523
745 H ARG 94 HN ARG 94 3.825 2.732 8.228
746 HA ARG 94 HA ARG 94 5.600 4.215 6.599
747 HB2 ARG 94 2HB ARG 94 4.257 5.042 8.619
748 HB3 ARG 94 1HB ARG 94 5.511 4.314 9.613
749 HG2 ARG 94 2HG ARG 94 6.188 6.510 9.480
750 HG3 ARG 94 1HG ARG 94 7.136 5.744 8.204
751 HD2 ARG 94 2HD ARG 94 6.315 7.681 7.199
752 HD3 ARG 94 1HD ARG 94 5.203 6.425 6.650
753 HE ARG 94 HE ARG 94 4.270 7.657 9.046
754 HH11 ARG 94 1HH1 ARG 94 4.367 8.001 5.555
755 HH12 ARG 94 2HH1 ARG 94 3.132 9.232 5.520
756 HH21 ARG 94 1HH2 ARG 94 2.649 9.266 9.001
757 HH22 ARG 94 2HH2 ARG 94 2.143 9.927 7.470
758 H TRP 95 HN TRP 95 6.157 2.164 9.452
759 HA TRP 95 HA TRP 95 7.902 0.911 10.160
760 HB2 TRP 95 2HB TRP 95 8.282 0.948 7.245
761 HB3 TRP 95 1HB TRP 95 9.731 0.577 8.180
762 HD1 TRP 95 1HD TRP 95 9.322 -1.430 10.098
763 HE1 TRP 95 1HE TRP 95 8.069 -3.664 9.806
764 HE3 TRP 95 3HE TRP 95 6.467 -0.211 6.043
765 HZ2 TRP 95 2HZ TRP 95 6.115 -4.743 8.089
766 HZ3 TRP 95 3HZ TRP 95 4.923 -1.903 5.142
767 HH2 TRP 95 2HH TRP 95 4.753 -4.122 6.149
768 H ARG 96 HN ARG 96 9.319 1.586 11.553
769 HA ARG 96 HA ARG 96 10.688 4.111 11.120
770 HB2 ARG 96 2HB ARG 96 11.255 3.950 13.493
771 HB3 ARG 96 1HB ARG 96 9.533 3.729 13.245
772 HG2 ARG 96 2HG ARG 96 9.892 1.275 13.416
773 HG3 ARG 96 1HG ARG 96 11.579 1.598 13.826
774 HD2 ARG 96 2HD ARG 96 10.816 2.945 15.749
775 HD3 ARG 96 1HD ARG 96 9.149 2.522 15.357
776 HE ARG 96 HE ARG 96 11.046 0.355 15.881
777 HH11 ARG 96 1HH1 ARG 96 8.286 2.253 16.891
778 HH12 ARG 96 2HH1 ARG 96 7.874 1.192 18.207
779 HH21 ARG 96 1HH2 ARG 96 10.498 -1.065 17.603
780 HH22 ARG 96 2HH2 ARG 96 9.105 -0.711 18.591
781 H GLY 97 HN GLY 97 11.344 1.195 10.089
782 HA2 GLY 97 2HA GLY 97 13.866 1.397 9.300
783 HA3 GLY 97 1HA GLY 97 14.104 0.975 10.989
784 H TYR 98 HN TYR 98 12.825 -0.126 7.914
785 HA TYR 98 HA TYR 98 12.426 -2.807 8.972
786 HB2 TYR 98 2HB TYR 98 11.550 -3.303 6.689
787 HB3 TYR 98 1HB TYR 98 10.673 -2.037 7.528
788 HD1 TYR 98 2HD TYR 98 11.017 0.343 6.840
789 HD2 TYR 98 1HD TYR 98 12.625 -2.903 4.617
790 HE1 TYR 98 2HE TYR 98 11.299 1.821 4.900
791 HE2 TYR 98 1HE TYR 98 12.907 -1.434 2.665
792 HH TYR 98 HH TYR 98 12.760 1.903 2.826
793 H LEU 99 HN LEU 99 13.354 -4.669 7.812
794 HA LEU 99 HA LEU 99 15.161 -5.892 7.318
795 HB2 LEU 99 2HB LEU 99 15.884 -3.528 5.602
796 HB3 LEU 99 1HB LEU 99 16.517 -5.146 5.492
797 HG LEU 99 HG LEU 99 13.648 -4.405 4.983
798 HD11 LEU 99 1HD1 LEU 99 14.158 -4.818 2.634
799 HD12 LEU 99 2HD1 LEU 99 15.849 -5.098 3.042
800 HD13 LEU 99 3HD1 LEU 99 15.139 -3.501 3.276
801 HD21 LEU 99 3HD2 LEU 99 13.891 -6.682 5.803
802 HD22 LEU 99 1HD2 LEU 99 15.129 -7.004 4.587
803 HD23 LEU 99 2HD2 LEU 99 13.467 -6.681 4.090
804 H GLU 100 HN GLU 100 15.270 -3.732 9.422
805 HA GLU 100 HA GLU 100 17.876 -2.670 9.566
806 HB2 GLU 100 2HB GLU 100 15.928 -1.740 10.766
807 HB3 GLU 100 1HB GLU 100 15.879 -3.169 11.785
808 HG2 GLU 100 2HG GLU 100 16.919 -1.156 12.822
809 HG3 GLU 100 1HG GLU 100 17.927 -2.603 12.829
810 H HIS 101 HN HIS 101 19.533 -3.187 11.094
811 HA HIS 101 HA HIS 101 20.980 -4.513 12.216
812 HB2 HIS 101 2HB HIS 101 19.041 -5.274 13.546
813 HB3 HIS 101 1HB HIS 101 18.736 -6.540 12.364
814 HD1 HIS 101 1HD HIS 101 19.448 -8.700 13.298
815 HD2 HIS 101 2HD HIS 101 22.029 -5.628 14.383
816 HE1 HIS 101 1HE HIS 101 21.239 -9.782 14.690
817 HE2 HIS 101 2HE HIS 101 22.653 -7.865 15.526
818 H HIS 102 HN HIS 102 19.076 -6.200 9.760
819 HA HIS 102 HA HIS 102 21.320 -7.922 9.113
820 HB2 HIS 102 2HB HIS 102 18.968 -8.770 9.114
821 HB3 HIS 102 1HB HIS 102 18.628 -7.719 7.745
822 HD1 HIS 102 1HD HIS 102 18.875 -8.784 5.528
823 HD2 HIS 102 2HD HIS 102 21.141 -10.705 8.443
824 HE1 HIS 102 1HE HIS 102 19.917 -10.772 4.382
825 HE2 HIS 102 2HE HIS 102 21.400 -11.834 6.127
826 H HIS 103 HN HIS 103 19.477 -5.294 7.560
827 HA HIS 103 HA HIS 103 21.802 -4.749 5.887
828 HB2 HIS 103 2HB HIS 103 20.450 -6.325 4.555
829 HB3 HIS 103 1HB HIS 103 19.066 -5.247 4.686
830 HD1 HIS 103 1HD HIS 103 22.498 -5.429 3.086
831 HD2 HIS 103 2HD HIS 103 18.972 -3.236 2.816
832 HE1 HIS 103 1HE HIS 103 22.738 -3.999 1.026
833 HE2 HIS 103 2HE HIS 103 20.539 -2.786 0.811
834 H HIS 104 HN HIS 104 18.384 -3.738 5.857
835 HA HIS 104 HA HIS 104 17.407 -1.703 5.704
836 HB2 HIS 104 2HB HIS 104 18.320 -1.568 8.053
837 HB3 HIS 104 1HB HIS 104 19.701 -0.695 7.405
838 HD1 HIS 104 1HD HIS 104 17.732 0.503 9.514
839 HD2 HIS 104 2HD HIS 104 17.558 1.186 5.409
840 HE1 HIS 104 1HE HIS 104 16.511 2.684 9.233
841 HE2 HIS 104 2HE HIS 104 16.615 3.172 6.770
842 H HIS 105 HN HIS 105 20.477 -0.085 6.031
843 HA HIS 105 HA HIS 105 21.470 0.117 3.506
844 HB2 HIS 105 2HB HIS 105 19.273 0.942 2.744
845 HB3 HIS 105 1HB HIS 105 19.342 2.241 3.927
846 HD1 HIS 105 1HD HIS 105 19.674 4.337 2.683
847 HD2 HIS 105 2HD HIS 105 22.008 1.253 1.145
848 HE1 HIS 105 1HE HIS 105 21.048 5.372 0.850
849 HE2 HIS 105 2HE HIS 105 22.335 3.463 -0.164
850 H HIS 106 HN HIS 106 20.446 3.112 5.005
851 HA HIS 106 HA HIS 106 22.329 3.434 7.008
852 HB2 HIS 106 2HB HIS 106 23.942 3.233 5.031
853 HB3 HIS 106 1HB HIS 106 23.288 4.764 4.461
854 HD1 HIS 106 1HD HIS 106 24.312 6.844 5.394
855 HD2 HIS 106 2HD HIS 106 25.276 3.461 7.614
856 HE1 HIS 106 1HE HIS 106 26.033 7.597 7.068
857 HE2 HIS 106 2HE HIS 106 26.436 5.585 8.532
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -16.149 3.455 5.344
2 H2 MET 1 H2 MET 1 -14.832 2.954 6.283
3 H3 MET 1 H3 MET 1 -15.797 1.802 5.497
4 HA MET 1 HA MET 1 -15.109 2.714 3.352
5 HB2 MET 1 2HB MET 1 -14.502 4.953 3.954
6 HB3 MET 1 1HB MET 1 -13.346 4.385 5.148
7 HG2 MET 1 2HG MET 1 -11.914 3.520 3.396
8 HG3 MET 1 1HG MET 1 -13.080 4.004 2.169
9 HE1 MET 1 2HE MET 1 -12.971 7.934 2.544
10 HE2 MET 1 3HE MET 1 -14.048 6.822 3.388
11 HE3 MET 1 1HE MET 1 -13.702 6.584 1.675
12 H THR 2 HN THR 2 -14.283 0.916 2.627
13 HA THR 2 HA THR 2 -12.360 -0.608 4.164
14 HB THR 2 HB THR 2 -12.484 -2.206 2.251
15 HG1 THR 2 1HG THR 2 -14.596 -0.608 1.229
16 HG21 THR 2 3HG2 THR 2 -15.149 -1.322 3.371
17 HG22 THR 2 1HG2 THR 2 -14.018 -2.441 4.135
18 HG23 THR 2 2HG2 THR 2 -14.815 -2.886 2.627
19 H PHE 3 HN PHE 3 -10.425 -1.526 2.880
20 HA PHE 3 HA PHE 3 -8.796 0.652 2.059
21 HB2 PHE 3 2HB PHE 3 -7.923 -1.439 3.103
22 HB3 PHE 3 1HB PHE 3 -8.314 -2.303 1.621
23 HD1 PHE 3 2HD PHE 3 -6.191 0.352 3.058
24 HD2 PHE 3 1HD PHE 3 -6.872 -2.249 -0.239
25 HE1 PHE 3 2HE PHE 3 -3.987 0.942 2.142
26 HE2 PHE 3 1HE PHE 3 -4.665 -1.667 -1.157
27 HZ PHE 3 HZ PHE 3 -3.219 -0.066 0.036
28 H SER 4 HN SER 4 -10.692 -1.772 0.380
29 HA SER 4 HA SER 4 -9.847 -1.301 -2.243
30 HB2 SER 4 2HB SER 4 -11.300 -3.187 -1.611
31 HB3 SER 4 1HB SER 4 -12.608 -2.065 -1.242
32 HG SER 4 HG SER 4 -12.982 -2.800 -3.285
33 H GLU 5 HN GLU 5 -12.448 0.209 -0.362
34 HA GLU 5 HA GLU 5 -13.303 2.038 -2.314
35 HB2 GLU 5 2HB GLU 5 -13.423 2.089 0.700
36 HB3 GLU 5 1HB GLU 5 -14.207 3.287 -0.308
37 HG2 GLU 5 2HG GLU 5 -15.646 1.649 -1.263
38 HG3 GLU 5 1HG GLU 5 -14.758 0.344 -0.477
39 H CYS 6 HN CYS 6 -11.027 2.375 0.368
40 HA CYS 6 HA CYS 6 -10.523 5.129 0.033
41 HB2 CYS 6 2HB CYS 6 -10.061 3.851 2.094
42 HB3 CYS 6 1HB CYS 6 -8.761 3.021 1.280
43 HG CYS 6 HG CYS 6 -7.990 6.047 0.784
44 H ALA 7 HN ALA 7 -8.653 2.281 -0.933
45 HA ALA 7 HA ALA 7 -6.566 3.611 -2.228
46 HB1 ALA 7 1HB ALA 7 -7.733 0.928 -2.958
47 HB2 ALA 7 2HB ALA 7 -6.522 1.216 -1.710
48 HB3 ALA 7 3HB ALA 7 -6.136 1.526 -3.403
49 H ALA 8 HN ALA 8 -9.691 2.498 -3.516
50 HA ALA 8 HA ALA 8 -9.245 3.268 -6.181
51 HB1 ALA 8 1HB ALA 8 -11.082 1.803 -5.517
52 HB2 ALA 8 2HB ALA 8 -11.672 3.191 -6.431
53 HB3 ALA 8 3HB ALA 8 -11.855 3.147 -4.678
54 H LEU 9 HN LEU 9 -10.546 5.045 -3.411
55 HA LEU 9 HA LEU 9 -11.214 7.406 -4.791
56 HB2 LEU 9 2HB LEU 9 -10.435 6.938 -1.915
57 HB3 LEU 9 1HB LEU 9 -10.970 8.491 -2.525
58 HG LEU 9 HG LEU 9 -12.610 5.957 -2.524
59 HD11 LEU 9 1HD1 LEU 9 -13.950 7.102 -0.822
60 HD12 LEU 9 2HD1 LEU 9 -12.803 8.441 -0.825
61 HD13 LEU 9 3HD1 LEU 9 -12.290 6.844 -0.281
62 HD21 LEU 9 3HD2 LEU 9 -13.335 8.777 -3.310
63 HD22 LEU 9 1HD2 LEU 9 -14.450 7.411 -3.217
64 HD23 LEU 9 2HD2 LEU 9 -13.148 7.409 -4.406
65 H TYR 10 HN TYR 10 -8.227 6.386 -3.167
66 HA TYR 10 HA TYR 10 -6.786 8.763 -3.537
67 HB2 TYR 10 2HB TYR 10 -5.955 7.012 -2.064
68 HB3 TYR 10 1HB TYR 10 -5.770 5.915 -3.426
69 HD1 TYR 10 1HD TYR 10 -4.617 9.265 -2.254
70 HD2 TYR 10 2HD TYR 10 -3.698 5.752 -4.467
71 HE1 TYR 10 1HE TYR 10 -2.342 10.110 -2.636
72 HE2 TYR 10 2HE TYR 10 -1.416 6.585 -4.845
73 HH TYR 10 HH TYR 10 -0.103 9.214 -3.152
74 H ILE 11 HN ILE 11 -7.018 5.866 -5.543
75 HA ILE 11 HA ILE 11 -5.250 6.624 -7.562
76 HB ILE 11 HB ILE 11 -7.715 4.883 -7.759
77 HG12 ILE 11 2HG1 ILE 11 -4.791 4.158 -7.472
78 HG13 ILE 11 1HG1 ILE 11 -5.956 4.148 -6.154
79 HG21 ILE 11 1HG2 ILE 11 -5.400 5.153 -9.679
80 HG22 ILE 11 2HG2 ILE 11 -7.056 5.691 -9.966
81 HG23 ILE 11 3HG2 ILE 11 -6.704 3.971 -9.798
82 HD11 ILE 11 3HD1 ILE 11 -6.036 2.416 -8.611
83 HD12 ILE 11 1HD1 ILE 11 -7.240 2.421 -7.322
84 HD13 ILE 11 2HD1 ILE 11 -5.585 1.912 -6.983
85 H LYS 12 HN LYS 12 -8.748 7.197 -7.272
86 HA LYS 12 HA LYS 12 -8.974 8.556 -9.778
87 HB2 LYS 12 2HB LYS 12 -10.770 8.686 -7.339
88 HB3 LYS 12 1HB LYS 12 -11.187 9.262 -8.945
89 HG2 LYS 12 2HG LYS 12 -11.295 7.085 -9.817
90 HG3 LYS 12 1HG LYS 12 -10.479 6.396 -8.406
91 HD2 LYS 12 2HD LYS 12 -12.401 7.037 -7.008
92 HD3 LYS 12 1HD LYS 12 -13.217 7.674 -8.436
93 HE2 LYS 12 2HE LYS 12 -13.328 5.489 -9.418
94 HE3 LYS 12 1HE LYS 12 -12.324 4.814 -8.133
95 HZ1 LYS 12 3HZ LYS 12 -14.965 6.066 -7.631
96 HZ2 LYS 12 1HZ LYS 12 -14.046 5.121 -6.564
97 HZ3 LYS 12 2HZ LYS 12 -14.771 4.405 -7.920
98 H ALA 13 HN ALA 13 -8.399 9.596 -6.458
99 HA ALA 13 HA ALA 13 -8.810 12.367 -7.000
100 HB1 ALA 13 1HB ALA 13 -7.940 12.748 -4.757
101 HB2 ALA 13 2HB ALA 13 -7.398 11.070 -4.673
102 HB3 ALA 13 3HB ALA 13 -9.120 11.437 -4.764
103 H HIS 14 HN HIS 14 -5.966 10.276 -6.856
104 HA HIS 14 HA HIS 14 -4.274 12.634 -7.345
105 HB2 HIS 14 2HB HIS 14 -3.919 10.886 -5.408
106 HB3 HIS 14 1HB HIS 14 -3.170 9.927 -6.680
107 HD1 HIS 14 1HD HIS 14 -0.890 10.178 -5.357
108 HD2 HIS 14 2HD HIS 14 -2.498 13.727 -6.811
109 HE1 HIS 14 1HE HIS 14 0.961 11.872 -5.212
110 HE2 HIS 14 2HE HIS 14 -0.105 14.056 -5.896
111 H ARG 15 HN ARG 15 -5.913 10.789 -9.262
112 HA ARG 15 HA ARG 15 -4.037 9.428 -10.883
113 HB2 ARG 15 2HB ARG 15 -5.830 9.165 -12.487
114 HB3 ARG 15 1HB ARG 15 -6.454 8.907 -10.871
115 HG2 ARG 15 2HG ARG 15 -7.494 11.053 -10.855
116 HG3 ARG 15 1HG ARG 15 -6.722 11.491 -12.376
117 HD2 ARG 15 2HD ARG 15 -8.679 9.229 -12.028
118 HD3 ARG 15 1HD ARG 15 -9.095 10.832 -12.632
119 HE ARG 15 HE ARG 15 -7.067 9.971 -14.266
120 HH11 ARG 15 1HH1 ARG 15 -10.213 8.777 -13.350
121 HH12 ARG 15 2HH1 ARG 15 -10.510 7.962 -14.854
122 HH21 ARG 15 1HH2 ARG 15 -7.426 8.911 -16.277
123 HH22 ARG 15 2HH2 ARG 15 -8.907 8.024 -16.522
124 H SER 16 HN SER 16 -5.122 12.745 -10.820
125 HA SER 16 HA SER 16 -4.370 13.330 -13.523
126 HB2 SER 16 2HB SER 16 -6.124 14.556 -12.151
127 HB3 SER 16 1HB SER 16 -4.790 15.331 -11.300
128 HG SER 16 HG SER 16 -4.458 15.458 -13.987
129 H SER 17 HN SER 17 -2.715 13.021 -10.596
130 HA SER 17 HA SER 17 -0.469 14.679 -11.334
131 HB2 SER 17 2HB SER 17 -1.205 14.212 -8.948
132 HB3 SER 17 1HB SER 17 -0.589 12.574 -9.162
133 HG SER 17 HG SER 17 1.003 14.877 -9.615
134 H TRP 18 HN TRP 18 -1.636 11.635 -12.132
135 HA TRP 18 HA TRP 18 1.029 10.667 -12.934
136 HB2 TRP 18 2HB TRP 18 -1.519 9.045 -12.747
137 HB3 TRP 18 1HB TRP 18 0.111 8.439 -12.994
138 HD1 TRP 18 1HD TRP 18 1.359 10.244 -10.520
139 HE1 TRP 18 1HE TRP 18 0.928 9.375 -8.129
140 HE3 TRP 18 3HE TRP 18 -2.641 7.215 -11.465
141 HZ2 TRP 18 2HZ TRP 18 -0.873 7.623 -6.824
142 HZ3 TRP 18 3HZ TRP 18 -3.658 5.970 -9.608
143 HH2 TRP 18 2HH TRP 18 -2.791 6.174 -7.331
144 H LYS 19 HN LYS 19 -0.419 12.667 -14.456
145 HA LYS 19 HA LYS 19 -1.008 13.127 -16.529
146 HB2 LYS 19 2HB LYS 19 -0.100 10.338 -17.070
147 HB3 LYS 19 1HB LYS 19 -0.818 11.350 -18.323
148 HG2 LYS 19 2HG LYS 19 0.877 13.102 -17.764
149 HG3 LYS 19 1HG LYS 19 1.652 11.926 -16.707
150 HD2 LYS 19 2HD LYS 19 2.780 11.985 -18.833
151 HD3 LYS 19 1HD LYS 19 1.966 10.435 -18.634
152 HE2 LYS 19 2HE LYS 19 1.689 11.303 -20.895
153 HE3 LYS 19 1HE LYS 19 0.141 11.199 -20.056
154 HZ1 LYS 19 3HZ LYS 19 0.040 13.498 -19.802
155 HZ2 LYS 19 1HZ LYS 19 0.630 13.293 -21.376
156 HZ3 LYS 19 2HZ LYS 19 1.691 13.719 -20.123
157 H ASN 20 HN ASN 20 -3.906 12.094 -17.725
158 HA ASN 20 HA ASN 20 -3.742 9.425 -17.267
159 HB2 ASN 20 2HB ASN 20 -4.210 10.966 -19.772
160 HB3 ASN 20 1HB ASN 20 -4.292 9.207 -19.715
161 HD21 ASN 20 1HD2 ASN 20 -6.353 11.223 -20.226
162 HD22 ASN 20 2HD2 ASN 20 -7.604 10.927 -19.068
163 H THR 21 HN THR 21 -1.851 8.614 -16.779
164 HA THR 21 HA THR 21 -0.468 7.651 -19.211
165 HB THR 21 HB THR 21 1.032 6.413 -17.572
166 HG1 THR 21 1HG THR 21 -0.025 8.290 -15.701
167 HG21 THR 21 3HG2 THR 21 1.127 9.421 -17.492
168 HG22 THR 21 1HG2 THR 21 1.830 8.388 -18.738
169 HG23 THR 21 2HG2 THR 21 2.458 8.336 -17.090
170 H LYS 22 HN LYS 22 0.110 5.119 -18.692
171 HA LYS 22 HA LYS 22 -2.439 3.842 -18.062
172 HB2 LYS 22 2HB LYS 22 0.167 2.659 -19.040
173 HB3 LYS 22 1HB LYS 22 -1.317 1.762 -18.778
174 HG2 LYS 22 2HG LYS 22 -2.339 3.483 -20.437
175 HG3 LYS 22 1HG LYS 22 -0.659 3.747 -20.901
176 HD2 LYS 22 2HD LYS 22 -2.169 1.137 -20.979
177 HD3 LYS 22 1HD LYS 22 -1.665 2.103 -22.364
178 HE2 LYS 22 2HE LYS 22 0.688 1.730 -21.729
179 HE3 LYS 22 1HE LYS 22 0.150 0.708 -20.396
180 HZ1 LYS 22 3HZ LYS 22 -0.131 0.208 -23.305
181 HZ2 LYS 22 1HZ LYS 22 -1.011 -0.660 -22.144
182 HZ3 LYS 22 2HZ LYS 22 0.679 -0.741 -22.152
183 H HIS 23 HN HIS 23 -0.214 5.094 -16.239
184 HA HIS 23 HA HIS 23 0.702 3.061 -14.518
185 HB2 HIS 23 2HB HIS 23 0.235 6.006 -14.033
186 HB3 HIS 23 1HB HIS 23 0.916 4.937 -12.814
187 HD1 HIS 23 1HD HIS 23 2.510 7.350 -13.961
188 HD2 HIS 23 2HD HIS 23 2.805 3.432 -15.334
189 HE1 HIS 23 1HE HIS 23 4.756 7.190 -15.074
190 HE2 HIS 23 2HE HIS 23 4.878 4.843 -15.984
191 H ALA 24 HN ALA 24 -2.323 4.806 -14.690
192 HA ALA 24 HA ALA 24 -3.380 4.280 -12.162
193 HB1 ALA 24 1HB ALA 24 -4.430 5.798 -13.779
194 HB2 ALA 24 2HB ALA 24 -5.577 4.600 -13.179
195 HB3 ALA 24 3HB ALA 24 -4.874 4.418 -14.785
196 H ASP 25 HN ASP 25 -3.380 2.303 -15.099
197 HA ASP 25 HA ASP 25 -4.892 0.157 -13.993
198 HB2 ASP 25 2HB ASP 25 -4.698 0.455 -16.423
199 HB3 ASP 25 1HB ASP 25 -2.967 0.157 -16.333
200 H GLN 26 HN GLN 26 -1.450 0.755 -14.465
201 HA GLN 26 HA GLN 26 -0.451 -1.661 -13.521
202 HB2 GLN 26 2HB GLN 26 0.713 1.122 -13.472
203 HB3 GLN 26 1HB GLN 26 1.627 -0.325 -13.084
204 HG2 GLN 26 2HG GLN 26 1.422 -1.162 -15.286
205 HG3 GLN 26 1HG GLN 26 0.199 0.038 -15.694
206 HE21 GLN 26 1HE2 GLN 26 1.382 0.722 -17.464
207 HE22 GLN 26 2HE2 GLN 26 2.806 1.686 -17.307
208 H TRP 27 HN TRP 27 -1.522 1.192 -11.767
209 HA TRP 27 HA TRP 27 -0.665 0.209 -9.210
210 HB2 TRP 27 2HB TRP 27 -2.456 2.451 -10.107
211 HB3 TRP 27 1HB TRP 27 -2.368 2.003 -8.409
212 HD1 TRP 27 1HD TRP 27 0.294 2.757 -11.152
213 HE1 TRP 27 1HE TRP 27 2.076 4.297 -10.114
214 HE3 TRP 27 3HE TRP 27 -1.653 3.155 -6.447
215 HZ2 TRP 27 2HZ TRP 27 2.580 5.517 -7.617
216 HZ3 TRP 27 3HZ TRP 27 -0.466 4.535 -4.791
217 HH2 TRP 27 2HH TRP 27 1.609 5.692 -5.365
218 H THR 28 HN THR 28 -3.821 0.434 -10.853
219 HA THR 28 HA THR 28 -5.303 -0.671 -8.719
220 HB THR 28 HB THR 28 -6.064 -0.639 -11.646
221 HG1 THR 28 1HG THR 28 -5.598 1.467 -11.060
222 HG21 THR 28 3HG2 THR 28 -8.364 -0.564 -10.774
223 HG22 THR 28 1HG2 THR 28 -7.739 -0.700 -9.131
224 HG23 THR 28 2HG2 THR 28 -7.523 -2.029 -10.270
225 H ASN 29 HN ASN 29 -4.030 -2.107 -11.702
226 HA ASN 29 HA ASN 29 -5.289 -4.580 -11.601
227 HB2 ASN 29 2HB ASN 29 -3.970 -3.650 -13.517
228 HB3 ASN 29 1HB ASN 29 -2.498 -4.022 -12.630
229 HD21 ASN 29 1HD2 ASN 29 -5.091 -5.250 -14.517
230 HD22 ASN 29 2HD2 ASN 29 -4.489 -6.866 -14.669
231 H THR 30 HN THR 30 -2.130 -3.672 -10.270
232 HA THR 30 HA THR 30 -1.589 -6.305 -9.325
233 HB THR 30 HB THR 30 0.278 -5.056 -8.045
234 HG1 THR 30 1HG THR 30 -0.132 -2.984 -9.897
235 HG21 THR 30 3HG2 THR 30 0.152 -4.926 -11.062
236 HG22 THR 30 1HG2 THR 30 0.637 -6.331 -10.110
237 HG23 THR 30 2HG2 THR 30 1.619 -4.866 -10.087
238 H ILE 31 HN ILE 31 -2.734 -3.307 -7.802
239 HA ILE 31 HA ILE 31 -2.675 -4.299 -5.155
240 HB ILE 31 HB ILE 31 -4.340 -2.080 -6.362
241 HG12 ILE 31 2HG1 ILE 31 -1.853 -2.030 -4.632
242 HG13 ILE 31 1HG1 ILE 31 -1.898 -1.729 -6.365
243 HG21 ILE 31 1HG2 ILE 31 -5.461 -2.948 -4.375
244 HG22 ILE 31 2HG2 ILE 31 -4.795 -1.343 -4.072
245 HG23 ILE 31 3HG2 ILE 31 -3.970 -2.771 -3.444
246 HD11 ILE 31 3HD1 ILE 31 -3.270 -0.058 -4.273
247 HD12 ILE 31 1HD1 ILE 31 -3.236 0.256 -6.007
248 HD13 ILE 31 2HD1 ILE 31 -1.745 0.333 -5.070
249 H LYS 32 HN LYS 32 -5.169 -4.314 -7.657
250 HA LYS 32 HA LYS 32 -7.288 -5.334 -6.140
251 HB2 LYS 32 2HB LYS 32 -7.410 -4.464 -8.505
252 HB3 LYS 32 1HB LYS 32 -6.705 -5.981 -9.037
253 HG2 LYS 32 2HG LYS 32 -8.622 -7.194 -8.099
254 HG3 LYS 32 1HG LYS 32 -9.339 -5.658 -7.614
255 HD2 LYS 32 2HD LYS 32 -9.323 -4.964 -10.001
256 HD3 LYS 32 1HD LYS 32 -8.746 -6.574 -10.427
257 HE2 LYS 32 2HE LYS 32 -10.767 -7.553 -9.444
258 HE3 LYS 32 1HE LYS 32 -11.346 -5.938 -9.034
259 HZ1 LYS 32 3HZ LYS 32 -12.401 -6.581 -11.042
260 HZ2 LYS 32 1HZ LYS 32 -10.937 -7.077 -11.746
261 HZ3 LYS 32 2HZ LYS 32 -11.228 -5.432 -11.466
262 H THR 33 HN THR 33 -4.569 -6.936 -7.694
263 HA THR 33 HA THR 33 -5.629 -9.575 -7.227
264 HB THR 33 HB THR 33 -2.838 -8.797 -8.084
265 HG1 THR 33 1HG THR 33 -3.594 -8.777 -10.123
266 HG21 THR 33 3HG2 THR 33 -2.759 -11.061 -9.018
267 HG22 THR 33 1HG2 THR 33 -4.374 -11.384 -8.383
268 HG23 THR 33 2HG2 THR 33 -3.029 -11.105 -7.276
269 H TYR 34 HN TYR 34 -2.873 -7.707 -5.903
270 HA TYR 34 HA TYR 34 -2.189 -9.856 -4.120
271 HB2 TYR 34 2HB TYR 34 -1.120 -7.038 -4.308
272 HB3 TYR 34 1HB TYR 34 -0.465 -8.285 -3.255
273 HD1 TYR 34 1HD TYR 34 0.004 -10.595 -4.645
274 HD2 TYR 34 2HD TYR 34 0.070 -6.648 -6.232
275 HE1 TYR 34 1HE TYR 34 1.487 -11.351 -6.454
276 HE2 TYR 34 2HE TYR 34 1.549 -7.396 -8.047
277 HH TYR 34 HH TYR 34 2.051 -10.624 -8.802
278 H CYS 35 HN CYS 35 -3.545 -6.589 -3.674
279 HA CYS 35 HA CYS 35 -3.677 -7.064 -0.799
280 HB2 CYS 35 2HB CYS 35 -4.358 -4.565 -2.364
281 HB3 CYS 35 1HB CYS 35 -4.177 -4.686 -0.617
282 HG CYS 35 HG CYS 35 -1.407 -5.567 -0.998
283 H GLY 36 HN GLY 36 -5.734 -7.000 -3.551
284 HA2 GLY 36 2HA GLY 36 -8.180 -6.191 -2.600
285 HA3 GLY 36 1HA GLY 36 -7.968 -7.426 -3.826
286 HA PRO 37 HA PRO 37 -9.546 -10.546 -1.180
287 HB2 PRO 37 2HB PRO 37 -7.171 -12.269 -1.269
288 HB3 PRO 37 1HB PRO 37 -8.778 -12.535 -1.948
289 HG2 PRO 37 2HG PRO 37 -6.646 -12.034 -3.506
290 HG3 PRO 37 1HG PRO 37 -8.273 -11.466 -3.923
291 HD2 PRO 37 2HD PRO 37 -5.991 -9.952 -2.708
292 HD3 PRO 37 1HD PRO 37 -7.131 -9.447 -3.975
293 H VAL 38 HN VAL 38 -6.539 -9.187 -0.217
294 HA VAL 38 HA VAL 38 -6.512 -10.632 2.316
295 HB VAL 38 HB VAL 38 -4.557 -8.542 1.341
296 HG11 VAL 38 1HG1 VAL 38 -4.576 -8.828 3.769
297 HG12 VAL 38 2HG1 VAL 38 -3.082 -9.450 3.067
298 HG13 VAL 38 3HG1 VAL 38 -4.350 -10.565 3.573
299 HG21 VAL 38 3HG2 VAL 38 -3.092 -10.423 0.777
300 HG22 VAL 38 1HG2 VAL 38 -4.585 -10.468 -0.161
301 HG23 VAL 38 2HG2 VAL 38 -4.372 -11.556 1.211
302 H ILE 39 HN ILE 39 -6.135 -7.174 1.459
303 HA ILE 39 HA ILE 39 -7.486 -6.552 4.003
304 HB ILE 39 HB ILE 39 -6.242 -4.381 3.941
305 HG12 ILE 39 2HG1 ILE 39 -4.632 -5.776 1.791
306 HG13 ILE 39 1HG1 ILE 39 -5.687 -4.395 1.533
307 HG21 ILE 39 1HG2 ILE 39 -5.545 -6.179 5.395
308 HG22 ILE 39 2HG2 ILE 39 -4.129 -5.347 4.751
309 HG23 ILE 39 3HG2 ILE 39 -4.612 -6.909 4.091
310 HD11 ILE 39 3HD1 ILE 39 -3.365 -3.716 1.620
311 HD12 ILE 39 1HD1 ILE 39 -3.206 -4.418 3.230
312 HD13 ILE 39 2HD1 ILE 39 -4.268 -3.034 2.973
313 H GLY 40 HN GLY 40 -8.152 -6.679 0.868
314 HA2 GLY 40 2HA GLY 40 -9.049 -4.198 0.021
315 HA3 GLY 40 1HA GLY 40 -9.769 -5.726 -0.454
316 HA PRO 41 HA PRO 41 -13.373 -4.783 1.879
317 HB2 PRO 41 2HB PRO 41 -13.548 -7.294 3.324
318 HB3 PRO 41 1HB PRO 41 -14.480 -6.757 1.925
319 HG2 PRO 41 2HG PRO 41 -12.649 -8.772 1.824
320 HG3 PRO 41 1HG PRO 41 -13.061 -7.754 0.434
321 HD2 PRO 41 2HD PRO 41 -10.699 -7.595 2.268
322 HD3 PRO 41 1HD PRO 41 -10.776 -7.381 0.504
323 H LEU 42 HN LEU 42 -10.552 -5.195 3.569
324 HA LEU 42 HA LEU 42 -11.676 -4.826 6.213
325 HB2 LEU 42 2HB LEU 42 -8.837 -4.752 5.188
326 HB3 LEU 42 1HB LEU 42 -9.266 -4.449 6.860
327 HG LEU 42 HG LEU 42 -9.743 -7.037 5.373
328 HD11 LEU 42 1HD1 LEU 42 -8.009 -7.928 6.859
329 HD12 LEU 42 2HD1 LEU 42 -7.743 -6.311 7.513
330 HD13 LEU 42 3HD1 LEU 42 -7.382 -6.649 5.820
331 HD21 LEU 42 3HD2 LEU 42 -10.371 -7.918 7.568
332 HD22 LEU 42 1HD2 LEU 42 -11.444 -6.609 7.076
333 HD23 LEU 42 2HD2 LEU 42 -10.182 -6.311 8.271
334 H SER 43 HN SER 43 -11.585 -2.899 7.397
335 HA SER 43 HA SER 43 -12.001 -0.545 5.898
336 HB2 SER 43 2HB SER 43 -12.950 -1.017 8.174
337 HB3 SER 43 1HB SER 43 -11.350 -0.744 8.844
338 HG SER 43 HG SER 43 -12.777 1.163 7.293
339 H VAL 44 HN VAL 44 -10.727 1.262 5.593
340 HA VAL 44 HA VAL 44 -7.926 0.916 5.473
341 HB VAL 44 HB VAL 44 -9.138 2.517 4.036
342 HG11 VAL 44 1HG1 VAL 44 -9.428 4.164 6.542
343 HG12 VAL 44 2HG1 VAL 44 -10.731 3.359 5.669
344 HG13 VAL 44 3HG1 VAL 44 -9.846 4.681 4.907
345 HG21 VAL 44 3HG2 VAL 44 -6.741 2.778 4.328
346 HG22 VAL 44 1HG2 VAL 44 -7.007 3.793 5.746
347 HG23 VAL 44 2HG2 VAL 44 -7.521 4.351 4.153
348 H GLN 45 HN GLN 45 -10.084 1.872 7.953
349 HA GLN 45 HA GLN 45 -8.232 3.190 9.671
350 HB2 GLN 45 2HB GLN 45 -11.009 2.587 9.632
351 HB3 GLN 45 1HB GLN 45 -10.357 1.929 11.124
352 HG2 GLN 45 2HG GLN 45 -9.989 4.772 10.216
353 HG3 GLN 45 1HG GLN 45 -11.244 4.228 11.329
354 HE21 GLN 45 1HE2 GLN 45 -9.092 6.129 11.746
355 HE22 GLN 45 2HE2 GLN 45 -8.172 5.531 13.093
356 H ASP 46 HN ASP 46 -9.326 -0.140 9.248
357 HA ASP 46 HA ASP 46 -8.157 -1.093 11.669
358 HB2 ASP 46 2HB ASP 46 -9.341 -2.468 9.270
359 HB3 ASP 46 1HB ASP 46 -8.621 -3.366 10.597
360 H VAL 47 HN VAL 47 -6.852 -0.431 8.592
361 HA VAL 47 HA VAL 47 -4.902 -2.421 8.335
362 HB VAL 47 HB VAL 47 -4.680 0.465 7.463
363 HG11 VAL 47 1HG1 VAL 47 -3.094 -0.396 5.792
364 HG12 VAL 47 2HG1 VAL 47 -3.219 -2.002 6.515
365 HG13 VAL 47 3HG1 VAL 47 -2.528 -0.671 7.443
366 HG21 VAL 47 3HG2 VAL 47 -6.689 -0.587 6.582
367 HG22 VAL 47 1HG2 VAL 47 -5.734 -1.944 5.985
368 HG23 VAL 47 2HG2 VAL 47 -5.505 -0.333 5.299
369 H ASP 48 HN ASP 48 -3.434 -2.958 9.786
370 HA ASP 48 HA ASP 48 -2.119 -0.849 11.376
371 HB2 ASP 48 2HB ASP 48 -3.673 -2.145 12.751
372 HB3 ASP 48 1HB ASP 48 -2.933 -3.647 12.231
373 H THR 49 HN THR 49 -0.066 -1.564 12.279
374 HA THR 49 HA THR 49 1.821 -2.131 10.328
375 HB THR 49 HB THR 49 2.339 -2.821 13.200
376 HG1 THR 49 1HG THR 49 1.641 -0.925 13.822
377 HG21 THR 49 3HG2 THR 49 4.443 -1.643 12.769
378 HG22 THR 49 1HG2 THR 49 3.892 -1.242 11.142
379 HG23 THR 49 2HG2 THR 49 4.179 -2.925 11.587
380 H LYS 50 HN LYS 50 0.294 -4.224 12.716
381 HA LYS 50 HA LYS 50 1.799 -6.561 12.287
382 HB2 LYS 50 2HB LYS 50 0.212 -5.976 14.198
383 HB3 LYS 50 1HB LYS 50 -1.100 -6.415 13.124
384 HG2 LYS 50 2HG LYS 50 1.108 -8.332 13.787
385 HG3 LYS 50 1HG LYS 50 -0.314 -8.142 14.812
386 HD2 LYS 50 2HD LYS 50 -1.700 -8.613 12.753
387 HD3 LYS 50 1HD LYS 50 -0.195 -9.069 11.952
388 HE2 LYS 50 2HE LYS 50 -1.251 -11.051 12.789
389 HE3 LYS 50 1HE LYS 50 0.199 -10.733 13.740
390 HZ1 LYS 50 3HZ LYS 50 -2.568 -10.022 14.564
391 HZ2 LYS 50 1HZ LYS 50 -1.165 -9.810 15.490
392 HZ3 LYS 50 2HZ LYS 50 -1.707 -11.373 15.115
393 H LEU 51 HN LEU 51 -1.205 -5.382 10.844
394 HA LEU 51 HA LEU 51 -1.763 -7.729 9.369
395 HB2 LEU 51 2HB LEU 51 -2.723 -4.901 8.961
396 HB3 LEU 51 1HB LEU 51 -3.382 -6.310 8.164
397 HG LEU 51 HG LEU 51 -3.474 -5.727 11.114
398 HD11 LEU 51 1HD1 LEU 51 -5.885 -5.555 10.754
399 HD12 LEU 51 2HD1 LEU 51 -5.646 -5.814 9.026
400 HD13 LEU 51 3HD1 LEU 51 -5.002 -4.365 9.797
401 HD21 LEU 51 3HD2 LEU 51 -3.234 -8.118 10.736
402 HD22 LEU 51 1HD2 LEU 51 -4.563 -8.085 9.576
403 HD23 LEU 51 2HD2 LEU 51 -4.869 -7.738 11.278
404 H ILE 52 HN ILE 52 -0.156 -4.676 8.545
405 HA ILE 52 HA ILE 52 0.108 -5.125 5.789
406 HB ILE 52 HB ILE 52 2.017 -3.605 7.579
407 HG12 ILE 52 2HG1 ILE 52 -0.378 -2.628 6.002
408 HG13 ILE 52 1HG1 ILE 52 -0.326 -2.822 7.750
409 HG21 ILE 52 1HG2 ILE 52 2.613 -2.389 5.533
410 HG22 ILE 52 2HG2 ILE 52 1.550 -3.447 4.603
411 HG23 ILE 52 3HG2 ILE 52 2.976 -4.110 5.400
412 HD11 ILE 52 3HD1 ILE 52 1.410 -1.112 7.888
413 HD12 ILE 52 1HD1 ILE 52 -0.048 -0.501 7.108
414 HD13 ILE 52 2HD1 ILE 52 1.359 -0.923 6.135
415 H MET 53 HN MET 53 2.182 -6.057 8.501
416 HA MET 53 HA MET 53 4.303 -7.170 7.043
417 HB2 MET 53 2HB MET 53 3.189 -8.045 9.722
418 HB3 MET 53 1HB MET 53 4.742 -8.538 9.068
419 HG2 MET 53 2HG MET 53 5.482 -6.202 9.106
420 HG3 MET 53 1HG MET 53 3.930 -5.736 9.797
421 HE1 MET 53 3HE MET 53 5.090 -4.552 11.857
422 HE2 MET 53 1HE MET 53 6.666 -4.938 11.161
423 HE3 MET 53 2HE MET 53 6.326 -5.315 12.853
424 H LYS 54 HN LYS 54 1.202 -8.526 8.048
425 HA LYS 54 HA LYS 54 1.816 -11.178 7.239
426 HB2 LYS 54 2HB LYS 54 -0.834 -9.848 7.811
427 HB3 LYS 54 1HB LYS 54 -0.636 -11.568 7.509
428 HG2 LYS 54 2HG LYS 54 0.724 -10.084 9.754
429 HG3 LYS 54 1HG LYS 54 -0.807 -10.940 9.917
430 HD2 LYS 54 2HD LYS 54 0.891 -12.402 10.715
431 HD3 LYS 54 1HD LYS 54 0.385 -13.018 9.145
432 HE2 LYS 54 2HE LYS 54 2.339 -11.949 8.107
433 HE3 LYS 54 1HE LYS 54 2.843 -11.354 9.687
434 HZ1 LYS 54 3HZ LYS 54 2.465 -14.242 9.163
435 HZ2 LYS 54 1HZ LYS 54 3.335 -13.498 10.417
436 HZ3 LYS 54 2HZ LYS 54 3.937 -13.460 8.828
437 H VAL 55 HN VAL 55 0.211 -8.461 5.664
438 HA VAL 55 HA VAL 55 -0.611 -9.795 3.330
439 HB VAL 55 HB VAL 55 0.365 -6.938 3.539
440 HG11 VAL 55 1HG1 VAL 55 -1.449 -8.271 1.531
441 HG12 VAL 55 2HG1 VAL 55 0.193 -7.694 1.242
442 HG13 VAL 55 3HG1 VAL 55 -1.094 -6.545 1.604
443 HG21 VAL 55 3HG2 VAL 55 -1.977 -6.330 3.872
444 HG22 VAL 55 1HG2 VAL 55 -1.389 -7.367 5.171
445 HG23 VAL 55 2HG2 VAL 55 -2.419 -8.036 3.902
446 H LEU 56 HN LEU 56 2.435 -8.227 4.189
447 HA LEU 56 HA LEU 56 3.603 -8.660 1.600
448 HB2 LEU 56 2HB LEU 56 4.758 -7.691 4.208
449 HB3 LEU 56 1HB LEU 56 5.657 -7.756 2.707
450 HG LEU 56 HG LEU 56 3.208 -6.068 3.226
451 HD11 LEU 56 1HD1 LEU 56 6.105 -5.309 2.882
452 HD12 LEU 56 2HD1 LEU 56 5.185 -5.250 4.385
453 HD13 LEU 56 3HD1 LEU 56 4.756 -4.185 3.048
454 HD21 LEU 56 3HD2 LEU 56 4.968 -6.262 0.784
455 HD22 LEU 56 1HD2 LEU 56 3.676 -5.087 1.029
456 HD23 LEU 56 2HD2 LEU 56 3.295 -6.805 0.909
457 H ASP 57 HN ASP 57 3.427 -10.441 4.533
458 HA ASP 57 HA ASP 57 5.845 -11.709 4.748
459 HB2 ASP 57 2HB ASP 57 3.708 -11.865 6.224
460 HB3 ASP 57 1HB ASP 57 3.324 -13.261 5.231
461 HA PRO 58 HA PRO 58 4.604 -15.322 1.858
462 HB2 PRO 58 2HB PRO 58 2.367 -15.177 0.355
463 HB3 PRO 58 1HB PRO 58 2.342 -15.780 2.016
464 HG2 PRO 58 2HG PRO 58 1.612 -13.073 0.971
465 HG3 PRO 58 1HG PRO 58 0.773 -14.067 2.176
466 HD2 PRO 58 2HD PRO 58 2.415 -11.998 2.828
467 HD3 PRO 58 1HD PRO 58 2.184 -13.415 3.870
468 H ILE 59 HN ILE 59 4.229 -12.022 0.966
469 HA ILE 59 HA ILE 59 4.745 -12.405 -1.838
470 HB ILE 59 HB ILE 59 4.973 -9.845 -0.253
471 HG12 ILE 59 2HG1 ILE 59 2.767 -10.928 0.063
472 HG13 ILE 59 1HG1 ILE 59 2.655 -9.415 -0.817
473 HG21 ILE 59 1HG2 ILE 59 5.974 -9.741 -2.466
474 HG22 ILE 59 2HG2 ILE 59 4.492 -8.786 -2.422
475 HG23 ILE 59 3HG2 ILE 59 4.494 -10.377 -3.185
476 HD11 ILE 59 3HD1 ILE 59 2.550 -12.171 -2.017
477 HD12 ILE 59 1HD1 ILE 59 2.457 -10.657 -2.917
478 HD13 ILE 59 2HD1 ILE 59 1.186 -11.081 -1.771
479 H TRP 60 HN TRP 60 6.607 -11.619 1.052
480 HA TRP 60 HA TRP 60 9.027 -10.900 -0.158
481 HB2 TRP 60 2HB TRP 60 8.424 -12.210 2.485
482 HB3 TRP 60 1HB TRP 60 10.068 -11.827 1.996
483 HD1 TRP 60 1HD TRP 60 7.157 -10.363 3.729
484 HE1 TRP 60 1HE TRP 60 7.520 -7.849 4.156
485 HE3 TRP 60 3HE TRP 60 11.198 -9.611 0.691
486 HZ2 TRP 60 2HZ TRP 60 9.292 -5.814 3.309
487 HZ3 TRP 60 3HZ TRP 60 12.170 -7.354 0.560
488 HH2 TRP 60 2HH TRP 60 11.236 -5.498 1.840
489 H GLU 61 HN GLU 61 7.539 -14.004 0.196
490 HA GLU 61 HA GLU 61 9.924 -15.528 -0.212
491 HB2 GLU 61 2HB GLU 61 7.000 -16.264 -0.237
492 HB3 GLU 61 1HB GLU 61 8.323 -17.403 -0.296
493 HG2 GLU 61 2HG GLU 61 9.089 -16.629 1.897
494 HG3 GLU 61 1HG GLU 61 7.731 -15.507 1.951
495 H GLN 62 HN GLN 62 7.369 -14.214 -2.166
496 HA GLN 62 HA GLN 62 8.177 -15.822 -4.469
497 HB2 GLN 62 2HB GLN 62 5.762 -14.066 -4.015
498 HB3 GLN 62 1HB GLN 62 6.074 -14.989 -5.473
499 HG2 GLN 62 2HG GLN 62 5.898 -17.062 -4.275
500 HG3 GLN 62 1HG GLN 62 5.766 -16.206 -2.740
501 HE21 GLN 62 1HE2 GLN 62 3.855 -15.173 -2.218
502 HE22 GLN 62 2HE2 GLN 62 2.368 -15.508 -3.047
503 H LYS 63 HN LYS 63 7.494 -12.444 -3.602
504 HA LYS 63 HA LYS 63 9.336 -11.570 -5.712
505 HB2 LYS 63 2HB LYS 63 6.602 -10.348 -5.253
506 HB3 LYS 63 1HB LYS 63 7.788 -9.834 -6.444
507 HG2 LYS 63 2HG LYS 63 7.539 -11.954 -7.620
508 HG3 LYS 63 1HG LYS 63 6.360 -12.488 -6.420
509 HD2 LYS 63 2HD LYS 63 4.926 -10.569 -7.032
510 HD3 LYS 63 1HD LYS 63 6.088 -10.130 -8.284
511 HE2 LYS 63 2HE LYS 63 4.562 -12.724 -8.120
512 HE3 LYS 63 1HE LYS 63 4.193 -11.382 -9.203
513 HZ1 LYS 63 3HZ LYS 63 6.637 -13.072 -9.221
514 HZ2 LYS 63 1HZ LYS 63 6.431 -11.687 -10.181
515 HZ3 LYS 63 2HZ LYS 63 5.416 -13.031 -10.397
516 HA PRO 64 HA PRO 64 10.195 -9.742 -1.526
517 HB2 PRO 64 2HB PRO 64 12.887 -9.531 -2.747
518 HB3 PRO 64 1HB PRO 64 12.409 -10.180 -1.175
519 HG2 PRO 64 2HG PRO 64 13.145 -11.796 -3.174
520 HG3 PRO 64 1HG PRO 64 11.857 -12.247 -2.042
521 HD2 PRO 64 2HD PRO 64 11.651 -11.256 -4.853
522 HD3 PRO 64 1HD PRO 64 10.675 -12.477 -4.009
523 H GLU 65 HN GLU 65 11.773 -8.563 -4.515
524 HA GLU 65 HA GLU 65 12.009 -5.914 -3.675
525 HB2 GLU 65 2HB GLU 65 11.714 -6.887 -6.506
526 HB3 GLU 65 1HB GLU 65 12.501 -5.429 -5.963
527 HG2 GLU 65 2HG GLU 65 14.360 -6.648 -6.233
528 HG3 GLU 65 1HG GLU 65 13.950 -7.225 -4.619
529 H THR 66 HN THR 66 9.455 -7.636 -5.376
530 HA THR 66 HA THR 66 7.923 -5.345 -6.066
531 HB THR 66 HB THR 66 6.996 -8.207 -5.725
532 HG1 THR 66 1HG THR 66 8.619 -8.039 -7.303
533 HG21 THR 66 3HG2 THR 66 5.133 -6.618 -5.737
534 HG22 THR 66 1HG2 THR 66 5.165 -7.568 -7.222
535 HG23 THR 66 2HG2 THR 66 5.749 -5.904 -7.226
536 H ALA 67 HN ALA 67 7.953 -7.486 -3.272
537 HA ALA 67 HA ALA 67 5.689 -6.516 -1.937
538 HB1 ALA 67 1HB ALA 67 8.279 -7.510 -0.749
539 HB2 ALA 67 2HB ALA 67 6.912 -8.515 -1.225
540 HB3 ALA 67 3HB ALA 67 6.742 -7.365 0.103
541 H SER 68 HN SER 68 9.020 -5.373 -1.997
542 HA SER 68 HA SER 68 8.671 -3.295 -0.098
543 HB2 SER 68 2HB SER 68 10.731 -3.531 -2.304
544 HB3 SER 68 1HB SER 68 10.836 -2.476 -0.894
545 HG SER 68 HG SER 68 10.858 -5.315 -0.943
546 H ARG 69 HN ARG 69 8.536 -3.413 -3.637
547 HA ARG 69 HA ARG 69 8.185 -0.646 -4.028
548 HB2 ARG 69 2HB ARG 69 7.373 -2.961 -5.786
549 HB3 ARG 69 1HB ARG 69 7.493 -1.294 -6.296
550 HG2 ARG 69 2HG ARG 69 9.953 -1.514 -5.440
551 HG3 ARG 69 1HG ARG 69 9.647 -3.235 -5.675
552 HD2 ARG 69 2HD ARG 69 10.595 -2.470 -7.694
553 HD3 ARG 69 1HD ARG 69 8.866 -2.638 -8.012
554 HE ARG 69 HE ARG 69 9.346 -0.014 -7.163
555 HH11 ARG 69 1HH1 ARG 69 10.047 -2.074 -9.916
556 HH12 ARG 69 2HH1 ARG 69 10.233 -0.734 -11.012
557 HH21 ARG 69 1HH2 ARG 69 9.586 1.721 -8.594
558 HH22 ARG 69 2HH2 ARG 69 9.962 1.418 -10.267
559 H LEU 70 HN LEU 70 5.908 -3.327 -3.699
560 HA LEU 70 HA LEU 70 3.550 -1.866 -4.164
561 HB2 LEU 70 2HB LEU 70 3.605 -4.302 -4.160
562 HB3 LEU 70 1HB LEU 70 4.031 -4.314 -2.460
563 HG LEU 70 HG LEU 70 1.828 -3.323 -1.922
564 HD11 LEU 70 1HD1 LEU 70 0.092 -3.231 -3.619
565 HD12 LEU 70 2HD1 LEU 70 1.239 -3.762 -4.847
566 HD13 LEU 70 3HD1 LEU 70 1.443 -2.192 -4.072
567 HD21 LEU 70 3HD2 LEU 70 0.514 -5.340 -2.377
568 HD22 LEU 70 1HD2 LEU 70 2.143 -5.734 -1.822
569 HD23 LEU 70 2HD2 LEU 70 1.737 -5.868 -3.532
570 H ARG 71 HN ARG 71 5.374 -2.564 -1.229
571 HA ARG 71 HA ARG 71 3.631 -1.457 0.654
572 HB2 ARG 71 2HB ARG 71 5.542 -2.871 1.240
573 HB3 ARG 71 1HB ARG 71 6.651 -1.609 0.721
574 HG2 ARG 71 2HG ARG 71 5.748 -0.137 2.478
575 HG3 ARG 71 1HG ARG 71 4.724 -1.465 3.027
576 HD2 ARG 71 2HD ARG 71 6.774 -1.259 4.361
577 HD3 ARG 71 1HD ARG 71 6.670 -2.806 3.524
578 HE ARG 71 HE ARG 71 8.332 -2.022 1.982
579 HH11 ARG 71 1HH1 ARG 71 7.803 0.046 4.739
580 HH12 ARG 71 2HH1 ARG 71 9.369 0.789 4.655
581 HH21 ARG 71 1HH2 ARG 71 10.393 -1.049 1.844
582 HH22 ARG 71 2HH2 ARG 71 10.853 0.175 2.982
583 H GLY 72 HN GLY 72 6.162 0.032 -1.293
584 HA2 GLY 72 2HA GLY 72 6.190 2.565 -0.076
585 HA3 GLY 72 1HA GLY 72 6.646 2.231 -1.741
586 H ARG 73 HN ARG 73 4.170 1.268 -2.673
587 HA ARG 73 HA ARG 73 2.815 3.731 -3.159
588 HB2 ARG 73 2HB ARG 73 1.931 0.911 -3.800
589 HB3 ARG 73 1HB ARG 73 1.223 2.382 -4.450
590 HG2 ARG 73 2HG ARG 73 3.471 2.907 -5.441
591 HG3 ARG 73 1HG ARG 73 3.973 1.284 -4.963
592 HD2 ARG 73 2HD ARG 73 1.734 2.013 -6.847
593 HD3 ARG 73 1HD ARG 73 3.270 1.261 -7.272
594 HE ARG 73 HE ARG 73 1.945 -0.344 -5.387
595 HH11 ARG 73 1HH1 ARG 73 1.703 0.647 -8.735
596 HH12 ARG 73 2HH1 ARG 73 0.869 -0.789 -9.235
597 HH21 ARG 73 1HH2 ARG 73 0.830 -2.232 -6.043
598 HH22 ARG 73 2HH2 ARG 73 0.370 -2.426 -7.707
599 H ILE 74 HN ILE 74 2.198 0.907 -1.146
600 HA ILE 74 HA ILE 74 -0.366 1.592 -0.225
601 HB ILE 74 HB ILE 74 1.829 0.098 1.231
602 HG12 ILE 74 2HG1 ILE 74 -0.529 -0.919 -0.379
603 HG13 ILE 74 1HG1 ILE 74 1.150 -0.921 -0.914
604 HG21 ILE 74 1HG2 ILE 74 -1.132 0.208 1.805
605 HG22 ILE 74 2HG2 ILE 74 0.144 0.937 2.782
606 HG23 ILE 74 3HG2 ILE 74 0.044 -0.818 2.627
607 HD11 ILE 74 3HD1 ILE 74 1.719 -2.464 0.887
608 HD12 ILE 74 1HD1 ILE 74 0.452 -3.118 -0.151
609 HD13 ILE 74 2HD1 ILE 74 0.041 -2.454 1.431
610 H GLU 75 HN GLU 75 2.863 2.472 0.942
611 HA GLU 75 HA GLU 75 2.150 3.938 3.213
612 HB2 GLU 75 2HB GLU 75 4.507 3.353 2.323
613 HB3 GLU 75 1HB GLU 75 4.355 4.816 1.356
614 HG2 GLU 75 2HG GLU 75 3.719 5.883 3.670
615 HG3 GLU 75 1HG GLU 75 4.617 4.503 4.297
616 H SER 76 HN SER 76 2.356 4.928 -0.180
617 HA SER 76 HA SER 76 1.786 7.651 0.224
618 HB2 SER 76 2HB SER 76 1.271 5.942 -2.201
619 HB3 SER 76 1HB SER 76 1.269 7.701 -2.182
620 HG SER 76 HG SER 76 3.510 6.253 -1.271
621 H VAL 77 HN VAL 77 -0.328 4.874 -0.337
622 HA VAL 77 HA VAL 77 -2.722 6.373 -0.627
623 HB VAL 77 HB VAL 77 -2.393 3.502 0.270
624 HG11 VAL 77 1HG1 VAL 77 -4.596 4.373 0.830
625 HG12 VAL 77 2HG1 VAL 77 -4.708 3.216 -0.496
626 HG13 VAL 77 3HG1 VAL 77 -4.808 4.946 -0.826
627 HG21 VAL 77 3HG2 VAL 77 -2.841 2.931 -2.070
628 HG22 VAL 77 1HG2 VAL 77 -1.377 3.903 -1.912
629 HG23 VAL 77 2HG2 VAL 77 -2.871 4.648 -2.483
630 H LEU 78 HN LEU 78 -1.314 4.628 2.137
631 HA LEU 78 HA LEU 78 -3.354 5.365 3.964
632 HB2 LEU 78 2HB LEU 78 -0.511 4.491 4.461
633 HB3 LEU 78 1HB LEU 78 -1.732 4.659 5.706
634 HG LEU 78 HG LEU 78 -1.818 2.709 3.402
635 HD11 LEU 78 1HD1 LEU 78 -1.355 2.293 6.352
636 HD12 LEU 78 2HD1 LEU 78 -0.159 2.106 5.069
637 HD13 LEU 78 3HD1 LEU 78 -1.540 1.014 5.151
638 HD21 LEU 78 3HD2 LEU 78 -3.783 1.783 4.539
639 HD22 LEU 78 1HD2 LEU 78 -4.054 3.445 4.017
640 HD23 LEU 78 2HD2 LEU 78 -3.718 3.097 5.714
641 H ASP 79 HN ASP 79 -0.339 6.857 2.990
642 HA ASP 79 HA ASP 79 -0.117 8.843 4.957
643 HB2 ASP 79 2HB ASP 79 1.591 8.273 3.211
644 HB3 ASP 79 1HB ASP 79 0.580 9.080 2.021
645 H TRP 80 HN TRP 80 -1.724 8.858 1.815
646 HA TRP 80 HA TRP 80 -2.892 11.401 1.943
647 HB2 TRP 80 2HB TRP 80 -2.749 10.161 -0.130
648 HB3 TRP 80 1HB TRP 80 -3.745 8.869 0.523
649 HD1 TRP 80 1HD TRP 80 -4.080 12.587 -0.528
650 HE1 TRP 80 1HE TRP 80 -6.494 12.954 -1.345
651 HE3 TRP 80 3HE TRP 80 -6.004 7.970 0.529
652 HZ2 TRP 80 2HZ TRP 80 -8.897 11.471 -1.518
653 HZ3 TRP 80 3HZ TRP 80 -8.364 7.524 0.005
654 HH2 TRP 80 2HH TRP 80 -9.780 9.242 -0.998
655 H ALA 81 HN ALA 81 -4.092 8.218 2.951
656 HA ALA 81 HA ALA 81 -6.651 8.997 3.779
657 HB1 ALA 81 1HB ALA 81 -6.667 6.939 5.106
658 HB2 ALA 81 2HB ALA 81 -4.927 6.776 4.875
659 HB3 ALA 81 3HB ALA 81 -6.016 6.661 3.491
660 H THR 82 HN THR 82 -3.557 9.085 5.456
661 HA THR 82 HA THR 82 -4.566 9.683 8.032
662 HB THR 82 HB THR 82 -1.866 10.411 6.877
663 HG1 THR 82 1HG THR 82 -2.143 8.187 6.737
664 HG21 THR 82 3HG2 THR 82 -2.322 11.599 8.950
665 HG22 THR 82 1HG2 THR 82 -1.113 10.345 9.223
666 HG23 THR 82 2HG2 THR 82 -2.780 10.088 9.738
667 H VAL 83 HN VAL 83 -3.412 11.740 5.378
668 HA VAL 83 HA VAL 83 -3.813 14.204 6.733
669 HB VAL 83 HB VAL 83 -3.780 13.693 3.751
670 HG11 VAL 83 1HG1 VAL 83 -4.678 15.894 4.299
671 HG12 VAL 83 2HG1 VAL 83 -3.074 16.044 3.580
672 HG13 VAL 83 3HG1 VAL 83 -3.278 16.227 5.322
673 HG21 VAL 83 3HG2 VAL 83 -1.513 14.390 5.618
674 HG22 VAL 83 1HG2 VAL 83 -1.403 14.273 3.863
675 HG23 VAL 83 2HG2 VAL 83 -1.761 12.835 4.820
676 H ARG 84 HN ARG 84 -5.827 12.216 4.645
677 HA ARG 84 HA ARG 84 -7.973 14.052 4.394
678 HB2 ARG 84 2HB ARG 84 -7.727 11.081 4.014
679 HB3 ARG 84 1HB ARG 84 -9.261 11.912 3.807
680 HG2 ARG 84 2HG ARG 84 -6.755 12.625 2.306
681 HG3 ARG 84 1HG ARG 84 -7.992 11.521 1.703
682 HD2 ARG 84 2HD ARG 84 -8.447 14.397 2.483
683 HD3 ARG 84 1HD ARG 84 -8.265 13.806 0.831
684 HE ARG 84 HE ARG 84 -10.301 12.337 1.522
685 HH11 ARG 84 1HH1 ARG 84 -9.723 15.657 2.467
686 HH12 ARG 84 2HH1 ARG 84 -11.410 16.051 2.600
687 HH21 ARG 84 1HH2 ARG 84 -12.514 12.844 1.670
688 HH22 ARG 84 2HH2 ARG 84 -13.001 14.445 2.144
689 H GLY 85 HN GLY 85 -7.048 11.843 6.899
690 HA2 GLY 85 2HA GLY 85 -7.892 11.992 9.102
691 HA3 GLY 85 1HA GLY 85 -9.336 12.764 8.468
692 H TYR 86 HN TYR 86 -8.118 9.879 6.973
693 HA TYR 86 HA TYR 86 -10.505 8.437 7.808
694 HB2 TYR 86 2HB TYR 86 -8.260 7.523 5.996
695 HB3 TYR 86 1HB TYR 86 -9.813 6.727 6.211
696 HD1 TYR 86 1HD TYR 86 -11.425 9.401 6.196
697 HD2 TYR 86 2HD TYR 86 -8.459 7.758 3.618
698 HE1 TYR 86 1HE TYR 86 -12.338 10.704 4.323
699 HE2 TYR 86 2HE TYR 86 -9.361 9.063 1.740
700 HH TYR 86 HH TYR 86 -11.627 10.109 1.139
701 H ARG 87 HN ARG 87 -7.472 8.961 8.968
702 HA ARG 87 HA ARG 87 -7.718 6.924 10.954
703 HB2 ARG 87 2HB ARG 87 -5.498 5.901 10.561
704 HB3 ARG 87 1HB ARG 87 -6.644 5.556 9.272
705 HG2 ARG 87 2HG ARG 87 -5.588 7.058 7.795
706 HG3 ARG 87 1HG ARG 87 -4.635 7.780 9.094
707 HD2 ARG 87 2HD ARG 87 -3.422 6.156 7.571
708 HD3 ARG 87 1HD ARG 87 -3.280 5.869 9.306
709 HE ARG 87 HE ARG 87 -5.219 4.401 7.645
710 HH11 ARG 87 1HH1 ARG 87 -2.591 4.451 9.967
711 HH12 ARG 87 2HH1 ARG 87 -2.739 2.768 10.357
712 HH21 ARG 87 1HH2 ARG 87 -5.428 2.198 8.166
713 HH22 ARG 87 2HH2 ARG 87 -4.335 1.476 9.315
714 H GLU 88 HN GLU 88 -5.899 7.069 12.535
715 HA GLU 88 HA GLU 88 -4.569 9.675 12.498
716 HB2 GLU 88 2HB GLU 88 -5.099 10.023 14.868
717 HB3 GLU 88 1HB GLU 88 -6.556 9.936 13.897
718 HG2 GLU 88 2HG GLU 88 -5.465 7.667 15.551
719 HG3 GLU 88 1HG GLU 88 -6.728 8.778 16.074
720 H GLY 89 HN GLY 89 -2.863 9.743 14.306
721 HA2 GLY 89 2HA GLY 89 -1.258 8.583 15.615
722 HA3 GLY 89 1HA GLY 89 -1.728 7.089 14.818
723 H ASP 90 HN ASP 90 -0.178 6.302 13.603
724 HA ASP 90 HA ASP 90 1.535 8.147 12.072
725 HB2 ASP 90 2HB ASP 90 2.696 7.172 14.084
726 HB3 ASP 90 1HB ASP 90 2.452 5.574 13.393
727 H ASN 91 HN ASN 91 2.718 6.844 10.275
728 HA ASN 91 HA ASN 91 0.682 5.187 8.972
729 HB2 ASN 91 2HB ASN 91 1.420 7.245 7.758
730 HB3 ASN 91 1HB ASN 91 3.029 6.532 7.623
731 HD21 ASN 91 1HD2 ASN 91 2.713 6.649 5.305
732 HD22 ASN 91 2HD2 ASN 91 1.762 5.448 4.507
733 HA PRO 92 HA PRO 92 3.524 2.008 10.493
734 HB2 PRO 92 2HB PRO 92 1.814 -0.062 9.969
735 HB3 PRO 92 1HB PRO 92 1.699 0.961 11.403
736 HG2 PRO 92 2HG PRO 92 0.199 1.147 8.816
737 HG3 PRO 92 1HG PRO 92 -0.424 1.246 10.476
738 HD2 PRO 92 2HD PRO 92 -0.019 3.447 9.030
739 HD3 PRO 92 1HD PRO 92 0.359 3.417 10.765
740 H ALA 93 HN ALA 93 2.889 2.770 7.355
741 HA ALA 93 HA ALA 93 3.635 0.215 6.182
742 HB1 ALA 93 1HB ALA 93 2.953 2.828 4.852
743 HB2 ALA 93 2HB ALA 93 1.830 1.504 5.165
744 HB3 ALA 93 3HB ALA 93 3.177 1.275 4.049
745 H ARG 94 HN ARG 94 5.173 3.208 7.041
746 HA ARG 94 HA ARG 94 7.211 2.940 5.023
747 HB2 ARG 94 2HB ARG 94 8.265 4.905 6.265
748 HB3 ARG 94 1HB ARG 94 6.745 5.168 5.430
749 HG2 ARG 94 2HG ARG 94 5.547 5.027 7.538
750 HG3 ARG 94 1HG ARG 94 7.062 4.718 8.390
751 HD2 ARG 94 2HD ARG 94 6.178 7.113 8.409
752 HD3 ARG 94 1HD ARG 94 7.871 6.882 7.964
753 HE ARG 94 HE ARG 94 6.277 6.845 5.643
754 HH11 ARG 94 1HH1 ARG 94 7.376 9.094 8.085
755 HH12 ARG 94 2HH1 ARG 94 7.398 10.451 6.995
756 HH21 ARG 94 1HH2 ARG 94 6.335 8.588 4.207
757 HH22 ARG 94 2HH2 ARG 94 6.817 10.168 4.778
758 H TRP 95 HN TRP 95 7.178 2.682 8.581
759 HA TRP 95 HA TRP 95 8.514 1.540 10.026
760 HB2 TRP 95 2HB TRP 95 9.115 0.138 7.471
761 HB3 TRP 95 1HB TRP 95 10.182 -0.144 8.844
762 HD1 TRP 95 1HD TRP 95 8.802 -0.912 11.177
763 HE1 TRP 95 1HE TRP 95 6.891 -2.625 11.363
764 HE3 TRP 95 3HE TRP 95 7.197 -0.861 6.328
765 HZ2 TRP 95 2HZ TRP 95 4.946 -3.786 9.677
766 HZ3 TRP 95 3HZ TRP 95 5.299 -2.296 5.700
767 HH2 TRP 95 2HH TRP 95 4.199 -3.726 7.340
768 H ARG 96 HN ARG 96 10.416 1.864 11.071
769 HA ARG 96 HA ARG 96 12.325 3.688 9.865
770 HB2 ARG 96 2HB ARG 96 11.513 3.852 12.249
771 HB3 ARG 96 1HB ARG 96 12.405 2.377 12.585
772 HG2 ARG 96 2HG ARG 96 14.486 3.488 11.974
773 HG3 ARG 96 1HG ARG 96 13.591 4.971 11.632
774 HD2 ARG 96 2HD ARG 96 12.773 4.907 14.000
775 HD3 ARG 96 1HD ARG 96 13.895 3.578 14.284
776 HE ARG 96 HE ARG 96 15.467 5.539 13.240
777 HH11 ARG 96 1HH1 ARG 96 13.264 5.337 15.957
778 HH12 ARG 96 2HH1 ARG 96 14.054 6.604 16.853
779 HH21 ARG 96 1HH2 ARG 96 16.532 7.163 14.428
780 HH22 ARG 96 2HH2 ARG 96 15.937 7.627 15.995
781 H GLY 97 HN GLY 97 12.006 0.357 10.731
782 HA2 GLY 97 2HA GLY 97 14.233 -0.399 9.076
783 HA3 GLY 97 1HA GLY 97 14.510 -0.686 10.788
784 H TYR 98 HN TYR 98 12.843 -1.705 7.953
785 HA TYR 98 HA TYR 98 10.774 -3.235 9.074
786 HB2 TYR 98 2HB TYR 98 11.077 -2.534 6.643
787 HB3 TYR 98 1HB TYR 98 12.201 -3.876 6.488
788 HD1 TYR 98 2HD TYR 98 11.150 -6.203 7.417
789 HD2 TYR 98 1HD TYR 98 8.924 -2.899 5.933
790 HE1 TYR 98 2HE TYR 98 9.275 -7.707 6.909
791 HE2 TYR 98 1HE TYR 98 7.039 -4.394 5.424
792 HH TYR 98 HH TYR 98 6.852 -7.593 6.579
793 H LEU 99 HN LEU 99 13.833 -4.460 7.667
794 HA LEU 99 HA LEU 99 13.564 -6.815 9.416
795 HB2 LEU 99 2HB LEU 99 14.933 -6.484 6.747
796 HB3 LEU 99 1HB LEU 99 15.084 -7.911 7.746
797 HG LEU 99 HG LEU 99 12.516 -6.892 6.534
798 HD11 LEU 99 1HD1 LEU 99 14.010 -7.787 4.848
799 HD12 LEU 99 2HD1 LEU 99 12.661 -8.889 5.120
800 HD13 LEU 99 3HD1 LEU 99 14.246 -9.250 5.804
801 HD21 LEU 99 3HD2 LEU 99 12.116 -8.027 8.646
802 HD22 LEU 99 1HD2 LEU 99 13.087 -9.399 8.115
803 HD23 LEU 99 2HD2 LEU 99 11.570 -9.025 7.299
804 H GLU 100 HN GLU 100 15.984 -4.713 7.898
805 HA GLU 100 HA GLU 100 17.668 -4.843 10.253
806 HB2 GLU 100 2HB GLU 100 18.250 -6.873 8.982
807 HB3 GLU 100 1HB GLU 100 18.583 -5.892 7.565
808 HG2 GLU 100 2HG GLU 100 20.480 -4.903 8.603
809 HG3 GLU 100 1HG GLU 100 20.070 -5.622 10.162
810 H HIS 101 HN HIS 101 19.347 -3.225 10.211
811 HA HIS 101 HA HIS 101 18.998 -1.213 8.090
812 HB2 HIS 101 2HB HIS 101 17.654 -0.694 10.177
813 HB3 HIS 101 1HB HIS 101 19.183 -0.532 11.030
814 HD1 HIS 101 1HD HIS 101 20.555 1.614 10.618
815 HD2 HIS 101 2HD HIS 101 17.049 1.387 8.380
816 HE1 HIS 101 1HE HIS 101 20.169 3.929 9.713
817 HE2 HIS 101 2HE HIS 101 17.953 3.809 8.518
818 H HIS 102 HN HIS 102 21.035 -2.243 7.378
819 HA HIS 102 HA HIS 102 23.416 -1.634 8.898
820 HB2 HIS 102 2HB HIS 102 22.976 -2.606 6.075
821 HB3 HIS 102 1HB HIS 102 24.571 -2.193 6.687
822 HD1 HIS 102 1HD HIS 102 23.195 -5.065 5.817
823 HD2 HIS 102 2HD HIS 102 24.400 -3.737 9.572
824 HE1 HIS 102 1HE HIS 102 23.664 -7.147 7.157
825 HE2 HIS 102 2HE HIS 102 24.529 -6.317 9.380
826 H HIS 103 HN HIS 103 23.174 0.594 9.263
827 HA HIS 103 HA HIS 103 23.499 2.810 8.857
828 HB2 HIS 103 2HB HIS 103 25.386 1.518 7.321
829 HB3 HIS 103 1HB HIS 103 24.556 2.503 6.123
830 HD1 HIS 103 1HD HIS 103 26.933 2.677 8.954
831 HD2 HIS 103 2HD HIS 103 24.806 5.307 6.527
832 HE1 HIS 103 1HE HIS 103 27.961 4.940 9.335
833 HE2 HIS 103 2HE HIS 103 26.803 6.467 7.690
834 H HIS 104 HN HIS 104 23.203 4.382 6.586
835 HA HIS 104 HA HIS 104 20.830 3.495 5.172
836 HB2 HIS 104 2HB HIS 104 19.896 4.570 7.167
837 HB3 HIS 104 1HB HIS 104 20.837 6.022 6.844
838 HD1 HIS 104 1HD HIS 104 17.879 4.070 5.541
839 HD2 HIS 104 2HD HIS 104 19.728 7.761 5.002
840 HE1 HIS 104 1HE HIS 104 16.301 5.424 4.128
841 HE2 HIS 104 2HE HIS 104 17.346 7.715 3.996
842 H HIS 105 HN HIS 105 20.663 4.354 3.159
843 HA HIS 105 HA HIS 105 22.232 6.687 2.429
844 HB2 HIS 105 2HB HIS 105 23.412 5.555 0.602
845 HB3 HIS 105 1HB HIS 105 23.839 4.840 2.152
846 HD1 HIS 105 1HD HIS 105 23.051 2.401 2.596
847 HD2 HIS 105 2HD HIS 105 22.044 3.872 -1.164
848 HE1 HIS 105 1HE HIS 105 22.336 0.402 1.255
849 HE2 HIS 105 2HE HIS 105 21.588 1.333 -0.967
850 H HIS 106 HN HIS 106 21.767 7.358 0.175
851 HA HIS 106 HA HIS 106 18.982 6.944 -0.451
852 HB2 HIS 106 2HB HIS 106 20.000 9.171 -0.709
853 HB3 HIS 106 1HB HIS 106 21.105 8.531 -1.922
854 HD1 HIS 106 1HD HIS 106 17.580 9.664 -1.431
855 HD2 HIS 106 2HD HIS 106 19.946 8.047 -4.449
856 HE1 HIS 106 1HE HIS 106 16.257 9.928 -3.554
857 HE2 HIS 106 2HE HIS 106 17.613 8.742 -5.319
Start of MODEL 3
1 H1 MET 1 H1 MET 1 -14.688 3.556 6.162
2 H2 MET 1 H2 MET 1 -15.698 2.750 5.056
3 H3 MET 1 H3 MET 1 -15.688 4.446 5.118
4 HA MET 1 HA MET 1 -14.478 3.591 3.208
5 HB2 MET 1 2HB MET 1 -13.871 5.754 4.261
6 HB3 MET 1 1HB MET 1 -12.703 4.910 5.271
7 HG2 MET 1 2HG MET 1 -11.243 5.427 3.674
8 HG3 MET 1 1HG MET 1 -11.966 4.089 2.793
9 HE1 MET 1 2HE MET 1 -14.561 6.003 0.504
10 HE2 MET 1 3HE MET 1 -14.853 5.313 2.100
11 HE3 MET 1 1HE MET 1 -13.897 4.423 0.916
12 H THR 2 HN THR 2 -13.624 1.745 2.527
13 HA THR 2 HA THR 2 -11.871 0.216 4.307
14 HB THR 2 HB THR 2 -12.049 -1.571 2.587
15 HG1 THR 2 1HG THR 2 -14.009 0.129 1.391
16 HG21 THR 2 3HG2 THR 2 -13.599 -1.542 4.483
17 HG22 THR 2 1HG2 THR 2 -14.403 -2.139 3.031
18 HG23 THR 2 2HG2 THR 2 -14.694 -0.494 3.586
19 H PHE 3 HN PHE 3 -9.979 -0.873 3.163
20 HA PHE 3 HA PHE 3 -8.190 1.148 2.386
21 HB2 PHE 3 2HB PHE 3 -7.530 -0.989 3.464
22 HB3 PHE 3 1HB PHE 3 -7.908 -1.835 1.967
23 HD1 PHE 3 2HD PHE 3 -5.734 0.819 3.385
24 HD2 PHE 3 1HD PHE 3 -6.298 -2.054 0.296
25 HE1 PHE 3 2HE PHE 3 -3.445 1.234 2.581
26 HE2 PHE 3 1HE PHE 3 -4.012 -1.641 -0.511
27 HZ PHE 3 HZ PHE 3 -2.580 0.003 0.631
28 H SER 4 HN SER 4 -9.933 -1.291 0.497
29 HA SER 4 HA SER 4 -8.775 -0.724 -1.998
30 HB2 SER 4 2HB SER 4 -11.593 -1.680 -1.448
31 HB3 SER 4 1HB SER 4 -10.718 -1.840 -2.970
32 HG SER 4 HG SER 4 -10.129 -3.067 -0.485
33 H GLU 5 HN GLU 5 -11.698 0.599 -0.473
34 HA GLU 5 HA GLU 5 -12.523 2.241 -2.581
35 HB2 GLU 5 2HB GLU 5 -12.908 2.503 0.399
36 HB3 GLU 5 1HB GLU 5 -13.743 3.490 -0.784
37 HG2 GLU 5 2HG GLU 5 -14.844 1.557 -1.694
38 HG3 GLU 5 1HG GLU 5 -13.919 0.497 -0.634
39 H CYS 6 HN CYS 6 -10.486 2.920 0.228
40 HA CYS 6 HA CYS 6 -10.132 5.673 -0.262
41 HB2 CYS 6 2HB CYS 6 -9.640 4.375 1.877
42 HB3 CYS 6 1HB CYS 6 -8.138 3.880 1.115
43 HG CYS 6 HG CYS 6 -7.678 6.829 0.637
44 H ALA 7 HN ALA 7 -8.114 2.866 -1.021
45 HA ALA 7 HA ALA 7 -6.024 4.157 -2.328
46 HB1 ALA 7 1HB ALA 7 -5.604 2.039 -3.458
47 HB2 ALA 7 2HB ALA 7 -7.213 1.470 -3.017
48 HB3 ALA 7 3HB ALA 7 -6.010 1.766 -1.764
49 H ALA 8 HN ALA 8 -9.085 2.950 -3.638
50 HA ALA 8 HA ALA 8 -8.671 3.669 -6.304
51 HB1 ALA 8 1HB ALA 8 -11.282 3.555 -4.800
52 HB2 ALA 8 2HB ALA 8 -10.481 2.194 -5.588
53 HB3 ALA 8 3HB ALA 8 -11.093 3.540 -6.553
54 H LEU 9 HN LEU 9 -10.029 5.537 -3.608
55 HA LEU 9 HA LEU 9 -10.828 7.792 -5.081
56 HB2 LEU 9 2HB LEU 9 -9.923 7.562 -2.211
57 HB3 LEU 9 1HB LEU 9 -10.627 9.006 -2.901
58 HG LEU 9 HG LEU 9 -12.028 6.343 -2.678
59 HD11 LEU 9 1HD1 LEU 9 -11.690 7.375 -0.502
60 HD12 LEU 9 2HD1 LEU 9 -13.386 7.476 -0.979
61 HD13 LEU 9 3HD1 LEU 9 -12.346 8.897 -1.105
62 HD21 LEU 9 3HD2 LEU 9 -12.761 7.664 -4.600
63 HD22 LEU 9 1HD2 LEU 9 -13.032 9.050 -3.542
64 HD23 LEU 9 2HD2 LEU 9 -14.009 7.594 -3.352
65 H TYR 10 HN TYR 10 -7.778 7.066 -3.430
66 HA TYR 10 HA TYR 10 -6.404 9.437 -3.983
67 HB2 TYR 10 2HB TYR 10 -5.536 7.753 -2.446
68 HB3 TYR 10 1HB TYR 10 -5.361 6.601 -3.761
69 HD1 TYR 10 2HD TYR 10 -4.054 9.771 -2.381
70 HD2 TYR 10 1HD TYR 10 -3.427 6.593 -5.126
71 HE1 TYR 10 2HE TYR 10 -1.749 10.547 -2.740
72 HE2 TYR 10 1HE TYR 10 -1.120 7.352 -5.493
73 HH TYR 10 HH TYR 10 0.229 9.353 -5.279
74 H ILE 11 HN ILE 11 -6.616 6.430 -5.801
75 HA ILE 11 HA ILE 11 -5.015 7.131 -7.983
76 HB ILE 11 HB ILE 11 -7.362 5.237 -7.828
77 HG12 ILE 11 2HG1 ILE 11 -4.394 4.677 -7.794
78 HG13 ILE 11 1HG1 ILE 11 -5.386 4.801 -6.347
79 HG21 ILE 11 1HG2 ILE 11 -6.994 5.858 -10.144
80 HG22 ILE 11 2HG2 ILE 11 -6.459 4.201 -9.866
81 HG23 ILE 11 3HG2 ILE 11 -5.273 5.500 -9.988
82 HD11 ILE 11 3HD1 ILE 11 -5.008 2.490 -6.962
83 HD12 ILE 11 1HD1 ILE 11 -5.720 2.782 -8.550
84 HD13 ILE 11 2HD1 ILE 11 -6.717 2.904 -7.101
85 H LYS 12 HN LYS 12 -8.537 7.399 -7.558
86 HA LYS 12 HA LYS 12 -9.112 8.480 -10.088
87 HB2 LYS 12 2HB LYS 12 -10.567 8.794 -7.458
88 HB3 LYS 12 1HB LYS 12 -11.220 9.275 -9.016
89 HG2 LYS 12 2HG LYS 12 -11.340 7.036 -9.762
90 HG3 LYS 12 1HG LYS 12 -10.371 6.458 -8.404
91 HD2 LYS 12 2HD LYS 12 -12.161 7.126 -6.859
92 HD3 LYS 12 1HD LYS 12 -13.127 7.678 -8.229
93 HE2 LYS 12 2HE LYS 12 -13.202 5.418 -9.116
94 HE3 LYS 12 1HE LYS 12 -12.173 4.847 -7.803
95 HZ1 LYS 12 3HZ LYS 12 -14.829 6.105 -7.378
96 HZ2 LYS 12 1HZ LYS 12 -13.880 5.297 -6.226
97 HZ3 LYS 12 2HZ LYS 12 -14.596 4.428 -7.498
98 H ALA 13 HN ALA 13 -8.207 10.006 -7.044
99 HA ALA 13 HA ALA 13 -8.844 12.654 -7.818
100 HB1 ALA 13 1HB ALA 13 -7.593 13.333 -5.844
101 HB2 ALA 13 2HB ALA 13 -6.915 11.712 -5.702
102 HB3 ALA 13 3HB ALA 13 -8.646 11.965 -5.480
103 H HIS 14 HN HIS 14 -6.085 10.639 -8.454
104 HA HIS 14 HA HIS 14 -4.670 13.000 -9.529
105 HB2 HIS 14 2HB HIS 14 -3.737 11.789 -7.411
106 HB3 HIS 14 1HB HIS 14 -3.212 10.557 -8.554
107 HD1 HIS 14 1HD HIS 14 -0.980 10.939 -9.594
108 HD2 HIS 14 2HD HIS 14 -2.622 14.441 -8.066
109 HE1 HIS 14 1HE HIS 14 0.814 12.687 -9.828
110 HE2 HIS 14 2HE HIS 14 -0.221 14.816 -8.961
111 H ARG 15 HN ARG 15 -6.515 10.945 -10.767
112 HA ARG 15 HA ARG 15 -4.862 9.185 -12.301
113 HB2 ARG 15 2HB ARG 15 -6.875 8.353 -13.247
114 HB3 ARG 15 1HB ARG 15 -7.220 8.691 -11.558
115 HG2 ARG 15 2HG ARG 15 -8.177 10.897 -12.339
116 HG3 ARG 15 1HG ARG 15 -8.062 10.256 -13.975
117 HD2 ARG 15 2HD ARG 15 -9.727 9.261 -11.684
118 HD3 ARG 15 1HD ARG 15 -10.270 9.829 -13.258
119 HE ARG 15 HE ARG 15 -8.613 7.516 -13.499
120 HH11 ARG 15 1HH1 ARG 15 -11.879 8.616 -12.863
121 HH12 ARG 15 2HH1 ARG 15 -12.592 7.047 -13.092
122 HH21 ARG 15 1HH2 ARG 15 -9.556 5.443 -13.809
123 HH22 ARG 15 2HH2 ARG 15 -11.275 5.260 -13.635
124 H SER 16 HN SER 16 -6.355 12.311 -12.824
125 HA SER 16 HA SER 16 -5.998 12.399 -15.629
126 HB2 SER 16 2HB SER 16 -6.228 14.663 -13.638
127 HB3 SER 16 1HB SER 16 -6.502 14.763 -15.370
128 HG SER 16 HG SER 16 -8.493 14.295 -14.879
129 H SER 17 HN SER 17 -3.912 12.897 -12.939
130 HA SER 17 HA SER 17 -1.925 14.385 -14.392
131 HB2 SER 17 2HB SER 17 -2.334 14.443 -11.862
132 HB3 SER 17 1HB SER 17 -1.505 12.890 -11.804
133 HG SER 17 HG SER 17 -0.466 15.351 -11.920
134 H TRP 18 HN TRP 18 -2.731 11.075 -13.829
135 HA TRP 18 HA TRP 18 -0.204 10.113 -14.941
136 HB2 TRP 18 2HB TRP 18 -2.606 8.570 -13.927
137 HB3 TRP 18 1HB TRP 18 -1.083 7.861 -14.449
138 HD1 TRP 18 1HD TRP 18 0.866 9.887 -12.857
139 HE1 TRP 18 1HE TRP 18 1.054 9.662 -10.291
140 HE3 TRP 18 3HE TRP 18 -3.503 7.389 -11.945
141 HZ2 TRP 18 2HZ TRP 18 -0.460 8.568 -8.176
142 HZ3 TRP 18 3HZ TRP 18 -4.056 6.789 -9.626
143 HH2 TRP 18 2HH TRP 18 -2.567 7.367 -7.779
144 H LYS 19 HN LYS 19 -1.448 11.614 -16.756
145 HA LYS 19 HA LYS 19 -2.767 9.737 -18.580
146 HB2 LYS 19 2HB LYS 19 -4.188 11.672 -17.449
147 HB3 LYS 19 1HB LYS 19 -3.385 12.668 -18.654
148 HG2 LYS 19 2HG LYS 19 -5.475 12.031 -19.559
149 HG3 LYS 19 1HG LYS 19 -4.245 11.079 -20.397
150 HD2 LYS 19 2HD LYS 19 -4.708 9.196 -18.878
151 HD3 LYS 19 1HD LYS 19 -5.979 10.151 -18.110
152 HE2 LYS 19 2HE LYS 19 -7.134 10.299 -20.293
153 HE3 LYS 19 1HE LYS 19 -5.895 9.249 -20.985
154 HZ1 LYS 19 3HZ LYS 19 -6.535 7.596 -19.240
155 HZ2 LYS 19 1HZ LYS 19 -7.716 7.884 -20.424
156 HZ3 LYS 19 2HZ LYS 19 -7.869 8.575 -18.883
157 H ASN 20 HN ASN 20 -0.480 10.484 -20.899
158 HA ASN 20 HA ASN 20 -2.875 9.174 -19.861
159 HB2 ASN 20 2HB ASN 20 -3.205 10.090 -22.122
160 HB3 ASN 20 1HB ASN 20 -1.815 9.177 -22.699
161 HD21 ASN 20 1HD2 ASN 20 -2.823 7.896 -24.135
162 HD22 ASN 20 2HD2 ASN 20 -4.025 6.719 -23.716
163 H THR 21 HN THR 21 -1.744 7.852 -18.439
164 HA THR 21 HA THR 21 -0.294 5.668 -19.756
165 HB THR 21 HB THR 21 1.122 5.546 -17.614
166 HG1 THR 21 1HG THR 21 0.386 8.296 -17.478
167 HG21 THR 21 3HG2 THR 21 1.516 7.854 -19.521
168 HG22 THR 21 1HG2 THR 21 2.037 6.190 -19.787
169 HG23 THR 21 2HG2 THR 21 2.760 7.145 -18.493
170 H LYS 22 HN LYS 22 -0.228 3.675 -18.437
171 HA LYS 22 HA LYS 22 -2.794 3.336 -17.087
172 HB2 LYS 22 2HB LYS 22 -0.819 1.394 -18.249
173 HB3 LYS 22 1HB LYS 22 -2.157 0.882 -17.233
174 HG2 LYS 22 2HG LYS 22 -3.720 1.960 -18.831
175 HG3 LYS 22 1HG LYS 22 -2.342 2.316 -19.875
176 HD2 LYS 22 2HD LYS 22 -3.476 0.299 -20.622
177 HD3 LYS 22 1HD LYS 22 -1.861 -0.091 -20.028
178 HE2 LYS 22 2HE LYS 22 -3.399 -1.739 -19.207
179 HE3 LYS 22 1HE LYS 22 -2.876 -0.735 -17.857
180 HZ1 LYS 22 3HZ LYS 22 -5.470 -0.606 -19.296
181 HZ2 LYS 22 1HZ LYS 22 -4.964 0.559 -18.168
182 HZ3 LYS 22 2HZ LYS 22 -5.209 -1.043 -17.675
183 H HIS 23 HN HIS 23 -0.542 4.636 -15.764
184 HA HIS 23 HA HIS 23 0.515 2.930 -13.779
185 HB2 HIS 23 2HB HIS 23 0.057 5.914 -13.821
186 HB3 HIS 23 1HB HIS 23 0.740 5.095 -12.422
187 HD1 HIS 23 1HD HIS 23 3.139 4.036 -12.726
188 HD2 HIS 23 2HD HIS 23 1.792 6.333 -15.925
189 HE1 HIS 23 1HE HIS 23 5.172 4.506 -14.131
190 HE2 HIS 23 2HE HIS 23 4.323 5.818 -16.112
191 H ALA 24 HN ALA 24 -2.462 4.813 -13.969
192 HA ALA 24 HA ALA 24 -3.390 4.368 -11.357
193 HB1 ALA 24 1HB ALA 24 -5.597 4.935 -12.230
194 HB2 ALA 24 2HB ALA 24 -4.999 4.757 -13.881
195 HB3 ALA 24 3HB ALA 24 -4.366 6.040 -12.846
196 H ASP 25 HN ASP 25 -3.664 2.489 -14.315
197 HA ASP 25 HA ASP 25 -5.339 0.429 -13.380
198 HB2 ASP 25 2HB ASP 25 -4.750 0.759 -15.768
199 HB3 ASP 25 1HB ASP 25 -3.098 0.266 -15.417
200 H GLN 26 HN GLN 26 -1.801 0.682 -13.532
201 HA GLN 26 HA GLN 26 -1.216 -1.800 -12.409
202 HB2 GLN 26 2HB GLN 26 0.345 0.769 -12.568
203 HB3 GLN 26 1HB GLN 26 1.020 -0.704 -11.898
204 HG2 GLN 26 2HG GLN 26 -0.077 -0.448 -14.684
205 HG3 GLN 26 1HG GLN 26 1.626 -0.307 -14.259
206 HE21 GLN 26 1HE2 GLN 26 2.215 -2.057 -15.519
207 HE22 GLN 26 2HE2 GLN 26 1.831 -3.683 -15.084
208 H TRP 27 HN TRP 27 -1.712 1.351 -10.859
209 HA TRP 27 HA TRP 27 -0.988 0.639 -8.252
210 HB2 TRP 27 2HB TRP 27 -2.820 2.686 -9.424
211 HB3 TRP 27 1HB TRP 27 -2.900 2.393 -7.691
212 HD1 TRP 27 1HD TRP 27 -0.203 3.308 -10.332
213 HE1 TRP 27 1HE TRP 27 1.509 4.875 -9.211
214 HE3 TRP 27 3HE TRP 27 -2.121 3.311 -5.600
215 HZ2 TRP 27 2HZ TRP 27 1.971 5.968 -6.636
216 HZ3 TRP 27 3HZ TRP 27 -0.994 4.638 -3.865
217 HH2 TRP 27 2HH TRP 27 1.009 5.939 -4.372
218 H THR 28 HN THR 28 -4.160 0.496 -9.831
219 HA THR 28 HA THR 28 -5.509 -0.671 -7.622
220 HB THR 28 HB THR 28 -6.348 -0.912 -10.514
221 HG1 THR 28 1HG THR 28 -5.965 1.269 -10.242
222 HG21 THR 28 3HG2 THR 28 -7.678 -2.153 -8.866
223 HG22 THR 28 1HG2 THR 28 -8.603 -0.830 -9.579
224 HG23 THR 28 2HG2 THR 28 -7.933 -0.664 -7.955
225 H ASN 29 HN ASN 29 -4.084 -1.955 -10.575
226 HA ASN 29 HA ASN 29 -5.117 -4.534 -10.516
227 HB2 ASN 29 2HB ASN 29 -3.744 -3.173 -12.301
228 HB3 ASN 29 1HB ASN 29 -2.368 -3.992 -11.577
229 HD21 ASN 29 1HD2 ASN 29 -3.599 -4.135 -14.246
230 HD22 ASN 29 2HD2 ASN 29 -3.926 -5.824 -14.513
231 H THR 30 HN THR 30 -2.069 -3.306 -9.128
232 HA THR 30 HA THR 30 -1.164 -5.872 -8.282
233 HB THR 30 HB THR 30 -0.333 -3.239 -7.061
234 HG1 THR 30 1HG THR 30 -0.059 -4.059 -9.620
235 HG21 THR 30 3HG2 THR 30 0.466 -5.235 -5.914
236 HG22 THR 30 1HG2 THR 30 1.799 -4.415 -6.726
237 HG23 THR 30 2HG2 THR 30 1.098 -5.870 -7.432
238 H ILE 31 HN ILE 31 -2.702 -3.155 -6.579
239 HA ILE 31 HA ILE 31 -2.644 -4.348 -4.026
240 HB ILE 31 HB ILE 31 -4.430 -2.158 -5.100
241 HG12 ILE 31 2HG1 ILE 31 -1.911 -2.051 -3.423
242 HG13 ILE 31 1HG1 ILE 31 -2.011 -1.664 -5.138
243 HG21 ILE 31 1HG2 ILE 31 -4.851 -1.577 -2.755
244 HG22 ILE 31 2HG2 ILE 31 -3.941 -2.997 -2.246
245 HG23 ILE 31 3HG2 ILE 31 -5.446 -3.193 -3.140
246 HD11 ILE 31 3HD1 ILE 31 -3.515 0.197 -4.614
247 HD12 ILE 31 1HD1 ILE 31 -1.958 0.349 -3.797
248 HD13 ILE 31 2HD1 ILE 31 -3.377 -0.190 -2.899
249 H LYS 32 HN LYS 32 -5.096 -4.279 -6.561
250 HA LYS 32 HA LYS 32 -7.201 -5.485 -5.176
251 HB2 LYS 32 2HB LYS 32 -7.308 -4.435 -7.460
252 HB3 LYS 32 1HB LYS 32 -6.505 -5.861 -8.095
253 HG2 LYS 32 2HG LYS 32 -8.380 -7.247 -7.389
254 HG3 LYS 32 1HG LYS 32 -9.195 -5.821 -6.739
255 HD2 LYS 32 2HD LYS 32 -9.209 -4.829 -8.988
256 HD3 LYS 32 1HD LYS 32 -8.423 -6.277 -9.620
257 HE2 LYS 32 2HE LYS 32 -10.356 -7.614 -8.886
258 HE3 LYS 32 1HE LYS 32 -11.142 -6.140 -8.323
259 HZ1 LYS 32 3HZ LYS 32 -10.386 -6.770 -11.126
260 HZ2 LYS 32 1HZ LYS 32 -11.056 -5.297 -10.611
261 HZ3 LYS 32 2HZ LYS 32 -11.958 -6.731 -10.494
262 H THR 33 HN THR 33 -4.386 -6.850 -6.762
263 HA THR 33 HA THR 33 -5.375 -9.554 -6.613
264 HB THR 33 HB THR 33 -2.657 -8.476 -7.385
265 HG1 THR 33 1HG THR 33 -4.008 -7.839 -8.965
266 HG21 THR 33 3HG2 THR 33 -2.281 -10.670 -8.405
267 HG22 THR 33 1HG2 THR 33 -3.825 -11.236 -7.776
268 HG23 THR 33 2HG2 THR 33 -2.522 -10.814 -6.666
269 H TYR 34 HN TYR 34 -2.635 -7.795 -5.108
270 HA TYR 34 HA TYR 34 -2.039 -10.084 -3.457
271 HB2 TYR 34 2HB TYR 34 -0.801 -7.344 -3.640
272 HB3 TYR 34 1HB TYR 34 -0.251 -8.574 -2.507
273 HD1 TYR 34 1HD TYR 34 0.649 -10.749 -3.413
274 HD2 TYR 34 2HD TYR 34 -0.134 -7.394 -5.911
275 HE1 TYR 34 1HE TYR 34 2.079 -11.724 -5.159
276 HE2 TYR 34 2HE TYR 34 1.293 -8.364 -7.664
277 HH TYR 34 HH TYR 34 2.332 -11.567 -7.639
278 H CYS 35 HN CYS 35 -3.222 -6.785 -2.829
279 HA CYS 35 HA CYS 35 -3.338 -7.350 0.011
280 HB2 CYS 35 2HB CYS 35 -4.126 -4.859 -1.512
281 HB3 CYS 35 1HB CYS 35 -3.974 -4.994 0.239
282 HG CYS 35 HG CYS 35 -1.132 -5.896 -0.366
283 H GLY 36 HN GLY 36 -5.483 -7.152 -2.688
284 HA2 GLY 36 2HA GLY 36 -7.933 -6.561 -1.681
285 HA3 GLY 36 1HA GLY 36 -7.678 -7.750 -2.942
286 HA PRO 37 HA PRO 37 -9.039 -11.196 -0.638
287 HB2 PRO 37 2HB PRO 37 -6.297 -12.278 -0.235
288 HB3 PRO 37 1HB PRO 37 -7.727 -13.056 -0.919
289 HG2 PRO 37 2HG PRO 37 -5.772 -12.232 -2.508
290 HG3 PRO 37 1HG PRO 37 -7.467 -12.018 -2.984
291 HD2 PRO 37 2HD PRO 37 -5.530 -10.007 -1.916
292 HD3 PRO 37 1HD PRO 37 -6.768 -9.825 -3.175
293 H VAL 38 HN VAL 38 -6.559 -9.310 0.908
294 HA VAL 38 HA VAL 38 -7.357 -10.480 3.493
295 HB VAL 38 HB VAL 38 -4.706 -9.155 2.922
296 HG11 VAL 38 1HG1 VAL 38 -4.041 -10.133 5.076
297 HG12 VAL 38 2HG1 VAL 38 -5.682 -10.744 5.296
298 HG13 VAL 38 3HG1 VAL 38 -5.386 -9.006 5.252
299 HG21 VAL 38 3HG2 VAL 38 -4.883 -11.237 1.665
300 HG22 VAL 38 1HG2 VAL 38 -5.345 -12.096 3.134
301 HG23 VAL 38 2HG2 VAL 38 -3.733 -11.398 2.992
302 H ILE 39 HN ILE 39 -5.636 -7.481 2.574
303 HA ILE 39 HA ILE 39 -7.131 -6.136 4.691
304 HB ILE 39 HB ILE 39 -5.484 -4.309 4.448
305 HG12 ILE 39 2HG1 ILE 39 -4.166 -6.150 2.436
306 HG13 ILE 39 1HG1 ILE 39 -4.974 -4.636 2.051
307 HG21 ILE 39 1HG2 ILE 39 -3.574 -5.544 5.368
308 HG22 ILE 39 2HG2 ILE 39 -4.296 -7.056 4.815
309 HG23 ILE 39 3HG2 ILE 39 -5.104 -6.093 6.053
310 HD11 ILE 39 3HD1 ILE 39 -2.544 -4.406 2.093
311 HD12 ILE 39 1HD1 ILE 39 -2.527 -4.908 3.784
312 HD13 ILE 39 2HD1 ILE 39 -3.320 -3.403 3.320
313 H GLY 40 HN GLY 40 -7.502 -6.544 1.459
314 HA2 GLY 40 2HA GLY 40 -8.020 -4.018 0.414
315 HA3 GLY 40 1HA GLY 40 -8.795 -5.496 -0.119
316 HA PRO 41 HA PRO 41 -12.586 -4.187 1.695
317 HB2 PRO 41 2HB PRO 41 -13.181 -6.621 3.137
318 HB3 PRO 41 1HB PRO 41 -13.834 -6.066 1.595
319 HG2 PRO 41 2HG PRO 41 -12.184 -8.226 1.848
320 HG3 PRO 41 1HG PRO 41 -12.300 -7.242 0.378
321 HD2 PRO 41 2HD PRO 41 -10.236 -7.167 2.552
322 HD3 PRO 41 1HD PRO 41 -10.027 -7.045 0.789
323 H LEU 42 HN LEU 42 -10.037 -4.627 3.716
324 HA LEU 42 HA LEU 42 -11.471 -4.315 6.212
325 HB2 LEU 42 2HB LEU 42 -8.517 -4.169 5.595
326 HB3 LEU 42 1HB LEU 42 -9.205 -4.036 7.201
327 HG LEU 42 HG LEU 42 -9.286 -6.461 5.410
328 HD11 LEU 42 1HD1 LEU 42 -7.904 -7.477 7.129
329 HD12 LEU 42 2HD1 LEU 42 -7.924 -5.974 8.053
330 HD13 LEU 42 3HD1 LEU 42 -7.126 -6.030 6.483
331 HD21 LEU 42 3HD2 LEU 42 -11.367 -6.238 6.686
332 HD22 LEU 42 1HD2 LEU 42 -10.431 -6.089 8.177
333 HD23 LEU 42 2HD2 LEU 42 -10.392 -7.595 7.257
334 H SER 43 HN SER 43 -11.568 -2.434 7.431
335 HA SER 43 HA SER 43 -11.869 -0.026 6.104
336 HB2 SER 43 2HB SER 43 -11.291 -0.427 9.039
337 HB3 SER 43 1HB SER 43 -12.222 0.854 8.289
338 HG SER 43 HG SER 43 -13.862 -0.386 8.661
339 H VAL 44 HN VAL 44 -10.554 1.754 5.829
340 HA VAL 44 HA VAL 44 -7.744 1.328 5.772
341 HB VAL 44 HB VAL 44 -8.995 2.837 4.220
342 HG11 VAL 44 1HG1 VAL 44 -9.019 4.738 6.560
343 HG12 VAL 44 2HG1 VAL 44 -10.428 3.936 5.870
344 HG13 VAL 44 3HG1 VAL 44 -9.526 5.108 4.912
345 HG21 VAL 44 3HG2 VAL 44 -6.692 4.112 5.689
346 HG22 VAL 44 1HG2 VAL 44 -7.254 4.545 4.075
347 HG23 VAL 44 2HG2 VAL 44 -6.571 2.947 4.370
348 H GLN 45 HN GLN 45 -9.870 2.319 8.204
349 HA GLN 45 HA GLN 45 -7.897 3.721 9.798
350 HB2 GLN 45 2HB GLN 45 -10.418 4.223 9.678
351 HB3 GLN 45 1HB GLN 45 -10.641 2.788 10.663
352 HG2 GLN 45 2HG GLN 45 -8.864 5.039 11.537
353 HG3 GLN 45 1HG GLN 45 -10.602 5.064 11.817
354 HE21 GLN 45 1HE2 GLN 45 -8.441 5.033 13.750
355 HE22 GLN 45 2HE2 GLN 45 -8.658 3.611 14.706
356 H ASP 46 HN ASP 46 -8.980 0.536 9.243
357 HA ASP 46 HA ASP 46 -8.240 -0.439 11.896
358 HB2 ASP 46 2HB ASP 46 -10.377 -1.138 10.735
359 HB3 ASP 46 1HB ASP 46 -9.377 -2.017 9.584
360 H VAL 47 HN VAL 47 -7.187 -0.515 8.571
361 HA VAL 47 HA VAL 47 -5.512 -2.716 8.527
362 HB VAL 47 HB VAL 47 -5.086 -0.076 7.118
363 HG11 VAL 47 1HG1 VAL 47 -3.906 -2.793 6.544
364 HG12 VAL 47 2HG1 VAL 47 -3.033 -1.372 7.119
365 HG13 VAL 47 3HG1 VAL 47 -3.753 -1.373 5.510
366 HG21 VAL 47 3HG2 VAL 47 -6.160 -1.176 5.213
367 HG22 VAL 47 1HG2 VAL 47 -7.240 -1.081 6.604
368 HG23 VAL 47 2HG2 VAL 47 -6.448 -2.606 6.206
369 H ASP 48 HN ASP 48 -4.034 -3.219 9.963
370 HA ASP 48 HA ASP 48 -2.261 -1.161 11.065
371 HB2 ASP 48 2HB ASP 48 -2.908 -3.975 11.914
372 HB3 ASP 48 1HB ASP 48 -1.482 -3.147 12.518
373 H THR 49 HN THR 49 0.026 -1.988 11.478
374 HA THR 49 HA THR 49 1.303 -2.756 9.074
375 HB THR 49 HB THR 49 2.506 -3.064 11.826
376 HG1 THR 49 1HG THR 49 2.672 -0.921 11.985
377 HG21 THR 49 3HG2 THR 49 4.555 -2.350 10.634
378 HG22 THR 49 1HG2 THR 49 3.636 -2.298 9.130
379 HG23 THR 49 2HG2 THR 49 3.873 -3.832 9.968
380 H LYS 50 HN LYS 50 0.265 -4.452 11.965
381 HA LYS 50 HA LYS 50 1.378 -6.966 11.644
382 HB2 LYS 50 2HB LYS 50 0.085 -6.276 13.604
383 HB3 LYS 50 1HB LYS 50 -1.378 -6.207 12.638
384 HG2 LYS 50 2HG LYS 50 -1.001 -8.687 12.196
385 HG3 LYS 50 1HG LYS 50 0.176 -8.620 13.509
386 HD2 LYS 50 2HD LYS 50 -2.731 -7.838 13.721
387 HD3 LYS 50 1HD LYS 50 -2.039 -9.356 14.291
388 HE2 LYS 50 2HE LYS 50 -1.165 -6.636 15.259
389 HE3 LYS 50 1HE LYS 50 -2.388 -7.617 16.062
390 HZ1 LYS 50 3HZ LYS 50 -0.796 -9.291 16.522
391 HZ2 LYS 50 1HZ LYS 50 -0.106 -7.818 16.995
392 HZ3 LYS 50 2HZ LYS 50 0.380 -8.555 15.550
393 H LEU 51 HN LEU 51 -1.633 -5.692 10.330
394 HA LEU 51 HA LEU 51 -2.501 -8.065 9.089
395 HB2 LEU 51 2HB LEU 51 -3.149 -5.193 8.429
396 HB3 LEU 51 1HB LEU 51 -4.049 -6.586 7.880
397 HG LEU 51 HG LEU 51 -3.788 -5.632 10.722
398 HD11 LEU 51 1HD1 LEU 51 -6.161 -5.196 10.573
399 HD12 LEU 51 2HD1 LEU 51 -6.189 -5.790 8.913
400 HD13 LEU 51 3HD1 LEU 51 -5.306 -4.317 9.305
401 HD21 LEU 51 3HD2 LEU 51 -5.344 -7.437 11.284
402 HD22 LEU 51 1HD2 LEU 51 -3.815 -8.060 10.663
403 HD23 LEU 51 2HD2 LEU 51 -5.245 -8.033 9.626
404 H ILE 52 HN ILE 52 -0.611 -5.327 7.953
405 HA ILE 52 HA ILE 52 -0.503 -6.141 5.237
406 HB ILE 52 HB ILE 52 1.242 -4.246 6.809
407 HG12 ILE 52 2HG1 ILE 52 -1.006 -3.763 4.842
408 HG13 ILE 52 1HG1 ILE 52 -1.146 -3.637 6.592
409 HG21 ILE 52 1HG2 ILE 52 1.153 -4.759 3.839
410 HG22 ILE 52 2HG2 ILE 52 2.520 -5.018 4.926
411 HG23 ILE 52 3HG2 ILE 52 1.952 -3.381 4.597
412 HD11 ILE 52 3HD1 ILE 52 0.575 -1.922 4.819
413 HD12 ILE 52 1HD1 ILE 52 0.465 -1.798 6.574
414 HD13 ILE 52 2HD1 ILE 52 -0.946 -1.455 5.577
415 H MET 53 HN MET 53 1.513 -6.780 8.053
416 HA MET 53 HA MET 53 3.772 -7.870 6.852
417 HB2 MET 53 2HB MET 53 2.387 -8.706 9.407
418 HB3 MET 53 1HB MET 53 3.978 -9.267 8.925
419 HG2 MET 53 2HG MET 53 4.843 -7.012 9.040
420 HG3 MET 53 1HG MET 53 3.238 -6.397 9.433
421 HE1 MET 53 3HE MET 53 5.831 -5.756 11.184
422 HE2 MET 53 1HE MET 53 5.176 -5.956 12.811
423 HE3 MET 53 2HE MET 53 4.217 -5.152 11.565
424 H LYS 54 HN LYS 54 0.679 -9.397 7.626
425 HA LYS 54 HA LYS 54 1.423 -12.021 6.915
426 HB2 LYS 54 2HB LYS 54 -1.328 -10.768 6.909
427 HB3 LYS 54 1HB LYS 54 -0.983 -12.492 6.899
428 HG2 LYS 54 2HG LYS 54 0.121 -12.251 9.094
429 HG3 LYS 54 1HG LYS 54 -0.337 -10.547 9.105
430 HD2 LYS 54 2HD LYS 54 -1.920 -11.832 10.413
431 HD3 LYS 54 1HD LYS 54 -2.709 -11.206 8.963
432 HE2 LYS 54 2HE LYS 54 -3.347 -13.525 9.399
433 HE3 LYS 54 1HE LYS 54 -2.463 -13.379 7.882
434 HZ1 LYS 54 3HZ LYS 54 -0.458 -14.131 9.044
435 HZ2 LYS 54 1HZ LYS 54 -1.697 -15.284 9.128
436 HZ3 LYS 54 2HZ LYS 54 -1.348 -14.320 10.472
437 H VAL 55 HN VAL 55 0.059 -9.360 5.077
438 HA VAL 55 HA VAL 55 -0.514 -10.838 2.715
439 HB VAL 55 HB VAL 55 0.017 -7.873 2.979
440 HG11 VAL 55 1HG1 VAL 55 -1.489 -9.426 0.877
441 HG12 VAL 55 2HG1 VAL 55 0.087 -8.659 0.676
442 HG13 VAL 55 3HG1 VAL 55 -1.347 -7.669 0.959
443 HG21 VAL 55 3HG2 VAL 55 -2.420 -7.629 3.175
444 HG22 VAL 55 1HG2 VAL 55 -1.739 -8.556 4.514
445 HG23 VAL 55 2HG2 VAL 55 -2.583 -9.385 3.205
446 H LEU 56 HN LEU 56 2.266 -9.026 3.873
447 HA LEU 56 HA LEU 56 3.628 -9.072 1.351
448 HB2 LEU 56 2HB LEU 56 4.535 -8.290 4.112
449 HB3 LEU 56 1HB LEU 56 5.547 -8.165 2.688
450 HG LEU 56 HG LEU 56 2.966 -6.681 3.176
451 HD11 LEU 56 1HD1 LEU 56 5.829 -5.752 3.051
452 HD12 LEU 56 2HD1 LEU 56 4.826 -5.858 4.496
453 HD13 LEU 56 3HD1 LEU 56 4.415 -4.713 3.222
454 HD21 LEU 56 3HD2 LEU 56 4.853 -6.585 0.820
455 HD22 LEU 56 1HD2 LEU 56 3.490 -5.497 1.086
456 HD23 LEU 56 2HD2 LEU 56 3.207 -7.216 0.814
457 H ASP 57 HN ASP 57 3.432 -11.199 4.037
458 HA ASP 57 HA ASP 57 5.882 -12.360 4.270
459 HB2 ASP 57 2HB ASP 57 3.780 -12.958 5.540
460 HB3 ASP 57 1HB ASP 57 3.362 -14.006 4.209
461 HA PRO 58 HA PRO 58 5.187 -15.497 0.694
462 HB2 PRO 58 2HB PRO 58 3.154 -15.082 -1.049
463 HB3 PRO 58 1HB PRO 58 2.970 -16.036 0.427
464 HG2 PRO 58 2HG PRO 58 2.199 -13.193 -0.102
465 HG3 PRO 58 1HG PRO 58 1.301 -14.454 0.764
466 HD2 PRO 58 2HD PRO 58 2.716 -12.517 2.033
467 HD3 PRO 58 1HD PRO 58 2.495 -14.140 2.707
468 H ILE 59 HN ILE 59 4.963 -12.109 0.403
469 HA ILE 59 HA ILE 59 5.812 -12.035 -2.377
470 HB ILE 59 HB ILE 59 5.509 -9.736 -0.435
471 HG12 ILE 59 2HG1 ILE 59 3.557 -10.814 -2.480
472 HG13 ILE 59 1HG1 ILE 59 3.393 -10.961 -0.735
473 HG21 ILE 59 1HG2 ILE 59 5.383 -8.364 -2.466
474 HG22 ILE 59 2HG2 ILE 59 5.677 -9.799 -3.446
475 HG23 ILE 59 3HG2 ILE 59 6.926 -9.213 -2.347
476 HD11 ILE 59 3HD1 ILE 59 3.381 -8.386 -2.294
477 HD12 ILE 59 1HD1 ILE 59 3.206 -8.537 -0.546
478 HD13 ILE 59 2HD1 ILE 59 1.972 -9.200 -1.617
479 H TRP 60 HN TRP 60 7.141 -11.543 0.849
480 HA TRP 60 HA TRP 60 9.630 -10.453 0.165
481 HB2 TRP 60 2HB TRP 60 8.901 -12.292 2.452
482 HB3 TRP 60 1HB TRP 60 10.449 -11.477 2.307
483 HD1 TRP 60 1HD TRP 60 7.268 -11.103 3.991
484 HE1 TRP 60 1HE TRP 60 6.899 -8.691 4.793
485 HE3 TRP 60 3HE TRP 60 10.902 -8.773 1.252
486 HZ2 TRP 60 2HZ TRP 60 7.996 -6.132 4.324
487 HZ3 TRP 60 3HZ TRP 60 11.176 -6.337 1.486
488 HH2 TRP 60 2HH TRP 60 9.751 -5.046 2.990
489 H GLU 61 HN GLU 61 8.450 -13.723 -0.012
490 HA GLU 61 HA GLU 61 10.957 -15.012 -0.196
491 HB2 GLU 61 2HB GLU 61 8.174 -15.830 -1.012
492 HB3 GLU 61 1HB GLU 61 9.559 -16.893 -1.053
493 HG2 GLU 61 2HG GLU 61 9.842 -16.581 1.375
494 HG3 GLU 61 1HG GLU 61 8.377 -15.598 1.380
495 H GLN 62 HN GLN 62 8.807 -13.484 -2.466
496 HA GLN 62 HA GLN 62 10.197 -14.638 -4.748
497 HB2 GLN 62 2HB GLN 62 7.801 -12.795 -4.620
498 HB3 GLN 62 1HB GLN 62 8.433 -13.545 -6.074
499 HG2 GLN 62 2HG GLN 62 7.305 -15.026 -3.713
500 HG3 GLN 62 1HG GLN 62 6.430 -14.663 -5.199
501 HE21 GLN 62 1HE2 GLN 62 6.081 -16.765 -5.748
502 HE22 GLN 62 2HE2 GLN 62 7.346 -17.849 -6.234
503 H LYS 63 HN LYS 63 9.224 -11.394 -3.637
504 HA LYS 63 HA LYS 63 11.555 -10.230 -4.945
505 HB2 LYS 63 2HB LYS 63 8.717 -9.517 -5.711
506 HB3 LYS 63 1HB LYS 63 10.147 -8.635 -6.221
507 HG2 LYS 63 2HG LYS 63 10.929 -10.518 -7.487
508 HG3 LYS 63 1HG LYS 63 9.630 -11.532 -6.856
509 HD2 LYS 63 2HD LYS 63 7.988 -10.046 -7.956
510 HD3 LYS 63 1HD LYS 63 9.324 -9.117 -8.642
511 HE2 LYS 63 2HE LYS 63 10.104 -11.088 -9.833
512 HE3 LYS 63 1HE LYS 63 8.822 -12.057 -9.109
513 HZ1 LYS 63 3HZ LYS 63 8.322 -11.338 -11.387
514 HZ2 LYS 63 1HZ LYS 63 8.378 -9.721 -10.892
515 HZ3 LYS 63 2HZ LYS 63 7.186 -10.760 -10.276
516 HA PRO 64 HA PRO 64 10.620 -8.230 -0.883
517 HB2 PRO 64 2HB PRO 64 13.483 -7.538 -1.266
518 HB3 PRO 64 1HB PRO 64 12.663 -8.190 0.158
519 HG2 PRO 64 2HG PRO 64 14.233 -9.741 -1.331
520 HG3 PRO 64 1HG PRO 64 12.727 -10.371 -0.639
521 HD2 PRO 64 2HD PRO 64 13.311 -9.514 -3.444
522 HD3 PRO 64 1HD PRO 64 12.334 -10.879 -2.858
523 H GLU 65 HN GLU 65 12.409 -6.994 -3.681
524 HA GLU 65 HA GLU 65 12.196 -4.269 -3.053
525 HB2 GLU 65 2HB GLU 65 12.602 -5.761 -5.631
526 HB3 GLU 65 1HB GLU 65 12.600 -4.020 -5.541
527 HG2 GLU 65 2HG GLU 65 14.859 -4.814 -5.551
528 HG3 GLU 65 1HG GLU 65 14.494 -4.108 -3.978
529 H THR 66 HN THR 66 10.142 -6.481 -4.874
530 HA THR 66 HA THR 66 8.298 -4.543 -5.799
531 HB THR 66 HB THR 66 7.834 -7.491 -5.291
532 HG1 THR 66 1HG THR 66 9.576 -6.691 -6.850
533 HG21 THR 66 3HG2 THR 66 5.747 -6.222 -5.551
534 HG22 THR 66 1HG2 THR 66 6.031 -7.278 -6.936
535 HG23 THR 66 2HG2 THR 66 6.344 -5.548 -7.068
536 H ALA 67 HN ALA 67 8.497 -6.507 -2.882
537 HA ALA 67 HA ALA 67 6.030 -5.798 -1.742
538 HB1 ALA 67 1HB ALA 67 7.032 -6.452 0.395
539 HB2 ALA 67 2HB ALA 67 8.630 -6.449 -0.352
540 HB3 ALA 67 3HB ALA 67 7.415 -7.618 -0.873
541 H SER 68 HN SER 68 9.230 -4.273 -1.566
542 HA SER 68 HA SER 68 8.525 -2.135 0.112
543 HB2 SER 68 2HB SER 68 10.629 -2.206 -2.068
544 HB3 SER 68 1HB SER 68 10.550 -1.042 -0.745
545 HG SER 68 HG SER 68 11.901 -2.543 0.031
546 H ARG 69 HN ARG 69 8.393 -2.486 -3.416
547 HA ARG 69 HA ARG 69 7.594 0.164 -3.958
548 HB2 ARG 69 2HB ARG 69 7.360 -2.394 -5.527
549 HB3 ARG 69 1HB ARG 69 6.815 -0.851 -6.145
550 HG2 ARG 69 2HG ARG 69 9.469 -0.595 -5.149
551 HG3 ARG 69 1HG ARG 69 9.378 -1.952 -6.272
552 HD2 ARG 69 2HD ARG 69 9.904 0.036 -7.492
553 HD3 ARG 69 1HD ARG 69 8.272 -0.465 -7.906
554 HE ARG 69 HE ARG 69 8.006 1.352 -5.847
555 HH11 ARG 69 1HH1 ARG 69 9.314 1.373 -9.101
556 HH12 ARG 69 2HH1 ARG 69 9.011 3.064 -9.338
557 HH21 ARG 69 1HH2 ARG 69 7.585 3.568 -6.172
558 HH22 ARG 69 2HH2 ARG 69 8.022 4.313 -7.686
559 H LEU 70 HN LEU 70 5.823 -2.767 -3.173
560 HA LEU 70 HA LEU 70 3.238 -1.683 -3.640
561 HB2 LEU 70 2HB LEU 70 3.707 -4.107 -3.429
562 HB3 LEU 70 1HB LEU 70 4.072 -3.873 -1.731
563 HG LEU 70 HG LEU 70 1.741 -3.158 -1.337
564 HD11 LEU 70 1HD1 LEU 70 0.064 -3.451 -3.064
565 HD12 LEU 70 2HD1 LEU 70 1.307 -3.932 -4.219
566 HD13 LEU 70 3HD1 LEU 70 1.280 -2.285 -3.586
567 HD21 LEU 70 3HD2 LEU 70 0.719 -5.362 -1.601
568 HD22 LEU 70 1HD2 LEU 70 2.378 -5.495 -1.017
569 HD23 LEU 70 2HD2 LEU 70 2.008 -5.831 -2.708
570 H ARG 71 HN ARG 71 5.321 -1.908 -0.790
571 HA ARG 71 HA ARG 71 3.541 -0.739 1.050
572 HB2 ARG 71 2HB ARG 71 6.514 -1.118 0.964
573 HB3 ARG 71 1HB ARG 71 5.763 -0.217 2.274
574 HG2 ARG 71 2HG ARG 71 4.876 -2.984 1.538
575 HG3 ARG 71 1HG ARG 71 6.205 -2.686 2.660
576 HD2 ARG 71 2HD ARG 71 3.520 -1.398 3.030
577 HD3 ARG 71 1HD ARG 71 3.851 -3.021 3.634
578 HE ARG 71 HE ARG 71 5.868 -1.228 4.476
579 HH11 ARG 71 1HH1 ARG 71 2.503 -1.954 5.092
580 HH12 ARG 71 2HH1 ARG 71 2.607 -1.574 6.783
581 HH21 ARG 71 1HH2 ARG 71 6.014 -0.790 6.705
582 HH22 ARG 71 2HH2 ARG 71 4.593 -0.910 7.698
583 H GLY 72 HN GLY 72 5.939 0.666 -1.125
584 HA2 GLY 72 2HA GLY 72 5.837 3.305 -0.175
585 HA3 GLY 72 1HA GLY 72 6.232 2.837 -1.823
586 H ARG 73 HN ARG 73 3.791 1.613 -2.503
587 HA ARG 73 HA ARG 73 2.227 3.902 -3.133
588 HB2 ARG 73 2HB ARG 73 1.828 0.948 -3.568
589 HB3 ARG 73 1HB ARG 73 0.614 2.132 -4.037
590 HG2 ARG 73 2HG ARG 73 2.268 3.252 -5.459
591 HG3 ARG 73 1HG ARG 73 3.459 2.030 -5.017
592 HD2 ARG 73 2HD ARG 73 0.823 1.302 -6.256
593 HD3 ARG 73 1HD ARG 73 2.211 1.755 -7.241
594 HE ARG 73 HE ARG 73 3.059 -0.233 -5.496
595 HH11 ARG 73 1HH1 ARG 73 0.739 0.101 -8.106
596 HH12 ARG 73 2HH1 ARG 73 0.894 -1.545 -8.634
597 HH21 ARG 73 1HH2 ARG 73 3.289 -2.400 -6.216
598 HH22 ARG 73 2HH2 ARG 73 2.352 -2.962 -7.564
599 H ILE 74 HN ILE 74 1.899 1.251 -0.828
600 HA ILE 74 HA ILE 74 -0.633 1.929 0.191
601 HB ILE 74 HB ILE 74 1.692 0.585 1.589
602 HG12 ILE 74 2HG1 ILE 74 -0.749 -0.592 0.239
603 HG13 ILE 74 1HG1 ILE 74 0.874 -0.583 -0.438
604 HG21 ILE 74 1HG2 ILE 74 -1.219 0.703 2.364
605 HG22 ILE 74 2HG2 ILE 74 0.125 1.458 3.219
606 HG23 ILE 74 3HG2 ILE 74 0.007 -0.298 3.141
607 HD11 ILE 74 3HD1 ILE 74 0.005 -1.997 2.072
608 HD12 ILE 74 1HD1 ILE 74 1.642 -1.985 1.417
609 HD13 ILE 74 2HD1 ILE 74 0.333 -2.745 0.509
610 H GLU 75 HN GLU 75 2.620 3.010 1.017
611 HA GLU 75 HA GLU 75 2.131 4.587 3.246
612 HB2 GLU 75 2HB GLU 75 4.358 4.115 2.298
613 HB3 GLU 75 1HB GLU 75 3.992 5.150 0.927
614 HG2 GLU 75 2HG GLU 75 3.702 7.031 2.577
615 HG3 GLU 75 1HG GLU 75 4.380 5.948 3.795
616 H SER 76 HN SER 76 1.918 5.467 -0.184
617 HA SER 76 HA SER 76 1.156 8.136 0.197
618 HB2 SER 76 2HB SER 76 0.574 6.299 -2.117
619 HB3 SER 76 1HB SER 76 0.413 8.052 -2.152
620 HG SER 76 HG SER 76 2.453 8.130 -2.577
621 H VAL 77 HN VAL 77 -0.806 5.213 -0.247
622 HA VAL 77 HA VAL 77 -3.308 6.507 -0.331
623 HB VAL 77 HB VAL 77 -2.661 3.690 0.561
624 HG11 VAL 77 1HG1 VAL 77 -4.996 3.183 0.106
625 HG12 VAL 77 2HG1 VAL 77 -5.302 4.876 -0.275
626 HG13 VAL 77 3HG1 VAL 77 -4.854 4.409 1.365
627 HG21 VAL 77 3HG2 VAL 77 -3.546 4.776 -2.108
628 HG22 VAL 77 1HG2 VAL 77 -3.331 3.069 -1.718
629 HG23 VAL 77 2HG2 VAL 77 -1.942 4.157 -1.718
630 H LEU 78 HN LEU 78 -1.567 4.984 2.374
631 HA LEU 78 HA LEU 78 -3.613 5.446 4.268
632 HB2 LEU 78 2HB LEU 78 -0.669 4.901 4.631
633 HB3 LEU 78 1HB LEU 78 -1.820 4.970 5.952
634 HG LEU 78 HG LEU 78 -1.856 2.984 3.675
635 HD11 LEU 78 1HD1 LEU 78 -0.064 2.589 5.290
636 HD12 LEU 78 2HD1 LEU 78 -1.310 1.345 5.385
637 HD13 LEU 78 3HD1 LEU 78 -1.242 2.617 6.602
638 HD21 LEU 78 3HD2 LEU 78 -3.656 3.213 6.088
639 HD22 LEU 78 1HD2 LEU 78 -3.675 1.908 4.903
640 HD23 LEU 78 2HD2 LEU 78 -4.116 3.544 4.418
641 H ASP 79 HN ASP 79 -0.785 7.318 3.300
642 HA ASP 79 HA ASP 79 -1.040 9.226 5.419
643 HB2 ASP 79 2HB ASP 79 1.101 8.831 4.246
644 HB3 ASP 79 1HB ASP 79 0.404 9.507 2.777
645 H TRP 80 HN TRP 80 -2.016 9.126 2.026
646 HA TRP 80 HA TRP 80 -3.139 11.679 1.816
647 HB2 TRP 80 2HB TRP 80 -2.742 10.193 -0.100
648 HB3 TRP 80 1HB TRP 80 -3.983 9.093 0.483
649 HD1 TRP 80 1HD TRP 80 -3.590 12.578 -1.102
650 HE1 TRP 80 1HE TRP 80 -5.807 13.197 -2.260
651 HE3 TRP 80 3HE TRP 80 -6.443 8.644 0.490
652 HZ2 TRP 80 2HZ TRP 80 -8.423 12.140 -2.462
653 HZ3 TRP 80 3HZ TRP 80 -8.793 8.529 -0.230
654 HH2 TRP 80 2HH TRP 80 -9.758 10.244 -1.674
655 H ALA 81 HN ALA 81 -4.602 8.593 2.796
656 HA ALA 81 HA ALA 81 -7.194 9.524 3.300
657 HB1 ALA 81 1HB ALA 81 -7.448 7.541 4.712
658 HB2 ALA 81 2HB ALA 81 -5.703 7.296 4.681
659 HB3 ALA 81 3HB ALA 81 -6.639 7.153 3.194
660 H THR 82 HN THR 82 -4.298 9.553 5.290
661 HA THR 82 HA THR 82 -5.514 10.346 7.716
662 HB THR 82 HB THR 82 -2.692 10.898 6.765
663 HG1 THR 82 1HG THR 82 -2.966 8.702 6.737
664 HG21 THR 82 3HG2 THR 82 -2.152 10.978 9.164
665 HG22 THR 82 1HG2 THR 82 -3.862 10.784 9.548
666 HG23 THR 82 2HG2 THR 82 -3.303 12.235 8.715
667 H VAL 83 HN VAL 83 -3.970 12.165 5.095
668 HA VAL 83 HA VAL 83 -4.375 14.736 6.193
669 HB VAL 83 HB VAL 83 -4.039 13.925 3.298
670 HG11 VAL 83 1HG1 VAL 83 -4.969 16.168 3.484
671 HG12 VAL 83 2HG1 VAL 83 -3.294 16.231 2.936
672 HG13 VAL 83 3HG1 VAL 83 -3.690 16.618 4.609
673 HG21 VAL 83 3HG2 VAL 83 -1.688 14.529 3.639
674 HG22 VAL 83 1HG2 VAL 83 -2.183 13.200 4.687
675 HG23 VAL 83 2HG2 VAL 83 -2.018 14.827 5.344
676 H ARG 84 HN ARG 84 -6.310 12.736 4.015
677 HA ARG 84 HA ARG 84 -8.280 14.740 3.524
678 HB2 ARG 84 2HB ARG 84 -8.282 11.754 3.138
679 HB3 ARG 84 1HB ARG 84 -9.624 12.785 2.662
680 HG2 ARG 84 2HG ARG 84 -6.806 13.034 1.634
681 HG3 ARG 84 1HG ARG 84 -8.126 12.218 0.796
682 HD2 ARG 84 2HD ARG 84 -8.023 15.137 1.551
683 HD3 ARG 84 1HD ARG 84 -7.810 14.473 -0.068
684 HE ARG 84 HE ARG 84 -10.327 13.973 1.354
685 HH11 ARG 84 1HH1 ARG 84 -8.590 15.574 -1.239
686 HH12 ARG 84 2HH1 ARG 84 -10.036 16.015 -2.096
687 HH21 ARG 84 1HH2 ARG 84 -12.216 14.534 0.235
688 HH22 ARG 84 2HH2 ARG 84 -12.111 15.430 -1.255
689 H GLY 85 HN GLY 85 -7.805 12.380 6.028
690 HA2 GLY 85 2HA GLY 85 -8.841 12.506 8.136
691 HA3 GLY 85 1HA GLY 85 -10.118 13.486 7.427
692 H TYR 86 HN TYR 86 -9.021 10.463 6.035
693 HA TYR 86 HA TYR 86 -11.661 9.306 6.536
694 HB2 TYR 86 2HB TYR 86 -9.366 8.444 4.769
695 HB3 TYR 86 1HB TYR 86 -10.803 7.460 5.019
696 HD1 TYR 86 2HD TYR 86 -13.064 8.994 4.709
697 HD2 TYR 86 1HD TYR 86 -9.322 9.586 2.782
698 HE1 TYR 86 2HE TYR 86 -14.205 10.174 2.879
699 HE2 TYR 86 1HE TYR 86 -10.448 10.772 0.947
700 HH TYR 86 HH TYR 86 -12.692 10.907 -0.079
701 H ARG 87 HN ARG 87 -8.939 9.553 8.191
702 HA ARG 87 HA ARG 87 -9.445 7.347 9.898
703 HB2 ARG 87 2HB ARG 87 -7.333 6.149 9.589
704 HB3 ARG 87 1HB ARG 87 -8.265 6.137 8.100
705 HG2 ARG 87 2HG ARG 87 -6.867 8.062 7.315
706 HG3 ARG 87 1HG ARG 87 -5.857 7.822 8.741
707 HD2 ARG 87 2HD ARG 87 -6.373 5.816 6.548
708 HD3 ARG 87 1HD ARG 87 -4.887 6.725 6.804
709 HE ARG 87 HE ARG 87 -5.822 4.418 8.306
710 HH11 ARG 87 1HH1 ARG 87 -3.569 7.085 8.109
711 HH12 ARG 87 2HH1 ARG 87 -2.361 6.320 9.093
712 HH21 ARG 87 1HH2 ARG 87 -4.243 3.395 9.621
713 HH22 ARG 87 2HH2 ARG 87 -2.759 4.219 9.972
714 H GLU 88 HN GLU 88 -7.219 7.192 11.367
715 HA GLU 88 HA GLU 88 -6.809 9.947 12.235
716 HB2 GLU 88 2HB GLU 88 -6.283 7.297 13.583
717 HB3 GLU 88 1HB GLU 88 -5.841 8.849 14.285
718 HG2 GLU 88 2HG GLU 88 -8.117 9.537 14.407
719 HG3 GLU 88 1HG GLU 88 -8.645 8.151 13.457
720 H GLY 89 HN GLY 89 -4.487 10.214 13.302
721 HA2 GLY 89 2HA GLY 89 -2.805 10.182 10.953
722 HA3 GLY 89 1HA GLY 89 -2.495 11.042 12.447
723 H ASP 90 HN ASP 90 -1.674 8.456 10.526
724 HA ASP 90 HA ASP 90 0.619 7.845 12.010
725 HB2 ASP 90 2HB ASP 90 -1.004 6.666 13.487
726 HB3 ASP 90 1HB ASP 90 -1.469 5.653 12.123
727 H ASN 91 HN ASN 91 2.030 6.456 10.854
728 HA ASN 91 HA ASN 91 1.010 5.610 8.227
729 HB2 ASN 91 2HB ASN 91 2.460 7.567 7.948
730 HB3 ASN 91 1HB ASN 91 3.757 6.737 8.802
731 HD21 ASN 91 1HD2 ASN 91 1.865 6.821 5.849
732 HD22 ASN 91 2HD2 ASN 91 2.958 5.875 4.907
733 HA PRO 92 HA PRO 92 2.502 1.820 10.312
734 HB2 PRO 92 2HB PRO 92 0.508 0.573 8.551
735 HB3 PRO 92 1HB PRO 92 0.647 0.506 10.310
736 HG2 PRO 92 2HG PRO 92 -1.315 1.884 9.095
737 HG3 PRO 92 1HG PRO 92 -0.581 2.434 10.614
738 HD2 PRO 92 2HD PRO 92 -0.067 3.371 7.813
739 HD3 PRO 92 1HD PRO 92 -0.254 4.323 9.302
740 H ALA 93 HN ALA 93 3.000 3.109 7.365
741 HA ALA 93 HA ALA 93 3.858 0.660 5.999
742 HB1 ALA 93 1HB ALA 93 2.614 2.353 4.722
743 HB2 ALA 93 2HB ALA 93 4.231 2.094 4.069
744 HB3 ALA 93 3HB ALA 93 3.892 3.527 5.037
745 H ARG 94 HN ARG 94 5.176 2.659 8.247
746 HA ARG 94 HA ARG 94 7.856 2.759 7.191
747 HB2 ARG 94 2HB ARG 94 8.455 3.668 9.374
748 HB3 ARG 94 1HB ARG 94 7.037 4.490 8.739
749 HG2 ARG 94 2HG ARG 94 5.607 3.111 10.186
750 HG3 ARG 94 1HG ARG 94 7.046 2.329 10.843
751 HD2 ARG 94 2HD ARG 94 6.278 4.067 12.347
752 HD3 ARG 94 1HD ARG 94 7.837 4.514 11.656
753 HE ARG 94 HE ARG 94 6.471 5.914 10.062
754 HH11 ARG 94 1HH1 ARG 94 5.378 5.163 13.305
755 HH12 ARG 94 2HH1 ARG 94 4.356 6.562 13.415
756 HH21 ARG 94 1HH2 ARG 94 5.164 7.774 10.218
757 HH22 ARG 94 2HH2 ARG 94 4.236 8.052 11.667
758 H TRP 95 HN TRP 95 9.680 1.689 8.285
759 HA TRP 95 HA TRP 95 9.157 -0.524 10.043
760 HB2 TRP 95 2HB TRP 95 9.316 -1.016 7.202
761 HB3 TRP 95 1HB TRP 95 10.651 -1.805 8.036
762 HD1 TRP 95 1HD TRP 95 9.324 -2.842 10.632
763 HE1 TRP 95 1HE TRP 95 7.480 -4.633 10.567
764 HE3 TRP 95 3HE TRP 95 7.793 -2.227 5.810
765 HZ2 TRP 95 2HZ TRP 95 5.614 -5.655 8.690
766 HZ3 TRP 95 3HZ TRP 95 5.962 -3.619 4.962
767 HH2 TRP 95 2HH TRP 95 4.909 -5.319 6.365
768 H ARG 96 HN ARG 96 10.745 -0.338 11.477
769 HA ARG 96 HA ARG 96 13.437 0.292 10.495
770 HB2 ARG 96 2HB ARG 96 12.164 0.638 13.203
771 HB3 ARG 96 1HB ARG 96 13.875 0.873 12.899
772 HG2 ARG 96 2HG ARG 96 13.355 2.655 11.319
773 HG3 ARG 96 1HG ARG 96 11.633 2.411 11.616
774 HD2 ARG 96 2HD ARG 96 11.955 2.988 13.965
775 HD3 ARG 96 1HD ARG 96 13.679 3.219 13.674
776 HE ARG 96 HE ARG 96 12.489 4.894 11.892
777 HH11 ARG 96 1HH1 ARG 96 12.279 4.447 15.360
778 HH12 ARG 96 2HH1 ARG 96 11.884 6.115 15.679
779 HH21 ARG 96 1HH2 ARG 96 11.976 7.090 12.301
780 HH22 ARG 96 2HH2 ARG 96 11.696 7.612 13.939
781 H GLY 97 HN GLY 97 11.508 -2.207 11.752
782 HA2 GLY 97 2HA GLY 97 13.809 -3.936 12.029
783 HA3 GLY 97 1HA GLY 97 12.943 -3.632 13.525
784 H TYR 98 HN TYR 98 12.950 -5.287 10.516
785 HA TYR 98 HA TYR 98 10.870 -7.048 11.551
786 HB2 TYR 98 2HB TYR 98 9.674 -5.428 10.093
787 HB3 TYR 98 1HB TYR 98 10.714 -5.892 8.751
788 HD1 TYR 98 2HD TYR 98 8.157 -7.191 11.112
789 HD2 TYR 98 1HD TYR 98 10.183 -7.763 7.417
790 HE1 TYR 98 2HE TYR 98 6.590 -8.996 10.538
791 HE2 TYR 98 1HE TYR 98 8.621 -9.570 6.829
792 HH TYR 98 HH TYR 98 7.129 -11.158 7.956
793 H LEU 99 HN LEU 99 13.253 -6.374 9.033
794 HA LEU 99 HA LEU 99 13.490 -9.225 8.464
795 HB2 LEU 99 2HB LEU 99 14.776 -6.829 7.155
796 HB3 LEU 99 1HB LEU 99 14.973 -8.487 6.630
797 HG LEU 99 HG LEU 99 12.354 -6.982 6.647
798 HD11 LEU 99 1HD1 LEU 99 13.905 -6.091 4.988
799 HD12 LEU 99 2HD1 LEU 99 12.582 -6.964 4.216
800 HD13 LEU 99 3HD1 LEU 99 14.171 -7.716 4.353
801 HD21 LEU 99 3HD2 LEU 99 11.521 -8.881 5.357
802 HD22 LEU 99 1HD2 LEU 99 12.078 -9.389 6.950
803 HD23 LEU 99 2HD2 LEU 99 13.078 -9.690 5.530
804 H GLU 100 HN GLU 100 15.530 -6.474 9.362
805 HA GLU 100 HA GLU 100 17.576 -6.282 10.305
806 HB2 GLU 100 2HB GLU 100 16.260 -7.552 12.116
807 HB3 GLU 100 1HB GLU 100 17.128 -8.982 11.576
808 HG2 GLU 100 2HG GLU 100 19.234 -8.002 12.167
809 HG3 GLU 100 1HG GLU 100 18.463 -6.461 12.533
810 H HIS 101 HN HIS 101 19.552 -8.221 10.913
811 HA HIS 101 HA HIS 101 21.283 -9.354 9.973
812 HB2 HIS 101 2HB HIS 101 19.272 -10.200 7.872
813 HB3 HIS 101 1HB HIS 101 20.868 -10.901 8.102
814 HD1 HIS 101 1HD HIS 101 21.066 -12.777 9.776
815 HD2 HIS 101 2HD HIS 101 17.423 -10.775 9.995
816 HE1 HIS 101 1HE HIS 101 19.642 -14.119 11.357
817 HE2 HIS 101 2HE HIS 101 17.520 -12.782 11.622
818 H HIS 102 HN HIS 102 22.545 -9.551 7.784
819 HA HIS 102 HA HIS 102 23.610 -8.522 6.047
820 HB2 HIS 102 2HB HIS 102 20.911 -8.455 5.454
821 HB3 HIS 102 1HB HIS 102 21.381 -6.776 5.262
822 HD1 HIS 102 1HD HIS 102 21.026 -9.723 3.357
823 HD2 HIS 102 2HD HIS 102 23.854 -6.673 3.473
824 HE1 HIS 102 1HE HIS 102 22.214 -9.815 1.148
825 HE2 HIS 102 2HE HIS 102 23.827 -7.881 1.183
826 H HIS 103 HN HIS 103 23.457 -5.962 4.997
827 HA HIS 103 HA HIS 103 23.924 -3.777 5.271
828 HB2 HIS 103 2HB HIS 103 21.655 -3.906 6.384
829 HB3 HIS 103 1HB HIS 103 22.497 -3.974 7.926
830 HD1 HIS 103 1HD HIS 103 20.938 -1.643 5.720
831 HD2 HIS 103 2HD HIS 103 24.275 -1.545 8.208
832 HE1 HIS 103 1HE HIS 103 21.439 0.795 6.096
833 HE2 HIS 103 2HE HIS 103 23.594 0.813 7.401
834 H HIS 104 HN HIS 104 26.198 -4.349 5.463
835 HA HIS 104 HA HIS 104 27.206 -3.038 7.826
836 HB2 HIS 104 2HB HIS 104 28.729 -4.691 8.567
837 HB3 HIS 104 1HB HIS 104 27.186 -5.504 8.402
838 HD1 HIS 104 1HD HIS 104 29.691 -7.174 8.517
839 HD2 HIS 104 2HD HIS 104 28.089 -5.775 4.943
840 HE1 HIS 104 1HE HIS 104 30.588 -8.693 6.727
841 HE2 HIS 104 2HE HIS 104 29.822 -7.653 4.561
842 H HIS 105 HN HIS 105 29.306 -2.186 7.565
843 HA HIS 105 HA HIS 105 30.486 -2.492 4.884
844 HB2 HIS 105 2HB HIS 105 29.150 -0.258 5.420
845 HB3 HIS 105 1HB HIS 105 30.648 0.167 6.243
846 HD1 HIS 105 1HD HIS 105 32.202 1.436 4.781
847 HD2 HIS 105 2HD HIS 105 29.812 -1.191 2.613
848 HE1 HIS 105 1HE HIS 105 32.830 1.774 2.369
849 HE2 HIS 105 2HE HIS 105 31.205 0.343 1.073
850 H HIS 106 HN HIS 106 30.795 -1.738 8.263
851 HA HIS 106 HA HIS 106 33.212 -3.220 8.470
852 HB2 HIS 106 2HB HIS 106 34.084 -0.986 7.698
853 HB3 HIS 106 1HB HIS 106 33.390 -0.269 9.147
854 HD1 HIS 106 1HD HIS 106 34.694 -0.507 11.318
855 HD2 HIS 106 2HD HIS 106 36.332 -2.691 8.176
856 HE1 HIS 106 1HE HIS 106 36.960 -1.254 12.116
857 HE2 HIS 106 2HE HIS 106 37.885 -2.678 10.256
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -14.518 3.393 6.053
2 H2 MET 1 H2 MET 1 -15.705 2.424 5.330
3 H3 MET 1 H3 MET 1 -15.783 4.113 5.190
4 HA MET 1 HA MET 1 -15.003 3.071 3.150
5 HB2 MET 1 2HB MET 1 -14.265 5.357 3.813
6 HB3 MET 1 1HB MET 1 -12.849 4.650 4.580
7 HG2 MET 1 2HG MET 1 -12.222 5.502 2.435
8 HG3 MET 1 1HG MET 1 -12.173 3.742 2.380
9 HE1 MET 1 2HE MET 1 -14.210 6.953 1.386
10 HE2 MET 1 3HE MET 1 -15.391 6.012 2.297
11 HE3 MET 1 1HE MET 1 -15.599 6.244 0.561
12 H THR 2 HN THR 2 -13.943 1.386 2.267
13 HA THR 2 HA THR 2 -12.275 -0.226 4.035
14 HB THR 2 HB THR 2 -12.335 -1.906 2.217
15 HG1 THR 2 1HG THR 2 -14.247 -0.283 0.897
16 HG21 THR 2 3HG2 THR 2 -14.718 -2.452 2.387
17 HG22 THR 2 1HG2 THR 2 -15.047 -0.828 2.992
18 HG23 THR 2 2HG2 THR 2 -14.065 -1.940 3.944
19 H PHE 3 HN PHE 3 -10.299 -1.254 3.009
20 HA PHE 3 HA PHE 3 -8.475 0.798 2.348
21 HB2 PHE 3 2HB PHE 3 -7.855 -1.309 3.514
22 HB3 PHE 3 1HB PHE 3 -8.126 -2.191 2.016
23 HD1 PHE 3 2HD PHE 3 -6.063 0.489 3.532
24 HD2 PHE 3 1HD PHE 3 -6.427 -2.403 0.432
25 HE1 PHE 3 2HE PHE 3 -3.729 0.909 2.872
26 HE2 PHE 3 1HE PHE 3 -4.098 -1.984 -0.239
27 HZ PHE 3 HZ PHE 3 -2.745 -0.329 0.982
28 H SER 4 HN SER 4 -10.081 -1.696 0.417
29 HA SER 4 HA SER 4 -8.766 -1.171 -2.012
30 HB2 SER 4 2HB SER 4 -11.554 -2.263 -1.557
31 HB3 SER 4 1HB SER 4 -10.643 -2.371 -3.064
32 HG SER 4 HG SER 4 -8.985 -3.396 -1.560
33 H GLU 5 HN GLU 5 -11.820 0.086 -0.699
34 HA GLU 5 HA GLU 5 -12.527 1.670 -2.907
35 HB2 GLU 5 2HB GLU 5 -13.192 1.843 0.020
36 HB3 GLU 5 1HB GLU 5 -13.873 2.940 -1.164
37 HG2 GLU 5 2HG GLU 5 -14.886 1.084 -2.338
38 HG3 GLU 5 1HG GLU 5 -14.158 -0.048 -1.200
39 H CYS 6 HN CYS 6 -10.766 2.465 0.062
40 HA CYS 6 HA CYS 6 -10.459 5.212 -0.457
41 HB2 CYS 6 2HB CYS 6 -10.053 3.930 1.720
42 HB3 CYS 6 1HB CYS 6 -8.473 3.543 1.068
43 HG CYS 6 HG CYS 6 -8.134 6.493 0.627
44 H ALA 7 HN ALA 7 -8.353 2.453 -1.117
45 HA ALA 7 HA ALA 7 -6.231 3.822 -2.314
46 HB1 ALA 7 1HB ALA 7 -5.635 1.716 -3.359
47 HB2 ALA 7 2HB ALA 7 -7.242 1.072 -3.028
48 HB3 ALA 7 3HB ALA 7 -6.151 1.443 -1.695
49 H ALA 8 HN ALA 8 -9.177 2.478 -3.773
50 HA ALA 8 HA ALA 8 -8.624 3.177 -6.429
51 HB1 ALA 8 1HB ALA 8 -10.413 1.623 -5.758
52 HB2 ALA 8 2HB ALA 8 -10.993 2.883 -6.846
53 HB3 ALA 8 3HB ALA 8 -11.336 2.984 -5.119
54 H LEU 9 HN LEU 9 -10.164 5.001 -3.822
55 HA LEU 9 HA LEU 9 -10.946 7.239 -5.333
56 HB2 LEU 9 2HB LEU 9 -10.124 7.086 -2.430
57 HB3 LEU 9 1HB LEU 9 -10.931 8.451 -3.173
58 HG LEU 9 HG LEU 9 -12.086 5.682 -2.842
59 HD11 LEU 9 1HD1 LEU 9 -12.760 8.290 -1.487
60 HD12 LEU 9 2HD1 LEU 9 -11.925 6.925 -0.746
61 HD13 LEU 9 3HD1 LEU 9 -13.603 6.757 -1.262
62 HD21 LEU 9 3HD2 LEU 9 -13.350 8.190 -3.942
63 HD22 LEU 9 1HD2 LEU 9 -14.151 6.638 -3.695
64 HD23 LEU 9 2HD2 LEU 9 -12.863 6.787 -4.891
65 H TYR 10 HN TYR 10 -7.943 6.511 -3.599
66 HA TYR 10 HA TYR 10 -6.606 8.928 -4.056
67 HB2 TYR 10 2HB TYR 10 -5.803 7.176 -2.510
68 HB3 TYR 10 1HB TYR 10 -5.422 6.145 -3.883
69 HD1 TYR 10 1HD TYR 10 -4.611 9.445 -2.388
70 HD2 TYR 10 2HD TYR 10 -3.294 6.255 -4.864
71 HE1 TYR 10 1HE TYR 10 -2.377 10.455 -2.483
72 HE2 TYR 10 2HE TYR 10 -1.048 7.254 -4.963
73 HH TYR 10 HH TYR 10 -0.088 9.822 -2.894
74 H ILE 11 HN ILE 11 -6.765 5.981 -5.962
75 HA ILE 11 HA ILE 11 -5.004 6.744 -8.017
76 HB ILE 11 HB ILE 11 -7.308 4.785 -8.053
77 HG12 ILE 11 2HG1 ILE 11 -4.338 4.290 -7.762
78 HG13 ILE 11 1HG1 ILE 11 -5.447 4.405 -6.401
79 HG21 ILE 11 1HG2 ILE 11 -6.727 5.447 -10.324
80 HG22 ILE 11 2HG2 ILE 11 -6.215 3.789 -10.010
81 HG23 ILE 11 3HG2 ILE 11 -5.029 5.092 -10.007
82 HD11 ILE 11 3HD1 ILE 11 -4.981 2.098 -6.952
83 HD12 ILE 11 1HD1 ILE 11 -5.546 2.359 -8.602
84 HD13 ILE 11 2HD1 ILE 11 -6.677 2.475 -7.254
85 H LYS 12 HN LYS 12 -8.549 6.981 -7.774
86 HA LYS 12 HA LYS 12 -8.862 8.157 -10.355
87 HB2 LYS 12 2HB LYS 12 -10.720 8.074 -7.973
88 HB3 LYS 12 1HB LYS 12 -11.174 8.679 -9.563
89 HG2 LYS 12 2HG LYS 12 -10.680 6.467 -10.520
90 HG3 LYS 12 1HG LYS 12 -10.293 5.874 -8.904
91 HD2 LYS 12 2HD LYS 12 -12.567 6.305 -8.174
92 HD3 LYS 12 1HD LYS 12 -12.964 6.998 -9.749
93 HE2 LYS 12 2HE LYS 12 -12.448 4.826 -10.796
94 HE3 LYS 12 1HE LYS 12 -12.148 4.147 -9.198
95 HZ1 LYS 12 3HZ LYS 12 -14.434 4.551 -8.605
96 HZ2 LYS 12 1HZ LYS 12 -14.378 3.649 -10.037
97 HZ3 LYS 12 2HZ LYS 12 -14.734 5.306 -10.095
98 H ALA 13 HN ALA 13 -8.448 9.480 -7.111
99 HA ALA 13 HA ALA 13 -8.941 12.174 -7.794
100 HB1 ALA 13 1HB ALA 13 -7.106 11.080 -5.664
101 HB2 ALA 13 2HB ALA 13 -8.829 11.416 -5.474
102 HB3 ALA 13 3HB ALA 13 -7.698 12.738 -5.771
103 H HIS 14 HN HIS 14 -6.170 10.092 -8.193
104 HA HIS 14 HA HIS 14 -4.565 12.360 -9.147
105 HB2 HIS 14 2HB HIS 14 -3.838 9.694 -7.990
106 HB3 HIS 14 1HB HIS 14 -2.689 10.548 -9.012
107 HD1 HIS 14 1HD HIS 14 -4.508 10.893 -5.725
108 HD2 HIS 14 2HD HIS 14 -1.373 12.634 -7.824
109 HE1 HIS 14 1HE HIS 14 -3.387 12.454 -4.095
110 HE2 HIS 14 2HE HIS 14 -1.422 13.414 -5.360
111 H ARG 15 HN ARG 15 -6.671 10.548 -10.573
112 HA ARG 15 HA ARG 15 -5.263 9.126 -12.566
113 HB2 ARG 15 2HB ARG 15 -7.361 9.060 -13.800
114 HB3 ARG 15 1HB ARG 15 -7.661 8.744 -12.096
115 HG2 ARG 15 2HG ARG 15 -8.471 10.992 -11.780
116 HG3 ARG 15 1HG ARG 15 -8.067 11.399 -13.443
117 HD2 ARG 15 2HD ARG 15 -9.700 9.801 -14.260
118 HD3 ARG 15 1HD ARG 15 -10.066 9.308 -12.607
119 HE ARG 15 HE ARG 15 -10.702 11.803 -12.356
120 HH11 ARG 15 1HH1 ARG 15 -11.183 9.873 -15.254
121 HH12 ARG 15 2HH1 ARG 15 -12.579 10.781 -15.755
122 HH21 ARG 15 1HH2 ARG 15 -12.505 12.990 -13.041
123 HH22 ARG 15 2HH2 ARG 15 -13.326 12.552 -14.514
124 H SER 16 HN SER 16 -6.289 12.460 -12.279
125 HA SER 16 HA SER 16 -5.759 13.278 -14.919
126 HB2 SER 16 2HB SER 16 -5.481 15.041 -12.499
127 HB3 SER 16 1HB SER 16 -6.133 15.434 -14.088
128 HG SER 16 HG SER 16 -8.022 14.643 -13.540
129 H SER 17 HN SER 17 -3.817 12.958 -12.020
130 HA SER 17 HA SER 17 -1.503 14.284 -13.010
131 HB2 SER 17 2HB SER 17 -1.527 12.201 -10.829
132 HB3 SER 17 1HB SER 17 -0.495 13.622 -10.983
133 HG SER 17 HG SER 17 -2.335 14.928 -10.588
134 H TRP 18 HN TRP 18 -2.698 10.994 -12.979
135 HA TRP 18 HA TRP 18 -0.235 9.987 -14.194
136 HB2 TRP 18 2HB TRP 18 -2.675 8.509 -13.190
137 HB3 TRP 18 1HB TRP 18 -1.207 7.758 -13.802
138 HD1 TRP 18 1HD TRP 18 0.696 9.930 -12.083
139 HE1 TRP 18 1HE TRP 18 1.022 9.404 -9.580
140 HE3 TRP 18 3HE TRP 18 -3.295 6.825 -11.379
141 HZ2 TRP 18 2HZ TRP 18 -0.240 7.867 -7.579
142 HZ3 TRP 18 3HZ TRP 18 -3.656 5.855 -9.149
143 HH2 TRP 18 2HH TRP 18 -2.165 6.371 -7.290
144 H LYS 19 HN LYS 19 -1.965 11.698 -15.750
145 HA LYS 19 HA LYS 19 -3.011 9.787 -17.706
146 HB2 LYS 19 2HB LYS 19 -4.799 11.174 -16.644
147 HB3 LYS 19 1HB LYS 19 -3.984 12.615 -17.236
148 HG2 LYS 19 2HG LYS 19 -4.450 12.073 -19.489
149 HG3 LYS 19 1HG LYS 19 -4.957 10.437 -19.061
150 HD2 LYS 19 2HD LYS 19 -6.888 11.321 -17.881
151 HD3 LYS 19 1HD LYS 19 -6.362 12.970 -18.217
152 HE2 LYS 19 2HE LYS 19 -8.158 12.220 -19.732
153 HE3 LYS 19 1HE LYS 19 -6.675 12.631 -20.589
154 HZ1 LYS 19 3HZ LYS 19 -7.396 9.846 -19.851
155 HZ2 LYS 19 1HZ LYS 19 -6.177 10.356 -20.914
156 HZ3 LYS 19 2HZ LYS 19 -7.810 10.546 -21.335
157 H ASN 20 HN ASN 20 -0.735 10.788 -19.902
158 HA ASN 20 HA ASN 20 -2.706 9.059 -18.636
159 HB2 ASN 20 2HB ASN 20 -3.518 9.778 -20.862
160 HB3 ASN 20 1HB ASN 20 -2.066 9.096 -21.593
161 HD21 ASN 20 1HD2 ASN 20 -3.237 7.641 -22.838
162 HD22 ASN 20 2HD2 ASN 20 -4.004 6.251 -22.141
163 H THR 21 HN THR 21 -1.478 7.832 -17.463
164 HA THR 21 HA THR 21 0.618 6.247 -18.806
165 HB THR 21 HB THR 21 1.690 5.977 -16.590
166 HG1 THR 21 1HG THR 21 -0.502 7.577 -15.802
167 HG21 THR 21 3HG2 THR 21 1.274 8.857 -17.385
168 HG22 THR 21 1HG2 THR 21 2.506 7.766 -18.019
169 HG23 THR 21 2HG2 THR 21 2.554 8.264 -16.327
170 H LYS 22 HN LYS 22 0.708 3.992 -18.226
171 HA LYS 22 HA LYS 22 -1.818 2.908 -17.287
172 HB2 LYS 22 2HB LYS 22 0.742 1.540 -18.154
173 HB3 LYS 22 1HB LYS 22 -0.730 0.696 -17.692
174 HG2 LYS 22 2HG LYS 22 -1.895 1.987 -19.530
175 HG3 LYS 22 1HG LYS 22 -0.291 2.483 -20.065
176 HD2 LYS 22 2HD LYS 22 -1.238 -0.366 -19.799
177 HD3 LYS 22 1HD LYS 22 -1.137 0.539 -21.308
178 HE2 LYS 22 2HE LYS 22 1.289 0.794 -20.958
179 HE3 LYS 22 1HE LYS 22 1.161 -0.181 -19.494
180 HZ1 LYS 22 3HZ LYS 22 1.862 -1.577 -21.277
181 HZ2 LYS 22 1HZ LYS 22 0.594 -1.055 -22.274
182 HZ3 LYS 22 2HZ LYS 22 0.264 -1.992 -20.900
183 H HIS 23 HN HIS 23 0.695 4.252 -15.899
184 HA HIS 23 HA HIS 23 1.523 2.760 -13.723
185 HB2 HIS 23 2HB HIS 23 2.472 4.909 -14.403
186 HB3 HIS 23 1HB HIS 23 0.976 5.728 -14.004
187 HD1 HIS 23 1HD HIS 23 4.084 4.337 -12.497
188 HD2 HIS 23 2HD HIS 23 0.640 6.337 -11.302
189 HE1 HIS 23 1HE HIS 23 4.553 5.164 -10.172
190 HE2 HIS 23 2HE HIS 23 2.557 6.586 -9.581
191 H ALA 24 HN ALA 24 -1.479 4.541 -14.228
192 HA ALA 24 HA ALA 24 -2.458 4.353 -11.562
193 HB1 ALA 24 1HB ALA 24 -4.608 4.982 -12.524
194 HB2 ALA 24 2HB ALA 24 -3.992 4.663 -14.146
195 HB3 ALA 24 3HB ALA 24 -3.315 5.980 -13.186
196 H ASP 25 HN ASP 25 -3.003 2.406 -14.478
197 HA ASP 25 HA ASP 25 -4.871 0.621 -13.337
198 HB2 ASP 25 2HB ASP 25 -4.607 0.951 -15.772
199 HB3 ASP 25 1HB ASP 25 -3.026 0.186 -15.698
200 H GLN 26 HN GLN 26 -1.391 0.374 -13.905
201 HA GLN 26 HA GLN 26 -0.951 -2.164 -12.844
202 HB2 GLN 26 2HB GLN 26 0.755 0.304 -13.105
203 HB3 GLN 26 1HB GLN 26 1.395 -1.178 -12.421
204 HG2 GLN 26 2HG GLN 26 0.990 -2.368 -14.456
205 HG3 GLN 26 1HG GLN 26 0.129 -0.991 -15.138
206 HE21 GLN 26 1HE2 GLN 26 1.506 -0.997 -16.911
207 HE22 GLN 26 2HE2 GLN 26 3.120 -0.367 -16.806
208 H TRP 27 HN TRP 27 -1.044 1.000 -11.235
209 HA TRP 27 HA TRP 27 -0.338 0.140 -8.662
210 HB2 TRP 27 2HB TRP 27 -1.690 2.485 -9.830
211 HB3 TRP 27 1HB TRP 27 -2.093 2.155 -8.148
212 HD1 TRP 27 1HD TRP 27 1.300 2.131 -10.074
213 HE1 TRP 27 1HE TRP 27 2.998 3.482 -8.678
214 HE3 TRP 27 3HE TRP 27 -1.752 3.508 -6.217
215 HZ2 TRP 27 2HZ TRP 27 3.019 4.956 -6.270
216 HZ3 TRP 27 3HZ TRP 27 -0.819 4.889 -4.412
217 HH2 TRP 27 2HH TRP 27 1.517 5.599 -4.438
218 H THR 28 HN THR 28 -3.511 0.445 -10.190
219 HA THR 28 HA THR 28 -5.080 -0.345 -8.017
220 HB THR 28 HB THR 28 -5.739 -0.864 -10.920
221 HG1 THR 28 1HG THR 28 -5.064 1.322 -10.624
222 HG21 THR 28 3HG2 THR 28 -8.050 -0.449 -10.170
223 HG22 THR 28 1HG2 THR 28 -7.469 -0.270 -8.514
224 HG23 THR 28 2HG2 THR 28 -7.323 -1.824 -9.338
225 H ASN 29 HN ASN 29 -3.761 -2.250 -10.701
226 HA ASN 29 HA ASN 29 -5.071 -4.647 -10.160
227 HB2 ASN 29 2HB ASN 29 -2.717 -3.801 -11.758
228 HB3 ASN 29 1HB ASN 29 -2.891 -5.515 -11.448
229 HD21 ASN 29 1HD2 ASN 29 -4.184 -2.744 -13.036
230 HD22 ASN 29 2HD2 ASN 29 -5.317 -3.583 -14.038
231 H THR 30 HN THR 30 -1.800 -3.611 -9.199
232 HA THR 30 HA THR 30 -1.062 -6.048 -8.015
233 HB THR 30 HB THR 30 -0.045 -3.318 -7.227
234 HG1 THR 30 1HG THR 30 0.372 -4.898 -9.529
235 HG21 THR 30 3HG2 THR 30 0.721 -5.154 -5.800
236 HG22 THR 30 1HG2 THR 30 2.045 -4.509 -6.772
237 HG23 THR 30 2HG2 THR 30 1.280 -6.033 -7.222
238 H ILE 31 HN ILE 31 -2.524 -3.127 -6.634
239 HA ILE 31 HA ILE 31 -2.398 -3.978 -3.941
240 HB ILE 31 HB ILE 31 -4.265 -1.977 -5.231
241 HG12 ILE 31 2HG1 ILE 31 -1.693 -1.570 -3.685
242 HG13 ILE 31 1HG1 ILE 31 -1.855 -1.438 -5.432
243 HG21 ILE 31 1HG2 ILE 31 -4.590 -1.101 -2.954
244 HG22 ILE 31 2HG2 ILE 31 -3.644 -2.448 -2.319
245 HG23 ILE 31 3HG2 ILE 31 -5.181 -2.757 -3.124
246 HD11 ILE 31 3HD1 ILE 31 -3.392 0.442 -5.142
247 HD12 ILE 31 1HD1 ILE 31 -1.825 0.751 -4.392
248 HD13 ILE 31 2HD1 ILE 31 -3.209 0.315 -3.392
249 H LYS 32 HN LYS 32 -4.916 -4.214 -6.419
250 HA LYS 32 HA LYS 32 -6.940 -5.238 -4.736
251 HB2 LYS 32 2HB LYS 32 -7.206 -4.278 -7.078
252 HB3 LYS 32 1HB LYS 32 -6.646 -5.831 -7.680
253 HG2 LYS 32 2HG LYS 32 -8.521 -6.935 -6.523
254 HG3 LYS 32 1HG LYS 32 -9.103 -5.352 -6.006
255 HD2 LYS 32 2HD LYS 32 -9.412 -4.686 -8.324
256 HD3 LYS 32 1HD LYS 32 -8.772 -6.239 -8.871
257 HE2 LYS 32 2HE LYS 32 -10.627 -7.366 -7.662
258 HE3 LYS 32 1HE LYS 32 -11.294 -5.780 -7.278
259 HZ1 LYS 32 3HZ LYS 32 -12.319 -6.858 -9.236
260 HZ2 LYS 32 1HZ LYS 32 -10.827 -6.770 -10.039
261 HZ3 LYS 32 2HZ LYS 32 -11.640 -5.346 -9.589
262 H THR 33 HN THR 33 -4.251 -6.726 -6.370
263 HA THR 33 HA THR 33 -5.315 -9.395 -6.182
264 HB THR 33 HB THR 33 -2.529 -8.460 -6.894
265 HG1 THR 33 1HG THR 33 -4.161 -7.740 -8.362
266 HG21 THR 33 3HG2 THR 33 -2.554 -10.803 -6.179
267 HG22 THR 33 1HG2 THR 33 -2.264 -10.676 -7.914
268 HG23 THR 33 2HG2 THR 33 -3.857 -11.143 -7.318
269 H TYR 34 HN TYR 34 -2.575 -7.687 -4.631
270 HA TYR 34 HA TYR 34 -2.085 -9.953 -2.919
271 HB2 TYR 34 2HB TYR 34 -0.802 -7.226 -3.052
272 HB3 TYR 34 1HB TYR 34 -0.315 -8.480 -1.917
273 HD1 TYR 34 2HD TYR 34 0.266 -10.804 -3.010
274 HD2 TYR 34 1HD TYR 34 0.282 -7.095 -5.093
275 HE1 TYR 34 2HE TYR 34 1.758 -11.773 -4.708
276 HE2 TYR 34 1HE TYR 34 1.775 -8.051 -6.795
277 HH TYR 34 HH TYR 34 3.427 -9.908 -6.960
278 H CYS 35 HN CYS 35 -3.229 -6.624 -2.412
279 HA CYS 35 HA CYS 35 -3.442 -7.069 0.432
280 HB2 CYS 35 2HB CYS 35 -4.313 -4.685 -1.208
281 HB3 CYS 35 1HB CYS 35 -4.115 -4.734 0.541
282 HG CYS 35 HG CYS 35 -1.333 -5.131 0.417
283 H GLY 36 HN GLY 36 -5.505 -7.220 -2.314
284 HA2 GLY 36 2HA GLY 36 -7.994 -6.519 -1.422
285 HA3 GLY 36 1HA GLY 36 -7.706 -7.810 -2.574
286 HA PRO 37 HA PRO 37 -9.199 -10.926 0.059
287 HB2 PRO 37 2HB PRO 37 -7.171 -12.721 0.480
288 HB3 PRO 37 1HB PRO 37 -8.097 -12.600 -1.020
289 HG2 PRO 37 2HG PRO 37 -5.412 -11.448 -0.353
290 HG3 PRO 37 1HG PRO 37 -5.940 -12.264 -1.836
291 HD2 PRO 37 2HD PRO 37 -5.756 -9.602 -1.703
292 HD3 PRO 37 1HD PRO 37 -7.059 -10.390 -2.617
293 H VAL 38 HN VAL 38 -6.287 -9.427 1.288
294 HA VAL 38 HA VAL 38 -6.660 -10.683 3.902
295 HB VAL 38 HB VAL 38 -4.411 -8.877 3.022
296 HG11 VAL 38 1HG1 VAL 38 -4.701 -8.994 5.442
297 HG12 VAL 38 2HG1 VAL 38 -3.224 -9.821 4.947
298 HG13 VAL 38 3HG1 VAL 38 -4.658 -10.756 5.371
299 HG21 VAL 38 3HG2 VAL 38 -4.458 -10.873 1.636
300 HG22 VAL 38 1HG2 VAL 38 -4.536 -11.889 3.077
301 HG23 VAL 38 2HG2 VAL 38 -3.095 -10.927 2.753
302 H ILE 39 HN ILE 39 -6.306 -7.398 2.532
303 HA ILE 39 HA ILE 39 -7.625 -6.376 4.965
304 HB ILE 39 HB ILE 39 -6.185 -4.355 4.826
305 HG12 ILE 39 2HG1 ILE 39 -4.580 -6.043 2.884
306 HG13 ILE 39 1HG1 ILE 39 -5.504 -4.601 2.466
307 HG21 ILE 39 1HG2 ILE 39 -4.206 -5.410 5.844
308 HG22 ILE 39 2HG2 ILE 39 -4.774 -6.983 5.280
309 HG23 ILE 39 3HG2 ILE 39 -5.717 -6.073 6.463
310 HD11 ILE 39 3HD1 ILE 39 -3.097 -4.719 4.269
311 HD12 ILE 39 1HD1 ILE 39 -4.030 -3.271 3.900
312 HD13 ILE 39 2HD1 ILE 39 -3.149 -4.100 2.619
313 H GLY 40 HN GLY 40 -8.070 -6.772 1.834
314 HA2 GLY 40 2HA GLY 40 -8.557 -4.259 0.709
315 HA3 GLY 40 1HA GLY 40 -9.297 -5.764 0.195
316 HA PRO 41 HA PRO 41 -13.164 -4.445 1.814
317 HB2 PRO 41 2HB PRO 41 -13.761 -6.888 3.271
318 HB3 PRO 41 1HB PRO 41 -14.414 -6.330 1.730
319 HG2 PRO 41 2HG PRO 41 -12.760 -8.474 1.948
320 HG3 PRO 41 1HG PRO 41 -12.826 -7.445 0.505
321 HD2 PRO 41 2HD PRO 41 -10.849 -7.423 2.762
322 HD3 PRO 41 1HD PRO 41 -10.564 -7.281 1.012
323 H LEU 42 HN LEU 42 -10.686 -4.869 3.930
324 HA LEU 42 HA LEU 42 -12.213 -4.407 6.354
325 HB2 LEU 42 2HB LEU 42 -9.225 -4.383 5.887
326 HB3 LEU 42 1HB LEU 42 -10.008 -4.245 7.448
327 HG LEU 42 HG LEU 42 -10.020 -6.654 5.632
328 HD11 LEU 42 1HD1 LEU 42 -8.835 -7.704 7.515
329 HD12 LEU 42 2HD1 LEU 42 -8.815 -6.148 8.348
330 HD13 LEU 42 3HD1 LEU 42 -7.941 -6.347 6.829
331 HD21 LEU 42 3HD2 LEU 42 -11.364 -6.293 8.311
332 HD22 LEU 42 1HD2 LEU 42 -11.294 -7.781 7.369
333 HD23 LEU 42 2HD2 LEU 42 -12.191 -6.391 6.758
334 H SER 43 HN SER 43 -11.807 -2.486 7.678
335 HA SER 43 HA SER 43 -12.156 -0.110 6.207
336 HB2 SER 43 2HB SER 43 -12.975 -0.523 8.557
337 HB3 SER 43 1HB SER 43 -11.319 -0.309 9.102
338 HG SER 43 HG SER 43 -13.104 1.571 8.018
339 H VAL 44 HN VAL 44 -10.790 1.551 5.724
340 HA VAL 44 HA VAL 44 -8.043 0.997 5.409
341 HB VAL 44 HB VAL 44 -9.301 2.581 3.985
342 HG11 VAL 44 1HG1 VAL 44 -9.713 4.872 4.768
343 HG12 VAL 44 2HG1 VAL 44 -9.191 4.403 6.388
344 HG13 VAL 44 3HG1 VAL 44 -10.638 3.682 5.685
345 HG21 VAL 44 3HG2 VAL 44 -6.875 2.653 4.002
346 HG22 VAL 44 1HG2 VAL 44 -6.902 3.787 5.351
347 HG23 VAL 44 2HG2 VAL 44 -7.545 4.268 3.779
348 H GLN 45 HN GLN 45 -9.858 2.327 8.037
349 HA GLN 45 HA GLN 45 -7.524 3.374 9.373
350 HB2 GLN 45 2HB GLN 45 -9.070 4.033 11.101
351 HB3 GLN 45 1HB GLN 45 -9.716 4.502 9.543
352 HG2 GLN 45 2HG GLN 45 -11.164 2.519 9.589
353 HG3 GLN 45 1HG GLN 45 -10.549 2.131 11.192
354 HE21 GLN 45 1HE2 GLN 45 -11.197 5.392 10.074
355 HE22 GLN 45 2HE2 GLN 45 -12.539 5.675 11.130
356 H ASP 46 HN ASP 46 -9.183 0.389 9.103
357 HA ASP 46 HA ASP 46 -8.353 -0.561 11.728
358 HB2 ASP 46 2HB ASP 46 -10.575 -1.138 10.710
359 HB3 ASP 46 1HB ASP 46 -9.712 -2.116 9.526
360 H VAL 47 HN VAL 47 -7.145 -0.531 8.538
361 HA VAL 47 HA VAL 47 -5.581 -2.907 8.617
362 HB VAL 47 HB VAL 47 -5.162 -0.398 6.980
363 HG11 VAL 47 1HG1 VAL 47 -3.813 -1.826 5.508
364 HG12 VAL 47 2HG1 VAL 47 -3.996 -3.162 6.645
365 HG13 VAL 47 3HG1 VAL 47 -3.118 -1.710 7.124
366 HG21 VAL 47 3HG2 VAL 47 -7.323 -1.440 6.553
367 HG22 VAL 47 1HG2 VAL 47 -6.534 -2.996 6.289
368 HG23 VAL 47 2HG2 VAL 47 -6.244 -1.660 5.175
369 H ASP 48 HN ASP 48 -3.958 -3.276 9.974
370 HA ASP 48 HA ASP 48 -2.328 -0.986 10.867
371 HB2 ASP 48 2HB ASP 48 -2.939 -3.576 12.308
372 HB3 ASP 48 1HB ASP 48 -1.759 -2.394 12.863
373 H THR 49 HN THR 49 -0.079 -1.781 11.659
374 HA THR 49 HA THR 49 1.374 -2.639 9.426
375 HB THR 49 HB THR 49 2.289 -2.752 12.305
376 HG1 THR 49 1HG THR 49 2.618 -0.547 10.548
377 HG21 THR 49 3HG2 THR 49 4.503 -2.290 11.330
378 HG22 THR 49 1HG2 THR 49 3.798 -2.368 9.715
379 HG23 THR 49 2HG2 THR 49 3.828 -3.807 10.734
380 H LYS 50 HN LYS 50 0.215 -4.358 12.259
381 HA LYS 50 HA LYS 50 1.457 -6.815 11.984
382 HB2 LYS 50 2HB LYS 50 -0.011 -6.089 13.852
383 HB3 LYS 50 1HB LYS 50 -1.402 -6.290 12.805
384 HG2 LYS 50 2HG LYS 50 -0.881 -8.684 12.609
385 HG3 LYS 50 1HG LYS 50 0.459 -8.464 13.737
386 HD2 LYS 50 2HD LYS 50 -2.462 -7.951 14.296
387 HD3 LYS 50 1HD LYS 50 -1.494 -9.287 14.924
388 HE2 LYS 50 2HE LYS 50 -0.200 -7.856 16.268
389 HE3 LYS 50 1HE LYS 50 -0.750 -6.419 15.406
390 HZ1 LYS 50 3HZ LYS 50 -2.400 -8.132 17.190
391 HZ2 LYS 50 1HZ LYS 50 -2.969 -6.789 16.322
392 HZ3 LYS 50 2HZ LYS 50 -1.814 -6.577 17.543
393 H LEU 51 HN LEU 51 -1.520 -5.648 10.484
394 HA LEU 51 HA LEU 51 -2.125 -8.030 9.089
395 HB2 LEU 51 2HB LEU 51 -2.944 -5.171 8.571
396 HB3 LEU 51 1HB LEU 51 -3.657 -6.564 7.793
397 HG LEU 51 HG LEU 51 -3.779 -5.911 10.726
398 HD11 LEU 51 1HD1 LEU 51 -5.203 -4.497 9.348
399 HD12 LEU 51 2HD1 LEU 51 -6.168 -5.617 10.308
400 HD13 LEU 51 3HD1 LEU 51 -5.906 -5.925 8.592
401 HD21 LEU 51 3HD2 LEU 51 -3.661 -8.327 10.353
402 HD22 LEU 51 1HD2 LEU 51 -5.002 -8.216 9.213
403 HD23 LEU 51 2HD2 LEU 51 -5.258 -7.838 10.918
404 H ILE 52 HN ILE 52 -0.364 -5.097 8.252
405 HA ILE 52 HA ILE 52 -0.058 -5.621 5.503
406 HB ILE 52 HB ILE 52 1.664 -3.969 7.351
407 HG12 ILE 52 2HG1 ILE 52 -0.545 -3.170 5.443
408 HG13 ILE 52 1HG1 ILE 52 -0.698 -3.260 7.195
409 HG21 ILE 52 1HG2 ILE 52 2.448 -2.847 5.298
410 HG22 ILE 52 2HG2 ILE 52 1.598 -4.058 4.337
411 HG23 ILE 52 3HG2 ILE 52 2.936 -4.539 5.382
412 HD11 ILE 52 3HD1 ILE 52 -0.404 -0.972 6.413
413 HD12 ILE 52 1HD1 ILE 52 1.146 -1.413 5.699
414 HD13 ILE 52 2HD1 ILE 52 0.930 -1.483 7.448
415 H MET 53 HN MET 53 1.985 -6.422 8.290
416 HA MET 53 HA MET 53 4.182 -7.416 6.836
417 HB2 MET 53 2HB MET 53 3.201 -8.096 9.612
418 HB3 MET 53 1HB MET 53 4.725 -8.671 8.948
419 HG2 MET 53 2HG MET 53 5.449 -6.334 8.665
420 HG3 MET 53 1HG MET 53 3.945 -5.802 9.416
421 HE1 MET 53 3HE MET 53 3.514 -7.963 11.694
422 HE2 MET 53 1HE MET 53 3.314 -6.229 11.934
423 HE3 MET 53 2HE MET 53 4.305 -7.164 13.054
424 H LYS 54 HN LYS 54 1.183 -8.917 7.865
425 HA LYS 54 HA LYS 54 1.868 -11.579 7.219
426 HB2 LYS 54 2HB LYS 54 -0.843 -10.238 7.255
427 HB3 LYS 54 1HB LYS 54 -0.578 -11.974 7.167
428 HG2 LYS 54 2HG LYS 54 0.554 -11.880 9.358
429 HG3 LYS 54 1HG LYS 54 0.181 -10.158 9.446
430 HD2 LYS 54 2HD LYS 54 -1.460 -11.390 10.716
431 HD3 LYS 54 1HD LYS 54 -2.227 -10.714 9.277
432 HE2 LYS 54 2HE LYS 54 -2.046 -12.876 8.156
433 HE3 LYS 54 1HE LYS 54 -1.249 -13.552 9.576
434 HZ1 LYS 54 3HZ LYS 54 -3.581 -14.130 9.541
435 HZ2 LYS 54 1HZ LYS 54 -4.023 -12.496 9.482
436 HZ3 LYS 54 2HZ LYS 54 -3.258 -13.117 10.860
437 H VAL 55 HN VAL 55 0.522 -8.928 5.342
438 HA VAL 55 HA VAL 55 -0.066 -10.447 3.016
439 HB VAL 55 HB VAL 55 0.500 -7.482 3.203
440 HG11 VAL 55 1HG1 VAL 55 -1.036 -9.069 1.149
441 HG12 VAL 55 2HG1 VAL 55 0.547 -8.331 0.919
442 HG13 VAL 55 3HG1 VAL 55 -0.869 -7.315 1.182
443 HG21 VAL 55 3HG2 VAL 55 -1.258 -8.087 4.756
444 HG22 VAL 55 1HG2 VAL 55 -2.113 -8.959 3.482
445 HG23 VAL 55 2HG2 VAL 55 -1.930 -7.207 3.384
446 H LEU 56 HN LEU 56 2.704 -8.465 3.990
447 HA LEU 56 HA LEU 56 3.960 -8.578 1.440
448 HB2 LEU 56 2HB LEU 56 5.025 -7.776 4.141
449 HB3 LEU 56 1HB LEU 56 5.911 -7.592 2.640
450 HG LEU 56 HG LEU 56 3.316 -6.217 3.351
451 HD11 LEU 56 1HD1 LEU 56 4.680 -4.186 3.343
452 HD12 LEU 56 2HD1 LEU 56 6.123 -5.159 3.051
453 HD13 LEU 56 3HD1 LEU 56 5.232 -5.335 4.563
454 HD21 LEU 56 3HD2 LEU 56 3.617 -4.990 1.263
455 HD22 LEU 56 1HD2 LEU 56 3.451 -6.720 0.961
456 HD23 LEU 56 2HD2 LEU 56 5.041 -5.960 0.889
457 H ASP 57 HN ASP 57 4.167 -10.572 4.305
458 HA ASP 57 HA ASP 57 6.707 -11.619 4.126
459 HB2 ASP 57 2HB ASP 57 4.970 -12.053 5.925
460 HB3 ASP 57 1HB ASP 57 4.316 -13.288 4.877
461 HA PRO 58 HA PRO 58 5.278 -15.227 1.273
462 HB2 PRO 58 2HB PRO 58 2.888 -15.024 -0.002
463 HB3 PRO 58 1HB PRO 58 3.083 -15.793 1.576
464 HG2 PRO 58 2HG PRO 58 2.113 -13.043 0.916
465 HG3 PRO 58 1HG PRO 58 1.496 -14.190 2.119
466 HD2 PRO 58 2HD PRO 58 3.098 -12.098 2.764
467 HD3 PRO 58 1HD PRO 58 3.108 -13.624 3.664
468 H ILE 59 HN ILE 59 4.822 -11.897 0.519
469 HA ILE 59 HA ILE 59 4.901 -12.236 -2.338
470 HB ILE 59 HB ILE 59 5.450 -9.691 -0.794
471 HG12 ILE 59 2HG1 ILE 59 2.831 -10.730 -1.913
472 HG13 ILE 59 1HG1 ILE 59 3.243 -10.633 -0.203
473 HG21 ILE 59 1HG2 ILE 59 4.778 -8.597 -2.887
474 HG22 ILE 59 2HG2 ILE 59 4.580 -10.176 -3.647
475 HG23 ILE 59 3HG2 ILE 59 6.178 -9.644 -3.123
476 HD11 ILE 59 3HD1 ILE 59 1.790 -8.806 -0.886
477 HD12 ILE 59 1HD1 ILE 59 2.979 -8.298 -2.088
478 HD13 ILE 59 2HD1 ILE 59 3.365 -8.207 -0.368
479 H TRP 60 HN TRP 60 7.223 -11.571 0.230
480 HA TRP 60 HA TRP 60 9.453 -10.936 -1.364
481 HB2 TRP 60 2HB TRP 60 9.337 -12.294 1.343
482 HB3 TRP 60 1HB TRP 60 10.816 -11.705 0.595
483 HD1 TRP 60 1HD TRP 60 8.063 -10.635 2.825
484 HE1 TRP 60 1HE TRP 60 8.211 -8.108 3.279
485 HE3 TRP 60 3HE TRP 60 11.471 -9.363 -0.764
486 HZ2 TRP 60 2HZ TRP 60 9.590 -5.871 2.257
487 HZ3 TRP 60 3HZ TRP 60 12.154 -7.006 -0.959
488 HH2 TRP 60 2HH TRP 60 11.231 -5.299 0.521
489 H GLU 61 HN GLU 61 7.930 -13.951 -0.613
490 HA GLU 61 HA GLU 61 9.990 -15.728 -1.301
491 HB2 GLU 61 2HB GLU 61 6.996 -15.872 -1.143
492 HB3 GLU 61 1HB GLU 61 7.929 -17.234 -1.716
493 HG2 GLU 61 2HG GLU 61 8.697 -16.010 0.870
494 HG3 GLU 61 1HG GLU 61 7.232 -16.988 0.805
495 H GLN 62 HN GLN 62 7.505 -14.073 -3.172
496 HA GLN 62 HA GLN 62 8.243 -15.607 -5.550
497 HB2 GLN 62 2HB GLN 62 5.848 -13.879 -4.949
498 HB3 GLN 62 1HB GLN 62 6.129 -14.692 -6.479
499 HG2 GLN 62 2HG GLN 62 6.070 -16.852 -5.341
500 HG3 GLN 62 1HG GLN 62 5.778 -16.029 -3.809
501 HE21 GLN 62 1HE2 GLN 62 4.152 -17.982 -5.290
502 HE22 GLN 62 2HE2 GLN 62 2.618 -17.221 -5.534
503 H LYS 63 HN LYS 63 7.578 -12.243 -4.579
504 HA LYS 63 HA LYS 63 9.294 -11.320 -6.762
505 HB2 LYS 63 2HB LYS 63 6.434 -10.423 -6.351
506 HB3 LYS 63 1HB LYS 63 7.578 -9.646 -7.432
507 HG2 LYS 63 2HG LYS 63 7.732 -11.716 -8.743
508 HG3 LYS 63 1HG LYS 63 6.553 -12.470 -7.666
509 HD2 LYS 63 2HD LYS 63 4.898 -10.784 -8.294
510 HD3 LYS 63 1HD LYS 63 6.078 -10.014 -9.354
511 HE2 LYS 63 2HE LYS 63 4.615 -11.370 -10.687
512 HE3 LYS 63 1HE LYS 63 6.210 -12.118 -10.659
513 HZ1 LYS 63 3HZ LYS 63 3.966 -12.942 -8.895
514 HZ2 LYS 63 1HZ LYS 63 5.452 -13.731 -9.095
515 HZ3 LYS 63 2HZ LYS 63 4.335 -13.692 -10.367
516 HA PRO 64 HA PRO 64 10.188 -9.138 -2.794
517 HB2 PRO 64 2HB PRO 64 12.772 -8.808 -4.201
518 HB3 PRO 64 1HB PRO 64 12.450 -9.376 -2.560
519 HG2 PRO 64 2HG PRO 64 13.197 -11.070 -4.481
520 HG3 PRO 64 1HG PRO 64 12.007 -11.540 -3.254
521 HD2 PRO 64 2HD PRO 64 11.575 -10.736 -6.104
522 HD3 PRO 64 1HD PRO 64 10.763 -11.992 -5.149
523 H GLU 65 HN GLU 65 11.050 -8.134 -6.093
524 HA GLU 65 HA GLU 65 11.411 -5.393 -5.449
525 HB2 GLU 65 2HB GLU 65 12.368 -6.425 -7.468
526 HB3 GLU 65 1HB GLU 65 10.749 -6.668 -8.100
527 HG2 GLU 65 2HG GLU 65 10.396 -4.279 -8.214
528 HG3 GLU 65 1HG GLU 65 11.982 -3.995 -7.500
529 H THR 66 HN THR 66 8.694 -7.315 -6.560
530 HA THR 66 HA THR 66 6.913 -5.156 -7.018
531 HB THR 66 HB THR 66 6.093 -7.957 -6.246
532 HG1 THR 66 1HG THR 66 6.732 -7.050 -8.879
533 HG21 THR 66 3HG2 THR 66 4.850 -5.916 -8.098
534 HG22 THR 66 1HG2 THR 66 4.294 -6.288 -6.465
535 HG23 THR 66 2HG2 THR 66 4.200 -7.513 -7.730
536 H ALA 67 HN ALA 67 7.666 -7.156 -4.230
537 HA ALA 67 HA ALA 67 5.660 -6.237 -2.487
538 HB1 ALA 67 1HB ALA 67 7.091 -7.048 -0.684
539 HB2 ALA 67 2HB ALA 67 8.447 -7.174 -1.803
540 HB3 ALA 67 3HB ALA 67 7.036 -8.212 -2.008
541 H SER 68 HN SER 68 8.921 -5.058 -3.151
542 HA SER 68 HA SER 68 8.938 -2.984 -1.237
543 HB2 SER 68 2HB SER 68 10.454 -3.142 -3.858
544 HB3 SER 68 1HB SER 68 10.866 -2.130 -2.474
545 HG SER 68 HG SER 68 10.845 -4.972 -2.560
546 H ARG 69 HN ARG 69 8.027 -3.071 -4.660
547 HA ARG 69 HA ARG 69 7.467 -0.327 -4.939
548 HB2 ARG 69 2HB ARG 69 6.647 -2.799 -6.435
549 HB3 ARG 69 1HB ARG 69 6.018 -1.227 -6.877
550 HG2 ARG 69 2HG ARG 69 8.311 -0.412 -7.199
551 HG3 ARG 69 1HG ARG 69 8.906 -2.027 -6.816
552 HD2 ARG 69 2HD ARG 69 7.835 -2.954 -8.740
553 HD3 ARG 69 1HD ARG 69 6.985 -1.441 -9.056
554 HE ARG 69 HE ARG 69 9.721 -0.898 -9.094
555 HH11 ARG 69 1HH1 ARG 69 7.375 -2.749 -10.922
556 HH12 ARG 69 2HH1 ARG 69 8.238 -2.590 -12.426
557 HH21 ARG 69 1HH2 ARG 69 10.834 -0.656 -11.067
558 HH22 ARG 69 2HH2 ARG 69 10.193 -1.377 -12.508
559 H LEU 70 HN LEU 70 5.387 -3.107 -4.180
560 HA LEU 70 HA LEU 70 2.968 -1.675 -3.995
561 HB2 LEU 70 2HB LEU 70 3.073 -4.118 -4.177
562 HB3 LEU 70 1HB LEU 70 3.817 -4.215 -2.593
563 HG LEU 70 HG LEU 70 1.742 -3.260 -1.606
564 HD11 LEU 70 1HD1 LEU 70 0.921 -2.085 -3.577
565 HD12 LEU 70 2HD1 LEU 70 -0.290 -3.206 -2.955
566 HD13 LEU 70 3HD1 LEU 70 0.645 -3.626 -4.391
567 HD21 LEU 70 3HD2 LEU 70 2.111 -5.653 -1.600
568 HD22 LEU 70 1HD2 LEU 70 1.423 -5.787 -3.219
569 HD23 LEU 70 2HD2 LEU 70 0.402 -5.303 -1.863
570 H ARG 71 HN ARG 71 5.554 -2.283 -1.727
571 HA ARG 71 HA ARG 71 4.339 -1.572 0.669
572 HB2 ARG 71 2HB ARG 71 6.778 -2.445 0.054
573 HB3 ARG 71 1HB ARG 71 7.163 -0.734 0.174
574 HG2 ARG 71 2HG ARG 71 5.917 -2.424 2.334
575 HG3 ARG 71 1HG ARG 71 7.599 -1.897 2.265
576 HD2 ARG 71 2HD ARG 71 7.083 0.270 2.808
577 HD3 ARG 71 1HD ARG 71 5.454 0.164 2.138
578 HE ARG 71 HE ARG 71 6.308 -0.589 4.803
579 HH11 ARG 71 1HH1 ARG 71 3.796 -0.640 2.372
580 HH12 ARG 71 2HH1 ARG 71 2.545 -1.095 3.480
581 HH21 ARG 71 1HH2 ARG 71 4.664 -1.184 6.281
582 HH22 ARG 71 2HH2 ARG 71 3.038 -1.386 5.718
583 H GLY 72 HN GLY 72 6.069 0.483 -1.665
584 HA2 GLY 72 2HA GLY 72 5.832 2.880 -0.191
585 HA3 GLY 72 1HA GLY 72 6.153 2.763 -1.915
586 H ARG 73 HN ARG 73 3.726 1.343 -2.538
587 HA ARG 73 HA ARG 73 2.035 3.516 -3.077
588 HB2 ARG 73 2HB ARG 73 1.307 0.580 -3.053
589 HB3 ARG 73 1HB ARG 73 0.435 1.861 -3.884
590 HG2 ARG 73 2HG ARG 73 2.409 2.255 -5.297
591 HG3 ARG 73 1HG ARG 73 3.227 0.916 -4.490
592 HD2 ARG 73 2HD ARG 73 1.408 -0.588 -5.236
593 HD3 ARG 73 1HD ARG 73 0.696 0.764 -6.120
594 HE ARG 73 HE ARG 73 3.374 0.481 -6.920
595 HH11 ARG 73 1HH1 ARG 73 0.319 -1.210 -7.198
596 HH12 ARG 73 2HH1 ARG 73 0.730 -1.967 -8.706
597 HH21 ARG 73 1HH2 ARG 73 3.909 -0.488 -8.893
598 HH22 ARG 73 2HH2 ARG 73 2.782 -1.549 -9.674
599 H ILE 74 HN ILE 74 1.796 0.935 -0.664
600 HA ILE 74 HA ILE 74 -0.678 1.649 0.432
601 HB ILE 74 HB ILE 74 1.661 0.378 1.872
602 HG12 ILE 74 2HG1 ILE 74 -0.610 -0.919 0.349
603 HG13 ILE 74 1HG1 ILE 74 1.055 -0.808 -0.215
604 HG21 ILE 74 1HG2 ILE 74 -0.061 1.147 3.402
605 HG22 ILE 74 2HG2 ILE 74 -0.064 -0.615 3.310
606 HG23 ILE 74 3HG2 ILE 74 -1.297 0.316 2.456
607 HD11 ILE 74 3HD1 ILE 74 0.132 -2.286 2.242
608 HD12 ILE 74 1HD1 ILE 74 1.784 -2.205 1.634
609 HD13 ILE 74 2HD1 ILE 74 0.535 -3.015 0.688
610 H GLU 75 HN GLU 75 2.592 2.712 1.205
611 HA GLU 75 HA GLU 75 2.037 4.296 3.471
612 HB2 GLU 75 2HB GLU 75 4.293 3.584 2.651
613 HB3 GLU 75 1HB GLU 75 4.142 4.755 1.350
614 HG2 GLU 75 2HG GLU 75 3.901 6.526 3.116
615 HG3 GLU 75 1HG GLU 75 4.349 5.291 4.297
616 H SER 76 HN SER 76 2.180 5.132 0.012
617 HA SER 76 HA SER 76 1.650 7.870 0.314
618 HB2 SER 76 2HB SER 76 0.974 6.106 -2.033
619 HB3 SER 76 1HB SER 76 1.131 7.860 -2.065
620 HG SER 76 HG SER 76 3.362 6.914 -1.010
621 H VAL 77 HN VAL 77 -0.529 5.111 -0.146
622 HA VAL 77 HA VAL 77 -2.893 6.670 -0.414
623 HB VAL 77 HB VAL 77 -2.605 3.767 0.394
624 HG11 VAL 77 1HG1 VAL 77 -4.760 4.647 1.075
625 HG12 VAL 77 2HG1 VAL 77 -4.944 3.541 -0.285
626 HG13 VAL 77 3HG1 VAL 77 -5.034 5.283 -0.548
627 HG21 VAL 77 3HG2 VAL 77 -3.160 5.029 -2.288
628 HG22 VAL 77 1HG2 VAL 77 -3.162 3.298 -1.948
629 HG23 VAL 77 2HG2 VAL 77 -1.668 4.224 -1.800
630 H LEU 78 HN LEU 78 -1.460 4.923 2.347
631 HA LEU 78 HA LEU 78 -3.589 5.464 4.114
632 HB2 LEU 78 2HB LEU 78 -0.710 4.774 4.656
633 HB3 LEU 78 1HB LEU 78 -1.916 4.926 5.919
634 HG LEU 78 HG LEU 78 -1.945 2.919 3.664
635 HD11 LEU 78 1HD1 LEU 78 -1.620 1.277 5.431
636 HD12 LEU 78 2HD1 LEU 78 -1.533 2.569 6.627
637 HD13 LEU 78 3HD1 LEU 78 -0.289 2.433 5.385
638 HD21 LEU 78 3HD2 LEU 78 -3.906 1.976 4.763
639 HD22 LEU 78 1HD2 LEU 78 -4.206 3.639 4.258
640 HD23 LEU 78 2HD2 LEU 78 -3.876 3.279 5.953
641 H ASP 79 HN ASP 79 -0.575 7.209 3.484
642 HA ASP 79 HA ASP 79 -0.847 9.157 5.502
643 HB2 ASP 79 2HB ASP 79 1.212 8.795 4.123
644 HB3 ASP 79 1HB ASP 79 0.382 9.537 2.760
645 H TRP 80 HN TRP 80 -1.904 9.083 2.146
646 HA TRP 80 HA TRP 80 -3.169 11.569 1.987
647 HB2 TRP 80 2HB TRP 80 -2.656 10.178 0.044
648 HB3 TRP 80 1HB TRP 80 -3.791 8.955 0.591
649 HD1 TRP 80 1HD TRP 80 -3.750 12.529 -0.851
650 HE1 TRP 80 1HE TRP 80 -5.988 12.933 -2.063
651 HE3 TRP 80 3HE TRP 80 -6.156 8.209 0.459
652 HZ2 TRP 80 2HZ TRP 80 -8.454 11.584 -2.402
653 HZ3 TRP 80 3HZ TRP 80 -8.451 7.847 -0.350
654 HH2 TRP 80 2HH TRP 80 -9.573 9.500 -1.749
655 H ALA 81 HN ALA 81 -4.531 8.377 2.771
656 HA ALA 81 HA ALA 81 -7.182 9.175 3.132
657 HB1 ALA 81 1HB ALA 81 -5.734 6.922 4.516
658 HB2 ALA 81 2HB ALA 81 -6.469 6.845 2.915
659 HB3 ALA 81 3HB ALA 81 -7.482 7.088 4.339
660 H THR 82 HN THR 82 -4.476 9.216 5.378
661 HA THR 82 HA THR 82 -6.007 9.685 7.716
662 HB THR 82 HB THR 82 -3.123 10.448 7.225
663 HG1 THR 82 1HG THR 82 -3.232 8.279 6.834
664 HG21 THR 82 3HG2 THR 82 -4.619 9.823 9.774
665 HG22 THR 82 1HG2 THR 82 -4.079 11.421 9.258
666 HG23 THR 82 2HG2 THR 82 -2.895 10.174 9.650
667 H VAL 83 HN VAL 83 -4.483 11.826 5.351
668 HA VAL 83 HA VAL 83 -5.113 14.213 6.828
669 HB VAL 83 HB VAL 83 -4.299 13.958 3.929
670 HG11 VAL 83 1HG1 VAL 83 -5.303 16.121 4.473
671 HG12 VAL 83 2HG1 VAL 83 -3.577 16.283 4.148
672 HG13 VAL 83 3HG1 VAL 83 -4.168 16.315 5.810
673 HG21 VAL 83 3HG2 VAL 83 -2.640 12.926 5.388
674 HG22 VAL 83 1HG2 VAL 83 -2.587 14.384 6.378
675 HG23 VAL 83 2HG2 VAL 83 -2.022 14.431 4.707
676 H ARG 84 HN ARG 84 -6.572 12.361 4.229
677 HA ARG 84 HA ARG 84 -8.506 14.316 3.487
678 HB2 ARG 84 2HB ARG 84 -8.404 11.332 3.034
679 HB3 ARG 84 1HB ARG 84 -9.640 12.380 2.352
680 HG2 ARG 84 2HG ARG 84 -6.681 12.557 1.828
681 HG3 ARG 84 1HG ARG 84 -7.899 11.905 0.729
682 HD2 ARG 84 2HD ARG 84 -7.728 14.749 1.722
683 HD3 ARG 84 1HD ARG 84 -7.291 14.182 0.112
684 HE ARG 84 HE ARG 84 -9.775 13.458 0.070
685 HH11 ARG 84 1HH1 ARG 84 -8.484 16.324 1.588
686 HH12 ARG 84 2HH1 ARG 84 -9.930 17.260 1.362
687 HH21 ARG 84 1HH2 ARG 84 -11.698 14.674 -0.234
688 HH22 ARG 84 2HH2 ARG 84 -11.770 16.302 0.364
689 H GLY 85 HN GLY 85 -8.372 11.908 5.987
690 HA2 GLY 85 2HA GLY 85 -9.726 12.205 7.941
691 HA3 GLY 85 1HA GLY 85 -10.975 12.905 6.925
692 H TYR 86 HN TYR 86 -9.400 10.011 5.850
693 HA TYR 86 HA TYR 86 -11.890 8.549 6.299
694 HB2 TYR 86 2HB TYR 86 -9.433 7.815 4.688
695 HB3 TYR 86 1HB TYR 86 -10.887 6.826 4.817
696 HD1 TYR 86 1HD TYR 86 -13.129 8.214 4.260
697 HD2 TYR 86 2HD TYR 86 -9.243 9.119 2.793
698 HE1 TYR 86 1HE TYR 86 -14.129 9.435 2.374
699 HE2 TYR 86 2HE TYR 86 -10.233 10.339 0.901
700 HH TYR 86 HH TYR 86 -13.437 11.298 0.829
701 H ARG 87 HN ARG 87 -8.898 9.003 7.711
702 HA ARG 87 HA ARG 87 -9.393 7.055 9.734
703 HB2 ARG 87 2HB ARG 87 -7.377 5.724 9.450
704 HB3 ARG 87 1HB ARG 87 -8.368 5.610 8.002
705 HG2 ARG 87 2HG ARG 87 -6.927 7.210 6.871
706 HG3 ARG 87 1HG ARG 87 -5.945 7.367 8.329
707 HD2 ARG 87 2HD ARG 87 -6.302 4.917 6.610
708 HD3 ARG 87 1HD ARG 87 -4.833 5.867 6.825
709 HE ARG 87 HE ARG 87 -5.843 3.814 8.552
710 HH11 ARG 87 1HH1 ARG 87 -3.885 6.725 8.438
711 HH12 ARG 87 2HH1 ARG 87 -2.927 6.280 9.816
712 HH21 ARG 87 1HH2 ARG 87 -4.590 3.248 10.401
713 HH22 ARG 87 2HH2 ARG 87 -3.338 4.324 10.928
714 H GLU 88 HN GLU 88 -8.024 7.369 11.553
715 HA GLU 88 HA GLU 88 -6.276 9.729 11.383
716 HB2 GLU 88 2HB GLU 88 -8.104 8.881 13.636
717 HB3 GLU 88 1HB GLU 88 -6.865 10.119 13.799
718 HG2 GLU 88 2HG GLU 88 -7.964 11.468 12.101
719 HG3 GLU 88 1HG GLU 88 -9.185 10.217 11.876
720 H GLY 89 HN GLY 89 -4.704 9.741 13.338
721 HA2 GLY 89 2HA GLY 89 -3.364 8.425 14.835
722 HA3 GLY 89 1HA GLY 89 -3.796 6.998 13.900
723 H ASP 90 HN ASP 90 -1.677 6.364 13.480
724 HA ASP 90 HA ASP 90 -0.031 8.264 11.954
725 HB2 ASP 90 2HB ASP 90 0.736 6.867 14.110
726 HB3 ASP 90 1HB ASP 90 1.082 5.657 12.881
727 H ASN 91 HN ASN 91 1.595 6.628 10.571
728 HA ASN 91 HA ASN 91 -0.230 5.331 8.663
729 HB2 ASN 91 2HB ASN 91 1.216 7.205 7.808
730 HB3 ASN 91 1HB ASN 91 2.626 6.207 8.158
731 HD21 ASN 91 1HD2 ASN 91 1.994 7.157 5.580
732 HD22 ASN 91 2HD2 ASN 91 1.600 5.809 4.581
733 HA PRO 92 HA PRO 92 1.590 1.632 10.703
734 HB2 PRO 92 2HB PRO 92 -0.066 -0.063 9.256
735 HB3 PRO 92 1HB PRO 92 -0.433 0.616 10.844
736 HG2 PRO 92 2HG PRO 92 -1.290 1.546 8.137
737 HG3 PRO 92 1HG PRO 92 -2.223 1.476 9.644
738 HD2 PRO 92 2HD PRO 92 -1.241 3.785 8.739
739 HD3 PRO 92 1HD PRO 92 -1.242 3.417 10.477
740 H ALA 93 HN ALA 93 1.512 2.642 7.405
741 HA ALA 93 HA ALA 93 3.085 0.394 6.438
742 HB1 ALA 93 1HB ALA 93 1.450 1.425 4.953
743 HB2 ALA 93 2HB ALA 93 3.080 1.582 4.298
744 HB3 ALA 93 3HB ALA 93 2.301 2.966 5.066
745 H ARG 94 HN ARG 94 3.629 3.228 8.088
746 HA ARG 94 HA ARG 94 6.233 3.884 7.024
747 HB2 ARG 94 2HB ARG 94 4.700 5.561 7.943
748 HB3 ARG 94 1HB ARG 94 4.752 4.774 9.500
749 HG2 ARG 94 2HG ARG 94 7.144 5.364 9.674
750 HG3 ARG 94 1HG ARG 94 6.994 6.241 8.142
751 HD2 ARG 94 2HD ARG 94 5.172 7.585 9.141
752 HD3 ARG 94 1HD ARG 94 5.439 6.764 10.673
753 HE ARG 94 HE ARG 94 7.777 8.088 9.621
754 HH11 ARG 94 1HH1 ARG 94 4.872 8.399 11.562
755 HH12 ARG 94 2HH1 ARG 94 5.443 9.794 12.433
756 HH21 ARG 94 1HH2 ARG 94 8.531 9.938 10.773
757 HH22 ARG 94 2HH2 ARG 94 7.532 10.631 12.013
758 H TRP 95 HN TRP 95 8.153 3.236 7.819
759 HA TRP 95 HA TRP 95 8.119 1.441 10.156
760 HB2 TRP 95 2HB TRP 95 8.737 0.751 7.419
761 HB3 TRP 95 1HB TRP 95 10.117 0.447 8.469
762 HD1 TRP 95 1HD TRP 95 8.922 -0.763 11.005
763 HE1 TRP 95 1HE TRP 95 7.617 -2.984 10.983
764 HE3 TRP 95 3HE TRP 95 7.593 -0.881 6.066
765 HZ2 TRP 95 2HZ TRP 95 6.216 -4.573 9.117
766 HZ3 TRP 95 3HZ TRP 95 6.274 -2.786 5.247
767 HH2 TRP 95 2HH TRP 95 5.604 -4.596 6.741
768 H ARG 96 HN ARG 96 10.009 3.568 8.084
769 HA ARG 96 HA ARG 96 12.017 4.501 8.182
770 HB2 ARG 96 2HB ARG 96 11.540 4.334 11.144
771 HB3 ARG 96 1HB ARG 96 12.720 5.339 10.336
772 HG2 ARG 96 2HG ARG 96 10.998 6.609 9.246
773 HG3 ARG 96 1HG ARG 96 9.760 5.548 9.920
774 HD2 ARG 96 2HD ARG 96 11.658 7.183 11.593
775 HD3 ARG 96 1HD ARG 96 10.057 7.738 11.108
776 HE ARG 96 HE ARG 96 9.144 5.828 12.369
777 HH11 ARG 96 1HH1 ARG 96 12.427 6.846 13.047
778 HH12 ARG 96 2HH1 ARG 96 12.409 6.278 14.689
779 HH21 ARG 96 1HH2 ARG 96 9.102 5.086 14.523
780 HH22 ARG 96 2HH2 ARG 96 10.511 5.253 15.527
781 H GLY 97 HN GLY 97 11.731 1.616 10.126
782 HA2 GLY 97 2HA GLY 97 14.416 0.853 9.226
783 HA3 GLY 97 1HA GLY 97 14.024 0.721 10.938
784 H TYR 98 HN TYR 98 13.375 -0.523 7.745
785 HA TYR 98 HA TYR 98 11.413 -2.411 8.638
786 HB2 TYR 98 2HB TYR 98 11.439 -3.221 6.328
787 HB3 TYR 98 1HB TYR 98 11.269 -1.478 6.393
788 HD1 TYR 98 1HD TYR 98 13.698 -0.227 6.291
789 HD2 TYR 98 2HD TYR 98 12.779 -4.057 4.686
790 HE1 TYR 98 1HE TYR 98 15.540 0.013 4.684
791 HE2 TYR 98 2HE TYR 98 14.631 -3.834 3.084
792 HH TYR 98 HH TYR 98 15.919 -1.927 1.996
793 H LEU 99 HN LEU 99 11.995 -4.734 7.369
794 HA LEU 99 HA LEU 99 13.111 -6.239 9.317
795 HB2 LEU 99 2HB LEU 99 13.245 -6.851 6.367
796 HB3 LEU 99 1HB LEU 99 13.377 -8.024 7.662
797 HG LEU 99 HG LEU 99 10.924 -6.368 7.056
798 HD11 LEU 99 1HD1 LEU 99 9.953 -8.483 6.309
799 HD12 LEU 99 2HD1 LEU 99 11.502 -9.284 6.563
800 HD13 LEU 99 3HD1 LEU 99 11.351 -8.030 5.334
801 HD21 LEU 99 3HD2 LEU 99 11.115 -6.905 9.424
802 HD22 LEU 99 1HD2 LEU 99 11.358 -8.606 9.031
803 HD23 LEU 99 2HD2 LEU 99 9.815 -7.830 8.672
804 H GLU 100 HN GLU 100 14.911 -5.680 6.279
805 HA GLU 100 HA GLU 100 17.341 -5.276 7.817
806 HB2 GLU 100 2HB GLU 100 17.204 -7.725 7.445
807 HB3 GLU 100 1HB GLU 100 17.144 -7.439 5.711
808 HG2 GLU 100 2HG GLU 100 19.360 -6.544 5.718
809 HG3 GLU 100 1HG GLU 100 19.422 -6.587 7.478
810 H HIS 101 HN HIS 101 18.610 -3.783 6.887
811 HA HIS 101 HA HIS 101 17.544 -2.365 4.655
812 HB2 HIS 101 2HB HIS 101 18.682 -1.252 6.562
813 HB3 HIS 101 1HB HIS 101 20.202 -1.978 6.050
814 HD1 HIS 101 1HD HIS 101 21.606 -0.499 4.657
815 HD2 HIS 101 2HD HIS 101 17.564 0.441 4.321
816 HE1 HIS 101 1HE HIS 101 21.496 1.514 3.151
817 HE2 HIS 101 2HE HIS 101 19.052 2.128 3.034
818 H HIS 102 HN HIS 102 17.764 -2.996 2.636
819 HA HIS 102 HA HIS 102 20.351 -4.105 1.758
820 HB2 HIS 102 2HB HIS 102 17.548 -4.923 1.032
821 HB3 HIS 102 1HB HIS 102 18.877 -5.205 -0.086
822 HD1 HIS 102 1HD HIS 102 19.546 -7.562 0.056
823 HD2 HIS 102 2HD HIS 102 18.588 -6.015 3.796
824 HE1 HIS 102 1HE HIS 102 19.950 -9.433 1.689
825 HE2 HIS 102 2HE HIS 102 19.559 -8.411 3.963
826 H HIS 103 HN HIS 103 21.158 -3.356 -0.201
827 HA HIS 103 HA HIS 103 19.724 -1.601 -1.921
828 HB2 HIS 103 2HB HIS 103 20.035 -0.129 0.088
829 HB3 HIS 103 1HB HIS 103 21.774 -0.273 -0.134
830 HD1 HIS 103 1HD HIS 103 22.742 1.657 -1.318
831 HD2 HIS 103 2HD HIS 103 18.814 0.945 -2.480
832 HE1 HIS 103 1HE HIS 103 22.179 3.479 -2.959
833 HE2 HIS 103 2HE HIS 103 19.718 3.170 -3.442
834 H HIS 104 HN HIS 104 20.617 -2.097 -3.820
835 HA HIS 104 HA HIS 104 23.550 -2.369 -3.929
836 HB2 HIS 104 2HB HIS 104 23.376 -4.048 -5.626
837 HB3 HIS 104 1HB HIS 104 22.327 -4.534 -4.306
838 HD1 HIS 104 1HD HIS 104 19.819 -4.728 -4.793
839 HD2 HIS 104 2HD HIS 104 22.058 -3.343 -8.018
840 HE1 HIS 104 1HE HIS 104 18.286 -4.826 -6.779
841 HE2 HIS 104 2HE HIS 104 19.719 -4.179 -8.748
842 H HIS 105 HN HIS 105 24.585 -1.588 -5.835
843 HA HIS 105 HA HIS 105 23.117 -0.156 -7.840
844 HB2 HIS 105 2HB HIS 105 23.097 1.393 -5.798
845 HB3 HIS 105 1HB HIS 105 24.838 1.531 -6.011
846 HD1 HIS 105 1HD HIS 105 25.641 2.716 -8.283
847 HD2 HIS 105 2HD HIS 105 21.579 2.968 -7.427
848 HE1 HIS 105 1HE HIS 105 24.755 4.560 -9.740
849 HE2 HIS 105 2HE HIS 105 22.288 4.688 -9.226
850 H HIS 106 HN HIS 106 24.324 -0.309 -9.648
851 HA HIS 106 HA HIS 106 27.196 -0.043 -9.542
852 HB2 HIS 106 2HB HIS 106 26.798 -2.441 -8.918
853 HB3 HIS 106 1HB HIS 106 26.025 -2.676 -10.481
854 HD1 HIS 106 1HD HIS 106 29.300 -2.622 -8.830
855 HD2 HIS 106 2HD HIS 106 27.838 -2.404 -12.714
856 HE1 HIS 106 1HE HIS 106 31.271 -3.067 -10.319
857 HE2 HIS 106 2HE HIS 106 30.403 -2.725 -12.661
Start of MODEL 5
1 H1 MET 1 H1 MET 1 -16.115 2.646 5.357
2 H2 MET 1 H2 MET 1 -16.217 4.327 5.137
3 H3 MET 1 H3 MET 1 -15.009 3.677 6.127
4 HA MET 1 HA MET 1 -15.260 3.295 3.204
5 HB2 MET 1 2HB MET 1 -14.498 5.516 3.679
6 HB3 MET 1 1HB MET 1 -13.400 4.941 4.922
7 HG2 MET 1 2HG MET 1 -11.989 3.911 3.265
8 HG3 MET 1 1HG MET 1 -13.116 4.335 1.983
9 HE1 MET 1 2HE MET 1 -13.686 6.920 1.350
10 HE2 MET 1 3HE MET 1 -12.905 8.288 2.143
11 HE3 MET 1 1HE MET 1 -13.996 7.246 3.055
12 H THR 2 HN THR 2 -14.387 1.482 2.497
13 HA THR 2 HA THR 2 -12.715 -0.098 4.290
14 HB THR 2 HB THR 2 -12.854 -1.831 2.500
15 HG1 THR 2 1HG THR 2 -14.736 -0.074 1.272
16 HG21 THR 2 3HG2 THR 2 -14.493 -1.774 4.329
17 HG22 THR 2 1HG2 THR 2 -15.219 -2.351 2.828
18 HG23 THR 2 2HG2 THR 2 -15.517 -0.703 3.375
19 H PHE 3 HN PHE 3 -10.789 -1.234 3.196
20 HA PHE 3 HA PHE 3 -8.916 0.758 2.522
21 HB2 PHE 3 2HB PHE 3 -8.308 -1.378 3.603
22 HB3 PHE 3 1HB PHE 3 -8.699 -2.232 2.115
23 HD1 PHE 3 1HD PHE 3 -6.422 0.288 3.577
24 HD2 PHE 3 2HD PHE 3 -7.121 -2.454 0.400
25 HE1 PHE 3 1HE PHE 3 -4.114 0.610 2.798
26 HE2 PHE 3 2HE PHE 3 -4.810 -2.137 -0.385
27 HZ PHE 3 HZ PHE 3 -3.302 -0.604 0.817
28 H SER 4 HN SER 4 -10.713 -1.546 0.551
29 HA SER 4 HA SER 4 -9.438 -1.049 -1.905
30 HB2 SER 4 2HB SER 4 -12.329 -1.827 -1.450
31 HB3 SER 4 1HB SER 4 -11.399 -2.065 -2.931
32 HG SER 4 HG SER 4 -11.154 -3.363 -0.444
33 H GLU 5 HN GLU 5 -12.290 0.443 -0.422
34 HA GLU 5 HA GLU 5 -12.966 2.147 -2.549
35 HB2 GLU 5 2HB GLU 5 -13.450 2.370 0.425
36 HB3 GLU 5 1HB GLU 5 -14.196 3.418 -0.764
37 HG2 GLU 5 2HG GLU 5 -15.322 1.543 -1.775
38 HG3 GLU 5 1HG GLU 5 -14.498 0.434 -0.682
39 H CYS 6 HN CYS 6 -11.012 2.672 0.348
40 HA CYS 6 HA CYS 6 -10.409 5.388 -0.067
41 HB2 CYS 6 2HB CYS 6 -10.068 4.164 2.050
42 HB3 CYS 6 1HB CYS 6 -8.774 3.259 1.313
43 HG CYS 6 HG CYS 6 -8.084 6.409 0.891
44 H ALA 7 HN ALA 7 -8.575 2.464 -0.838
45 HA ALA 7 HA ALA 7 -6.358 3.631 -2.042
46 HB1 ALA 7 1HB ALA 7 -6.543 1.231 -1.516
47 HB2 ALA 7 2HB ALA 7 -6.007 1.517 -3.173
48 HB3 ALA 7 3HB ALA 7 -7.676 1.043 -2.857
49 H ALA 8 HN ALA 8 -9.444 2.693 -3.529
50 HA ALA 8 HA ALA 8 -8.799 3.410 -6.166
51 HB1 ALA 8 1HB ALA 8 -10.747 2.038 -5.557
52 HB2 ALA 8 2HB ALA 8 -11.186 3.396 -6.593
53 HB3 ALA 8 3HB ALA 8 -11.522 3.463 -4.862
54 H LEU 9 HN LEU 9 -10.110 5.297 -3.481
55 HA LEU 9 HA LEU 9 -10.679 7.641 -4.945
56 HB2 LEU 9 2HB LEU 9 -9.999 7.272 -2.029
57 HB3 LEU 9 1HB LEU 9 -10.559 8.778 -2.720
58 HG LEU 9 HG LEU 9 -12.118 6.200 -2.612
59 HD11 LEU 9 1HD1 LEU 9 -12.474 8.808 -1.148
60 HD12 LEU 9 2HD1 LEU 9 -11.905 7.293 -0.447
61 HD13 LEU 9 3HD1 LEU 9 -13.555 7.416 -1.060
62 HD21 LEU 9 3HD2 LEU 9 -13.971 7.493 -3.511
63 HD22 LEU 9 1HD2 LEU 9 -12.611 7.499 -4.633
64 HD23 LEU 9 2HD2 LEU 9 -12.939 8.916 -3.637
65 H TYR 10 HN TYR 10 -7.804 6.654 -3.098
66 HA TYR 10 HA TYR 10 -6.261 8.944 -3.552
67 HB2 TYR 10 2HB TYR 10 -5.592 7.199 -1.956
68 HB3 TYR 10 1HB TYR 10 -5.331 6.073 -3.280
69 HD1 TYR 10 2HD TYR 10 -4.074 9.168 -1.698
70 HD2 TYR 10 1HD TYR 10 -3.319 6.114 -4.558
71 HE1 TYR 10 2HE TYR 10 -1.758 9.964 -1.930
72 HE2 TYR 10 1HE TYR 10 -1.006 6.906 -4.805
73 HH TYR 10 HH TYR 10 0.384 9.258 -2.680
74 H ILE 11 HN ILE 11 -6.586 5.975 -5.403
75 HA ILE 11 HA ILE 11 -4.775 6.545 -7.457
76 HB ILE 11 HB ILE 11 -7.278 4.858 -7.435
77 HG12 ILE 11 2HG1 ILE 11 -4.352 4.091 -7.386
78 HG13 ILE 11 1HG1 ILE 11 -5.370 4.216 -5.954
79 HG21 ILE 11 1HG2 ILE 11 -6.532 3.838 -9.501
80 HG22 ILE 11 2HG2 ILE 11 -5.146 4.920 -9.565
81 HG23 ILE 11 3HG2 ILE 11 -6.775 5.567 -9.737
82 HD11 ILE 11 3HD1 ILE 11 -6.765 2.415 -6.762
83 HD12 ILE 11 1HD1 ILE 11 -5.078 1.908 -6.711
84 HD13 ILE 11 2HD1 ILE 11 -5.827 2.326 -8.252
85 H LYS 12 HN LYS 12 -8.290 7.140 -7.300
86 HA LYS 12 HA LYS 12 -8.483 8.370 -9.835
87 HB2 LYS 12 2HB LYS 12 -10.221 8.536 -7.375
88 HB3 LYS 12 1HB LYS 12 -10.626 9.343 -8.883
89 HG2 LYS 12 2HG LYS 12 -10.703 7.218 -10.038
90 HG3 LYS 12 1HG LYS 12 -10.212 6.378 -8.567
91 HD2 LYS 12 2HD LYS 12 -12.632 6.216 -8.948
92 HD3 LYS 12 1HD LYS 12 -12.259 7.080 -7.457
93 HE2 LYS 12 2HE LYS 12 -12.655 9.204 -8.556
94 HE3 LYS 12 1HE LYS 12 -12.939 8.386 -10.092
95 HZ1 LYS 12 3HZ LYS 12 -14.581 7.956 -7.653
96 HZ2 LYS 12 1HZ LYS 12 -14.900 7.375 -9.213
97 HZ3 LYS 12 2HZ LYS 12 -14.994 9.036 -8.892
98 H ALA 13 HN ALA 13 -7.743 9.651 -6.646
99 HA ALA 13 HA ALA 13 -7.972 12.385 -7.298
100 HB1 ALA 13 1HB ALA 13 -6.257 11.089 -5.185
101 HB2 ALA 13 2HB ALA 13 -7.944 11.567 -4.997
102 HB3 ALA 13 3HB ALA 13 -6.703 12.793 -5.257
103 H HIS 14 HN HIS 14 -5.609 10.075 -8.186
104 HA HIS 14 HA HIS 14 -3.800 12.249 -9.014
105 HB2 HIS 14 2HB HIS 14 -2.999 9.537 -7.940
106 HB3 HIS 14 1HB HIS 14 -1.887 10.736 -8.589
107 HD1 HIS 14 1HD HIS 14 -4.048 10.010 -5.612
108 HD2 HIS 14 2HD HIS 14 -1.257 12.827 -6.863
109 HE1 HIS 14 1HE HIS 14 -3.523 11.397 -3.577
110 HE2 HIS 14 2HE HIS 14 -1.749 13.020 -4.327
111 H ARG 15 HN ARG 15 -5.945 10.433 -10.301
112 HA ARG 15 HA ARG 15 -4.793 8.680 -12.130
113 HB2 ARG 15 2HB ARG 15 -7.307 10.305 -12.089
114 HB3 ARG 15 1HB ARG 15 -6.875 9.439 -13.551
115 HG2 ARG 15 2HG ARG 15 -6.942 8.027 -10.927
116 HG3 ARG 15 1HG ARG 15 -8.427 8.319 -11.836
117 HD2 ARG 15 2HD ARG 15 -7.504 7.150 -13.758
118 HD3 ARG 15 1HD ARG 15 -5.982 6.915 -12.898
119 HE ARG 15 HE ARG 15 -7.690 5.719 -11.245
120 HH11 ARG 15 1HH1 ARG 15 -7.446 5.534 -14.724
121 HH12 ARG 15 2HH1 ARG 15 -7.948 3.871 -14.812
122 HH21 ARG 15 1HH2 ARG 15 -8.356 3.521 -11.340
123 HH22 ARG 15 2HH2 ARG 15 -8.467 2.720 -12.878
124 H SER 16 HN SER 16 -5.435 12.159 -12.468
125 HA SER 16 HA SER 16 -4.419 12.294 -15.125
126 HB2 SER 16 2HB SER 16 -4.980 14.473 -13.110
127 HB3 SER 16 1HB SER 16 -4.742 14.693 -14.834
128 HG SER 16 HG SER 16 -7.005 14.192 -13.597
129 H SER 17 HN SER 17 -3.016 12.358 -12.012
130 HA SER 17 HA SER 17 -0.747 13.969 -12.648
131 HB2 SER 17 2HB SER 17 -1.102 12.055 -10.333
132 HB3 SER 17 1HB SER 17 0.008 13.417 -10.430
133 HG SER 17 HG SER 17 -1.641 14.301 -9.374
134 H TRP 18 HN TRP 18 -1.425 10.494 -12.463
135 HA TRP 18 HA TRP 18 1.362 9.832 -12.996
136 HB2 TRP 18 2HB TRP 18 -1.002 7.970 -12.793
137 HB3 TRP 18 1HB TRP 18 0.694 7.522 -12.760
138 HD1 TRP 18 1HD TRP 18 1.655 9.643 -10.538
139 HE1 TRP 18 1HE TRP 18 0.960 9.216 -8.077
140 HE3 TRP 18 3HE TRP 18 -2.357 6.612 -11.372
141 HZ2 TRP 18 2HZ TRP 18 -1.041 7.757 -6.702
142 HZ3 TRP 18 3HZ TRP 18 -3.595 5.723 -9.457
143 HH2 TRP 18 2HH TRP 18 -2.961 6.290 -7.163
144 H LYS 19 HN LYS 19 -1.052 10.860 -14.917
145 HA LYS 19 HA LYS 19 -1.682 10.628 -17.082
146 HB2 LYS 19 2HB LYS 19 0.464 8.487 -17.226
147 HB3 LYS 19 1HB LYS 19 -0.489 9.047 -18.595
148 HG2 LYS 19 2HG LYS 19 0.453 11.278 -18.356
149 HG3 LYS 19 1HG LYS 19 1.378 10.748 -16.953
150 HD2 LYS 19 2HD LYS 19 2.562 9.122 -18.382
151 HD3 LYS 19 1HD LYS 19 1.670 9.725 -19.778
152 HE2 LYS 19 2HE LYS 19 3.884 10.723 -19.691
153 HE3 LYS 19 1HE LYS 19 2.646 11.951 -19.426
154 HZ1 LYS 19 3HZ LYS 19 3.068 11.802 -17.044
155 HZ2 LYS 19 1HZ LYS 19 4.481 12.218 -17.886
156 HZ3 LYS 19 2HZ LYS 19 4.268 10.637 -17.312
157 H ASN 20 HN ASN 20 -4.112 8.383 -17.010
158 HA ASN 20 HA ASN 20 -4.271 8.949 -19.158
159 HB2 ASN 20 2HB ASN 20 -1.771 10.570 -18.622
160 HB3 ASN 20 1HB ASN 20 -2.633 10.577 -20.155
161 HD21 ASN 20 1HD2 ASN 20 -4.689 11.491 -20.255
162 HD22 ASN 20 2HD2 ASN 20 -5.266 12.593 -19.049
163 H THR 21 HN THR 21 -2.484 6.873 -17.907
164 HA THR 21 HA THR 21 -1.769 5.561 -20.383
165 HB THR 21 HB THR 21 0.446 4.824 -19.366
166 HG1 THR 21 1HG THR 21 -0.110 7.065 -17.703
167 HG21 THR 21 3HG2 THR 21 1.697 6.789 -20.120
168 HG22 THR 21 1HG2 THR 21 0.210 7.738 -20.126
169 HG23 THR 21 2HG2 THR 21 0.398 6.386 -21.242
170 H LYS 22 HN LYS 22 -0.648 3.289 -19.411
171 HA LYS 22 HA LYS 22 -2.790 2.142 -17.866
172 HB2 LYS 22 2HB LYS 22 -0.223 0.986 -18.946
173 HB3 LYS 22 1HB LYS 22 -1.421 0.049 -18.068
174 HG2 LYS 22 2HG LYS 22 -3.091 0.592 -19.785
175 HG3 LYS 22 1HG LYS 22 -1.861 1.496 -20.672
176 HD2 LYS 22 2HD LYS 22 -2.082 -0.692 -21.650
177 HD3 LYS 22 1HD LYS 22 -0.520 -0.584 -20.835
178 HE2 LYS 22 2HE LYS 22 -1.440 -1.773 -18.911
179 HE3 LYS 22 1HE LYS 22 -3.007 -1.874 -19.711
180 HZ1 LYS 22 3HZ LYS 22 -0.474 -3.119 -20.647
181 HZ2 LYS 22 1HZ LYS 22 -1.954 -3.177 -21.477
182 HZ3 LYS 22 2HZ LYS 22 -1.797 -3.928 -19.965
183 H HIS 23 HN HIS 23 -0.475 4.045 -16.796
184 HA HIS 23 HA HIS 23 0.792 2.636 -14.702
185 HB2 HIS 23 2HB HIS 23 0.062 5.570 -14.917
186 HB3 HIS 23 1HB HIS 23 1.058 4.897 -13.633
187 HD1 HIS 23 1HD HIS 23 2.035 7.080 -15.674
188 HD2 HIS 23 2HD HIS 23 2.770 2.997 -15.973
189 HE1 HIS 23 1HE HIS 23 4.113 6.861 -17.078
190 HE2 HIS 23 2HE HIS 23 4.661 4.401 -17.043
191 H ALA 24 HN ALA 24 -2.254 4.435 -14.839
192 HA ALA 24 HA ALA 24 -2.934 4.225 -12.111
193 HB1 ALA 24 1HB ALA 24 -3.968 5.825 -13.628
194 HB2 ALA 24 2HB ALA 24 -5.185 4.823 -12.836
195 HB3 ALA 24 3HB ALA 24 -4.736 4.507 -14.512
196 H ASP 25 HN ASP 25 -3.582 2.111 -14.885
197 HA ASP 25 HA ASP 25 -5.285 0.283 -13.573
198 HB2 ASP 25 2HB ASP 25 -4.987 0.355 -16.043
199 HB3 ASP 25 1HB ASP 25 -3.357 -0.273 -15.848
200 H GLN 26 HN GLN 26 -1.793 0.317 -14.102
201 HA GLN 26 HA GLN 26 -1.170 -2.069 -12.815
202 HB2 GLN 26 2HB GLN 26 0.372 0.444 -13.373
203 HB3 GLN 26 1HB GLN 26 1.112 -0.929 -12.570
204 HG2 GLN 26 2HG GLN 26 0.718 -2.336 -14.457
205 HG3 GLN 26 1HG GLN 26 -0.249 -1.092 -15.242
206 HE21 GLN 26 1HE2 GLN 26 0.756 0.630 -16.213
207 HE22 GLN 26 2HE2 GLN 26 2.456 0.654 -16.558
208 H TRP 27 HN TRP 27 -1.522 1.207 -11.503
209 HA TRP 27 HA TRP 27 -0.690 0.607 -8.873
210 HB2 TRP 27 2HB TRP 27 -2.249 2.766 -10.174
211 HB3 TRP 27 1HB TRP 27 -2.500 2.562 -8.444
212 HD1 TRP 27 1HD TRP 27 0.397 3.217 -10.934
213 HE1 TRP 27 1HE TRP 27 2.205 4.575 -9.702
214 HE3 TRP 27 3HE TRP 27 -1.656 3.244 -6.253
215 HZ2 TRP 27 2HZ TRP 27 2.694 5.531 -7.091
216 HZ3 TRP 27 3HZ TRP 27 -0.459 4.401 -4.446
217 HH2 TRP 27 2HH TRP 27 1.670 5.521 -4.855
218 H THR 28 HN THR 28 -3.876 0.578 -10.397
219 HA THR 28 HA THR 28 -5.308 -0.080 -8.036
220 HB THR 28 HB THR 28 -6.225 -0.560 -10.876
221 HG1 THR 28 1HG THR 28 -5.553 1.595 -10.734
222 HG21 THR 28 3HG2 THR 28 -7.736 0.054 -8.330
223 HG22 THR 28 1HG2 THR 28 -7.664 -1.508 -9.143
224 HG23 THR 28 2HG2 THR 28 -8.457 -0.142 -9.929
225 H ASN 29 HN ASN 29 -4.186 -1.985 -10.802
226 HA ASN 29 HA ASN 29 -5.591 -4.331 -10.314
227 HB2 ASN 29 2HB ASN 29 -4.245 -3.630 -12.374
228 HB3 ASN 29 1HB ASN 29 -2.830 -4.241 -11.527
229 HD21 ASN 29 1HD2 ASN 29 -4.072 -5.091 -14.009
230 HD22 ASN 29 2HD2 ASN 29 -4.437 -6.774 -13.814
231 H THR 30 HN THR 30 -2.279 -3.494 -9.288
232 HA THR 30 HA THR 30 -1.668 -5.958 -8.107
233 HB THR 30 HB THR 30 -0.603 -3.338 -7.095
234 HG1 THR 30 1HG THR 30 -0.013 -4.711 -9.531
235 HG21 THR 30 3HG2 THR 30 0.651 -6.061 -7.470
236 HG22 THR 30 1HG2 THR 30 0.143 -5.357 -5.937
237 HG23 THR 30 2HG2 THR 30 1.471 -4.630 -6.841
238 H ILE 31 HN ILE 31 -2.981 -2.983 -6.656
239 HA ILE 31 HA ILE 31 -3.017 -4.003 -4.009
240 HB ILE 31 HB ILE 31 -4.589 -1.709 -5.195
241 HG12 ILE 31 2HG1 ILE 31 -1.978 -1.715 -3.656
242 HG13 ILE 31 1HG1 ILE 31 -2.135 -1.472 -5.393
243 HG21 ILE 31 1HG2 ILE 31 -5.610 -2.459 -3.132
244 HG22 ILE 31 2HG2 ILE 31 -4.797 -0.918 -2.867
245 HG23 ILE 31 3HG2 ILE 31 -4.050 -2.415 -2.312
246 HD11 ILE 31 3HD1 ILE 31 -3.409 0.568 -4.992
247 HD12 ILE 31 1HD1 ILE 31 -1.818 0.634 -4.231
248 HD13 ILE 31 2HD1 ILE 31 -3.252 0.324 -3.251
249 H LYS 32 HN LYS 32 -5.453 -3.712 -6.535
250 HA LYS 32 HA LYS 32 -7.681 -4.647 -5.128
251 HB2 LYS 32 2HB LYS 32 -7.768 -3.584 -7.343
252 HB3 LYS 32 1HB LYS 32 -6.959 -4.963 -8.050
253 HG2 LYS 32 2HG LYS 32 -9.554 -5.369 -6.639
254 HG3 LYS 32 1HG LYS 32 -9.544 -4.684 -8.264
255 HD2 LYS 32 2HD LYS 32 -8.108 -6.671 -8.930
256 HD3 LYS 32 1HD LYS 32 -8.518 -7.368 -7.364
257 HE2 LYS 32 2HE LYS 32 -10.901 -7.230 -7.942
258 HE3 LYS 32 1HE LYS 32 -10.471 -6.565 -9.517
259 HZ1 LYS 32 3HZ LYS 32 -10.807 -8.840 -9.882
260 HZ2 LYS 32 1HZ LYS 32 -9.958 -9.292 -8.482
261 HZ3 LYS 32 2HZ LYS 32 -9.121 -8.672 -9.819
262 H THR 33 HN THR 33 -5.077 -6.340 -6.750
263 HA THR 33 HA THR 33 -6.388 -8.901 -6.534
264 HB THR 33 HB THR 33 -3.578 -8.244 -7.435
265 HG1 THR 33 1HG THR 33 -4.841 -7.328 -8.943
266 HG21 THR 33 3HG2 THR 33 -3.687 -10.438 -8.553
267 HG22 THR 33 1HG2 THR 33 -5.257 -10.732 -7.805
268 HG23 THR 33 2HG2 THR 33 -3.815 -10.589 -6.802
269 H TYR 34 HN TYR 34 -3.411 -7.475 -5.128
270 HA TYR 34 HA TYR 34 -2.977 -9.854 -3.560
271 HB2 TYR 34 2HB TYR 34 -1.484 -7.249 -3.780
272 HB3 TYR 34 1HB TYR 34 -1.019 -8.515 -2.646
273 HD1 TYR 34 2HD TYR 34 -1.256 -7.598 -6.199
274 HD2 TYR 34 1HD TYR 34 -0.011 -10.565 -3.413
275 HE1 TYR 34 2HE TYR 34 -0.002 -8.734 -7.983
276 HE2 TYR 34 1HE TYR 34 1.249 -11.709 -5.188
277 HH TYR 34 HH TYR 34 1.164 -11.878 -7.683
278 H CYS 35 HN CYS 35 -3.801 -6.474 -2.805
279 HA CYS 35 HA CYS 35 -3.845 -7.034 0.021
280 HB2 CYS 35 2HB CYS 35 -4.775 -4.556 -1.440
281 HB3 CYS 35 1HB CYS 35 -4.434 -4.689 0.282
282 HG CYS 35 HG CYS 35 -1.656 -5.324 -0.268
283 H GLY 36 HN GLY 36 -6.060 -7.168 -2.553
284 HA2 GLY 36 2HA GLY 36 -8.501 -6.495 -1.470
285 HA3 GLY 36 1HA GLY 36 -8.272 -7.730 -2.691
286 HA PRO 37 HA PRO 37 -9.506 -10.966 -0.062
287 HB2 PRO 37 2HB PRO 37 -7.460 -12.768 0.106
288 HB3 PRO 37 1HB PRO 37 -8.484 -12.575 -1.319
289 HG2 PRO 37 2HG PRO 37 -5.758 -11.458 -0.781
290 HG3 PRO 37 1HG PRO 37 -6.393 -12.190 -2.266
291 HD2 PRO 37 2HD PRO 37 -6.192 -9.530 -1.981
292 HD3 PRO 37 1HD PRO 37 -7.535 -10.273 -2.873
293 H VAL 38 HN VAL 38 -6.686 -9.283 0.952
294 HA VAL 38 HA VAL 38 -6.658 -10.608 3.557
295 HB VAL 38 HB VAL 38 -4.795 -8.439 2.581
296 HG11 VAL 38 1HG1 VAL 38 -4.869 -8.674 4.999
297 HG12 VAL 38 2HG1 VAL 38 -3.328 -9.257 4.368
298 HG13 VAL 38 3HG1 VAL 38 -4.574 -10.405 4.857
299 HG21 VAL 38 3HG2 VAL 38 -4.444 -11.435 2.490
300 HG22 VAL 38 1HG2 VAL 38 -3.190 -10.249 2.133
301 HG23 VAL 38 2HG2 VAL 38 -4.615 -10.359 1.104
302 H ILE 39 HN ILE 39 -6.501 -7.201 2.454
303 HA ILE 39 HA ILE 39 -8.066 -6.482 4.852
304 HB ILE 39 HB ILE 39 -6.774 -4.352 4.930
305 HG12 ILE 39 2HG1 ILE 39 -4.968 -5.758 2.945
306 HG13 ILE 39 1HG1 ILE 39 -5.984 -4.367 2.586
307 HG21 ILE 39 1HG2 ILE 39 -5.201 -6.903 5.251
308 HG22 ILE 39 2HG2 ILE 39 -6.216 -6.122 6.464
309 HG23 ILE 39 3HG2 ILE 39 -4.734 -5.339 5.919
310 HD11 ILE 39 3HD1 ILE 39 -3.693 -4.401 4.538
311 HD12 ILE 39 1HD1 ILE 39 -4.688 -3.005 4.126
312 HD13 ILE 39 2HD1 ILE 39 -3.648 -3.739 2.905
313 H GLY 40 HN GLY 40 -8.335 -6.696 1.680
314 HA2 GLY 40 2HA GLY 40 -8.913 -4.202 0.629
315 HA3 GLY 40 1HA GLY 40 -9.627 -5.703 0.071
316 HA PRO 41 HA PRO 41 -13.510 -4.414 1.700
317 HB2 PRO 41 2HB PRO 41 -14.640 -6.576 2.793
318 HB3 PRO 41 1HB PRO 41 -14.254 -6.514 1.069
319 HG2 PRO 41 2HG PRO 41 -12.751 -7.827 3.301
320 HG3 PRO 41 1HG PRO 41 -13.104 -8.443 1.676
321 HD2 PRO 41 2HD PRO 41 -10.713 -7.302 2.408
322 HD3 PRO 41 1HD PRO 41 -11.333 -7.333 0.746
323 H LEU 42 HN LEU 42 -11.105 -4.902 3.880
324 HA LEU 42 HA LEU 42 -12.713 -4.722 6.287
325 HB2 LEU 42 2HB LEU 42 -9.725 -4.507 5.892
326 HB3 LEU 42 1HB LEU 42 -10.533 -4.533 7.446
327 HG LEU 42 HG LEU 42 -10.434 -6.791 5.442
328 HD11 LEU 42 1HD1 LEU 42 -9.159 -7.935 7.191
329 HD12 LEU 42 2HD1 LEU 42 -9.209 -6.476 8.178
330 HD13 LEU 42 3HD1 LEU 42 -8.346 -6.468 6.641
331 HD21 LEU 42 3HD2 LEU 42 -11.764 -6.672 8.150
332 HD22 LEU 42 1HD2 LEU 42 -11.605 -8.108 7.136
333 HD23 LEU 42 2HD2 LEU 42 -12.588 -6.747 6.591
334 H SER 43 HN SER 43 -12.529 -2.916 7.771
335 HA SER 43 HA SER 43 -12.892 -0.397 6.659
336 HB2 SER 43 2HB SER 43 -13.579 -0.938 8.952
337 HB3 SER 43 1HB SER 43 -11.895 -1.108 9.430
338 HG SER 43 HG SER 43 -12.896 0.962 9.932
339 H VAL 44 HN VAL 44 -11.563 1.218 6.069
340 HA VAL 44 HA VAL 44 -8.773 0.664 5.772
341 HB VAL 44 HB VAL 44 -10.292 2.095 4.243
342 HG11 VAL 44 1HG1 VAL 44 -10.218 4.512 4.694
343 HG12 VAL 44 2HG1 VAL 44 -9.516 4.177 6.278
344 HG13 VAL 44 3HG1 VAL 44 -11.146 3.623 5.901
345 HG21 VAL 44 3HG2 VAL 44 -8.370 3.428 3.500
346 HG22 VAL 44 1HG2 VAL 44 -7.934 1.755 3.851
347 HG23 VAL 44 2HG2 VAL 44 -7.532 3.029 5.000
348 H GLN 45 HN GLN 45 -10.620 1.715 8.336
349 HA GLN 45 HA GLN 45 -8.476 3.253 9.581
350 HB2 GLN 45 2HB GLN 45 -10.815 4.007 9.840
351 HB3 GLN 45 1HB GLN 45 -11.203 2.489 10.639
352 HG2 GLN 45 2HG GLN 45 -9.674 3.027 12.448
353 HG3 GLN 45 1HG GLN 45 -9.223 4.526 11.639
354 HE21 GLN 45 1HE2 GLN 45 -12.482 3.246 11.760
355 HE22 GLN 45 2HE2 GLN 45 -13.129 4.501 12.760
356 H ASP 46 HN ASP 46 -9.856 0.072 9.539
357 HA ASP 46 HA ASP 46 -8.467 -0.660 11.997
358 HB2 ASP 46 2HB ASP 46 -10.533 -2.044 10.306
359 HB3 ASP 46 1HB ASP 46 -9.653 -2.887 11.574
360 H VAL 47 HN VAL 47 -7.137 -0.096 9.364
361 HA VAL 47 HA VAL 47 -5.890 -2.654 8.755
362 HB VAL 47 HB VAL 47 -5.236 0.107 7.692
363 HG11 VAL 47 1HG1 VAL 47 -3.342 -1.415 7.547
364 HG12 VAL 47 2HG1 VAL 47 -3.994 -1.061 5.948
365 HG13 VAL 47 3HG1 VAL 47 -4.347 -2.606 6.723
366 HG21 VAL 47 3HG2 VAL 47 -6.874 -2.111 6.474
367 HG22 VAL 47 1HG2 VAL 47 -6.412 -0.614 5.662
368 HG23 VAL 47 2HG2 VAL 47 -7.476 -0.563 7.066
369 H ASP 48 HN ASP 48 -4.497 -3.361 10.259
370 HA ASP 48 HA ASP 48 -2.917 -1.451 11.805
371 HB2 ASP 48 2HB ASP 48 -3.253 -4.441 12.109
372 HB3 ASP 48 1HB ASP 48 -2.263 -3.438 13.158
373 H THR 49 HN THR 49 -0.638 -2.076 12.308
374 HA THR 49 HA THR 49 0.999 -2.320 10.061
375 HB THR 49 HB THR 49 2.710 -2.961 11.909
376 HG1 THR 49 1HG THR 49 1.887 -3.297 13.819
377 HG21 THR 49 3HG2 THR 49 2.520 -0.701 10.980
378 HG22 THR 49 1HG2 THR 49 2.838 -0.659 12.713
379 HG23 THR 49 2HG2 THR 49 1.210 -0.354 12.108
380 H LYS 50 HN LYS 50 -0.040 -4.615 12.506
381 HA LYS 50 HA LYS 50 1.405 -6.868 11.788
382 HB2 LYS 50 2HB LYS 50 0.008 -6.481 13.845
383 HB3 LYS 50 1HB LYS 50 -1.414 -6.797 12.873
384 HG2 LYS 50 2HG LYS 50 0.723 -8.856 12.931
385 HG3 LYS 50 1HG LYS 50 -0.296 -8.660 14.356
386 HD2 LYS 50 2HD LYS 50 -2.274 -8.812 12.746
387 HD3 LYS 50 1HD LYS 50 -1.104 -9.407 11.563
388 HE2 LYS 50 2HE LYS 50 -2.211 -11.255 12.714
389 HE3 LYS 50 1HE LYS 50 -0.486 -11.217 13.077
390 HZ1 LYS 50 3HZ LYS 50 -2.609 -10.113 14.844
391 HZ2 LYS 50 1HZ LYS 50 -0.951 -10.207 15.196
392 HZ3 LYS 50 2HZ LYS 50 -1.870 -11.625 15.046
393 H LEU 51 HN LEU 51 -1.743 -5.742 10.635
394 HA LEU 51 HA LEU 51 -2.332 -7.964 9.017
395 HB2 LEU 51 2HB LEU 51 -3.249 -5.101 8.814
396 HB3 LEU 51 1HB LEU 51 -3.934 -6.425 7.903
397 HG LEU 51 HG LEU 51 -4.026 -6.059 10.887
398 HD11 LEU 51 1HD1 LEU 51 -6.439 -5.916 10.526
399 HD12 LEU 51 2HD1 LEU 51 -6.187 -6.064 8.788
400 HD13 LEU 51 3HD1 LEU 51 -5.582 -4.651 9.648
401 HD21 LEU 51 3HD2 LEU 51 -5.399 -8.101 10.912
402 HD22 LEU 51 1HD2 LEU 51 -3.746 -8.416 10.379
403 HD23 LEU 51 2HD2 LEU 51 -5.054 -8.335 9.198
404 H ILE 52 HN ILE 52 -0.723 -4.886 8.312
405 HA ILE 52 HA ILE 52 -0.444 -5.295 5.530
406 HB ILE 52 HB ILE 52 1.318 -3.632 7.341
407 HG12 ILE 52 2HG1 ILE 52 -1.139 -2.837 5.757
408 HG13 ILE 52 1HG1 ILE 52 -1.094 -3.060 7.504
409 HG21 ILE 52 1HG2 ILE 52 0.844 -3.485 4.363
410 HG22 ILE 52 2HG2 ILE 52 2.317 -4.049 5.151
411 HG23 ILE 52 3HG2 ILE 52 1.824 -2.363 5.305
412 HD11 ILE 52 3HD1 ILE 52 0.477 -1.013 5.954
413 HD12 ILE 52 1HD1 ILE 52 0.474 -1.215 7.706
414 HD13 ILE 52 2HD1 ILE 52 -0.996 -0.709 6.874
415 H MET 53 HN MET 53 1.584 -6.145 8.290
416 HA MET 53 HA MET 53 3.849 -7.042 6.901
417 HB2 MET 53 2HB MET 53 2.670 -8.030 9.506
418 HB3 MET 53 1HB MET 53 4.265 -8.470 8.912
419 HG2 MET 53 2HG MET 53 4.952 -6.129 9.013
420 HG3 MET 53 1HG MET 53 3.349 -5.684 9.597
421 HE1 MET 53 3HE MET 53 5.602 -5.206 12.768
422 HE2 MET 53 1HE MET 53 4.451 -4.443 11.672
423 HE3 MET 53 2HE MET 53 6.056 -4.889 11.094
424 H LYS 54 HN LYS 54 0.798 -8.621 7.638
425 HA LYS 54 HA LYS 54 1.553 -11.187 6.701
426 HB2 LYS 54 2HB LYS 54 -1.079 -9.872 7.271
427 HB3 LYS 54 1HB LYS 54 -1.022 -11.448 6.492
428 HG2 LYS 54 2HG LYS 54 0.491 -10.998 9.027
429 HG3 LYS 54 1HG LYS 54 -1.250 -11.274 9.077
430 HD2 LYS 54 2HD LYS 54 -0.115 -13.381 9.375
431 HD3 LYS 54 1HD LYS 54 -0.913 -13.377 7.804
432 HE2 LYS 54 2HE LYS 54 1.236 -14.344 7.499
433 HE3 LYS 54 1HE LYS 54 1.290 -12.730 6.797
434 HZ1 LYS 54 3HZ LYS 54 2.393 -13.562 9.428
435 HZ2 LYS 54 1HZ LYS 54 2.353 -11.960 8.875
436 HZ3 LYS 54 2HZ LYS 54 3.281 -13.113 8.049
437 H VAL 55 HN VAL 55 0.083 -8.382 5.146
438 HA VAL 55 HA VAL 55 -0.476 -9.586 2.662
439 HB VAL 55 HB VAL 55 0.323 -6.713 3.170
440 HG11 VAL 55 1HG1 VAL 55 0.419 -7.308 0.812
441 HG12 VAL 55 2HG1 VAL 55 -0.944 -6.232 1.123
442 HG13 VAL 55 3HG1 VAL 55 -1.218 -7.959 0.894
443 HG21 VAL 55 3HG2 VAL 55 -1.564 -7.369 4.570
444 HG22 VAL 55 1HG2 VAL 55 -2.420 -7.962 3.147
445 HG23 VAL 55 2HG2 VAL 55 -2.067 -6.242 3.311
446 H LEU 56 HN LEU 56 2.403 -7.961 3.910
447 HA LEU 56 HA LEU 56 3.859 -8.154 1.447
448 HB2 LEU 56 2HB LEU 56 4.799 -7.523 4.245
449 HB3 LEU 56 1HB LEU 56 5.761 -7.336 2.793
450 HG LEU 56 HG LEU 56 3.233 -5.812 3.431
451 HD11 LEU 56 1HD1 LEU 56 4.740 -3.883 3.632
452 HD12 LEU 56 2HD1 LEU 56 6.124 -4.955 3.423
453 HD13 LEU 56 3HD1 LEU 56 5.086 -5.124 4.837
454 HD21 LEU 56 3HD2 LEU 56 5.154 -5.519 1.122
455 HD22 LEU 56 1HD2 LEU 56 3.765 -4.488 1.456
456 HD23 LEU 56 2HD2 LEU 56 3.522 -6.181 1.026
457 H ASP 57 HN ASP 57 3.377 -10.203 4.151
458 HA ASP 57 HA ASP 57 5.718 -11.547 4.529
459 HB2 ASP 57 2HB ASP 57 3.432 -11.836 5.686
460 HB3 ASP 57 1HB ASP 57 3.114 -13.042 4.462
461 HA PRO 58 HA PRO 58 4.871 -14.853 1.183
462 HB2 PRO 58 2HB PRO 58 2.838 -14.615 -0.560
463 HB3 PRO 58 1HB PRO 58 2.599 -15.279 1.062
464 HG2 PRO 58 2HG PRO 58 2.066 -12.505 0.058
465 HG3 PRO 58 1HG PRO 58 1.034 -13.547 1.058
466 HD2 PRO 58 2HD PRO 58 2.578 -11.581 2.114
467 HD3 PRO 58 1HD PRO 58 2.207 -13.082 2.978
468 H ILE 59 HN ILE 59 4.800 -11.504 0.513
469 HA ILE 59 HA ILE 59 5.298 -11.711 -2.311
470 HB ILE 59 HB ILE 59 5.785 -9.292 -0.567
471 HG12 ILE 59 2HG1 ILE 59 3.271 -10.115 -2.044
472 HG13 ILE 59 1HG1 ILE 59 3.474 -10.114 -0.294
473 HG21 ILE 59 1HG2 ILE 59 6.799 -9.161 -2.773
474 HG22 ILE 59 2HG2 ILE 59 5.417 -8.070 -2.678
475 HG23 ILE 59 3HG2 ILE 59 5.269 -9.609 -3.526
476 HD11 ILE 59 3HD1 ILE 59 2.225 -8.177 -1.038
477 HD12 ILE 59 1HD1 ILE 59 3.559 -7.699 -2.085
478 HD13 ILE 59 2HD1 ILE 59 3.766 -7.693 -0.333
479 H TRP 60 HN TRP 60 7.243 -11.544 0.590
480 HA TRP 60 HA TRP 60 9.719 -10.923 -0.665
481 HB2 TRP 60 2HB TRP 60 9.157 -12.370 1.932
482 HB3 TRP 60 1HB TRP 60 10.749 -11.818 1.419
483 HD1 TRP 60 1HD TRP 60 7.676 -10.677 3.205
484 HE1 TRP 60 1HE TRP 60 7.887 -8.192 3.833
485 HE3 TRP 60 3HE TRP 60 11.793 -9.484 0.419
486 HZ2 TRP 60 2HZ TRP 60 9.585 -6.009 3.230
487 HZ3 TRP 60 3HZ TRP 60 12.649 -7.181 0.500
488 HH2 TRP 60 2HH TRP 60 11.568 -5.480 1.876
489 H GLU 61 HN GLU 61 7.800 -13.722 -0.622
490 HA GLU 61 HA GLU 61 9.888 -15.618 -1.131
491 HB2 GLU 61 2HB GLU 61 6.881 -15.668 -1.298
492 HB3 GLU 61 1HB GLU 61 7.870 -17.033 -1.755
493 HG2 GLU 61 2HG GLU 61 7.983 -15.769 0.960
494 HG3 GLU 61 1HG GLU 61 6.901 -17.099 0.555
495 H GLN 62 HN GLN 62 7.915 -13.438 -2.953
496 HA GLN 62 HA GLN 62 8.460 -14.862 -5.451
497 HB2 GLN 62 2HB GLN 62 6.489 -12.636 -4.949
498 HB3 GLN 62 1HB GLN 62 6.606 -13.637 -6.380
499 HG2 GLN 62 2HG GLN 62 5.858 -14.616 -3.639
500 HG3 GLN 62 1HG GLN 62 4.726 -14.259 -4.941
501 HE21 GLN 62 1HE2 GLN 62 3.929 -16.344 -4.969
502 HE22 GLN 62 2HE2 GLN 62 4.844 -17.690 -5.573
503 H LYS 63 HN LYS 63 8.184 -11.479 -4.329
504 HA LYS 63 HA LYS 63 10.426 -10.755 -6.062
505 HB2 LYS 63 2HB LYS 63 7.702 -9.455 -6.193
506 HB3 LYS 63 1HB LYS 63 9.149 -8.794 -6.935
507 HG2 LYS 63 2HG LYS 63 9.315 -10.909 -8.275
508 HG3 LYS 63 1HG LYS 63 7.730 -11.351 -7.638
509 HD2 LYS 63 2HD LYS 63 7.462 -10.320 -9.808
510 HD3 LYS 63 1HD LYS 63 6.814 -9.245 -8.565
511 HE2 LYS 63 2HE LYS 63 9.038 -8.064 -8.589
512 HE3 LYS 63 1HE LYS 63 9.447 -9.022 -10.010
513 HZ1 LYS 63 3HZ LYS 63 7.624 -8.040 -11.202
514 HZ2 LYS 63 1HZ LYS 63 8.577 -6.805 -10.543
515 HZ3 LYS 63 2HZ LYS 63 7.099 -7.210 -9.821
516 HA PRO 64 HA PRO 64 10.936 -9.088 -1.816
517 HB2 PRO 64 2HB PRO 64 13.599 -8.616 -3.067
518 HB3 PRO 64 1HB PRO 64 13.206 -9.276 -1.477
519 HG2 PRO 64 2HG PRO 64 13.999 -10.873 -3.446
520 HG3 PRO 64 1HG PRO 64 12.721 -11.383 -2.327
521 HD2 PRO 64 2HD PRO 64 12.508 -10.435 -5.147
522 HD3 PRO 64 1HD PRO 64 11.545 -11.656 -4.292
523 H GLU 65 HN GLU 65 12.224 -7.509 -4.769
524 HA GLU 65 HA GLU 65 12.422 -4.966 -3.594
525 HB2 GLU 65 2HB GLU 65 12.162 -5.784 -6.477
526 HB3 GLU 65 1HB GLU 65 12.616 -4.191 -5.923
527 HG2 GLU 65 2HG GLU 65 14.578 -5.212 -4.788
528 HG3 GLU 65 1HG GLU 65 14.147 -6.738 -5.557
529 H THR 66 HN THR 66 9.880 -6.598 -5.394
530 HA THR 66 HA THR 66 8.237 -4.307 -5.741
531 HB THR 66 HB THR 66 7.444 -7.231 -5.774
532 HG1 THR 66 1HG THR 66 8.783 -5.575 -7.552
533 HG21 THR 66 3HG2 THR 66 6.082 -4.804 -6.951
534 HG22 THR 66 1HG2 THR 66 5.524 -5.717 -5.551
535 HG23 THR 66 2HG2 THR 66 5.558 -6.479 -7.142
536 H ALA 67 HN ALA 67 8.562 -6.726 -3.228
537 HA ALA 67 HA ALA 67 6.245 -6.248 -1.760
538 HB1 ALA 67 1HB ALA 67 7.815 -8.077 -1.277
539 HB2 ALA 67 2HB ALA 67 7.450 -7.128 0.163
540 HB3 ALA 67 3HB ALA 67 8.985 -6.905 -0.674
541 H SER 68 HN SER 68 9.435 -4.698 -1.419
542 HA SER 68 HA SER 68 8.612 -2.896 0.582
543 HB2 SER 68 2HB SER 68 10.724 -1.650 -0.050
544 HB3 SER 68 1HB SER 68 10.944 -3.346 0.373
545 HG SER 68 HG SER 68 10.494 -3.203 -2.249
546 H ARG 69 HN ARG 69 8.573 -2.704 -2.929
547 HA ARG 69 HA ARG 69 8.022 0.084 -3.031
548 HB2 ARG 69 2HB ARG 69 7.695 -2.092 -5.095
549 HB3 ARG 69 1HB ARG 69 7.516 -0.380 -5.415
550 HG2 ARG 69 2HG ARG 69 9.886 -0.110 -4.569
551 HG3 ARG 69 1HG ARG 69 9.992 -1.867 -4.650
552 HD2 ARG 69 2HD ARG 69 10.895 -1.000 -6.679
553 HD3 ARG 69 1HD ARG 69 9.329 -1.719 -7.058
554 HE ARG 69 HE ARG 69 8.936 0.996 -6.514
555 HH11 ARG 69 1HH1 ARG 69 10.505 -1.008 -8.919
556 HH12 ARG 69 2HH1 ARG 69 10.312 0.157 -10.199
557 HH21 ARG 69 1HH2 ARG 69 8.684 2.528 -8.165
558 HH22 ARG 69 2HH2 ARG 69 9.251 2.170 -9.775
559 H LEU 70 HN LEU 70 6.057 -2.838 -2.979
560 HA LEU 70 HA LEU 70 3.585 -1.589 -3.563
561 HB2 LEU 70 2HB LEU 70 3.956 -4.032 -3.661
562 HB3 LEU 70 1HB LEU 70 4.104 -4.066 -1.914
563 HG LEU 70 HG LEU 70 1.769 -3.303 -1.705
564 HD11 LEU 70 1HD1 LEU 70 0.316 -3.288 -3.676
565 HD12 LEU 70 2HD1 LEU 70 1.720 -3.561 -4.709
566 HD13 LEU 70 3HD1 LEU 70 1.581 -2.064 -3.787
567 HD21 LEU 70 3HD2 LEU 70 2.082 -5.745 -3.449
568 HD22 LEU 70 1HD2 LEU 70 0.714 -5.377 -2.396
569 HD23 LEU 70 2HD2 LEU 70 2.304 -5.698 -1.700
570 H ARG 71 HN ARG 71 5.324 -2.207 -0.547
571 HA ARG 71 HA ARG 71 3.415 -1.205 1.239
572 HB2 ARG 71 2HB ARG 71 5.516 -2.387 1.904
573 HB3 ARG 71 1HB ARG 71 6.419 -0.940 1.480
574 HG2 ARG 71 2HG ARG 71 4.533 0.068 3.164
575 HG3 ARG 71 1HG ARG 71 4.818 -1.528 3.855
576 HD2 ARG 71 2HD ARG 71 6.303 0.115 4.856
577 HD3 ARG 71 1HD ARG 71 7.221 -1.067 3.919
578 HE ARG 71 HE ARG 71 7.645 0.585 2.286
579 HH11 ARG 71 1HH1 ARG 71 5.790 1.838 4.989
580 HH12 ARG 71 2HH1 ARG 71 6.195 3.503 4.650
581 HH21 ARG 71 1HH2 ARG 71 8.170 2.794 1.863
582 HH22 ARG 71 2HH2 ARG 71 7.543 4.032 2.906
583 H GLY 72 HN GLY 72 5.815 0.387 -0.772
584 HA2 GLY 72 2HA GLY 72 5.581 2.993 0.240
585 HA3 GLY 72 1HA GLY 72 6.065 2.578 -1.398
586 H ARG 73 HN ARG 73 3.676 1.266 -2.180
587 HA ARG 73 HA ARG 73 2.000 3.421 -2.902
588 HB2 ARG 73 2HB ARG 73 1.469 0.443 -2.894
589 HB3 ARG 73 1HB ARG 73 0.371 1.627 -3.581
590 HG2 ARG 73 2HG ARG 73 2.168 2.308 -5.153
591 HG3 ARG 73 1HG ARG 73 3.168 1.005 -4.508
592 HD2 ARG 73 2HD ARG 73 1.482 -0.631 -5.185
593 HD3 ARG 73 1HD ARG 73 0.468 0.666 -5.809
594 HE ARG 73 HE ARG 73 2.997 0.763 -7.054
595 HH11 ARG 73 1HH1 ARG 73 0.046 -1.122 -7.016
596 HH12 ARG 73 2HH1 ARG 73 0.253 -1.728 -8.631
597 HH21 ARG 73 1HH2 ARG 73 3.268 -0.025 -9.197
598 HH22 ARG 73 2HH2 ARG 73 2.081 -1.111 -9.855
599 H ILE 74 HN ILE 74 1.649 0.850 -0.483
600 HA ILE 74 HA ILE 74 -0.871 1.573 0.495
601 HB ILE 74 HB ILE 74 1.378 0.229 2.014
602 HG12 ILE 74 2HG1 ILE 74 -0.884 -0.988 0.411
603 HG13 ILE 74 1HG1 ILE 74 0.789 -0.888 -0.128
604 HG21 ILE 74 1HG2 ILE 74 -1.607 0.176 2.482
605 HG22 ILE 74 2HG2 ILE 74 -0.431 1.056 3.456
606 HG23 ILE 74 3HG2 ILE 74 -0.393 -0.707 3.411
607 HD11 ILE 74 3HD1 ILE 74 1.468 -2.315 1.738
608 HD12 ILE 74 1HD1 ILE 74 0.274 -3.101 0.705
609 HD13 ILE 74 2HD1 ILE 74 -0.214 -2.423 2.259
610 H GLU 75 HN GLU 75 2.384 2.513 1.612
611 HA GLU 75 HA GLU 75 1.642 4.082 3.804
612 HB2 GLU 75 2HB GLU 75 3.983 3.475 3.241
613 HB3 GLU 75 1HB GLU 75 3.926 4.590 1.883
614 HG2 GLU 75 2HG GLU 75 3.482 6.432 3.486
615 HG3 GLU 75 1HG GLU 75 3.718 5.285 4.802
616 H SER 76 HN SER 76 2.052 4.993 0.410
617 HA SER 76 HA SER 76 1.501 7.729 0.733
618 HB2 SER 76 2HB SER 76 1.121 6.021 -1.719
619 HB3 SER 76 1HB SER 76 1.281 7.776 -1.691
620 HG SER 76 HG SER 76 3.221 5.792 -1.334
621 H VAL 77 HN VAL 77 -0.597 4.987 -0.087
622 HA VAL 77 HA VAL 77 -2.934 6.519 -0.540
623 HB VAL 77 HB VAL 77 -2.674 3.623 0.288
624 HG11 VAL 77 1HG1 VAL 77 -5.068 5.087 -0.820
625 HG12 VAL 77 2HG1 VAL 77 -4.888 4.490 0.830
626 HG13 VAL 77 3HG1 VAL 77 -4.964 3.353 -0.514
627 HG21 VAL 77 3HG2 VAL 77 -3.099 4.874 -2.425
628 HG22 VAL 77 1HG2 VAL 77 -3.064 3.144 -2.079
629 HG23 VAL 77 2HG2 VAL 77 -1.611 4.119 -1.850
630 H LEU 78 HN LEU 78 -1.781 4.760 2.344
631 HA LEU 78 HA LEU 78 -4.072 5.408 3.886
632 HB2 LEU 78 2HB LEU 78 -1.330 4.500 4.726
633 HB3 LEU 78 1HB LEU 78 -2.668 4.706 5.836
634 HG LEU 78 HG LEU 78 -2.366 2.665 3.646
635 HD11 LEU 78 1HD1 LEU 78 -2.661 1.084 5.437
636 HD12 LEU 78 2HD1 LEU 78 -2.986 2.385 6.582
637 HD13 LEU 78 3HD1 LEU 78 -1.384 2.219 5.873
638 HD21 LEU 78 3HD2 LEU 78 -4.864 3.318 5.205
639 HD22 LEU 78 1HD2 LEU 78 -4.645 1.924 4.146
640 HD23 LEU 78 2HD2 LEU 78 -4.625 3.554 3.474
641 H ASP 79 HN ASP 79 -0.881 6.912 3.561
642 HA ASP 79 HA ASP 79 -1.098 8.748 5.672
643 HB2 ASP 79 2HB ASP 79 1.017 8.386 4.536
644 HB3 ASP 79 1HB ASP 79 0.350 8.990 3.024
645 H TRP 80 HN TRP 80 -2.164 8.887 2.335
646 HA TRP 80 HA TRP 80 -3.124 11.498 2.234
647 HB2 TRP 80 2HB TRP 80 -2.912 10.111 0.260
648 HB3 TRP 80 1HB TRP 80 -4.090 8.967 0.887
649 HD1 TRP 80 1HD TRP 80 -3.923 12.584 -0.468
650 HE1 TRP 80 1HE TRP 80 -6.210 13.149 -1.515
651 HE3 TRP 80 3HE TRP 80 -6.457 8.344 0.833
652 HZ2 TRP 80 2HZ TRP 80 -8.764 11.923 -1.753
653 HZ3 TRP 80 3HZ TRP 80 -8.808 8.112 0.157
654 HH2 TRP 80 2HH TRP 80 -9.938 9.867 -1.107
655 H ALA 81 HN ALA 81 -4.810 8.503 3.159
656 HA ALA 81 HA ALA 81 -7.299 9.763 3.630
657 HB1 ALA 81 1HB ALA 81 -6.319 7.122 4.697
658 HB2 ALA 81 2HB ALA 81 -7.056 7.378 3.115
659 HB3 ALA 81 3HB ALA 81 -7.997 7.653 4.581
660 H THR 82 HN THR 82 -4.543 9.091 5.732
661 HA THR 82 HA THR 82 -5.867 9.597 8.183
662 HB THR 82 HB THR 82 -2.942 9.830 7.456
663 HG1 THR 82 1HG THR 82 -3.171 7.849 9.020
664 HG21 THR 82 3HG2 THR 82 -3.434 11.232 9.407
665 HG22 THR 82 1HG2 THR 82 -2.491 9.813 9.866
666 HG23 THR 82 2HG2 THR 82 -4.224 9.866 10.195
667 H VAL 83 HN VAL 83 -4.054 11.688 5.965
668 HA VAL 83 HA VAL 83 -4.339 14.037 7.543
669 HB VAL 83 HB VAL 83 -3.786 13.786 4.578
670 HG11 VAL 83 1HG1 VAL 83 -2.882 16.047 4.747
671 HG12 VAL 83 2HG1 VAL 83 -3.370 16.120 6.440
672 HG13 VAL 83 3HG1 VAL 83 -4.594 16.013 5.174
673 HG21 VAL 83 3HG2 VAL 83 -1.435 14.150 5.253
674 HG22 VAL 83 1HG2 VAL 83 -2.104 12.646 5.888
675 HG23 VAL 83 2HG2 VAL 83 -1.931 14.050 6.942
676 H ARG 84 HN ARG 84 -6.230 12.580 4.952
677 HA ARG 84 HA ARG 84 -8.065 14.712 4.619
678 HB2 ARG 84 2HB ARG 84 -8.380 11.749 4.110
679 HB3 ARG 84 1HB ARG 84 -9.538 12.970 3.604
680 HG2 ARG 84 2HG ARG 84 -6.661 12.914 2.727
681 HG3 ARG 84 1HG ARG 84 -7.992 12.199 1.817
682 HD2 ARG 84 2HD ARG 84 -7.808 15.103 2.603
683 HD3 ARG 84 1HD ARG 84 -7.355 14.458 1.026
684 HE ARG 84 HE ARG 84 -10.094 14.455 2.139
685 HH11 ARG 84 1HH1 ARG 84 -7.874 14.411 -0.574
686 HH12 ARG 84 2HH1 ARG 84 -9.121 14.546 -1.772
687 HH21 ARG 84 1HH2 ARG 84 -11.748 14.655 0.557
688 HH22 ARG 84 2HH2 ARG 84 -11.319 14.679 -1.123
689 H GLY 85 HN GLY 85 -7.744 12.215 6.990
690 HA2 GLY 85 2HA GLY 85 -8.773 12.195 9.087
691 HA3 GLY 85 1HA GLY 85 -9.930 13.384 8.506
692 H TYR 86 HN TYR 86 -9.119 10.290 6.999
693 HA TYR 86 HA TYR 86 -11.934 9.517 7.225
694 HB2 TYR 86 2HB TYR 86 -9.663 8.357 5.605
695 HB3 TYR 86 1HB TYR 86 -11.284 7.676 5.645
696 HD1 TYR 86 2HD TYR 86 -12.968 10.078 5.539
697 HD2 TYR 86 1HD TYR 86 -9.372 9.172 3.447
698 HE1 TYR 86 2HE TYR 86 -13.648 11.593 3.727
699 HE2 TYR 86 1HE TYR 86 -10.044 10.687 1.630
700 HH TYR 86 HH TYR 86 -12.604 12.896 1.934
701 H ARG 87 HN ARG 87 -9.350 9.255 9.109
702 HA ARG 87 HA ARG 87 -10.434 7.070 10.600
703 HB2 ARG 87 2HB ARG 87 -8.586 5.559 10.519
704 HB3 ARG 87 1HB ARG 87 -9.005 5.920 8.849
705 HG2 ARG 87 2HG ARG 87 -7.154 7.436 8.652
706 HG3 ARG 87 1HG ARG 87 -6.778 7.264 10.367
707 HD2 ARG 87 2HD ARG 87 -5.238 5.908 9.162
708 HD3 ARG 87 1HD ARG 87 -6.389 4.823 9.941
709 HE ARG 87 HE ARG 87 -7.232 4.239 7.871
710 HH11 ARG 87 1HH1 ARG 87 -4.862 6.793 7.610
711 HH12 ARG 87 2HH1 ARG 87 -4.779 6.714 5.877
712 HH21 ARG 87 1HH2 ARG 87 -7.145 4.137 5.597
713 HH22 ARG 87 2HH2 ARG 87 -6.086 5.196 4.725
714 H GLU 88 HN GLU 88 -8.621 6.574 12.431
715 HA GLU 88 HA GLU 88 -8.058 9.022 13.756
716 HB2 GLU 88 2HB GLU 88 -8.471 6.877 14.922
717 HB3 GLU 88 1HB GLU 88 -6.951 6.254 14.305
718 HG2 GLU 88 2HG GLU 88 -6.818 6.995 16.646
719 HG3 GLU 88 1HG GLU 88 -5.725 7.884 15.583
720 H GLY 89 HN GLY 89 -5.795 9.558 14.518
721 HA2 GLY 89 2HA GLY 89 -4.288 10.259 12.234
722 HA3 GLY 89 1HA GLY 89 -3.790 10.491 13.899
723 H ASP 90 HN ASP 90 -1.769 10.070 12.530
724 HA ASP 90 HA ASP 90 0.087 8.858 12.150
725 HB2 ASP 90 2HB ASP 90 -0.280 8.029 14.442
726 HB3 ASP 90 1HB ASP 90 -1.257 6.717 13.800
727 H ASN 91 HN ASN 91 0.944 6.878 11.071
728 HA ASN 91 HA ASN 91 -1.015 5.630 9.293
729 HB2 ASN 91 2HB ASN 91 -0.095 7.516 8.021
730 HB3 ASN 91 1HB ASN 91 1.541 6.925 8.315
731 HD21 ASN 91 1HD2 ASN 91 1.820 6.784 6.010
732 HD22 ASN 91 2HD2 ASN 91 1.148 5.473 5.126
733 HA PRO 92 HA PRO 92 1.499 2.368 11.265
734 HB2 PRO 92 2HB PRO 92 -0.249 0.415 10.329
735 HB3 PRO 92 1HB PRO 92 -0.343 1.213 11.901
736 HG2 PRO 92 2HG PRO 92 -1.836 1.792 9.380
737 HG3 PRO 92 1HG PRO 92 -2.404 1.839 11.060
738 HD2 PRO 92 2HD PRO 92 -1.841 4.084 9.727
739 HD3 PRO 92 1HD PRO 92 -1.454 3.919 11.453
740 H ALA 93 HN ALA 93 0.537 2.827 7.945
741 HA ALA 93 HA ALA 93 1.956 0.605 6.849
742 HB1 ALA 93 1HB ALA 93 0.987 3.172 5.608
743 HB2 ALA 93 2HB ALA 93 0.237 1.578 5.525
744 HB3 ALA 93 3HB ALA 93 1.763 1.877 4.700
745 H ARG 94 HN ARG 94 2.895 3.651 8.082
746 HA ARG 94 HA ARG 94 5.465 3.591 6.707
747 HB2 ARG 94 2HB ARG 94 4.442 5.779 6.940
748 HB3 ARG 94 1HB ARG 94 4.317 5.568 8.680
749 HG2 ARG 94 2HG ARG 94 6.607 5.810 9.001
750 HG3 ARG 94 1HG ARG 94 6.973 5.482 7.307
751 HD2 ARG 94 2HD ARG 94 5.493 7.911 8.298
752 HD3 ARG 94 1HD ARG 94 7.220 7.869 7.938
753 HE ARG 94 HE ARG 94 6.203 7.004 5.636
754 HH11 ARG 94 1HH1 ARG 94 5.286 9.718 7.657
755 HH12 ARG 94 2HH1 ARG 94 4.691 10.672 6.327
756 HH21 ARG 94 1HH2 ARG 94 5.443 8.247 3.891
757 HH22 ARG 94 2HH2 ARG 94 4.765 9.827 4.185
758 H TRP 95 HN TRP 95 7.261 2.916 7.582
759 HA TRP 95 HA TRP 95 7.198 1.985 10.375
760 HB2 TRP 95 2HB TRP 95 7.853 0.556 7.870
761 HB3 TRP 95 1HB TRP 95 8.893 0.234 9.255
762 HD1 TRP 95 1HD TRP 95 7.472 -0.454 11.562
763 HE1 TRP 95 1HE TRP 95 5.525 -2.113 11.741
764 HE3 TRP 95 3HE TRP 95 5.940 -0.411 6.695
765 HZ2 TRP 95 2HZ TRP 95 3.571 -3.250 10.038
766 HZ3 TRP 95 3HZ TRP 95 4.023 -1.813 6.049
767 HH2 TRP 95 2HH TRP 95 2.864 -3.202 7.687
768 H ARG 96 HN ARG 96 9.141 3.170 7.702
769 HA ARG 96 HA ARG 96 11.282 3.681 7.403
770 HB2 ARG 96 2HB ARG 96 10.703 5.470 8.977
771 HB3 ARG 96 1HB ARG 96 11.173 4.428 10.316
772 HG2 ARG 96 2HG ARG 96 13.428 4.321 9.395
773 HG3 ARG 96 1HG ARG 96 12.956 5.444 8.126
774 HD2 ARG 96 2HD ARG 96 12.869 6.014 11.088
775 HD3 ARG 96 1HD ARG 96 14.105 6.591 9.971
776 HE ARG 96 HE ARG 96 11.767 7.460 8.877
777 HH11 ARG 96 1HH1 ARG 96 13.253 7.808 12.035
778 HH12 ARG 96 2HH1 ARG 96 12.549 9.375 12.326
779 HH21 ARG 96 1HH2 ARG 96 10.851 9.481 9.241
780 HH22 ARG 96 2HH2 ARG 96 11.177 10.340 10.723
781 H GLY 97 HN GLY 97 11.174 2.233 10.645
782 HA2 GLY 97 2HA GLY 97 13.463 0.544 9.900
783 HA3 GLY 97 1HA GLY 97 12.893 0.838 11.536
784 H TYR 98 HN TYR 98 11.249 -0.285 8.572
785 HA TYR 98 HA TYR 98 9.816 -2.329 9.978
786 HB2 TYR 98 2HB TYR 98 8.915 -1.328 7.917
787 HB3 TYR 98 1HB TYR 98 10.274 -1.965 6.998
788 HD1 TYR 98 1HD TYR 98 7.647 -3.240 9.336
789 HD2 TYR 98 2HD TYR 98 9.874 -3.890 5.773
790 HE1 TYR 98 1HE TYR 98 6.382 -5.305 8.929
791 HE2 TYR 98 2HE TYR 98 8.608 -5.960 5.355
792 HH TYR 98 HH TYR 98 7.316 -7.641 6.747
793 H LEU 99 HN LEU 99 12.381 -2.419 7.523
794 HA LEU 99 HA LEU 99 13.124 -5.118 8.269
795 HB2 LEU 99 2HB LEU 99 14.372 -3.212 6.279
796 HB3 LEU 99 1HB LEU 99 14.803 -4.899 6.482
797 HG LEU 99 HG LEU 99 12.105 -3.907 5.559
798 HD11 LEU 99 1HD1 LEU 99 13.808 -3.447 3.898
799 HD12 LEU 99 2HD1 LEU 99 12.791 -4.787 3.369
800 HD13 LEU 99 3HD1 LEU 99 14.401 -5.103 4.012
801 HD21 LEU 99 3HD2 LEU 99 11.702 -6.255 5.002
802 HD22 LEU 99 1HD2 LEU 99 11.993 -6.044 6.729
803 HD23 LEU 99 2HD2 LEU 99 13.266 -6.688 5.693
804 H GLU 100 HN GLU 100 15.223 -2.359 7.615
805 HA GLU 100 HA GLU 100 16.001 -1.840 10.257
806 HB2 GLU 100 2HB GLU 100 17.236 -4.147 9.215
807 HB3 GLU 100 1HB GLU 100 18.450 -2.876 9.122
808 HG2 GLU 100 2HG GLU 100 16.939 -3.720 11.587
809 HG3 GLU 100 1HG GLU 100 18.623 -4.085 11.214
810 H HIS 101 HN HIS 101 17.496 -2.064 7.021
811 HA HIS 101 HA HIS 101 18.101 0.817 7.226
812 HB2 HIS 101 2HB HIS 101 19.729 -1.359 5.888
813 HB3 HIS 101 1HB HIS 101 20.068 0.363 5.748
814 HD1 HIS 101 1HD HIS 101 21.134 1.540 7.786
815 HD2 HIS 101 2HD HIS 101 20.403 -2.517 8.361
816 HE1 HIS 101 1HE HIS 101 22.375 0.916 9.875
817 HE2 HIS 101 2HE HIS 101 21.792 -1.495 10.291
818 H HIS 102 HN HIS 102 18.723 1.548 4.775
819 HA HIS 102 HA HIS 102 16.493 0.631 3.077
820 HB2 HIS 102 2HB HIS 102 17.299 3.493 3.618
821 HB3 HIS 102 1HB HIS 102 16.179 3.004 2.354
822 HD1 HIS 102 1HD HIS 102 13.802 2.343 3.058
823 HD2 HIS 102 2HD HIS 102 16.282 3.369 6.238
824 HE1 HIS 102 1HE HIS 102 12.286 2.616 5.047
825 HE2 HIS 102 2HE HIS 102 13.843 2.977 6.989
826 H HIS 103 HN HIS 103 19.441 2.644 3.073
827 HA HIS 103 HA HIS 103 21.029 3.046 1.502
828 HB2 HIS 103 2HB HIS 103 20.103 0.332 0.589
829 HB3 HIS 103 1HB HIS 103 21.261 1.246 -0.369
830 HD1 HIS 103 1HD HIS 103 22.199 -1.383 0.725
831 HD2 HIS 103 2HD HIS 103 22.569 2.200 2.813
832 HE1 HIS 103 1HE HIS 103 24.075 -1.737 2.363
833 HE2 HIS 103 2HE HIS 103 24.417 0.505 3.459
834 H HIS 104 HN HIS 104 18.482 4.238 1.228
835 HA HIS 104 HA HIS 104 17.613 4.045 -1.497
836 HB2 HIS 104 2HB HIS 104 16.054 5.822 -1.006
837 HB3 HIS 104 1HB HIS 104 16.051 4.687 0.333
838 HD1 HIS 104 1HD HIS 104 16.129 8.202 -0.364
839 HD2 HIS 104 2HD HIS 104 17.758 5.749 2.583
840 HE1 HIS 104 1HE HIS 104 16.679 9.719 1.565
841 HE2 HIS 104 2HE HIS 104 17.771 8.240 3.289
842 H HIS 105 HN HIS 105 18.616 4.821 -3.157
843 HA HIS 105 HA HIS 105 19.833 6.095 -4.547
844 HB2 HIS 105 2HB HIS 105 18.817 8.066 -2.672
845 HB3 HIS 105 1HB HIS 105 20.386 8.524 -3.328
846 HD1 HIS 105 1HD HIS 105 19.939 10.139 -5.143
847 HD2 HIS 105 2HD HIS 105 17.286 6.937 -5.216
848 HE1 HIS 105 1HE HIS 105 18.519 10.482 -7.189
849 HE2 HIS 105 2HE HIS 105 17.061 8.434 -7.317
850 H HIS 106 HN HIS 106 21.640 4.994 -4.605
851 HA HIS 106 HA HIS 106 23.861 5.988 -2.967
852 HB2 HIS 106 2HB HIS 106 23.304 3.880 -1.957
853 HB3 HIS 106 1HB HIS 106 23.166 3.097 -3.528
854 HD1 HIS 106 1HD HIS 106 25.145 1.795 -4.218
855 HD2 HIS 106 2HD HIS 106 26.126 4.743 -1.453
856 HE1 HIS 106 1HE HIS 106 27.593 1.491 -3.745
857 HE2 HIS 106 2HE HIS 106 28.200 3.363 -2.176
Start of MODEL 6
1 H1 MET 1 H1 MET 1 -15.471 5.080 5.705
2 H2 MET 1 H2 MET 1 -14.270 4.235 6.553
3 H3 MET 1 H3 MET 1 -15.525 3.383 5.794
4 HA MET 1 HA MET 1 -14.756 4.101 3.640
5 HB2 MET 1 2HB MET 1 -13.753 6.233 4.446
6 HB3 MET 1 1HB MET 1 -12.451 5.309 5.183
7 HG2 MET 1 2HG MET 1 -11.692 6.197 3.093
8 HG3 MET 1 1HG MET 1 -11.844 4.447 2.955
9 HE1 MET 1 2HE MET 1 -15.044 7.331 1.292
10 HE2 MET 1 3HE MET 1 -13.627 7.895 2.178
11 HE3 MET 1 1HE MET 1 -14.864 6.938 3.000
12 H THR 2 HN THR 2 -13.968 2.342 2.685
13 HA THR 2 HA THR 2 -12.358 0.493 4.286
14 HB THR 2 HB THR 2 -12.756 -1.110 2.421
15 HG1 THR 2 1HG THR 2 -14.619 0.790 1.412
16 HG21 THR 2 3HG2 THR 2 -15.153 -1.443 2.862
17 HG22 THR 2 1HG2 THR 2 -15.234 0.164 3.585
18 HG23 THR 2 2HG2 THR 2 -14.254 -1.093 4.339
19 H PHE 3 HN PHE 3 -10.586 -0.694 3.011
20 HA PHE 3 HA PHE 3 -8.709 1.240 2.136
21 HB2 PHE 3 2HB PHE 3 -8.075 -0.900 3.233
22 HB3 PHE 3 1HB PHE 3 -8.585 -1.764 1.785
23 HD1 PHE 3 2HD PHE 3 -6.259 0.899 2.926
24 HD2 PHE 3 1HD PHE 3 -7.068 -2.154 0.074
25 HE1 PHE 3 2HE PHE 3 -4.025 1.225 1.949
26 HE2 PHE 3 1HE PHE 3 -4.840 -1.828 -0.913
27 HZ PHE 3 HZ PHE 3 -3.314 -0.136 0.024
28 H SER 4 HN SER 4 -10.754 -1.107 0.454
29 HA SER 4 HA SER 4 -9.788 -0.739 -2.133
30 HB2 SER 4 2HB SER 4 -12.660 -1.240 -1.328
31 HB3 SER 4 1HB SER 4 -11.928 -1.602 -2.893
32 HG SER 4 HG SER 4 -10.787 -3.232 -2.013
33 H GLU 5 HN GLU 5 -12.375 0.992 -0.429
34 HA GLU 5 HA GLU 5 -13.072 2.730 -2.522
35 HB2 GLU 5 2HB GLU 5 -13.324 2.960 0.471
36 HB3 GLU 5 1HB GLU 5 -14.005 4.135 -0.635
37 HG2 GLU 5 2HG GLU 5 -15.416 2.434 -1.618
38 HG3 GLU 5 1HG GLU 5 -14.694 1.216 -0.567
39 H CYS 6 HN CYS 6 -10.885 3.130 0.231
40 HA CYS 6 HA CYS 6 -10.257 5.833 -0.261
41 HB2 CYS 6 2HB CYS 6 -9.899 4.470 1.865
42 HB3 CYS 6 1HB CYS 6 -8.443 3.860 1.107
43 HG CYS 6 HG CYS 6 -7.765 6.779 0.659
44 H ALA 7 HN ALA 7 -8.575 2.834 -1.087
45 HA ALA 7 HA ALA 7 -6.376 3.953 -2.409
46 HB1 ALA 7 1HB ALA 7 -7.762 1.339 -3.018
47 HB2 ALA 7 2HB ALA 7 -6.498 1.580 -1.813
48 HB3 ALA 7 3HB ALA 7 -6.134 1.789 -3.525
49 H ALA 8 HN ALA 8 -9.551 2.989 -3.657
50 HA ALA 8 HA ALA 8 -9.113 3.643 -6.345
51 HB1 ALA 8 1HB ALA 8 -11.037 2.338 -5.577
52 HB2 ALA 8 2HB ALA 8 -11.536 3.712 -6.562
53 HB3 ALA 8 3HB ALA 8 -11.706 3.777 -4.807
54 H LEU 9 HN LEU 9 -10.360 5.607 -3.661
55 HA LEU 9 HA LEU 9 -10.875 7.943 -5.125
56 HB2 LEU 9 2HB LEU 9 -10.045 7.657 -2.235
57 HB3 LEU 9 1HB LEU 9 -10.687 9.119 -2.952
58 HG LEU 9 HG LEU 9 -12.178 6.509 -2.675
59 HD11 LEU 9 1HD1 LEU 9 -11.877 7.610 -0.542
60 HD12 LEU 9 2HD1 LEU 9 -13.554 7.752 -1.072
61 HD13 LEU 9 3HD1 LEU 9 -12.462 9.130 -1.219
62 HD21 LEU 9 3HD2 LEU 9 -13.090 9.190 -3.710
63 HD22 LEU 9 1HD2 LEU 9 -14.115 7.779 -3.449
64 HD23 LEU 9 2HD2 LEU 9 -12.847 7.732 -4.673
65 H TYR 10 HN TYR 10 -7.940 6.856 -3.459
66 HA TYR 10 HA TYR 10 -6.387 9.149 -3.881
67 HB2 TYR 10 2HB TYR 10 -5.677 7.356 -2.372
68 HB3 TYR 10 1HB TYR 10 -5.497 6.258 -3.734
69 HD1 TYR 10 1HD TYR 10 -4.225 9.508 -2.434
70 HD2 TYR 10 2HD TYR 10 -3.416 6.053 -4.780
71 HE1 TYR 10 1HE TYR 10 -1.899 10.244 -2.708
72 HE2 TYR 10 2HE TYR 10 -1.082 6.784 -5.057
73 HH TYR 10 HH TYR 10 0.243 9.419 -3.241
74 H ILE 11 HN ILE 11 -6.701 6.214 -5.827
75 HA ILE 11 HA ILE 11 -4.871 7.000 -7.834
76 HB ILE 11 HB ILE 11 -7.121 4.982 -7.932
77 HG12 ILE 11 2HG1 ILE 11 -4.140 4.605 -7.537
78 HG13 ILE 11 1HG1 ILE 11 -5.326 4.606 -6.235
79 HG21 ILE 11 1HG2 ILE 11 -4.802 5.371 -9.821
80 HG22 ILE 11 2HG2 ILE 11 -6.500 5.675 -10.183
81 HG23 ILE 11 3HG2 ILE 11 -5.947 4.031 -9.865
82 HD11 ILE 11 3HD1 ILE 11 -5.204 2.646 -8.515
83 HD12 ILE 11 1HD1 ILE 11 -6.396 2.644 -7.214
84 HD13 ILE 11 2HD1 ILE 11 -4.694 2.351 -6.852
85 H LYS 12 HN LYS 12 -8.431 7.133 -7.698
86 HA LYS 12 HA LYS 12 -8.719 8.142 -10.331
87 HB2 LYS 12 2HB LYS 12 -10.606 8.177 -7.977
88 HB3 LYS 12 1HB LYS 12 -11.053 8.692 -9.599
89 HG2 LYS 12 2HG LYS 12 -10.619 6.487 -10.469
90 HG3 LYS 12 1HG LYS 12 -10.026 5.949 -8.901
91 HD2 LYS 12 2HD LYS 12 -12.271 5.141 -9.209
92 HD3 LYS 12 1HD LYS 12 -12.276 6.379 -7.953
93 HE2 LYS 12 2HE LYS 12 -13.193 7.997 -9.441
94 HE3 LYS 12 1HE LYS 12 -12.947 6.942 -10.835
95 HZ1 LYS 12 3HZ LYS 12 -14.792 6.373 -8.572
96 HZ2 LYS 12 1HZ LYS 12 -14.584 5.424 -9.963
97 HZ3 LYS 12 2HZ LYS 12 -15.262 6.971 -10.085
98 H ALA 13 HN ALA 13 -8.326 9.721 -7.207
99 HA ALA 13 HA ALA 13 -8.839 12.348 -8.277
100 HB1 ALA 13 1HB ALA 13 -9.286 11.849 -5.920
101 HB2 ALA 13 2HB ALA 13 -8.142 13.178 -6.095
102 HB3 ALA 13 3HB ALA 13 -7.566 11.570 -5.652
103 H HIS 14 HN HIS 14 -6.384 10.314 -8.888
104 HA HIS 14 HA HIS 14 -4.535 12.555 -9.359
105 HB2 HIS 14 2HB HIS 14 -3.880 9.836 -8.241
106 HB3 HIS 14 1HB HIS 14 -2.663 10.834 -9.025
107 HD1 HIS 14 1HD HIS 14 -4.584 10.446 -5.883
108 HD2 HIS 14 2HD HIS 14 -1.931 13.159 -7.580
109 HE1 HIS 14 1HE HIS 14 -3.834 11.934 -3.994
110 HE2 HIS 14 2HE HIS 14 -2.069 13.425 -5.005
111 H ARG 15 HN ARG 15 -6.481 10.428 -10.818
112 HA ARG 15 HA ARG 15 -4.766 9.187 -12.702
113 HB2 ARG 15 2HB ARG 15 -6.765 8.577 -13.911
114 HB3 ARG 15 1HB ARG 15 -7.035 8.349 -12.194
115 HG2 ARG 15 2HG ARG 15 -8.318 10.411 -12.104
116 HG3 ARG 15 1HG ARG 15 -8.007 10.690 -13.818
117 HD2 ARG 15 2HD ARG 15 -9.204 8.661 -14.397
118 HD3 ARG 15 1HD ARG 15 -9.459 8.298 -12.691
119 HE ARG 15 HE ARG 15 -10.667 10.622 -12.808
120 HH11 ARG 15 1HH1 ARG 15 -10.759 8.006 -15.148
121 HH12 ARG 15 2HH1 ARG 15 -12.345 8.416 -15.732
122 HH21 ARG 15 1HH2 ARG 15 -12.787 11.116 -13.536
123 HH22 ARG 15 2HH2 ARG 15 -13.506 10.151 -14.794
124 H SER 16 HN SER 16 -6.301 12.298 -12.536
125 HA SER 16 HA SER 16 -5.905 13.080 -15.223
126 HB2 SER 16 2HB SER 16 -6.019 14.850 -12.778
127 HB3 SER 16 1HB SER 16 -6.498 15.248 -14.424
128 HG SER 16 HG SER 16 -8.372 14.777 -13.362
129 H SER 17 HN SER 17 -3.900 12.923 -12.409
130 HA SER 17 HA SER 17 -1.822 14.633 -13.444
131 HB2 SER 17 2HB SER 17 -1.706 12.760 -11.068
132 HB3 SER 17 1HB SER 17 -0.714 14.182 -11.369
133 HG SER 17 HG SER 17 -2.939 15.270 -11.391
134 H TRP 18 HN TRP 18 -2.754 11.393 -13.747
135 HA TRP 18 HA TRP 18 -0.056 10.537 -14.495
136 HB2 TRP 18 2HB TRP 18 -2.512 9.000 -13.671
137 HB3 TRP 18 1HB TRP 18 -1.154 8.214 -14.468
138 HD1 TRP 18 1HD TRP 18 1.204 9.708 -12.934
139 HE1 TRP 18 1HE TRP 18 1.668 9.133 -10.470
140 HE3 TRP 18 3HE TRP 18 -3.348 7.728 -11.701
141 HZ2 TRP 18 2HZ TRP 18 0.279 7.983 -8.288
142 HZ3 TRP 18 3HZ TRP 18 -3.695 6.910 -9.407
143 HH2 TRP 18 2HH TRP 18 -1.922 7.034 -7.739
144 H LYS 19 HN LYS 19 -1.427 12.229 -16.255
145 HA LYS 19 HA LYS 19 -1.593 12.457 -18.417
146 HB2 LYS 19 2HB LYS 19 -0.563 9.660 -18.466
147 HB3 LYS 19 1HB LYS 19 -0.940 10.563 -19.933
148 HG2 LYS 19 2HG LYS 19 0.561 12.394 -19.044
149 HG3 LYS 19 1HG LYS 19 1.085 11.247 -17.814
150 HD2 LYS 19 2HD LYS 19 2.639 11.318 -19.688
151 HD3 LYS 19 1HD LYS 19 1.872 9.736 -19.553
152 HE2 LYS 19 2HE LYS 19 0.378 10.240 -21.363
153 HE3 LYS 19 1HE LYS 19 0.938 11.911 -21.418
154 HZ1 LYS 19 3HZ LYS 19 2.924 9.788 -21.778
155 HZ2 LYS 19 1HZ LYS 19 2.856 11.337 -22.466
156 HZ3 LYS 19 2HZ LYS 19 1.858 10.100 -23.060
157 H ASN 20 HN ASN 20 -4.044 11.293 -20.210
158 HA ASN 20 HA ASN 20 -4.095 8.659 -19.600
159 HB2 ASN 20 2HB ASN 20 -3.594 10.038 -22.192
160 HB3 ASN 20 1HB ASN 20 -3.733 8.287 -22.071
161 HD21 ASN 20 1HD2 ASN 20 -5.441 10.169 -23.454
162 HD22 ASN 20 2HD2 ASN 20 -7.023 9.968 -22.780
163 H THR 21 HN THR 21 -2.401 8.080 -18.320
164 HA THR 21 HA THR 21 -0.865 6.347 -20.103
165 HB THR 21 HB THR 21 0.855 6.149 -18.123
166 HG1 THR 21 1HG THR 21 -0.533 8.355 -17.421
167 HG21 THR 21 3HG2 THR 21 2.335 7.732 -19.269
168 HG22 THR 21 1HG2 THR 21 0.950 8.379 -20.148
169 HG23 THR 21 2HG2 THR 21 1.454 6.706 -20.401
170 H LYS 22 HN LYS 22 -0.296 4.261 -18.984
171 HA LYS 22 HA LYS 22 -2.734 3.278 -17.860
172 HB2 LYS 22 2HB LYS 22 -0.086 1.907 -18.305
173 HB3 LYS 22 1HB LYS 22 -1.564 1.097 -17.816
174 HG2 LYS 22 2HG LYS 22 -2.622 1.902 -19.919
175 HG3 LYS 22 1HG LYS 22 -1.043 2.516 -20.412
176 HD2 LYS 22 2HD LYS 22 -1.714 -0.358 -19.777
177 HD3 LYS 22 1HD LYS 22 -1.470 0.317 -21.389
178 HE2 LYS 22 2HE LYS 22 0.839 0.818 -20.868
179 HE3 LYS 22 1HE LYS 22 0.610 0.272 -19.207
180 HZ1 LYS 22 3HZ LYS 22 0.446 -1.412 -21.650
181 HZ2 LYS 22 1HZ LYS 22 0.121 -1.957 -20.075
182 HZ3 LYS 22 2HZ LYS 22 1.681 -1.438 -20.490
183 H HIS 23 HN HIS 23 -0.388 4.925 -16.330
184 HA HIS 23 HA HIS 23 0.471 3.378 -14.187
185 HB2 HIS 23 2HB HIS 23 0.062 6.336 -14.501
186 HB3 HIS 23 1HB HIS 23 0.545 5.668 -12.946
187 HD1 HIS 23 1HD HIS 23 2.994 5.326 -12.609
188 HD2 HIS 23 2HD HIS 23 1.989 5.697 -16.630
189 HE1 HIS 23 1HE HIS 23 5.175 5.357 -13.856
190 HE2 HIS 23 2HE HIS 23 4.541 5.421 -16.293
191 H ALA 24 HN ALA 24 -2.449 5.413 -14.391
192 HA ALA 24 HA ALA 24 -3.318 5.052 -11.757
193 HB1 ALA 24 1HB ALA 24 -4.998 5.480 -14.227
194 HB2 ALA 24 2HB ALA 24 -4.251 6.744 -13.250
195 HB3 ALA 24 3HB ALA 24 -5.523 5.733 -12.562
196 H ASP 25 HN ASP 25 -3.962 3.138 -14.662
197 HA ASP 25 HA ASP 25 -5.792 1.369 -13.378
198 HB2 ASP 25 2HB ASP 25 -5.731 1.837 -15.841
199 HB3 ASP 25 1HB ASP 25 -4.235 0.920 -15.931
200 H GLN 26 HN GLN 26 -2.370 1.179 -14.279
201 HA GLN 26 HA GLN 26 -1.867 -1.442 -13.458
202 HB2 GLN 26 2HB GLN 26 -0.080 0.985 -13.590
203 HB3 GLN 26 1HB GLN 26 0.509 -0.632 -13.258
204 HG2 GLN 26 2HG GLN 26 -0.937 0.223 -15.751
205 HG3 GLN 26 1HG GLN 26 0.800 -0.015 -15.598
206 HE21 GLN 26 1HE2 GLN 26 1.622 -2.091 -15.448
207 HE22 GLN 26 2HE2 GLN 26 0.684 -3.493 -15.843
208 H TRP 27 HN TRP 27 -1.685 1.606 -11.632
209 HA TRP 27 HA TRP 27 -0.778 0.612 -9.194
210 HB2 TRP 27 2HB TRP 27 -2.469 2.928 -10.003
211 HB3 TRP 27 1HB TRP 27 -2.475 2.480 -8.303
212 HD1 TRP 27 1HD TRP 27 0.234 3.222 -10.998
213 HE1 TRP 27 1HE TRP 27 2.113 4.570 -9.861
214 HE3 TRP 27 3HE TRP 27 -1.623 3.319 -6.237
215 HZ2 TRP 27 2HZ TRP 27 2.716 5.541 -7.273
216 HZ3 TRP 27 3HZ TRP 27 -0.337 4.477 -4.492
217 HH2 TRP 27 2HH TRP 27 1.787 5.566 -4.999
218 H THR 28 HN THR 28 -4.081 0.868 -10.424
219 HA THR 28 HA THR 28 -5.394 -0.208 -8.192
220 HB THR 28 HB THR 28 -6.291 -0.384 -11.078
221 HG1 THR 28 1HG THR 28 -5.823 1.777 -10.573
222 HG21 THR 28 3HG2 THR 28 -7.862 -0.303 -8.499
223 HG22 THR 28 1HG2 THR 28 -7.613 -1.728 -9.509
224 HG23 THR 28 2HG2 THR 28 -8.539 -0.361 -10.127
225 H ASN 29 HN ASN 29 -4.309 -1.740 -11.209
226 HA ASN 29 HA ASN 29 -5.444 -4.226 -10.874
227 HB2 ASN 29 2HB ASN 29 -2.907 -3.385 -12.273
228 HB3 ASN 29 1HB ASN 29 -3.594 -4.988 -12.409
229 HD21 ASN 29 1HD2 ASN 29 -3.138 -2.946 -14.427
230 HD22 ASN 29 2HD2 ASN 29 -4.675 -2.614 -15.150
231 H THR 30 HN THR 30 -2.199 -3.163 -9.860
232 HA THR 30 HA THR 30 -1.369 -5.713 -8.977
233 HB THR 30 HB THR 30 -0.337 -3.085 -7.930
234 HG1 THR 30 1HG THR 30 -0.126 -4.260 -10.461
235 HG21 THR 30 3HG2 THR 30 0.535 -5.070 -6.812
236 HG22 THR 30 1HG2 THR 30 1.790 -4.308 -7.787
237 HG23 THR 30 2HG2 THR 30 0.982 -5.764 -8.371
238 H ILE 31 HN ILE 31 -2.645 -2.904 -7.187
239 HA ILE 31 HA ILE 31 -2.423 -4.121 -4.637
240 HB ILE 31 HB ILE 31 -4.169 -1.808 -5.498
241 HG12 ILE 31 2HG1 ILE 31 -1.438 -1.826 -4.192
242 HG13 ILE 31 1HG1 ILE 31 -1.737 -1.482 -5.891
243 HG21 ILE 31 1HG2 ILE 31 -4.951 -2.770 -3.410
244 HG22 ILE 31 2HG2 ILE 31 -4.181 -1.212 -3.108
245 HG23 ILE 31 3HG2 ILE 31 -3.321 -2.709 -2.743
246 HD11 ILE 31 3HD1 ILE 31 -3.069 0.476 -5.231
247 HD12 ILE 31 1HD1 ILE 31 -1.400 0.566 -4.672
248 HD13 ILE 31 2HD1 ILE 31 -2.685 0.142 -3.541
249 H LYS 32 HN LYS 32 -5.097 -3.776 -6.927
250 HA LYS 32 HA LYS 32 -7.171 -4.774 -5.339
251 HB2 LYS 32 2HB LYS 32 -7.231 -3.619 -7.645
252 HB3 LYS 32 1HB LYS 32 -6.931 -5.211 -8.316
253 HG2 LYS 32 2HG LYS 32 -9.273 -4.668 -6.518
254 HG3 LYS 32 1HG LYS 32 -9.329 -4.377 -8.255
255 HD2 LYS 32 2HD LYS 32 -8.641 -6.768 -8.580
256 HD3 LYS 32 1HD LYS 32 -8.867 -6.996 -6.844
257 HE2 LYS 32 2HE LYS 32 -11.211 -6.224 -7.102
258 HE3 LYS 32 1HE LYS 32 -10.958 -6.144 -8.845
259 HZ1 LYS 32 3HZ LYS 32 -10.362 -8.556 -8.724
260 HZ2 LYS 32 1HZ LYS 32 -11.987 -8.205 -8.376
261 HZ3 LYS 32 2HZ LYS 32 -10.904 -8.551 -7.119
262 H THR 33 HN THR 33 -4.679 -6.378 -7.182
263 HA THR 33 HA THR 33 -5.919 -8.971 -7.059
264 HB THR 33 HB THR 33 -3.132 -8.162 -7.916
265 HG1 THR 33 1HG THR 33 -4.448 -7.255 -9.386
266 HG21 THR 33 3HG2 THR 33 -3.090 -10.307 -9.093
267 HG22 THR 33 1HG2 THR 33 -4.675 -10.711 -8.434
268 HG23 THR 33 2HG2 THR 33 -3.287 -10.548 -7.358
269 H TYR 34 HN TYR 34 -3.010 -7.489 -5.578
270 HA TYR 34 HA TYR 34 -2.426 -9.915 -4.149
271 HB2 TYR 34 2HB TYR 34 -1.144 -7.199 -4.203
272 HB3 TYR 34 1HB TYR 34 -0.606 -8.460 -3.099
273 HD1 TYR 34 2HD TYR 34 0.310 -10.595 -4.039
274 HD2 TYR 34 1HD TYR 34 -0.525 -7.217 -6.490
275 HE1 TYR 34 2HE TYR 34 1.733 -11.534 -5.808
276 HE2 TYR 34 1HE TYR 34 0.901 -8.147 -8.264
277 HH TYR 34 HH TYR 34 1.991 -11.357 -8.241
278 H CYS 35 HN CYS 35 -3.540 -6.670 -3.174
279 HA CYS 35 HA CYS 35 -3.758 -7.690 -0.426
280 HB2 CYS 35 2HB CYS 35 -3.662 -4.835 -1.417
281 HB3 CYS 35 1HB CYS 35 -3.762 -5.324 0.271
282 HG CYS 35 HG CYS 35 -1.210 -6.864 -1.050
283 H GLY 36 HN GLY 36 -5.639 -6.990 -3.093
284 HA2 GLY 36 2HA GLY 36 -7.873 -5.661 -2.150
285 HA3 GLY 36 1HA GLY 36 -7.899 -6.854 -3.437
286 HA PRO 37 HA PRO 37 -10.171 -9.739 -1.028
287 HB2 PRO 37 2HB PRO 37 -8.060 -11.805 -1.084
288 HB3 PRO 37 1HB PRO 37 -9.697 -11.852 -1.748
289 HG2 PRO 37 2HG PRO 37 -7.562 -11.649 -3.344
290 HG3 PRO 37 1HG PRO 37 -9.070 -10.796 -3.714
291 HD2 PRO 37 2HD PRO 37 -6.540 -9.737 -2.511
292 HD3 PRO 37 1HD PRO 37 -7.599 -9.002 -3.734
293 H VAL 38 HN VAL 38 -7.063 -8.875 0.113
294 HA VAL 38 HA VAL 38 -7.336 -10.370 2.599
295 HB VAL 38 HB VAL 38 -5.083 -8.536 1.767
296 HG11 VAL 38 1HG1 VAL 38 -3.806 -9.745 3.484
297 HG12 VAL 38 2HG1 VAL 38 -5.258 -10.645 3.917
298 HG13 VAL 38 3HG1 VAL 38 -5.196 -8.901 4.167
299 HG21 VAL 38 3HG2 VAL 38 -5.308 -10.370 0.177
300 HG22 VAL 38 1HG2 VAL 38 -5.303 -11.535 1.502
301 HG23 VAL 38 2HG2 VAL 38 -3.862 -10.574 1.165
302 H ILE 39 HN ILE 39 -6.475 -6.972 1.829
303 HA ILE 39 HA ILE 39 -7.778 -6.236 4.375
304 HB ILE 39 HB ILE 39 -6.223 -4.301 4.461
305 HG12 ILE 39 2HG1 ILE 39 -4.833 -5.721 2.175
306 HG13 ILE 39 1HG1 ILE 39 -5.700 -4.195 2.051
307 HG21 ILE 39 1HG2 ILE 39 -5.786 -6.356 5.724
308 HG22 ILE 39 2HG2 ILE 39 -4.289 -5.572 5.220
309 HG23 ILE 39 3HG2 ILE 39 -4.869 -6.998 4.359
310 HD11 ILE 39 3HD1 ILE 39 -3.239 -4.668 3.715
311 HD12 ILE 39 1HD1 ILE 39 -4.093 -3.136 3.526
312 HD13 ILE 39 2HD1 ILE 39 -3.286 -3.872 2.141
313 H GLY 40 HN GLY 40 -8.339 -6.111 1.204
314 HA2 GLY 40 2HA GLY 40 -8.837 -3.449 0.545
315 HA3 GLY 40 1HA GLY 40 -9.643 -4.834 -0.167
316 HA PRO 41 HA PRO 41 -13.446 -3.838 1.782
317 HB2 PRO 41 2HB PRO 41 -13.763 -6.405 3.164
318 HB3 PRO 41 1HB PRO 41 -14.672 -5.747 1.802
319 HG2 PRO 41 2HG PRO 41 -12.973 -7.818 1.523
320 HG3 PRO 41 1HG PRO 41 -13.212 -6.616 0.240
321 HD2 PRO 41 2HD PRO 41 -10.992 -6.839 2.241
322 HD3 PRO 41 1HD PRO 41 -10.907 -6.474 0.505
323 H LEU 42 HN LEU 42 -10.829 -4.323 3.752
324 HA LEU 42 HA LEU 42 -12.229 -4.022 6.278
325 HB2 LEU 42 2HB LEU 42 -9.277 -3.952 5.631
326 HB3 LEU 42 1HB LEU 42 -9.955 -3.913 7.246
327 HG LEU 42 HG LEU 42 -10.152 -6.214 5.299
328 HD11 LEU 42 1HD1 LEU 42 -8.730 -7.371 6.928
329 HD12 LEU 42 2HD1 LEU 42 -8.606 -5.885 7.868
330 HD13 LEU 42 3HD1 LEU 42 -7.926 -5.959 6.242
331 HD21 LEU 42 3HD2 LEU 42 -11.156 -5.955 8.131
332 HD22 LEU 42 1HD2 LEU 42 -11.167 -7.430 7.164
333 HD23 LEU 42 2HD2 LEU 42 -12.152 -6.051 6.680
334 H SER 43 HN SER 43 -11.717 -2.180 7.704
335 HA SER 43 HA SER 43 -12.111 0.283 6.430
336 HB2 SER 43 2HB SER 43 -11.169 -0.202 9.257
337 HB3 SER 43 1HB SER 43 -12.103 1.145 8.641
338 HG SER 43 HG SER 43 -12.940 -1.530 8.984
339 H VAL 44 HN VAL 44 -10.678 1.818 5.784
340 HA VAL 44 HA VAL 44 -7.968 1.108 5.398
341 HB VAL 44 HB VAL 44 -9.213 2.640 3.912
342 HG11 VAL 44 1HG1 VAL 44 -8.914 4.639 6.152
343 HG12 VAL 44 2HG1 VAL 44 -10.422 3.936 5.566
344 HG13 VAL 44 3HG1 VAL 44 -9.482 5.002 4.521
345 HG21 VAL 44 3HG2 VAL 44 -7.379 4.177 3.469
346 HG22 VAL 44 1HG2 VAL 44 -6.774 2.565 3.850
347 HG23 VAL 44 2HG2 VAL 44 -6.697 3.845 5.061
348 H GLN 45 HN GLN 45 -9.596 2.758 7.961
349 HA GLN 45 HA GLN 45 -7.268 3.964 9.095
350 HB2 GLN 45 2HB GLN 45 -8.792 4.404 10.992
351 HB3 GLN 45 1HB GLN 45 -9.432 4.959 9.460
352 HG2 GLN 45 2HG GLN 45 -10.751 2.830 9.359
353 HG3 GLN 45 1HG GLN 45 -10.234 2.516 11.014
354 HE21 GLN 45 1HE2 GLN 45 -10.322 5.391 11.691
355 HE22 GLN 45 2HE2 GLN 45 -12.005 5.757 11.867
356 H ASP 46 HN ASP 46 -8.656 0.842 9.111
357 HA ASP 46 HA ASP 46 -7.519 0.073 11.676
358 HB2 ASP 46 2HB ASP 46 -9.319 -1.285 9.688
359 HB3 ASP 46 1HB ASP 46 -8.538 -2.197 10.972
360 H VAL 47 HN VAL 47 -6.465 0.302 8.538
361 HA VAL 47 HA VAL 47 -4.943 -2.055 8.246
362 HB VAL 47 HB VAL 47 -4.356 0.688 7.112
363 HG11 VAL 47 1HG1 VAL 47 -2.416 -0.788 7.032
364 HG12 VAL 47 2HG1 VAL 47 -3.066 -0.503 5.418
365 HG13 VAL 47 3HG1 VAL 47 -3.386 -2.031 6.239
366 HG21 VAL 47 3HG2 VAL 47 -5.877 -1.628 5.920
367 HG22 VAL 47 1HG2 VAL 47 -5.482 -0.118 5.097
368 HG23 VAL 47 2HG2 VAL 47 -6.573 -0.108 6.483
369 H ASP 48 HN ASP 48 -3.436 -2.722 9.602
370 HA ASP 48 HA ASP 48 -1.632 -0.736 10.815
371 HB2 ASP 48 2HB ASP 48 -3.217 -1.452 12.510
372 HB3 ASP 48 1HB ASP 48 -2.898 -3.142 12.156
373 H THR 49 HN THR 49 0.343 -1.837 11.734
374 HA THR 49 HA THR 49 1.814 -3.025 9.695
375 HB THR 49 HB THR 49 2.652 -3.664 12.464
376 HG1 THR 49 1HG THR 49 2.102 -1.727 13.148
377 HG21 THR 49 3HG2 THR 49 3.987 -2.229 10.161
378 HG22 THR 49 1HG2 THR 49 4.154 -3.943 10.542
379 HG23 THR 49 2HG2 THR 49 4.772 -2.726 11.659
380 H LYS 50 HN LYS 50 -0.072 -4.462 12.294
381 HA LYS 50 HA LYS 50 0.827 -7.101 12.146
382 HB2 LYS 50 2HB LYS 50 -1.300 -5.644 13.363
383 HB3 LYS 50 1HB LYS 50 -1.981 -7.076 12.610
384 HG2 LYS 50 2HG LYS 50 0.302 -7.065 14.568
385 HG3 LYS 50 1HG LYS 50 -1.377 -7.441 14.954
386 HD2 LYS 50 2HD LYS 50 -1.280 -9.306 13.321
387 HD3 LYS 50 1HD LYS 50 0.438 -8.964 13.091
388 HE2 LYS 50 2HE LYS 50 0.832 -9.382 15.468
389 HE3 LYS 50 1HE LYS 50 -0.882 -9.726 15.692
390 HZ1 LYS 50 3HZ LYS 50 0.277 -11.774 15.486
391 HZ2 LYS 50 1HZ LYS 50 1.050 -11.273 14.059
392 HZ3 LYS 50 2HZ LYS 50 -0.622 -11.554 14.065
393 H LEU 51 HN LEU 51 -1.768 -5.477 10.373
394 HA LEU 51 HA LEU 51 -2.511 -7.748 8.832
395 HB2 LEU 51 2HB LEU 51 -2.983 -4.799 8.401
396 HB3 LEU 51 1HB LEU 51 -3.759 -6.072 7.491
397 HG LEU 51 HG LEU 51 -4.082 -5.555 10.437
398 HD11 LEU 51 1HD1 LEU 51 -6.017 -5.202 8.152
399 HD12 LEU 51 2HD1 LEU 51 -5.197 -3.900 9.015
400 HD13 LEU 51 3HD1 LEU 51 -6.359 -4.921 9.860
401 HD21 LEU 51 3HD2 LEU 51 -5.421 -7.600 8.672
402 HD22 LEU 51 1HD2 LEU 51 -5.792 -7.295 10.368
403 HD23 LEU 51 2HD2 LEU 51 -4.215 -7.941 9.912
404 H ILE 52 HN ILE 52 -0.386 -5.000 8.378
405 HA ILE 52 HA ILE 52 0.178 -5.361 5.653
406 HB ILE 52 HB ILE 52 1.745 -4.032 7.856
407 HG12 ILE 52 2HG1 ILE 52 0.062 -2.907 5.612
408 HG13 ILE 52 1HG1 ILE 52 -0.466 -3.083 7.282
409 HG21 ILE 52 1HG2 ILE 52 3.312 -4.655 6.119
410 HG22 ILE 52 2HG2 ILE 52 3.035 -2.913 6.088
411 HG23 ILE 52 3HG2 ILE 52 2.264 -3.950 4.888
412 HD11 ILE 52 3HD1 ILE 52 1.234 -1.509 8.000
413 HD12 ILE 52 1HD1 ILE 52 0.190 -0.798 6.769
414 HD13 ILE 52 2HD1 ILE 52 1.807 -1.356 6.339
415 H MET 53 HN MET 53 1.799 -6.584 8.562
416 HA MET 53 HA MET 53 3.961 -7.840 7.262
417 HB2 MET 53 2HB MET 53 2.602 -8.422 9.896
418 HB3 MET 53 1HB MET 53 4.039 -9.275 9.354
419 HG2 MET 53 2HG MET 53 5.281 -7.189 9.310
420 HG3 MET 53 1HG MET 53 3.837 -6.308 9.808
421 HE1 MET 53 3HE MET 53 6.124 -6.162 12.988
422 HE2 MET 53 1HE MET 53 5.177 -5.216 11.839
423 HE3 MET 53 2HE MET 53 6.619 -6.076 11.298
424 H LYS 54 HN LYS 54 0.745 -9.022 8.154
425 HA LYS 54 HA LYS 54 1.158 -11.705 7.492
426 HB2 LYS 54 2HB LYS 54 -1.225 -9.972 7.870
427 HB3 LYS 54 1HB LYS 54 -1.461 -11.518 7.065
428 HG2 LYS 54 2HG LYS 54 0.144 -11.658 9.514
429 HG3 LYS 54 1HG LYS 54 -1.524 -11.140 9.752
430 HD2 LYS 54 2HD LYS 54 -1.257 -13.583 9.946
431 HD3 LYS 54 1HD LYS 54 -2.346 -13.123 8.639
432 HE2 LYS 54 2HE LYS 54 -0.979 -14.863 7.794
433 HE3 LYS 54 1HE LYS 54 -0.387 -13.369 7.072
434 HZ1 LYS 54 3HZ LYS 54 0.817 -14.781 9.391
435 HZ2 LYS 54 1HZ LYS 54 1.395 -13.330 8.728
436 HZ3 LYS 54 2HZ LYS 54 1.433 -14.758 7.815
437 H VAL 55 HN VAL 55 0.130 -8.990 5.485
438 HA VAL 55 HA VAL 55 -0.474 -10.531 3.183
439 HB VAL 55 HB VAL 55 0.421 -7.641 3.303
440 HG11 VAL 55 1HG1 VAL 55 -0.746 -7.434 1.149
441 HG12 VAL 55 2HG1 VAL 55 -1.062 -9.170 1.163
442 HG13 VAL 55 3HG1 VAL 55 0.595 -8.575 1.064
443 HG21 VAL 55 3HG2 VAL 55 -1.963 -7.091 3.269
444 HG22 VAL 55 1HG2 VAL 55 -1.550 -8.037 4.698
445 HG23 VAL 55 2HG2 VAL 55 -2.366 -8.807 3.336
446 H LEU 56 HN LEU 56 2.461 -8.908 4.293
447 HA LEU 56 HA LEU 56 3.894 -9.435 1.853
448 HB2 LEU 56 2HB LEU 56 4.735 -8.298 4.507
449 HB3 LEU 56 1HB LEU 56 5.825 -8.482 3.148
450 HG LEU 56 HG LEU 56 3.363 -6.736 3.241
451 HD11 LEU 56 1HD1 LEU 56 4.972 -4.904 3.074
452 HD12 LEU 56 2HD1 LEU 56 6.299 -6.062 3.140
453 HD13 LEU 56 3HD1 LEU 56 5.234 -5.863 4.531
454 HD21 LEU 56 3HD2 LEU 56 3.702 -7.686 1.013
455 HD22 LEU 56 1HD2 LEU 56 5.374 -7.126 1.025
456 HD23 LEU 56 2HD2 LEU 56 4.052 -5.956 1.035
457 H ASP 57 HN ASP 57 3.440 -11.052 4.835
458 HA ASP 57 HA ASP 57 5.751 -12.261 5.503
459 HB2 ASP 57 2HB ASP 57 3.396 -12.489 6.507
460 HB3 ASP 57 1HB ASP 57 3.210 -13.854 5.433
461 HA PRO 58 HA PRO 58 5.364 -15.943 2.478
462 HB2 PRO 58 2HB PRO 58 3.462 -16.023 0.584
463 HB3 PRO 58 1HB PRO 58 3.138 -16.535 2.246
464 HG2 PRO 58 2HG PRO 58 2.512 -13.920 0.920
465 HG3 PRO 58 1HG PRO 58 1.474 -14.920 1.954
466 HD2 PRO 58 2HD PRO 58 2.822 -12.750 2.879
467 HD3 PRO 58 1HD PRO 58 2.459 -14.162 3.887
468 H ILE 59 HN ILE 59 5.108 -12.691 1.451
469 HA ILE 59 HA ILE 59 5.859 -13.210 -1.304
470 HB ILE 59 HB ILE 59 5.603 -10.545 0.098
471 HG12 ILE 59 2HG1 ILE 59 3.570 -12.059 -1.564
472 HG13 ILE 59 1HG1 ILE 59 3.493 -11.819 0.178
473 HG21 ILE 59 1HG2 ILE 59 5.601 -11.254 -2.836
474 HG22 ILE 59 2HG2 ILE 59 6.922 -10.480 -1.962
475 HG23 ILE 59 3HG2 ILE 59 5.384 -9.640 -2.159
476 HD11 ILE 59 3HD1 ILE 59 2.004 -10.297 -0.955
477 HD12 ILE 59 1HD1 ILE 59 3.338 -9.675 -1.925
478 HD13 ILE 59 2HD1 ILE 59 3.313 -9.400 -0.182
479 H TRP 60 HN TRP 60 7.355 -11.997 1.655
480 HA TRP 60 HA TRP 60 9.738 -10.991 0.598
481 HB2 TRP 60 2HB TRP 60 9.247 -12.349 3.257
482 HB3 TRP 60 1HB TRP 60 10.739 -11.518 2.838
483 HD1 TRP 60 1HD TRP 60 7.639 -10.929 4.618
484 HE1 TRP 60 1HE TRP 60 7.190 -8.420 4.928
485 HE3 TRP 60 3HE TRP 60 10.985 -9.070 1.226
486 HZ2 TRP 60 2HZ TRP 60 8.115 -5.975 3.871
487 HZ3 TRP 60 3HZ TRP 60 11.136 -6.635 0.939
488 HH2 TRP 60 2HH TRP 60 9.731 -5.121 2.234
489 H GLU 61 HN GLU 61 8.725 -14.276 1.164
490 HA GLU 61 HA GLU 61 11.188 -15.575 1.069
491 HB2 GLU 61 2HB GLU 61 8.559 -16.226 1.441
492 HB3 GLU 61 1HB GLU 61 8.889 -16.948 -0.126
493 HG2 GLU 61 2HG GLU 61 10.705 -17.410 2.193
494 HG3 GLU 61 1HG GLU 61 9.218 -18.323 1.988
495 H GLN 62 HN GLN 62 8.759 -15.185 -1.517
496 HA GLN 62 HA GLN 62 10.546 -16.283 -3.444
497 HB2 GLN 62 2HB GLN 62 8.039 -16.629 -3.336
498 HB3 GLN 62 1HB GLN 62 7.879 -14.991 -3.954
499 HG2 GLN 62 2HG GLN 62 9.178 -15.607 -5.901
500 HG3 GLN 62 1HG GLN 62 9.305 -17.253 -5.293
501 HE21 GLN 62 1HE2 GLN 62 8.173 -16.333 -7.775
502 HE22 GLN 62 2HE2 GLN 62 6.515 -16.836 -7.785
503 H LYS 63 HN LYS 63 8.937 -13.113 -3.042
504 HA LYS 63 HA LYS 63 11.073 -11.936 -4.678
505 HB2 LYS 63 2HB LYS 63 8.131 -11.379 -5.116
506 HB3 LYS 63 1HB LYS 63 9.464 -10.630 -5.980
507 HG2 LYS 63 2HG LYS 63 10.090 -12.844 -6.875
508 HG3 LYS 63 1HG LYS 63 8.694 -13.540 -6.059
509 HD2 LYS 63 2HD LYS 63 8.181 -13.147 -8.397
510 HD3 LYS 63 1HD LYS 63 7.212 -12.083 -7.375
511 HE2 LYS 63 2HE LYS 63 8.631 -10.216 -7.869
512 HE3 LYS 63 1HE LYS 63 9.788 -11.250 -8.707
513 HZ1 LYS 63 3HZ LYS 63 8.357 -11.529 -10.499
514 HZ2 LYS 63 1HZ LYS 63 8.161 -9.893 -10.103
515 HZ3 LYS 63 2HZ LYS 63 6.987 -11.027 -9.642
516 HA PRO 64 HA PRO 64 10.340 -9.676 -0.713
517 HB2 PRO 64 2HB PRO 64 12.965 -8.924 -0.448
518 HB3 PRO 64 1HB PRO 64 12.299 -10.437 0.172
519 HG2 PRO 64 2HG PRO 64 13.834 -9.929 -2.342
520 HG3 PRO 64 1HG PRO 64 13.965 -11.280 -1.202
521 HD2 PRO 64 2HD PRO 64 12.651 -11.515 -3.540
522 HD3 PRO 64 1HD PRO 64 12.115 -12.363 -2.073
523 H GLU 65 HN GLU 65 12.500 -8.571 -3.333
524 HA GLU 65 HA GLU 65 12.299 -5.851 -2.719
525 HB2 GLU 65 2HB GLU 65 13.100 -7.329 -5.209
526 HB3 GLU 65 1HB GLU 65 13.220 -5.593 -5.040
527 HG2 GLU 65 2HG GLU 65 14.714 -5.880 -3.122
528 HG3 GLU 65 1HG GLU 65 14.613 -7.627 -3.330
529 H THR 66 HN THR 66 10.359 -7.971 -4.717
530 HA THR 66 HA THR 66 8.881 -5.913 -6.014
531 HB THR 66 HB THR 66 7.923 -8.723 -5.471
532 HG1 THR 66 1HG THR 66 10.049 -7.820 -6.995
533 HG21 THR 66 3HG2 THR 66 7.419 -6.817 -7.764
534 HG22 THR 66 1HG2 THR 66 6.289 -7.167 -6.458
535 HG23 THR 66 2HG2 THR 66 6.744 -8.438 -7.593
536 H ALA 67 HN ALA 67 8.554 -7.676 -2.997
537 HA ALA 67 HA ALA 67 5.976 -6.807 -2.266
538 HB1 ALA 67 1HB ALA 67 7.138 -8.624 -1.098
539 HB2 ALA 67 2HB ALA 67 6.627 -7.365 0.025
540 HB3 ALA 67 3HB ALA 67 8.316 -7.471 -0.472
541 H SER 68 HN SER 68 9.178 -5.390 -1.816
542 HA SER 68 HA SER 68 8.393 -3.151 -0.307
543 HB2 SER 68 2HB SER 68 10.679 -3.302 -2.283
544 HB3 SER 68 1HB SER 68 10.541 -2.215 -0.903
545 HG SER 68 HG SER 68 10.516 -4.156 0.419
546 H ARG 69 HN ARG 69 8.572 -3.721 -3.789
547 HA ARG 69 HA ARG 69 8.040 -1.134 -4.692
548 HB2 ARG 69 2HB ARG 69 7.363 -3.818 -5.898
549 HB3 ARG 69 1HB ARG 69 7.221 -2.300 -6.745
550 HG2 ARG 69 2HG ARG 69 9.631 -1.942 -6.527
551 HG3 ARG 69 1HG ARG 69 9.760 -3.485 -5.680
552 HD2 ARG 69 2HD ARG 69 8.818 -4.605 -7.679
553 HD3 ARG 69 1HD ARG 69 8.829 -3.054 -8.514
554 HE ARG 69 HE ARG 69 11.414 -3.609 -7.519
555 HH11 ARG 69 1HH1 ARG 69 9.169 -4.644 -10.008
556 HH12 ARG 69 2HH1 ARG 69 10.416 -5.195 -11.085
557 HH21 ARG 69 1HH2 ARG 69 13.060 -4.398 -8.926
558 HH22 ARG 69 2HH2 ARG 69 12.609 -5.101 -10.456
559 H LEU 70 HN LEU 70 5.896 -3.762 -3.737
560 HA LEU 70 HA LEU 70 3.485 -2.445 -4.504
561 HB2 LEU 70 2HB LEU 70 3.600 -4.866 -4.345
562 HB3 LEU 70 1HB LEU 70 4.002 -4.765 -2.642
563 HG LEU 70 HG LEU 70 1.755 -3.784 -2.210
564 HD11 LEU 70 1HD1 LEU 70 1.315 -2.840 -4.400
565 HD12 LEU 70 2HD1 LEU 70 0.040 -3.972 -3.950
566 HD13 LEU 70 3HD1 LEU 70 1.278 -4.452 -5.110
567 HD21 LEU 70 3HD2 LEU 70 0.528 -5.867 -2.448
568 HD22 LEU 70 1HD2 LEU 70 2.181 -6.177 -1.917
569 HD23 LEU 70 2HD2 LEU 70 1.727 -6.460 -3.597
570 H ARG 71 HN ARG 71 5.378 -2.654 -1.555
571 HA ARG 71 HA ARG 71 3.357 -1.692 0.179
572 HB2 ARG 71 2HB ARG 71 5.512 -2.950 0.794
573 HB3 ARG 71 1HB ARG 71 6.301 -1.380 0.700
574 HG2 ARG 71 2HG ARG 71 5.804 -1.600 2.951
575 HG3 ARG 71 1HG ARG 71 4.484 -0.600 2.346
576 HD2 ARG 71 2HD ARG 71 4.426 -3.554 2.948
577 HD3 ARG 71 1HD ARG 71 3.560 -2.274 3.793
578 HE ARG 71 HE ARG 71 2.634 -2.094 1.248
579 HH11 ARG 71 1HH1 ARG 71 2.821 -4.693 3.582
580 HH12 ARG 71 2HH1 ARG 71 1.484 -5.567 2.915
581 HH21 ARG 71 1HH2 ARG 71 0.873 -3.251 0.351
582 HH22 ARG 71 2HH2 ARG 71 0.365 -4.739 1.077
583 H GLY 72 HN GLY 72 5.928 -0.100 -1.643
584 HA2 GLY 72 2HA GLY 72 5.777 2.437 -0.450
585 HA3 GLY 72 1HA GLY 72 6.344 2.117 -2.082
586 H ARG 73 HN ARG 73 3.843 0.995 -3.009
587 HA ARG 73 HA ARG 73 2.536 3.369 -3.824
588 HB2 ARG 73 2HB ARG 73 1.562 0.509 -3.966
589 HB3 ARG 73 1HB ARG 73 0.861 1.865 -4.835
590 HG2 ARG 73 2HG ARG 73 2.997 2.156 -6.039
591 HG3 ARG 73 1HG ARG 73 3.627 0.732 -5.206
592 HD2 ARG 73 2HD ARG 73 1.782 -0.597 -6.169
593 HD3 ARG 73 1HD ARG 73 1.254 0.827 -7.061
594 HE ARG 73 HE ARG 73 3.969 0.306 -7.621
595 HH11 ARG 73 1HH1 ARG 73 0.768 -0.928 -8.294
596 HH12 ARG 73 2HH1 ARG 73 1.226 -1.688 -9.783
597 HH21 ARG 73 1HH2 ARG 73 4.589 -0.669 -9.594
598 HH22 ARG 73 2HH2 ARG 73 3.402 -1.544 -10.528
599 H ILE 74 HN ILE 74 1.605 0.793 -1.569
600 HA ILE 74 HA ILE 74 -0.853 1.957 -0.797
601 HB ILE 74 HB ILE 74 0.879 -0.092 0.583
602 HG12 ILE 74 2HG1 ILE 74 -1.620 -0.230 -1.112
603 HG13 ILE 74 1HG1 ILE 74 -0.026 -0.849 -1.520
604 HG21 ILE 74 1HG2 ILE 74 -1.057 -0.590 2.000
605 HG22 ILE 74 2HG2 ILE 74 -1.921 0.774 1.293
606 HG23 ILE 74 3HG2 ILE 74 -0.474 1.054 2.259
607 HD11 ILE 74 3HD1 ILE 74 -1.775 -1.883 0.693
608 HD12 ILE 74 1HD1 ILE 74 -0.208 -2.530 0.209
609 HD13 ILE 74 2HD1 ILE 74 -1.582 -2.623 -0.896
610 H GLU 75 HN GLU 75 2.423 2.229 0.487
611 HA GLU 75 HA GLU 75 1.987 3.620 2.842
612 HB2 GLU 75 2HB GLU 75 4.207 2.902 2.068
613 HB3 GLU 75 1HB GLU 75 4.152 4.095 0.781
614 HG2 GLU 75 2HG GLU 75 3.955 5.842 2.606
615 HG3 GLU 75 1HG GLU 75 4.389 4.556 3.734
616 H SER 76 HN SER 76 2.268 4.887 -0.445
617 HA SER 76 HA SER 76 1.910 7.599 0.198
618 HB2 SER 76 2HB SER 76 1.280 6.191 -2.391
619 HB3 SER 76 1HB SER 76 1.555 7.919 -2.190
620 HG SER 76 HG SER 76 3.393 5.782 -2.038
621 H VAL 77 HN VAL 77 -0.380 5.035 -0.607
622 HA VAL 77 HA VAL 77 -2.681 6.670 -0.827
623 HB VAL 77 HB VAL 77 -2.523 3.767 0.002
624 HG11 VAL 77 1HG1 VAL 77 -4.837 3.635 -0.790
625 HG12 VAL 77 2HG1 VAL 77 -4.828 5.372 -1.097
626 HG13 VAL 77 3HG1 VAL 77 -4.671 4.766 0.553
627 HG21 VAL 77 3HG2 VAL 77 -3.011 3.294 -2.367
628 HG22 VAL 77 1HG2 VAL 77 -1.458 4.099 -2.143
629 HG23 VAL 77 2HG2 VAL 77 -2.850 5.014 -2.721
630 H LEU 78 HN LEU 78 -1.361 4.774 1.875
631 HA LEU 78 HA LEU 78 -3.361 5.417 3.748
632 HB2 LEU 78 2HB LEU 78 -0.472 4.655 4.185
633 HB3 LEU 78 1HB LEU 78 -1.678 4.738 5.455
634 HG LEU 78 HG LEU 78 -1.711 2.845 3.104
635 HD11 LEU 78 1HD1 LEU 78 -0.019 2.286 4.762
636 HD12 LEU 78 2HD1 LEU 78 -1.346 1.125 4.802
637 HD13 LEU 78 3HD1 LEU 78 -1.231 2.373 6.041
638 HD21 LEU 78 3HD2 LEU 78 -3.970 3.485 3.760
639 HD22 LEU 78 1HD2 LEU 78 -3.605 3.088 5.441
640 HD23 LEU 78 2HD2 LEU 78 -3.629 1.816 4.218
641 H ASP 79 HN ASP 79 -0.368 7.022 2.863
642 HA ASP 79 HA ASP 79 -0.331 8.887 4.997
643 HB2 ASP 79 2HB ASP 79 1.665 8.390 3.682
644 HB3 ASP 79 1HB ASP 79 0.900 9.041 2.237
645 H TRP 80 HN TRP 80 -1.456 9.103 1.644
646 HA TRP 80 HA TRP 80 -2.425 11.726 1.695
647 HB2 TRP 80 2HB TRP 80 -2.195 10.586 -0.394
648 HB3 TRP 80 1HB TRP 80 -3.264 9.290 0.121
649 HD1 TRP 80 1HD TRP 80 -3.399 12.998 -0.948
650 HE1 TRP 80 1HE TRP 80 -5.756 13.480 -1.873
651 HE3 TRP 80 3HE TRP 80 -5.609 8.517 0.118
652 HZ2 TRP 80 2HZ TRP 80 -8.226 12.120 -2.119
653 HZ3 TRP 80 3HZ TRP 80 -7.966 8.184 -0.496
654 HH2 TRP 80 2HH TRP 80 -9.248 9.952 -1.592
655 H ALA 81 HN ALA 81 -4.033 8.671 2.467
656 HA ALA 81 HA ALA 81 -6.596 9.698 2.960
657 HB1 ALA 81 1HB ALA 81 -7.005 7.611 4.161
658 HB2 ALA 81 2HB ALA 81 -5.273 7.275 4.179
659 HB3 ALA 81 3HB ALA 81 -6.148 7.318 2.648
660 H THR 82 HN THR 82 -3.764 9.457 5.027
661 HA THR 82 HA THR 82 -5.036 10.042 7.475
662 HB THR 82 HB THR 82 -2.182 10.712 6.713
663 HG1 THR 82 1HG THR 82 -2.350 8.550 6.379
664 HG21 THR 82 3HG2 THR 82 -1.737 10.491 9.099
665 HG22 THR 82 1HG2 THR 82 -3.437 10.140 9.401
666 HG23 THR 82 2HG2 THR 82 -2.957 11.732 8.814
667 H VAL 83 HN VAL 83 -3.517 12.088 5.014
668 HA VAL 83 HA VAL 83 -3.855 14.544 6.397
669 HB VAL 83 HB VAL 83 -3.623 14.088 3.415
670 HG11 VAL 83 1HG1 VAL 83 -4.408 16.328 3.956
671 HG12 VAL 83 2HG1 VAL 83 -2.751 16.385 3.355
672 HG13 VAL 83 3HG1 VAL 83 -3.067 16.544 5.082
673 HG21 VAL 83 3HG2 VAL 83 -1.221 14.500 3.729
674 HG22 VAL 83 1HG2 VAL 83 -1.764 13.050 4.574
675 HG23 VAL 83 2HG2 VAL 83 -1.468 14.537 5.476
676 H ARG 84 HN ARG 84 -5.788 12.774 4.039
677 HA ARG 84 HA ARG 84 -7.730 14.823 3.670
678 HB2 ARG 84 2HB ARG 84 -7.765 11.878 3.033
679 HB3 ARG 84 1HB ARG 84 -9.068 12.977 2.604
680 HG2 ARG 84 2HG ARG 84 -6.212 13.199 1.682
681 HG3 ARG 84 1HG ARG 84 -7.561 12.576 0.728
682 HD2 ARG 84 2HD ARG 84 -7.204 15.378 1.781
683 HD3 ARG 84 1HD ARG 84 -7.156 14.861 0.097
684 HE ARG 84 HE ARG 84 -9.563 14.930 1.798
685 HH11 ARG 84 1HH1 ARG 84 -8.048 14.937 -1.363
686 HH12 ARG 84 2HH1 ARG 84 -9.546 15.181 -2.217
687 HH21 ARG 84 1HH2 ARG 84 -11.521 15.243 0.697
688 HH22 ARG 84 2HH2 ARG 84 -11.530 15.347 -1.045
689 H GLY 85 HN GLY 85 -7.366 12.267 6.000
690 HA2 GLY 85 2HA GLY 85 -8.463 12.432 8.113
691 HA3 GLY 85 1HA GLY 85 -9.792 13.268 7.324
692 H TYR 86 HN TYR 86 -8.905 10.697 5.416
693 HA TYR 86 HA TYR 86 -11.280 9.242 6.030
694 HB2 TYR 86 2HB TYR 86 -8.951 8.584 4.220
695 HB3 TYR 86 1HB TYR 86 -10.398 7.590 4.354
696 HD1 TYR 86 2HD TYR 86 -12.647 9.151 4.160
697 HD2 TYR 86 1HD TYR 86 -8.877 9.927 2.357
698 HE1 TYR 86 2HE TYR 86 -13.755 10.527 2.448
699 HE2 TYR 86 1HE TYR 86 -9.971 11.305 0.643
700 HH TYR 86 HH TYR 86 -13.209 12.342 0.906
701 H ARG 87 HN ARG 87 -7.968 9.049 6.977
702 HA ARG 87 HA ARG 87 -8.692 7.080 8.985
703 HB2 ARG 87 2HB ARG 87 -6.771 5.652 8.552
704 HB3 ARG 87 1HB ARG 87 -7.781 5.727 7.115
705 HG2 ARG 87 2HG ARG 87 -6.253 7.234 6.047
706 HG3 ARG 87 1HG ARG 87 -5.303 7.388 7.525
707 HD2 ARG 87 2HD ARG 87 -5.680 4.849 5.942
708 HD3 ARG 87 1HD ARG 87 -4.252 5.883 5.894
709 HE ARG 87 HE ARG 87 -5.088 4.144 8.091
710 HH11 ARG 87 1HH1 ARG 87 -2.790 6.441 6.784
711 HH12 ARG 87 2HH1 ARG 87 -1.572 6.092 7.966
712 HH21 ARG 87 1HH2 ARG 87 -3.468 3.675 9.660
713 HH22 ARG 87 2HH2 ARG 87 -1.954 4.533 9.592
714 H GLU 88 HN GLU 88 -7.329 7.189 10.822
715 HA GLU 88 HA GLU 88 -5.294 9.302 10.741
716 HB2 GLU 88 2HB GLU 88 -7.382 8.904 12.887
717 HB3 GLU 88 1HB GLU 88 -6.000 9.982 13.034
718 HG2 GLU 88 2HG GLU 88 -6.806 11.244 11.081
719 HG3 GLU 88 1HG GLU 88 -8.219 10.193 11.010
720 H GLY 89 HN GLY 89 -3.755 9.173 12.550
721 HA2 GLY 89 2HA GLY 89 -2.940 7.545 14.315
722 HA3 GLY 89 1HA GLY 89 -3.140 6.337 13.050
723 H ASP 90 HN ASP 90 -1.283 5.782 12.166
724 HA ASP 90 HA ASP 90 0.554 7.911 11.320
725 HB2 ASP 90 2HB ASP 90 1.268 6.663 13.517
726 HB3 ASP 90 1HB ASP 90 1.671 5.342 12.427
727 H ASN 91 HN ASN 91 2.458 6.232 10.132
728 HA ASN 91 HA ASN 91 0.811 4.785 8.163
729 HB2 ASN 91 2HB ASN 91 2.798 6.834 7.779
730 HB3 ASN 91 1HB ASN 91 3.315 5.343 6.996
731 HD21 ASN 91 1HD2 ASN 91 3.022 6.097 4.935
732 HD22 ASN 91 2HD2 ASN 91 1.467 6.416 4.256
733 HA PRO 92 HA PRO 92 3.323 1.619 10.326
734 HB2 PRO 92 2HB PRO 92 1.591 -0.422 9.843
735 HB3 PRO 92 1HB PRO 92 1.405 0.711 11.185
736 HG2 PRO 92 2HG PRO 92 0.053 0.701 8.513
737 HG3 PRO 92 1HG PRO 92 -0.642 0.997 10.118
738 HD2 PRO 92 2HD PRO 92 -0.034 3.003 8.423
739 HD3 PRO 92 1HD PRO 92 0.117 3.177 10.183
740 H ALA 93 HN ALA 93 2.458 2.066 7.092
741 HA ALA 93 HA ALA 93 3.858 -0.321 6.158
742 HB1 ALA 93 1HB ALA 93 3.138 0.375 3.923
743 HB2 ALA 93 2HB ALA 93 2.448 1.849 4.605
744 HB3 ALA 93 3HB ALA 93 1.774 0.276 5.037
745 H ARG 94 HN ARG 94 4.769 2.532 7.305
746 HA ARG 94 HA ARG 94 6.620 3.353 5.219
747 HB2 ARG 94 2HB ARG 94 5.249 4.911 6.717
748 HB3 ARG 94 1HB ARG 94 6.363 4.482 8.006
749 HG2 ARG 94 2HG ARG 94 8.217 5.407 6.721
750 HG3 ARG 94 1HG ARG 94 7.104 5.817 5.408
751 HD2 ARG 94 2HD ARG 94 5.810 7.187 7.055
752 HD3 ARG 94 1HD ARG 94 7.099 6.899 8.221
753 HE ARG 94 HE ARG 94 8.449 7.943 6.150
754 HH11 ARG 94 1HH1 ARG 94 5.558 8.953 7.845
755 HH12 ARG 94 2HH1 ARG 94 5.785 10.641 7.504
756 HH21 ARG 94 1HH2 ARG 94 8.766 10.169 5.696
757 HH22 ARG 94 2HH2 ARG 94 7.631 11.338 6.299
758 H TRP 95 HN TRP 95 6.720 2.157 8.553
759 HA TRP 95 HA TRP 95 8.261 1.057 9.767
760 HB2 TRP 95 2HB TRP 95 8.960 0.273 7.004
761 HB3 TRP 95 1HB TRP 95 10.203 0.006 8.221
762 HD1 TRP 95 1HD TRP 95 9.081 -1.321 10.550
763 HE1 TRP 95 1HE TRP 95 7.667 -3.472 10.501
764 HE3 TRP 95 3HE TRP 95 7.473 -1.111 5.704
765 HZ2 TRP 95 2HZ TRP 95 6.073 -4.888 8.649
766 HZ3 TRP 95 3HZ TRP 95 6.006 -2.904 4.869
767 HH2 TRP 95 2HH TRP 95 5.322 -4.754 6.315
768 H ARG 96 HN ARG 96 10.767 0.785 10.024
769 HA ARG 96 HA ARG 96 12.057 3.393 9.613
770 HB2 ARG 96 2HB ARG 96 13.233 2.626 11.873
771 HB3 ARG 96 1HB ARG 96 11.726 3.529 11.875
772 HG2 ARG 96 2HG ARG 96 10.485 1.426 12.109
773 HG3 ARG 96 1HG ARG 96 12.010 0.539 12.152
774 HD2 ARG 96 2HD ARG 96 11.527 2.774 14.076
775 HD3 ARG 96 1HD ARG 96 10.797 1.195 14.369
776 HE ARG 96 HE ARG 96 13.210 0.364 14.133
777 HH11 ARG 96 1HH1 ARG 96 12.403 3.538 15.369
778 HH12 ARG 96 2HH1 ARG 96 13.710 3.563 16.519
779 HH21 ARG 96 1HH2 ARG 96 14.925 0.381 15.627
780 HH22 ARG 96 2HH2 ARG 96 15.150 1.762 16.666
781 H GLY 97 HN GLY 97 12.174 0.939 8.057
782 HA2 GLY 97 2HA GLY 97 14.415 0.491 6.972
783 HA3 GLY 97 1HA GLY 97 14.931 0.028 8.589
784 H TYR 98 HN TYR 98 13.020 -1.473 9.570
785 HA TYR 98 HA TYR 98 12.111 -3.530 9.663
786 HB2 TYR 98 2HB TYR 98 10.627 -2.722 7.886
787 HB3 TYR 98 1HB TYR 98 11.799 -3.216 6.672
788 HD1 TYR 98 1HD TYR 98 9.981 -4.732 9.575
789 HD2 TYR 98 2HD TYR 98 11.373 -5.202 5.585
790 HE1 TYR 98 1HE TYR 98 8.928 -6.948 9.474
791 HE2 TYR 98 2HE TYR 98 10.325 -7.425 5.476
792 HH TYR 98 HH TYR 98 9.562 -9.182 6.976
793 H LEU 99 HN LEU 99 13.602 -3.914 6.466
794 HA LEU 99 HA LEU 99 15.036 -6.238 7.427
795 HB2 LEU 99 2HB LEU 99 14.863 -4.941 4.710
796 HB3 LEU 99 1HB LEU 99 15.840 -6.357 5.047
797 HG LEU 99 HG LEU 99 12.838 -6.194 5.306
798 HD11 LEU 99 1HD1 LEU 99 12.798 -7.663 3.369
799 HD12 LEU 99 2HD1 LEU 99 14.558 -7.608 3.274
800 HD13 LEU 99 3HD1 LEU 99 13.615 -6.146 2.985
801 HD21 LEU 99 3HD2 LEU 99 13.804 -7.739 6.926
802 HD22 LEU 99 1HD2 LEU 99 14.713 -8.534 5.641
803 HD23 LEU 99 2HD2 LEU 99 12.952 -8.615 5.654
804 H GLU 100 HN GLU 100 15.893 -3.199 5.789
805 HA GLU 100 HA GLU 100 17.808 -1.989 5.683
806 HB2 GLU 100 2HB GLU 100 17.200 -1.706 8.100
807 HB3 GLU 100 1HB GLU 100 18.280 -3.036 8.483
808 HG2 GLU 100 2HG GLU 100 20.187 -1.805 7.795
809 HG3 GLU 100 1HG GLU 100 19.191 -0.538 7.084
810 H HIS 101 HN HIS 101 17.922 -4.516 4.535
811 HA HIS 101 HA HIS 101 20.298 -5.906 5.345
812 HB2 HIS 101 2HB HIS 101 18.430 -6.159 3.002
813 HB3 HIS 101 1HB HIS 101 19.952 -7.041 3.035
814 HD1 HIS 101 1HD HIS 101 18.714 -9.304 3.120
815 HD2 HIS 101 2HD HIS 101 17.903 -6.787 6.339
816 HE1 HIS 101 1HE HIS 101 17.519 -10.729 4.822
817 HE2 HIS 101 2HE HIS 101 17.146 -9.220 6.806
818 H HIS 102 HN HIS 102 22.017 -4.570 5.281
819 HA HIS 102 HA HIS 102 22.764 -3.477 2.659
820 HB2 HIS 102 2HB HIS 102 23.755 -2.857 5.449
821 HB3 HIS 102 1HB HIS 102 24.571 -2.284 3.997
822 HD1 HIS 102 1HD HIS 102 22.326 -1.102 6.416
823 HD2 HIS 102 2HD HIS 102 22.452 -0.880 2.267
824 HE1 HIS 102 1HE HIS 102 20.847 0.831 5.796
825 HE2 HIS 102 2HE HIS 102 21.036 1.029 3.288
826 H HIS 103 HN HIS 103 23.849 -4.890 1.497
827 HA HIS 103 HA HIS 103 26.075 -6.314 2.757
828 HB2 HIS 103 2HB HIS 103 23.908 -7.722 2.594
829 HB3 HIS 103 1HB HIS 103 24.233 -7.756 0.865
830 HD1 HIS 103 1HD HIS 103 25.264 -9.224 4.082
831 HD2 HIS 103 2HD HIS 103 26.600 -9.187 0.142
832 HE1 HIS 103 1HE HIS 103 26.942 -11.097 3.914
833 HE2 HIS 103 2HE HIS 103 27.585 -11.171 1.479
834 H HIS 104 HN HIS 104 27.849 -6.269 1.540
835 HA HIS 104 HA HIS 104 27.564 -5.292 -1.224
836 HB2 HIS 104 2HB HIS 104 29.806 -4.951 0.775
837 HB3 HIS 104 1HB HIS 104 29.972 -4.547 -0.928
838 HD1 HIS 104 1HD HIS 104 29.960 -2.077 -1.060
839 HD2 HIS 104 2HD HIS 104 27.090 -3.504 1.594
840 HE1 HIS 104 1HE HIS 104 28.686 -0.051 -0.280
841 HE2 HIS 104 2HE HIS 104 26.843 -0.959 1.177
842 H HIS 105 HN HIS 105 28.083 -6.627 -2.796
843 HA HIS 105 HA HIS 105 28.968 -9.274 -2.314
844 HB2 HIS 105 2HB HIS 105 28.656 -7.665 -4.845
845 HB3 HIS 105 1HB HIS 105 29.215 -9.333 -4.855
846 HD1 HIS 105 1HD HIS 105 26.232 -7.429 -5.225
847 HD2 HIS 105 2HD HIS 105 27.192 -11.068 -3.456
848 HE1 HIS 105 1HE HIS 105 24.065 -8.693 -5.050
849 HE2 HIS 105 2HE HIS 105 24.651 -10.851 -3.879
850 H HIS 106 HN HIS 106 30.874 -10.310 -2.960
851 HA HIS 106 HA HIS 106 33.106 -8.679 -3.866
852 HB2 HIS 106 2HB HIS 106 32.871 -9.673 -1.168
853 HB3 HIS 106 1HB HIS 106 34.255 -10.409 -1.974
854 HD1 HIS 106 1HD HIS 106 33.947 -7.955 0.283
855 HD2 HIS 106 2HD HIS 106 35.354 -7.830 -3.629
856 HE1 HIS 106 1HE HIS 106 35.430 -5.930 0.156
857 HE2 HIS 106 2HE HIS 106 36.092 -5.756 -2.268
Start of MODEL 7
1 H1 MET 1 H1 MET 1 -15.982 3.270 5.539
2 H2 MET 1 H2 MET 1 -14.730 2.433 6.317
3 H3 MET 1 H3 MET 1 -15.875 1.582 5.402
4 HA MET 1 HA MET 1 -15.112 2.577 3.381
5 HB2 MET 1 2HB MET 1 -14.429 4.743 4.341
6 HB3 MET 1 1HB MET 1 -13.078 3.957 5.147
7 HG2 MET 1 2HG MET 1 -12.207 5.004 3.220
8 HG3 MET 1 1HG MET 1 -12.246 3.278 2.884
9 HE1 MET 1 2HE MET 1 -15.298 6.298 1.201
10 HE2 MET 1 3HE MET 1 -13.949 6.749 2.245
11 HE3 MET 1 1HE MET 1 -15.281 5.791 2.891
12 H THR 2 HN THR 2 -14.078 0.999 2.332
13 HA THR 2 HA THR 2 -12.381 -0.793 3.875
14 HB THR 2 HB THR 2 -12.413 -2.239 1.873
15 HG1 THR 2 1HG THR 2 -14.330 -0.570 0.662
16 HG21 THR 2 3HG2 THR 2 -14.801 -2.787 1.892
17 HG22 THR 2 1HG2 THR 2 -15.152 -1.240 2.663
18 HG23 THR 2 2HG2 THR 2 -14.211 -2.459 3.523
19 H PHE 3 HN PHE 3 -10.311 -1.537 2.932
20 HA PHE 3 HA PHE 3 -8.650 0.676 2.350
21 HB2 PHE 3 2HB PHE 3 -7.798 -1.332 3.484
22 HB3 PHE 3 1HB PHE 3 -8.061 -2.277 2.021
23 HD1 PHE 3 2HD PHE 3 -6.200 0.663 3.320
24 HD2 PHE 3 1HD PHE 3 -6.379 -2.455 0.430
25 HE1 PHE 3 2HE PHE 3 -3.945 1.261 2.540
26 HE2 PHE 3 1HE PHE 3 -4.127 -1.859 -0.360
27 HZ PHE 3 HZ PHE 3 -2.904 0.003 0.698
28 H SER 4 HN SER 4 -10.140 -1.817 0.357
29 HA SER 4 HA SER 4 -8.863 -1.225 -2.071
30 HB2 SER 4 2HB SER 4 -11.678 -2.253 -1.628
31 HB3 SER 4 1HB SER 4 -10.772 -2.357 -3.135
32 HG SER 4 HG SER 4 -9.156 -3.451 -1.562
33 H GLU 5 HN GLU 5 -11.871 0.036 -0.665
34 HA GLU 5 HA GLU 5 -12.568 1.762 -2.767
35 HB2 GLU 5 2HB GLU 5 -13.188 1.679 0.165
36 HB3 GLU 5 1HB GLU 5 -13.762 3.004 -0.830
37 HG2 GLU 5 2HG GLU 5 -15.036 1.522 -2.188
38 HG3 GLU 5 1HG GLU 5 -14.328 0.113 -1.399
39 H CYS 6 HN CYS 6 -10.752 2.342 0.206
40 HA CYS 6 HA CYS 6 -10.418 5.113 -0.175
41 HB2 CYS 6 2HB CYS 6 -10.111 3.696 1.942
42 HB3 CYS 6 1HB CYS 6 -8.496 3.371 1.341
43 HG CYS 6 HG CYS 6 -8.029 6.264 1.130
44 H ALA 7 HN ALA 7 -8.342 2.349 -0.928
45 HA ALA 7 HA ALA 7 -6.176 3.792 -1.987
46 HB1 ALA 7 1HB ALA 7 -6.068 1.397 -1.445
47 HB2 ALA 7 2HB ALA 7 -5.524 1.728 -3.089
48 HB3 ALA 7 3HB ALA 7 -7.127 1.049 -2.811
49 H ALA 8 HN ALA 8 -9.108 2.531 -3.529
50 HA ALA 8 HA ALA 8 -8.511 3.276 -6.164
51 HB1 ALA 8 1HB ALA 8 -11.216 3.090 -4.833
52 HB2 ALA 8 2HB ALA 8 -10.346 1.763 -5.607
53 HB3 ALA 8 3HB ALA 8 -10.920 3.124 -6.571
54 H LEU 9 HN LEU 9 -9.974 5.073 -3.506
55 HA LEU 9 HA LEU 9 -10.699 7.388 -4.908
56 HB2 LEU 9 2HB LEU 9 -9.764 7.099 -2.051
57 HB3 LEU 9 1HB LEU 9 -10.504 8.539 -2.712
58 HG LEU 9 HG LEU 9 -11.868 5.854 -2.542
59 HD11 LEU 9 1HD1 LEU 9 -12.113 8.289 -0.784
60 HD12 LEU 9 2HD1 LEU 9 -11.450 6.722 -0.323
61 HD13 LEU 9 3HD1 LEU 9 -13.163 6.875 -0.718
62 HD21 LEU 9 3HD2 LEU 9 -12.928 8.600 -3.202
63 HD22 LEU 9 1HD2 LEU 9 -13.890 7.131 -3.039
64 HD23 LEU 9 2HD2 LEU 9 -12.708 7.271 -4.341
65 H TYR 10 HN TYR 10 -7.690 6.605 -3.184
66 HA TYR 10 HA TYR 10 -6.318 8.984 -3.680
67 HB2 TYR 10 2HB TYR 10 -5.451 7.356 -2.095
68 HB3 TYR 10 1HB TYR 10 -5.251 6.167 -3.375
69 HD1 TYR 10 2HD TYR 10 -3.914 9.280 -1.938
70 HD2 TYR 10 1HD TYR 10 -3.371 6.254 -4.877
71 HE1 TYR 10 2HE TYR 10 -1.634 10.099 -2.361
72 HE2 TYR 10 1HE TYR 10 -1.093 7.062 -5.302
73 HH TYR 10 HH TYR 10 0.568 9.030 -3.286
74 H ILE 11 HN ILE 11 -6.358 5.964 -5.515
75 HA ILE 11 HA ILE 11 -4.517 6.812 -7.485
76 HB ILE 11 HB ILE 11 -6.602 4.632 -7.654
77 HG12 ILE 11 2HG1 ILE 11 -3.660 4.482 -6.937
78 HG13 ILE 11 1HG1 ILE 11 -4.982 4.409 -5.778
79 HG21 ILE 11 1HG2 ILE 11 -5.815 5.283 -9.865
80 HG22 ILE 11 2HG2 ILE 11 -5.186 3.694 -9.432
81 HG23 ILE 11 3HG2 ILE 11 -4.141 5.113 -9.338
82 HD11 ILE 11 3HD1 ILE 11 -4.111 2.198 -6.278
83 HD12 ILE 11 1HD1 ILE 11 -4.476 2.434 -7.987
84 HD13 ILE 11 2HD1 ILE 11 -5.787 2.356 -6.809
85 H LYS 12 HN LYS 12 -8.081 6.635 -7.519
86 HA LYS 12 HA LYS 12 -8.366 7.472 -10.195
87 HB2 LYS 12 2HB LYS 12 -10.153 6.320 -9.022
88 HB3 LYS 12 1HB LYS 12 -10.308 7.655 -7.887
89 HG2 LYS 12 2HG LYS 12 -11.170 9.090 -9.568
90 HG3 LYS 12 1HG LYS 12 -10.771 7.940 -10.844
91 HD2 LYS 12 2HD LYS 12 -13.170 7.938 -10.299
92 HD3 LYS 12 1HD LYS 12 -12.412 6.377 -9.991
93 HE2 LYS 12 2HE LYS 12 -12.287 6.889 -7.611
94 HE3 LYS 12 1HE LYS 12 -12.990 8.479 -7.908
95 HZ1 LYS 12 3HZ LYS 12 -14.576 6.750 -7.096
96 HZ2 LYS 12 1HZ LYS 12 -14.376 5.940 -8.573
97 HZ3 LYS 12 2HZ LYS 12 -15.035 7.504 -8.546
98 H ALA 13 HN ALA 13 -8.112 9.275 -7.189
99 HA ALA 13 HA ALA 13 -8.874 11.786 -8.299
100 HB1 ALA 13 1HB ALA 13 -9.016 11.325 -5.899
101 HB2 ALA 13 2HB ALA 13 -8.027 12.747 -6.229
102 HB3 ALA 13 3HB ALA 13 -7.256 11.215 -5.819
103 H HIS 14 HN HIS 14 -6.054 9.916 -8.590
104 HA HIS 14 HA HIS 14 -4.486 12.295 -9.364
105 HB2 HIS 14 2HB HIS 14 -3.622 9.685 -8.140
106 HB3 HIS 14 1HB HIS 14 -2.485 10.725 -8.987
107 HD1 HIS 14 1HD HIS 14 -4.358 10.375 -5.804
108 HD2 HIS 14 2HD HIS 14 -1.894 13.155 -7.671
109 HE1 HIS 14 1HE HIS 14 -3.689 12.008 -4.006
110 HE2 HIS 14 2HE HIS 14 -2.045 13.570 -5.123
111 H ARG 15 HN ARG 15 -6.200 9.843 -10.679
112 HA ARG 15 HA ARG 15 -4.295 8.687 -12.436
113 HB2 ARG 15 2HB ARG 15 -6.092 7.508 -13.440
114 HB3 ARG 15 1HB ARG 15 -6.449 7.593 -11.724
115 HG2 ARG 15 2HG ARG 15 -8.058 9.353 -12.115
116 HG3 ARG 15 1HG ARG 15 -7.642 9.383 -13.829
117 HD2 ARG 15 2HD ARG 15 -8.365 7.002 -13.979
118 HD3 ARG 15 1HD ARG 15 -8.922 7.115 -12.309
119 HE ARG 15 HE ARG 15 -10.134 9.206 -13.618
120 HH11 ARG 15 1HH1 ARG 15 -10.105 5.705 -13.968
121 HH12 ARG 15 2HH1 ARG 15 -11.685 5.655 -14.695
122 HH21 ARG 15 1HH2 ARG 15 -12.213 9.107 -14.554
123 HH22 ARG 15 2HH2 ARG 15 -12.874 7.568 -15.020
124 H SER 16 HN SER 16 -6.314 11.516 -12.610
125 HA SER 16 HA SER 16 -6.288 11.863 -15.406
126 HB2 SER 16 2HB SER 16 -6.613 13.880 -13.176
127 HB3 SER 16 1HB SER 16 -6.995 14.160 -14.869
128 HG SER 16 HG SER 16 -8.878 13.368 -14.419
129 H SER 17 HN SER 17 -3.958 12.481 -12.924
130 HA SER 17 HA SER 17 -2.379 14.304 -14.511
131 HB2 SER 17 2HB SER 17 -2.441 14.360 -12.002
132 HB3 SER 17 1HB SER 17 -1.597 12.815 -11.992
133 HG SER 17 HG SER 17 -0.169 14.327 -13.552
134 H TRP 18 HN TRP 18 -2.845 10.967 -14.374
135 HA TRP 18 HA TRP 18 -0.224 10.428 -15.601
136 HB2 TRP 18 2HB TRP 18 -2.069 8.454 -14.235
137 HB3 TRP 18 1HB TRP 18 -0.459 8.125 -14.857
138 HD1 TRP 18 1HD TRP 18 1.045 10.627 -13.512
139 HE1 TRP 18 1HE TRP 18 1.458 10.592 -10.958
140 HE3 TRP 18 3HE TRP 18 -2.542 7.247 -12.158
141 HZ2 TRP 18 2HZ TRP 18 0.403 9.293 -8.694
142 HZ3 TRP 18 3HZ TRP 18 -2.774 6.657 -9.780
143 HH2 TRP 18 2HH TRP 18 -1.329 7.660 -8.083
144 H LYS 19 HN LYS 19 -2.146 11.486 -17.267
145 HA LYS 19 HA LYS 19 -3.140 11.159 -19.196
146 HB2 LYS 19 2HB LYS 19 -1.883 8.474 -18.999
147 HB3 LYS 19 1HB LYS 19 -2.953 8.900 -20.332
148 HG2 LYS 19 2HG LYS 19 -1.506 10.928 -20.696
149 HG3 LYS 19 1HG LYS 19 -0.365 10.213 -19.557
150 HD2 LYS 19 2HD LYS 19 -0.186 8.240 -20.976
151 HD3 LYS 19 1HD LYS 19 -1.335 8.949 -22.113
152 HE2 LYS 19 2HE LYS 19 1.354 10.097 -21.370
153 HE3 LYS 19 1HE LYS 19 0.983 9.232 -22.861
154 HZ1 LYS 19 3HZ LYS 19 -0.605 10.966 -23.428
155 HZ2 LYS 19 1HZ LYS 19 0.943 11.617 -23.197
156 HZ3 LYS 19 2HZ LYS 19 -0.243 11.801 -21.997
157 H ASN 20 HN ASN 20 -5.966 9.503 -19.509
158 HA ASN 20 HA ASN 20 -5.397 7.140 -18.290
159 HB2 ASN 20 2HB ASN 20 -7.165 7.750 -19.994
160 HB3 ASN 20 1HB ASN 20 -5.967 7.331 -21.211
161 HD21 ASN 20 1HD2 ASN 20 -8.521 6.117 -20.647
162 HD22 ASN 20 2HD2 ASN 20 -8.212 4.447 -20.282
163 H THR 21 HN THR 21 -3.241 6.884 -17.847
164 HA THR 21 HA THR 21 -1.945 5.332 -20.012
165 HB THR 21 HB THR 21 -0.082 4.947 -18.372
166 HG1 THR 21 1HG THR 21 -1.343 7.031 -16.889
167 HG21 THR 21 3HG2 THR 21 0.181 6.623 -20.096
168 HG22 THR 21 1HG2 THR 21 0.961 7.147 -18.603
169 HG23 THR 21 2HG2 THR 21 -0.597 7.828 -19.071
170 H LYS 22 HN LYS 22 -0.873 3.233 -18.891
171 HA LYS 22 HA LYS 22 -3.006 1.885 -17.439
172 HB2 LYS 22 2HB LYS 22 -0.487 0.951 -18.774
173 HB3 LYS 22 1HB LYS 22 -1.328 -0.081 -17.625
174 HG2 LYS 22 2HG LYS 22 -3.378 0.172 -19.015
175 HG3 LYS 22 1HG LYS 22 -2.395 1.016 -20.211
176 HD2 LYS 22 2HD LYS 22 -2.660 -1.347 -20.781
177 HD3 LYS 22 1HD LYS 22 -0.973 -0.951 -20.453
178 HE2 LYS 22 2HE LYS 22 -1.482 -3.051 -19.411
179 HE3 LYS 22 1HE LYS 22 -1.266 -1.841 -18.151
180 HZ1 LYS 22 3HZ LYS 22 -3.194 -3.368 -17.840
181 HZ2 LYS 22 1HZ LYS 22 -3.926 -2.655 -19.191
182 HZ3 LYS 22 2HZ LYS 22 -3.603 -1.727 -17.810
183 H HIS 23 HN HIS 23 -0.725 3.937 -16.502
184 HA HIS 23 HA HIS 23 0.642 2.535 -14.438
185 HB2 HIS 23 2HB HIS 23 0.113 5.468 -14.924
186 HB3 HIS 23 1HB HIS 23 0.926 4.914 -13.466
187 HD1 HIS 23 1HD HIS 23 3.368 4.965 -13.639
188 HD2 HIS 23 2HD HIS 23 1.580 4.381 -17.347
189 HE1 HIS 23 1HE HIS 23 5.253 4.914 -15.301
190 HE2 HIS 23 2HE HIS 23 4.122 4.796 -17.555
191 H ALA 24 HN ALA 24 -2.170 4.730 -14.330
192 HA ALA 24 HA ALA 24 -2.787 4.322 -11.621
193 HB1 ALA 24 1HB ALA 24 -3.751 6.149 -12.918
194 HB2 ALA 24 2HB ALA 24 -5.022 5.166 -12.192
195 HB3 ALA 24 3HB ALA 24 -4.642 4.994 -13.907
196 H ASP 25 HN ASP 25 -3.627 2.579 -14.523
197 HA ASP 25 HA ASP 25 -5.499 0.783 -13.433
198 HB2 ASP 25 2HB ASP 25 -5.189 1.173 -15.854
199 HB3 ASP 25 1HB ASP 25 -3.607 0.403 -15.767
200 H GLN 26 HN GLN 26 -2.009 0.436 -14.053
201 HA GLN 26 HA GLN 26 -1.705 -2.110 -12.937
202 HB2 GLN 26 2HB GLN 26 0.177 0.167 -13.467
203 HB3 GLN 26 1HB GLN 26 0.740 -1.329 -12.754
204 HG2 GLN 26 2HG GLN 26 -0.655 -1.063 -15.401
205 HG3 GLN 26 1HG GLN 26 1.075 -1.280 -15.167
206 HE21 GLN 26 1HE2 GLN 26 1.860 -3.291 -14.587
207 HE22 GLN 26 2HE2 GLN 26 0.891 -4.720 -14.646
208 H TRP 27 HN TRP 27 -1.402 1.109 -11.475
209 HA TRP 27 HA TRP 27 -0.600 0.392 -8.910
210 HB2 TRP 27 2HB TRP 27 -2.183 2.621 -10.076
211 HB3 TRP 27 1HB TRP 27 -2.329 2.379 -8.342
212 HD1 TRP 27 1HD TRP 27 0.631 2.697 -10.866
213 HE1 TRP 27 1HE TRP 27 2.437 4.158 -9.755
214 HE3 TRP 27 3HE TRP 27 -1.634 3.506 -6.354
215 HZ2 TRP 27 2HZ TRP 27 2.846 5.478 -7.291
216 HZ3 TRP 27 3HZ TRP 27 -0.469 4.876 -4.675
217 HH2 TRP 27 2HH TRP 27 1.727 5.842 -5.132
218 H THR 28 HN THR 28 -3.851 0.540 -10.293
219 HA THR 28 HA THR 28 -5.201 -0.288 -7.946
220 HB THR 28 HB THR 28 -6.171 -0.586 -10.792
221 HG1 THR 28 1HG THR 28 -5.421 1.601 -10.143
222 HG21 THR 28 3HG2 THR 28 -7.661 -0.232 -8.190
223 HG22 THR 28 1HG2 THR 28 -7.534 -1.730 -9.112
224 HG23 THR 28 2HG2 THR 28 -8.388 -0.346 -9.793
225 H ASN 29 HN ASN 29 -4.260 -2.045 -10.908
226 HA ASN 29 HA ASN 29 -5.367 -4.506 -10.315
227 HB2 ASN 29 2HB ASN 29 -2.883 -3.794 -11.873
228 HB3 ASN 29 1HB ASN 29 -3.575 -5.401 -11.831
229 HD21 ASN 29 1HD2 ASN 29 -3.173 -3.624 -14.084
230 HD22 ASN 29 2HD2 ASN 29 -4.729 -3.350 -14.788
231 H THR 30 HN THR 30 -2.133 -3.267 -9.506
232 HA THR 30 HA THR 30 -1.143 -5.685 -8.454
233 HB THR 30 HB THR 30 -0.269 -2.891 -7.707
234 HG1 THR 30 1HG THR 30 -0.099 -3.050 -9.920
235 HG21 THR 30 3HG2 THR 30 1.893 -3.934 -7.261
236 HG22 THR 30 1HG2 THR 30 1.233 -5.511 -7.685
237 HG23 THR 30 2HG2 THR 30 0.635 -4.659 -6.259
238 H ILE 31 HN ILE 31 -2.476 -2.821 -6.776
239 HA ILE 31 HA ILE 31 -2.235 -3.920 -4.183
240 HB ILE 31 HB ILE 31 -4.123 -1.761 -5.149
241 HG12 ILE 31 2HG1 ILE 31 -1.398 -1.549 -3.841
242 HG13 ILE 31 1HG1 ILE 31 -1.734 -1.259 -5.545
243 HG21 ILE 31 1HG2 ILE 31 -4.816 -2.749 -3.008
244 HG22 ILE 31 2HG2 ILE 31 -4.278 -1.081 -2.817
245 HG23 ILE 31 3HG2 ILE 31 -3.219 -2.408 -2.341
246 HD11 ILE 31 3HD1 ILE 31 -1.522 0.822 -4.308
247 HD12 ILE 31 1HD1 ILE 31 -2.838 0.331 -3.240
248 HD13 ILE 31 2HD1 ILE 31 -3.153 0.630 -4.949
249 H LYS 32 HN LYS 32 -4.871 -3.827 -6.507
250 HA LYS 32 HA LYS 32 -6.910 -4.952 -4.963
251 HB2 LYS 32 2HB LYS 32 -7.199 -3.880 -7.181
252 HB3 LYS 32 1HB LYS 32 -6.411 -5.255 -7.932
253 HG2 LYS 32 2HG LYS 32 -8.221 -6.709 -7.177
254 HG3 LYS 32 1HG LYS 32 -9.020 -5.325 -6.428
255 HD2 LYS 32 2HD LYS 32 -10.002 -5.816 -8.605
256 HD3 LYS 32 1HD LYS 32 -9.198 -4.246 -8.621
257 HE2 LYS 32 2HE LYS 32 -7.265 -5.223 -9.725
258 HE3 LYS 32 1HE LYS 32 -8.013 -6.819 -9.661
259 HZ1 LYS 32 3HZ LYS 32 -9.026 -4.465 -11.175
260 HZ2 LYS 32 1HZ LYS 32 -9.801 -5.972 -11.077
261 HZ3 LYS 32 2HZ LYS 32 -8.290 -5.844 -11.836
262 H THR 33 HN THR 33 -4.270 -6.427 -6.732
263 HA THR 33 HA THR 33 -5.360 -9.086 -6.534
264 HB THR 33 HB THR 33 -2.611 -8.160 -7.404
265 HG1 THR 33 1HG THR 33 -4.139 -7.422 -8.844
266 HG21 THR 33 3HG2 THR 33 -2.608 -10.513 -6.695
267 HG22 THR 33 1HG2 THR 33 -2.407 -10.369 -8.442
268 HG23 THR 33 2HG2 THR 33 -3.968 -10.838 -7.769
269 H TYR 34 HN TYR 34 -2.562 -7.416 -5.069
270 HA TYR 34 HA TYR 34 -1.893 -9.744 -3.525
271 HB2 TYR 34 2HB TYR 34 -0.750 -6.964 -3.643
272 HB3 TYR 34 1HB TYR 34 -0.160 -8.176 -2.511
273 HD1 TYR 34 2HD TYR 34 0.947 -10.223 -3.366
274 HD2 TYR 34 1HD TYR 34 -0.180 -7.052 -5.963
275 HE1 TYR 34 2HE TYR 34 2.432 -11.127 -5.102
276 HE2 TYR 34 1HE TYR 34 1.303 -7.948 -7.707
277 HH TYR 34 HH TYR 34 2.719 -11.060 -7.494
278 H CYS 35 HN CYS 35 -3.312 -6.576 -2.768
279 HA CYS 35 HA CYS 35 -3.320 -7.311 0.061
280 HB2 CYS 35 2HB CYS 35 -4.004 -4.673 -1.248
281 HB3 CYS 35 1HB CYS 35 -3.834 -4.962 0.482
282 HG CYS 35 HG CYS 35 -1.124 -5.911 -1.172
283 H GLY 36 HN GLY 36 -5.381 -7.338 -2.585
284 HA2 GLY 36 2HA GLY 36 -7.866 -6.583 -1.637
285 HA3 GLY 36 1HA GLY 36 -7.601 -7.826 -2.846
286 HA PRO 37 HA PRO 37 -8.921 -11.139 -0.331
287 HB2 PRO 37 2HB PRO 37 -6.702 -12.707 0.218
288 HB3 PRO 37 1HB PRO 37 -7.659 -12.774 -1.265
289 HG2 PRO 37 2HG PRO 37 -5.084 -11.357 -0.728
290 HG3 PRO 37 1HG PRO 37 -5.601 -12.245 -2.174
291 HD2 PRO 37 2HD PRO 37 -5.629 -9.569 -2.112
292 HD3 PRO 37 1HD PRO 37 -6.906 -10.484 -2.942
293 H VAL 38 HN VAL 38 -6.172 -9.420 0.995
294 HA VAL 38 HA VAL 38 -6.653 -10.577 3.637
295 HB VAL 38 HB VAL 38 -4.453 -8.673 2.834
296 HG11 VAL 38 1HG1 VAL 38 -4.895 -8.700 5.227
297 HG12 VAL 38 2HG1 VAL 38 -3.359 -9.492 4.880
298 HG13 VAL 38 3HG1 VAL 38 -4.788 -10.461 5.244
299 HG21 VAL 38 3HG2 VAL 38 -4.436 -11.688 2.983
300 HG22 VAL 38 1HG2 VAL 38 -3.008 -10.674 2.778
301 HG23 VAL 38 2HG2 VAL 38 -4.253 -10.704 1.530
302 H ILE 39 HN ILE 39 -5.874 -7.253 2.552
303 HA ILE 39 HA ILE 39 -7.489 -6.310 4.819
304 HB ILE 39 HB ILE 39 -6.177 -4.204 4.641
305 HG12 ILE 39 2HG1 ILE 39 -4.524 -5.806 2.673
306 HG13 ILE 39 1HG1 ILE 39 -5.513 -4.404 2.284
307 HG21 ILE 39 1HG2 ILE 39 -4.116 -5.142 5.620
308 HG22 ILE 39 2HG2 ILE 39 -4.619 -6.746 5.082
309 HG23 ILE 39 3HG2 ILE 39 -5.580 -5.874 6.277
310 HD11 ILE 39 3HD1 ILE 39 -3.133 -4.378 4.124
311 HD12 ILE 39 1HD1 ILE 39 -4.085 -2.984 3.614
312 HD13 ILE 39 2HD1 ILE 39 -3.123 -3.875 2.433
313 H GLY 40 HN GLY 40 -7.954 -6.808 1.705
314 HA2 GLY 40 2HA GLY 40 -8.674 -4.401 0.519
315 HA3 GLY 40 1HA GLY 40 -9.356 -5.965 0.110
316 HA PRO 41 HA PRO 41 -13.190 -4.762 1.874
317 HB2 PRO 41 2HB PRO 41 -14.116 -6.881 3.236
318 HB3 PRO 41 1HB PRO 41 -13.884 -6.929 1.483
319 HG2 PRO 41 2HG PRO 41 -12.120 -7.994 3.655
320 HG3 PRO 41 1HG PRO 41 -12.584 -8.753 2.121
321 HD2 PRO 41 2HD PRO 41 -10.198 -7.471 2.522
322 HD3 PRO 41 1HD PRO 41 -10.983 -7.612 0.937
323 H LEU 42 HN LEU 42 -10.630 -5.108 3.956
324 HA LEU 42 HA LEU 42 -12.088 -4.645 6.415
325 HB2 LEU 42 2HB LEU 42 -9.119 -4.539 5.853
326 HB3 LEU 42 1HB LEU 42 -9.858 -4.455 7.440
327 HG LEU 42 HG LEU 42 -9.890 -6.831 5.578
328 HD11 LEU 42 1HD1 LEU 42 -8.554 -6.377 8.242
329 HD12 LEU 42 2HD1 LEU 42 -7.747 -6.464 6.675
330 HD13 LEU 42 3HD1 LEU 42 -8.555 -7.888 7.333
331 HD21 LEU 42 3HD2 LEU 42 -11.081 -6.524 8.333
332 HD22 LEU 42 1HD2 LEU 42 -11.023 -8.011 7.384
333 HD23 LEU 42 2HD2 LEU 42 -11.991 -6.645 6.826
334 H SER 43 HN SER 43 -11.695 -2.700 7.724
335 HA SER 43 HA SER 43 -12.033 -0.332 6.229
336 HB2 SER 43 2HB SER 43 -12.957 -0.546 8.480
337 HB3 SER 43 1HB SER 43 -11.336 -0.680 9.155
338 HG SER 43 HG SER 43 -12.714 1.555 8.234
339 H VAL 44 HN VAL 44 -10.641 1.291 5.696
340 HA VAL 44 HA VAL 44 -7.885 0.725 5.467
341 HB VAL 44 HB VAL 44 -9.058 2.249 3.945
342 HG11 VAL 44 1HG1 VAL 44 -10.570 3.359 5.427
343 HG12 VAL 44 2HG1 VAL 44 -9.539 4.577 4.674
344 HG13 VAL 44 3HG1 VAL 44 -9.236 4.070 6.335
345 HG21 VAL 44 3HG2 VAL 44 -6.646 2.415 4.083
346 HG22 VAL 44 1HG2 VAL 44 -6.777 3.548 5.429
347 HG23 VAL 44 2HG2 VAL 44 -7.346 4.015 3.827
348 H GLN 45 HN GLN 45 -9.790 2.005 8.021
349 HA GLN 45 HA GLN 45 -7.547 3.146 9.464
350 HB2 GLN 45 2HB GLN 45 -9.791 4.104 9.732
351 HB3 GLN 45 1HB GLN 45 -10.376 2.568 10.360
352 HG2 GLN 45 2HG GLN 45 -8.899 2.762 12.273
353 HG3 GLN 45 1HG GLN 45 -8.248 4.271 11.636
354 HE21 GLN 45 1HE2 GLN 45 -8.870 5.422 13.433
355 HE22 GLN 45 2HE2 GLN 45 -10.520 5.844 13.730
356 H ASP 46 HN ASP 46 -9.238 0.137 9.196
357 HA ASP 46 HA ASP 46 -8.335 -0.934 11.704
358 HB2 ASP 46 2HB ASP 46 -10.468 -1.594 10.482
359 HB3 ASP 46 1HB ASP 46 -9.445 -2.496 9.369
360 H VAL 47 HN VAL 47 -7.108 -0.757 8.489
361 HA VAL 47 HA VAL 47 -5.391 -2.957 8.406
362 HB VAL 47 HB VAL 47 -4.919 -0.222 7.198
363 HG11 VAL 47 1HG1 VAL 47 -3.470 -1.405 5.610
364 HG12 VAL 47 2HG1 VAL 47 -3.722 -2.903 6.505
365 HG13 VAL 47 3HG1 VAL 47 -2.878 -1.554 7.265
366 HG21 VAL 47 3HG2 VAL 47 -7.051 -1.202 6.502
367 HG22 VAL 47 1HG2 VAL 47 -6.216 -2.679 6.020
368 HG23 VAL 47 2HG2 VAL 47 -5.897 -1.167 5.169
369 H ASP 48 HN ASP 48 -4.091 -3.459 10.028
370 HA ASP 48 HA ASP 48 -2.538 -1.348 11.348
371 HB2 ASP 48 2HB ASP 48 -3.991 -2.610 12.829
372 HB3 ASP 48 1HB ASP 48 -3.290 -4.125 12.287
373 H THR 49 HN THR 49 -0.402 -2.085 12.173
374 HA THR 49 HA THR 49 1.293 -2.727 10.045
375 HB THR 49 HB THR 49 1.928 -2.993 12.990
376 HG1 THR 49 1HG THR 49 2.504 -0.698 11.476
377 HG21 THR 49 3HG2 THR 49 3.683 -2.440 10.592
378 HG22 THR 49 1HG2 THR 49 3.648 -3.936 11.526
379 HG23 THR 49 2HG2 THR 49 4.221 -2.442 12.271
380 H LYS 50 HN LYS 50 -0.100 -4.741 12.582
381 HA LYS 50 HA LYS 50 1.425 -7.065 12.161
382 HB2 LYS 50 2HB LYS 50 -0.148 -6.544 14.090
383 HB3 LYS 50 1HB LYS 50 -1.466 -6.984 13.019
384 HG2 LYS 50 2HG LYS 50 -0.466 -9.223 12.764
385 HG3 LYS 50 1HG LYS 50 0.769 -8.773 13.939
386 HD2 LYS 50 2HD LYS 50 -1.063 -8.302 15.569
387 HD3 LYS 50 1HD LYS 50 -2.205 -8.960 14.399
388 HE2 LYS 50 2HE LYS 50 -0.882 -11.081 14.422
389 HE3 LYS 50 1HE LYS 50 0.067 -10.406 15.747
390 HZ1 LYS 50 3HZ LYS 50 -2.819 -11.079 15.726
391 HZ2 LYS 50 1HZ LYS 50 -2.119 -10.118 16.934
392 HZ3 LYS 50 2HZ LYS 50 -1.609 -11.714 16.725
393 H LEU 51 HN LEU 51 -1.625 -5.958 10.764
394 HA LEU 51 HA LEU 51 -2.068 -8.219 9.120
395 HB2 LEU 51 2HB LEU 51 -3.041 -5.376 8.835
396 HB3 LEU 51 1HB LEU 51 -3.668 -6.750 7.952
397 HG LEU 51 HG LEU 51 -3.839 -6.349 10.932
398 HD11 LEU 51 1HD1 LEU 51 -5.300 -4.840 9.715
399 HD12 LEU 51 2HD1 LEU 51 -6.243 -6.090 10.524
400 HD13 LEU 51 3HD1 LEU 51 -5.951 -6.193 8.788
401 HD21 LEU 51 3HD2 LEU 51 -5.278 -8.328 10.918
402 HD22 LEU 51 1HD2 LEU 51 -3.653 -8.711 10.349
403 HD23 LEU 51 2HD2 LEU 51 -4.974 -8.537 9.192
404 H ILE 52 HN ILE 52 -0.461 -5.125 8.656
405 HA ILE 52 HA ILE 52 0.107 -5.270 5.933
406 HB ILE 52 HB ILE 52 1.578 -3.985 8.223
407 HG12 ILE 52 2HG1 ILE 52 -0.098 -2.859 5.973
408 HG13 ILE 52 1HG1 ILE 52 -0.632 -3.088 7.636
409 HG21 ILE 52 1HG2 ILE 52 2.217 -3.741 5.290
410 HG22 ILE 52 2HG2 ILE 52 3.247 -4.445 6.539
411 HG23 ILE 52 3HG2 ILE 52 2.877 -2.720 6.567
412 HD11 ILE 52 3HD1 ILE 52 1.552 -1.230 6.715
413 HD12 ILE 52 1HD1 ILE 52 1.038 -1.468 8.385
414 HD13 ILE 52 2HD1 ILE 52 -0.077 -0.771 7.211
415 H MET 53 HN MET 53 1.852 -6.612 8.701
416 HA MET 53 HA MET 53 4.072 -7.623 7.296
417 HB2 MET 53 2HB MET 53 2.755 -8.610 9.830
418 HB3 MET 53 1HB MET 53 4.311 -9.175 9.238
419 HG2 MET 53 2HG MET 53 5.224 -6.925 9.469
420 HG3 MET 53 1HG MET 53 3.659 -6.344 10.038
421 HE1 MET 53 3HE MET 53 6.347 -5.852 11.631
422 HE2 MET 53 1HE MET 53 5.857 -6.233 13.282
423 HE3 MET 53 2HE MET 53 4.777 -5.319 12.230
424 H LYS 54 HN LYS 54 0.940 -9.045 8.102
425 HA LYS 54 HA LYS 54 1.414 -11.632 7.142
426 HB2 LYS 54 2HB LYS 54 -1.183 -10.088 7.279
427 HB3 LYS 54 1HB LYS 54 -1.058 -11.822 7.018
428 HG2 LYS 54 2HG LYS 54 -0.013 -12.078 9.216
429 HG3 LYS 54 1HG LYS 54 -0.134 -10.337 9.473
430 HD2 LYS 54 2HD LYS 54 -1.952 -11.462 10.613
431 HD3 LYS 54 1HD LYS 54 -2.586 -10.500 9.278
432 HE2 LYS 54 2HE LYS 54 -3.677 -12.676 9.383
433 HE3 LYS 54 1HE LYS 54 -2.745 -12.511 7.896
434 HZ1 LYS 54 3HZ LYS 54 -1.869 -13.969 10.337
435 HZ2 LYS 54 1HZ LYS 54 -0.978 -13.820 8.898
436 HZ3 LYS 54 2HZ LYS 54 -2.435 -14.684 8.907
437 H VAL 55 HN VAL 55 0.307 -8.718 5.506
438 HA VAL 55 HA VAL 55 -0.362 -9.948 3.044
439 HB VAL 55 HB VAL 55 0.486 -7.083 3.528
440 HG11 VAL 55 1HG1 VAL 55 0.577 -7.672 1.176
441 HG12 VAL 55 2HG1 VAL 55 -0.795 -6.606 1.480
442 HG13 VAL 55 3HG1 VAL 55 -1.055 -8.335 1.256
443 HG21 VAL 55 3HG2 VAL 55 -1.404 -7.681 4.931
444 HG22 VAL 55 1HG2 VAL 55 -2.263 -8.323 3.532
445 HG23 VAL 55 2HG2 VAL 55 -1.915 -6.597 3.638
446 H LEU 56 HN LEU 56 2.622 -8.518 4.286
447 HA LEU 56 HA LEU 56 3.945 -8.562 1.745
448 HB2 LEU 56 2HB LEU 56 4.862 -8.028 4.552
449 HB3 LEU 56 1HB LEU 56 6.005 -8.137 3.229
450 HG LEU 56 HG LEU 56 3.750 -6.143 3.459
451 HD11 LEU 56 1HD1 LEU 56 5.566 -5.685 5.003
452 HD12 LEU 56 2HD1 LEU 56 5.563 -4.508 3.690
453 HD13 LEU 56 3HD1 LEU 56 6.738 -5.823 3.691
454 HD21 LEU 56 3HD2 LEU 56 5.885 -6.451 1.346
455 HD22 LEU 56 1HD2 LEU 56 4.737 -5.117 1.463
456 HD23 LEU 56 2HD2 LEU 56 4.160 -6.749 1.133
457 H ASP 57 HN ASP 57 3.521 -10.835 4.287
458 HA ASP 57 HA ASP 57 5.857 -12.265 4.322
459 HB2 ASP 57 2HB ASP 57 3.697 -12.577 5.696
460 HB3 ASP 57 1HB ASP 57 3.212 -13.679 4.421
461 HA PRO 58 HA PRO 58 4.556 -15.059 0.644
462 HB2 PRO 58 2HB PRO 58 2.390 -14.440 -0.836
463 HB3 PRO 58 1HB PRO 58 2.278 -15.405 0.641
464 HG2 PRO 58 2HG PRO 58 1.709 -12.492 0.237
465 HG3 PRO 58 1HG PRO 58 0.793 -13.695 1.165
466 HD2 PRO 58 2HD PRO 58 2.515 -11.918 2.303
467 HD3 PRO 58 1HD PRO 58 2.171 -13.516 2.988
468 H ILE 59 HN ILE 59 4.305 -11.606 0.449
469 HA ILE 59 HA ILE 59 4.713 -11.464 -2.398
470 HB ILE 59 HB ILE 59 4.920 -9.223 -0.381
471 HG12 ILE 59 2HG1 ILE 59 2.590 -10.128 -2.092
472 HG13 ILE 59 1HG1 ILE 59 2.707 -10.300 -0.344
473 HG21 ILE 59 1HG2 ILE 59 4.536 -9.182 -3.377
474 HG22 ILE 59 2HG2 ILE 59 6.009 -8.733 -2.519
475 HG23 ILE 59 3HG2 ILE 59 4.546 -7.768 -2.320
476 HD11 ILE 59 3HD1 ILE 59 2.610 -7.700 -1.853
477 HD12 ILE 59 1HD1 ILE 59 2.715 -7.874 -0.100
478 HD13 ILE 59 2HD1 ILE 59 1.280 -8.435 -0.960
479 H TRP 60 HN TRP 60 6.727 -11.030 0.488
480 HA TRP 60 HA TRP 60 9.049 -10.103 -0.797
481 HB2 TRP 60 2HB TRP 60 8.647 -11.668 1.745
482 HB3 TRP 60 1HB TRP 60 10.249 -11.197 1.195
483 HD1 TRP 60 1HD TRP 60 7.518 -10.022 3.323
484 HE1 TRP 60 1HE TRP 60 7.801 -7.533 3.906
485 HE3 TRP 60 3HE TRP 60 11.110 -8.784 -0.094
486 HZ2 TRP 60 2HZ TRP 60 9.336 -5.338 3.037
487 HZ3 TRP 60 3HZ TRP 60 11.935 -6.469 -0.148
488 HH2 TRP 60 2HH TRP 60 11.065 -4.780 1.387
489 H GLU 61 HN GLU 61 7.686 -13.277 -0.567
490 HA GLU 61 HA GLU 61 10.055 -14.693 -1.279
491 HB2 GLU 61 2HB GLU 61 7.142 -15.463 -1.186
492 HB3 GLU 61 1HB GLU 61 8.460 -16.577 -1.447
493 HG2 GLU 61 2HG GLU 61 8.163 -14.879 1.011
494 HG3 GLU 61 1HG GLU 61 7.588 -16.540 0.878
495 H GLN 62 HN GLN 62 7.409 -13.208 -2.961
496 HA GLN 62 HA GLN 62 8.115 -14.508 -5.470
497 HB2 GLN 62 2HB GLN 62 5.860 -12.684 -4.660
498 HB3 GLN 62 1HB GLN 62 6.139 -13.163 -6.326
499 HG2 GLN 62 2HG GLN 62 5.877 -15.515 -5.677
500 HG3 GLN 62 1HG GLN 62 5.553 -15.002 -4.022
501 HE21 GLN 62 1HE2 GLN 62 3.912 -16.463 -5.991
502 HE22 GLN 62 2HE2 GLN 62 2.434 -15.572 -6.106
503 H LYS 63 HN LYS 63 7.565 -11.160 -4.349
504 HA LYS 63 HA LYS 63 9.515 -10.253 -6.362
505 HB2 LYS 63 2HB LYS 63 6.825 -8.973 -5.829
506 HB3 LYS 63 1HB LYS 63 8.035 -8.400 -6.964
507 HG2 LYS 63 2HG LYS 63 6.721 -11.093 -7.197
508 HG3 LYS 63 1HG LYS 63 6.079 -9.633 -7.951
509 HD2 LYS 63 2HD LYS 63 8.166 -9.360 -9.195
510 HD3 LYS 63 1HD LYS 63 8.813 -10.815 -8.433
511 HE2 LYS 63 2HE LYS 63 7.094 -12.165 -9.464
512 HE3 LYS 63 1HE LYS 63 6.325 -10.729 -10.137
513 HZ1 LYS 63 3HZ LYS 63 7.695 -11.951 -11.753
514 HZ2 LYS 63 1HZ LYS 63 9.072 -11.638 -10.810
515 HZ3 LYS 63 2HZ LYS 63 8.225 -10.355 -11.525
516 HA PRO 64 HA PRO 64 10.541 -8.595 -2.161
517 HB2 PRO 64 2HB PRO 64 13.173 -8.102 -2.881
518 HB3 PRO 64 1HB PRO 64 12.585 -9.579 -2.113
519 HG2 PRO 64 2HG PRO 64 13.149 -9.029 -4.989
520 HG3 PRO 64 1HG PRO 64 13.439 -10.504 -4.050
521 HD2 PRO 64 2HD PRO 64 11.373 -10.304 -5.753
522 HD3 PRO 64 1HD PRO 64 11.235 -11.199 -4.226
523 H GLU 65 HN GLU 65 11.859 -7.207 -5.199
524 HA GLU 65 HA GLU 65 12.087 -4.584 -4.186
525 HB2 GLU 65 2HB GLU 65 13.247 -5.358 -6.235
526 HB3 GLU 65 1HB GLU 65 11.695 -5.424 -7.058
527 HG2 GLU 65 2HG GLU 65 11.440 -2.977 -6.571
528 HG3 GLU 65 1HG GLU 65 13.111 -2.991 -6.011
529 H THR 66 HN THR 66 9.500 -6.295 -5.818
530 HA THR 66 HA THR 66 7.856 -4.012 -6.225
531 HB THR 66 HB THR 66 6.948 -6.890 -6.134
532 HG1 THR 66 1HG THR 66 7.352 -6.505 -8.558
533 HG21 THR 66 3HG2 THR 66 5.912 -4.460 -7.610
534 HG22 THR 66 1HG2 THR 66 5.142 -5.247 -6.232
535 HG23 THR 66 2HG2 THR 66 5.277 -6.100 -7.772
536 H ALA 67 HN ALA 67 8.166 -6.414 -3.679
537 HA ALA 67 HA ALA 67 5.892 -5.779 -2.174
538 HB1 ALA 67 1HB ALA 67 8.595 -6.652 -1.142
539 HB2 ALA 67 2HB ALA 67 7.325 -7.728 -1.724
540 HB3 ALA 67 3HB ALA 67 7.060 -6.757 -0.277
541 H SER 68 HN SER 68 9.138 -4.400 -2.173
542 HA SER 68 HA SER 68 8.738 -2.531 -0.109
543 HB2 SER 68 2HB SER 68 10.970 -3.184 -0.959
544 HB3 SER 68 1HB SER 68 10.621 -2.369 -2.482
545 HG SER 68 HG SER 68 10.984 -1.234 0.085
546 H ARG 69 HN ARG 69 8.438 -2.249 -3.642
547 HA ARG 69 HA ARG 69 7.699 0.459 -3.681
548 HB2 ARG 69 2HB ARG 69 7.320 -1.806 -5.617
549 HB3 ARG 69 1HB ARG 69 6.697 -0.202 -5.947
550 HG2 ARG 69 2HG ARG 69 9.064 0.633 -5.556
551 HG3 ARG 69 1HG ARG 69 9.542 -1.062 -5.645
552 HD2 ARG 69 2HD ARG 69 8.720 -1.261 -7.872
553 HD3 ARG 69 1HD ARG 69 7.954 0.326 -7.790
554 HE ARG 69 HE ARG 69 10.735 -0.255 -8.301
555 HH11 ARG 69 1HH1 ARG 69 8.384 2.164 -7.340
556 HH12 ARG 69 2HH1 ARG 69 9.427 3.508 -7.695
557 HH21 ARG 69 1HH2 ARG 69 12.102 1.523 -8.801
558 HH22 ARG 69 2HH2 ARG 69 11.531 3.148 -8.525
559 H LEU 70 HN LEU 70 5.762 -2.507 -3.636
560 HA LEU 70 HA LEU 70 3.241 -1.320 -3.893
561 HB2 LEU 70 2HB LEU 70 3.606 -3.721 -4.132
562 HB3 LEU 70 1HB LEU 70 4.030 -3.844 -2.436
563 HG LEU 70 HG LEU 70 1.728 -3.195 -1.823
564 HD11 LEU 70 1HD1 LEU 70 1.194 -1.876 -3.815
565 HD12 LEU 70 2HD1 LEU 70 -0.012 -3.129 -3.521
566 HD13 LEU 70 3HD1 LEU 70 1.196 -3.348 -4.787
567 HD21 LEU 70 3HD2 LEU 70 0.655 -5.279 -2.499
568 HD22 LEU 70 1HD2 LEU 70 2.326 -5.550 -2.005
569 HD23 LEU 70 2HD2 LEU 70 1.904 -5.532 -3.717
570 H ARG 71 HN ARG 71 5.201 -1.997 -1.017
571 HA ARG 71 HA ARG 71 3.223 -1.141 0.827
572 HB2 ARG 71 2HB ARG 71 5.388 -2.531 1.241
573 HB3 ARG 71 1HB ARG 71 6.157 -0.958 1.422
574 HG2 ARG 71 2HG ARG 71 5.604 -1.432 3.592
575 HG3 ARG 71 1HG ARG 71 4.185 -0.515 3.080
576 HD2 ARG 71 2HD ARG 71 4.466 -3.504 3.356
577 HD3 ARG 71 1HD ARG 71 3.400 -2.434 4.261
578 HE ARG 71 HE ARG 71 2.685 -2.195 1.595
579 HH11 ARG 71 1HH1 ARG 71 2.730 -4.695 4.046
580 HH12 ARG 71 2HH1 ARG 71 1.454 -5.612 3.323
581 HH21 ARG 71 1HH2 ARG 71 1.006 -3.429 0.622
582 HH22 ARG 71 2HH2 ARG 71 0.473 -4.892 1.378
583 H GLY 72 HN GLY 72 5.906 0.491 -0.795
584 HA2 GLY 72 2HA GLY 72 5.686 2.972 0.528
585 HA3 GLY 72 1HA GLY 72 6.384 2.719 -1.066
586 H ARG 73 HN ARG 73 4.119 1.726 -2.388
587 HA ARG 73 HA ARG 73 2.743 4.090 -3.071
588 HB2 ARG 73 2HB ARG 73 2.038 1.196 -3.600
589 HB3 ARG 73 1HB ARG 73 1.227 2.568 -4.346
590 HG2 ARG 73 2HG ARG 73 3.322 3.246 -5.393
591 HG3 ARG 73 1HG ARG 73 4.147 1.889 -4.626
592 HD2 ARG 73 2HD ARG 73 2.701 0.330 -5.844
593 HD3 ARG 73 1HD ARG 73 1.884 1.692 -6.611
594 HE ARG 73 HE ARG 73 4.697 1.806 -7.040
595 HH11 ARG 73 1HH1 ARG 73 1.808 0.146 -8.128
596 HH12 ARG 73 2HH1 ARG 73 2.443 -0.199 -9.710
597 HH21 ARG 73 1HH2 ARG 73 5.521 1.378 -9.118
598 HH22 ARG 73 2HH2 ARG 73 4.552 0.526 -10.283
599 H ILE 74 HN ILE 74 1.917 1.360 -0.996
600 HA ILE 74 HA ILE 74 -0.694 2.252 -0.349
601 HB ILE 74 HB ILE 74 1.179 0.336 1.025
602 HG12 ILE 74 2HG1 ILE 74 -1.346 0.015 -0.605
603 HG13 ILE 74 1HG1 ILE 74 0.288 -0.410 -1.098
604 HG21 ILE 74 1HG2 ILE 74 -1.671 0.942 1.797
605 HG22 ILE 74 2HG2 ILE 74 -0.239 1.349 2.742
606 HG23 ILE 74 3HG2 ILE 74 -0.665 -0.341 2.469
607 HD11 ILE 74 3HD1 ILE 74 0.361 -2.165 0.565
608 HD12 ILE 74 1HD1 ILE 74 -1.044 -2.362 -0.485
609 HD13 ILE 74 2HD1 ILE 74 -1.241 -1.705 1.140
610 H GLU 75 HN GLU 75 2.481 2.790 1.144
611 HA GLU 75 HA GLU 75 1.703 4.137 3.446
612 HB2 GLU 75 2HB GLU 75 4.066 3.581 2.790
613 HB3 GLU 75 1HB GLU 75 4.018 4.937 1.670
614 HG2 GLU 75 2HG GLU 75 3.250 6.203 3.887
615 HG3 GLU 75 1HG GLU 75 4.196 4.911 4.620
616 H SER 76 HN SER 76 2.134 5.368 0.158
617 HA SER 76 HA SER 76 1.532 8.055 0.658
618 HB2 SER 76 2HB SER 76 2.528 7.015 -1.458
619 HB3 SER 76 1HB SER 76 0.873 6.609 -1.893
620 HG SER 76 HG SER 76 1.749 9.243 -1.276
621 H VAL 77 HN VAL 77 -0.540 5.333 -0.276
622 HA VAL 77 HA VAL 77 -2.961 6.746 -0.445
623 HB VAL 77 HB VAL 77 -2.517 3.848 0.316
624 HG11 VAL 77 1HG1 VAL 77 -5.005 5.237 -0.682
625 HG12 VAL 77 2HG1 VAL 77 -4.751 4.590 0.938
626 HG13 VAL 77 3HG1 VAL 77 -4.826 3.497 -0.444
627 HG21 VAL 77 3HG2 VAL 77 -2.966 3.386 -2.053
628 HG22 VAL 77 1HG2 VAL 77 -1.540 4.402 -1.848
629 HG23 VAL 77 2HG2 VAL 77 -3.066 5.117 -2.369
630 H LEU 78 HN LEU 78 -1.489 4.983 2.268
631 HA LEU 78 HA LEU 78 -3.540 5.473 4.131
632 HB2 LEU 78 2HB LEU 78 -0.592 5.012 4.592
633 HB3 LEU 78 1HB LEU 78 -1.813 4.979 5.849
634 HG LEU 78 HG LEU 78 -1.624 3.066 3.519
635 HD11 LEU 78 1HD1 LEU 78 0.111 2.708 5.194
636 HD12 LEU 78 2HD1 LEU 78 -1.083 1.410 5.238
637 HD13 LEU 78 3HD1 LEU 78 -1.110 2.674 6.467
638 HD21 LEU 78 3HD2 LEU 78 -3.937 3.453 4.135
639 HD22 LEU 78 1HD2 LEU 78 -3.556 3.167 5.833
640 HD23 LEU 78 2HD2 LEU 78 -3.427 1.850 4.666
641 H ASP 79 HN ASP 79 -0.662 7.309 3.255
642 HA ASP 79 HA ASP 79 -0.781 9.248 5.298
643 HB2 ASP 79 2HB ASP 79 1.168 8.872 3.804
644 HB3 ASP 79 1HB ASP 79 0.245 9.533 2.460
645 H TRP 80 HN TRP 80 -2.042 9.233 1.996
646 HA TRP 80 HA TRP 80 -3.293 11.752 2.061
647 HB2 TRP 80 2HB TRP 80 -2.836 10.622 -0.030
648 HB3 TRP 80 1HB TRP 80 -3.853 9.265 0.430
649 HD1 TRP 80 1HD TRP 80 -4.110 12.921 -0.751
650 HE1 TRP 80 1HE TRP 80 -6.461 13.277 -1.741
651 HE3 TRP 80 3HE TRP 80 -6.197 8.420 0.484
652 HZ2 TRP 80 2HZ TRP 80 -8.885 11.833 -1.962
653 HZ3 TRP 80 3HZ TRP 80 -8.533 7.987 -0.155
654 HH2 TRP 80 2HH TRP 80 -9.846 9.661 -1.353
655 H ALA 81 HN ALA 81 -4.502 8.503 2.762
656 HA ALA 81 HA ALA 81 -7.196 9.177 3.161
657 HB1 ALA 81 1HB ALA 81 -6.404 6.889 2.804
658 HB2 ALA 81 2HB ALA 81 -7.399 7.020 4.255
659 HB3 ALA 81 3HB ALA 81 -5.645 6.909 4.396
660 H THR 82 HN THR 82 -4.458 9.137 5.392
661 HA THR 82 HA THR 82 -6.003 9.530 7.744
662 HB THR 82 HB THR 82 -3.099 10.275 7.336
663 HG1 THR 82 1HG THR 82 -3.200 8.148 6.798
664 HG21 THR 82 3HG2 THR 82 -4.100 11.109 9.419
665 HG22 THR 82 1HG2 THR 82 -2.920 9.838 9.744
666 HG23 THR 82 2HG2 THR 82 -4.647 9.479 9.811
667 H VAL 83 HN VAL 83 -4.358 11.710 5.502
668 HA VAL 83 HA VAL 83 -4.905 14.098 6.935
669 HB VAL 83 HB VAL 83 -4.364 13.684 3.987
670 HG11 VAL 83 1HG1 VAL 83 -5.477 15.823 4.370
671 HG12 VAL 83 2HG1 VAL 83 -3.785 16.067 3.938
672 HG13 VAL 83 3HG1 VAL 83 -4.297 16.224 5.619
673 HG21 VAL 83 3HG2 VAL 83 -2.542 14.475 6.258
674 HG22 VAL 83 1HG2 VAL 83 -2.087 14.400 4.556
675 HG23 VAL 83 2HG2 VAL 83 -2.544 12.928 5.412
676 H ARG 84 HN ARG 84 -6.593 12.416 4.294
677 HA ARG 84 HA ARG 84 -8.705 14.261 4.054
678 HB2 ARG 84 2HB ARG 84 -8.009 11.607 3.061
679 HB3 ARG 84 1HB ARG 84 -9.740 11.838 3.268
680 HG2 ARG 84 2HG ARG 84 -8.818 12.388 0.998
681 HG3 ARG 84 1HG ARG 84 -9.779 13.636 1.774
682 HD2 ARG 84 2HD ARG 84 -6.808 13.654 2.044
683 HD3 ARG 84 1HD ARG 84 -7.573 14.291 0.589
684 HE ARG 84 HE ARG 84 -7.785 15.389 3.301
685 HH11 ARG 84 1HH1 ARG 84 -8.536 15.605 -0.104
686 HH12 ARG 84 2HH1 ARG 84 -9.068 17.253 -0.022
687 HH21 ARG 84 1HH2 ARG 84 -8.486 17.559 3.433
688 HH22 ARG 84 2HH2 ARG 84 -9.018 18.380 1.991
689 H GLY 85 HN GLY 85 -8.132 11.655 6.293
690 HA2 GLY 85 2HA GLY 85 -9.207 11.524 8.386
691 HA3 GLY 85 1HA GLY 85 -10.523 12.494 7.745
692 H TYR 86 HN TYR 86 -9.490 9.887 5.763
693 HA TYR 86 HA TYR 86 -11.971 8.475 6.272
694 HB2 TYR 86 2HB TYR 86 -9.689 7.853 4.376
695 HB3 TYR 86 1HB TYR 86 -11.182 6.924 4.483
696 HD1 TYR 86 2HD TYR 86 -13.287 8.849 4.591
697 HD2 TYR 86 1HD TYR 86 -9.650 9.034 2.398
698 HE1 TYR 86 2HE TYR 86 -14.350 10.368 2.968
699 HE2 TYR 86 1HE TYR 86 -10.697 10.550 0.773
700 HH TYR 86 HH TYR 86 -13.594 12.143 1.335
701 H ARG 87 HN ARG 87 -8.776 8.446 7.335
702 HA ARG 87 HA ARG 87 -9.343 6.221 9.112
703 HB2 ARG 87 2HB ARG 87 -7.267 5.072 8.666
704 HB3 ARG 87 1HB ARG 87 -8.133 5.244 7.145
705 HG2 ARG 87 2HG ARG 87 -6.719 7.104 6.516
706 HG3 ARG 87 1HG ARG 87 -5.880 7.015 8.065
707 HD2 ARG 87 2HD ARG 87 -5.896 4.960 5.865
708 HD3 ARG 87 1HD ARG 87 -4.533 5.936 6.408
709 HE ARG 87 HE ARG 87 -5.594 3.545 7.654
710 HH11 ARG 87 1HH1 ARG 87 -3.600 6.405 8.054
711 HH12 ARG 87 2HH1 ARG 87 -2.632 5.711 9.320
712 HH21 ARG 87 1HH2 ARG 87 -4.344 2.641 9.351
713 HH22 ARG 87 2HH2 ARG 87 -3.088 3.580 10.082
714 H GLU 88 HN GLU 88 -8.008 6.299 11.012
715 HA GLU 88 HA GLU 88 -6.490 8.795 11.298
716 HB2 GLU 88 2HB GLU 88 -8.475 7.613 13.244
717 HB3 GLU 88 1HB GLU 88 -7.357 8.906 13.656
718 HG2 GLU 88 2HG GLU 88 -8.363 10.319 11.932
719 HG3 GLU 88 1HG GLU 88 -9.490 9.025 11.534
720 H GLY 89 HN GLY 89 -4.962 8.758 13.122
721 HA2 GLY 89 2HA GLY 89 -3.777 7.271 14.715
722 HA3 GLY 89 1HA GLY 89 -3.843 6.047 13.454
723 H ASP 90 HN ASP 90 -1.947 5.771 12.492
724 HA ASP 90 HA ASP 90 -0.418 8.118 11.651
725 HB2 ASP 90 2HB ASP 90 0.456 7.125 13.878
726 HB3 ASP 90 1HB ASP 90 1.010 5.770 12.898
727 H ASN 91 HN ASN 91 1.772 6.654 10.599
728 HA ASN 91 HA ASN 91 0.425 5.304 8.369
729 HB2 ASN 91 2HB ASN 91 2.816 7.063 8.614
730 HB3 ASN 91 1HB ASN 91 2.810 5.849 7.349
731 HD21 ASN 91 1HD2 ASN 91 1.535 6.130 5.577
732 HD22 ASN 91 2HD2 ASN 91 0.606 7.557 5.286
733 HA PRO 92 HA PRO 92 2.519 1.927 10.663
734 HB2 PRO 92 2HB PRO 92 0.630 0.240 9.165
735 HB3 PRO 92 1HB PRO 92 0.876 0.382 10.908
736 HG2 PRO 92 2HG PRO 92 -1.321 1.363 9.715
737 HG3 PRO 92 1HG PRO 92 -0.571 2.173 11.103
738 HD2 PRO 92 2HD PRO 92 -0.371 2.828 8.189
739 HD3 PRO 92 1HD PRO 92 -0.574 3.921 9.575
740 H ALA 93 HN ALA 93 2.163 2.520 7.316
741 HA ALA 93 HA ALA 93 3.909 0.277 6.589
742 HB1 ALA 93 1HB ALA 93 3.301 0.749 4.278
743 HB2 ALA 93 2HB ALA 93 2.394 2.173 4.790
744 HB3 ALA 93 3HB ALA 93 1.853 0.564 5.267
745 H ARG 94 HN ARG 94 4.390 3.189 7.766
746 HA ARG 94 HA ARG 94 6.473 4.003 5.872
747 HB2 ARG 94 2HB ARG 94 4.933 5.765 6.485
748 HB3 ARG 94 1HB ARG 94 5.194 5.454 8.193
749 HG2 ARG 94 2HG ARG 94 7.419 6.294 8.086
750 HG3 ARG 94 1HG ARG 94 7.356 6.384 6.323
751 HD2 ARG 94 2HD ARG 94 5.584 7.960 8.187
752 HD3 ARG 94 1HD ARG 94 7.057 8.581 7.442
753 HE ARG 94 HE ARG 94 5.750 7.848 5.275
754 HH11 ARG 94 1HH1 ARG 94 4.465 9.446 8.125
755 HH12 ARG 94 2HH1 ARG 94 3.263 10.331 7.232
756 HH21 ARG 94 1HH2 ARG 94 4.180 8.977 4.122
757 HH22 ARG 94 2HH2 ARG 94 3.082 10.053 4.952
758 H TRP 95 HN TRP 95 5.985 3.551 9.363
759 HA TRP 95 HA TRP 95 7.291 2.671 10.990
760 HB2 TRP 95 2HB TRP 95 8.801 1.706 8.590
761 HB3 TRP 95 1HB TRP 95 9.461 1.485 10.207
762 HD1 TRP 95 1HD TRP 95 7.645 0.200 11.961
763 HE1 TRP 95 1HE TRP 95 6.245 -1.898 11.458
764 HE3 TRP 95 3HE TRP 95 7.664 0.436 6.858
765 HZ2 TRP 95 2HZ TRP 95 5.265 -3.269 9.183
766 HZ3 TRP 95 3HZ TRP 95 6.469 -1.303 5.591
767 HH2 TRP 95 2HH TRP 95 5.295 -3.115 6.729
768 H ARG 96 HN ARG 96 9.027 3.159 12.293
769 HA ARG 96 HA ARG 96 10.751 5.363 11.420
770 HB2 ARG 96 2HB ARG 96 9.560 5.882 13.438
771 HB3 ARG 96 1HB ARG 96 9.957 4.324 14.145
772 HG2 ARG 96 2HG ARG 96 12.291 4.964 14.293
773 HG3 ARG 96 1HG ARG 96 11.919 6.506 13.527
774 HD2 ARG 96 2HD ARG 96 10.617 7.213 15.386
775 HD3 ARG 96 1HD ARG 96 10.640 5.599 16.096
776 HE ARG 96 HE ARG 96 13.089 5.959 16.400
777 HH11 ARG 96 1HH1 ARG 96 10.947 8.710 16.066
778 HH12 ARG 96 2HH1 ARG 96 11.932 9.761 17.046
779 HH21 ARG 96 1HH2 ARG 96 14.406 7.335 17.659
780 HH22 ARG 96 2HH2 ARG 96 13.903 8.972 17.955
781 H GLY 97 HN GLY 97 10.601 2.056 12.319
782 HA2 GLY 97 2HA GLY 97 13.199 1.507 11.325
783 HA3 GLY 97 1HA GLY 97 13.194 1.459 13.083
784 H TYR 98 HN TYR 98 12.044 -0.049 10.168
785 HA TYR 98 HA TYR 98 10.794 -2.197 11.705
786 HB2 TYR 98 2HB TYR 98 9.549 -1.321 9.780
787 HB3 TYR 98 1HB TYR 98 10.888 -1.735 8.715
788 HD1 TYR 98 1HD TYR 98 9.348 -3.731 11.466
789 HD2 TYR 98 2HD TYR 98 10.035 -3.362 7.286
790 HE1 TYR 98 1HE TYR 98 8.376 -5.961 11.115
791 HE2 TYR 98 2HE TYR 98 9.068 -5.593 6.925
792 HH TYR 98 HH TYR 98 7.459 -7.336 9.470
793 H LEU 99 HN LEU 99 12.870 -2.183 8.800
794 HA LEU 99 HA LEU 99 14.067 -4.675 9.691
795 HB2 LEU 99 2HB LEU 99 14.367 -3.118 7.121
796 HB3 LEU 99 1HB LEU 99 15.151 -4.648 7.448
797 HG LEU 99 HG LEU 99 12.169 -4.212 7.279
798 HD11 LEU 99 1HD1 LEU 99 13.270 -4.035 5.112
799 HD12 LEU 99 2HD1 LEU 99 12.322 -5.517 5.222
800 HD13 LEU 99 3HD1 LEU 99 14.076 -5.580 5.388
801 HD21 LEU 99 3HD2 LEU 99 13.754 -6.758 7.604
802 HD22 LEU 99 1HD2 LEU 99 12.003 -6.636 7.417
803 HD23 LEU 99 2HD2 LEU 99 12.784 -5.985 8.858
804 H GLU 100 HN GLU 100 15.107 -1.424 8.724
805 HA GLU 100 HA GLU 100 17.427 -1.691 10.470
806 HB2 GLU 100 2HB GLU 100 18.938 -0.799 8.750
807 HB3 GLU 100 1HB GLU 100 18.245 -2.335 8.247
808 HG2 GLU 100 2HG GLU 100 16.712 -1.233 6.777
809 HG3 GLU 100 1HG GLU 100 17.203 0.350 7.378
810 H HIS 101 HN HIS 101 18.354 0.344 11.057
811 HA HIS 101 HA HIS 101 16.540 2.613 10.771
812 HB2 HIS 101 2HB HIS 101 19.032 2.178 12.430
813 HB3 HIS 101 1HB HIS 101 18.232 3.741 12.307
814 HD1 HIS 101 1HD HIS 101 18.454 1.109 14.573
815 HD2 HIS 101 2HD HIS 101 15.243 3.230 12.978
816 HE1 HIS 101 1HE HIS 101 16.547 0.775 16.181
817 HE2 HIS 101 2HE HIS 101 14.573 1.914 15.108
818 H HIS 102 HN HIS 102 16.743 3.705 8.937
819 HA HIS 102 HA HIS 102 19.104 3.665 7.360
820 HB2 HIS 102 2HB HIS 102 16.514 5.149 7.220
821 HB3 HIS 102 1HB HIS 102 17.858 5.672 6.209
822 HD1 HIS 102 1HD HIS 102 18.392 4.286 4.166
823 HD2 HIS 102 2HD HIS 102 15.541 2.531 6.629
824 HE1 HIS 102 1HE HIS 102 17.476 2.339 2.861
825 HE2 HIS 102 2HE HIS 102 15.899 1.177 4.449
826 H HIS 103 HN HIS 103 17.682 6.081 9.507
827 HA HIS 103 HA HIS 103 18.537 7.876 10.590
828 HB2 HIS 103 2HB HIS 103 20.390 6.410 11.245
829 HB3 HIS 103 1HB HIS 103 21.223 6.767 9.736
830 HD1 HIS 103 1HD HIS 103 22.892 8.581 9.862
831 HD2 HIS 103 2HD HIS 103 20.045 8.888 12.877
832 HE1 HIS 103 1HE HIS 103 23.628 10.514 11.297
833 HE2 HIS 103 2HE HIS 103 21.822 10.761 13.042
834 H HIS 104 HN HIS 104 18.597 9.975 10.012
835 HA HIS 104 HA HIS 104 18.647 10.520 7.210
836 HB2 HIS 104 2HB HIS 104 17.967 12.727 7.722
837 HB3 HIS 104 1HB HIS 104 17.175 11.699 8.904
838 HD1 HIS 104 1HD HIS 104 19.288 14.640 8.580
839 HD2 HIS 104 2HD HIS 104 18.431 11.856 11.544
840 HE1 HIS 104 1HE HIS 104 20.060 15.684 10.734
841 HE2 HIS 104 2HE HIS 104 19.303 14.084 12.530
842 H HIS 105 HN HIS 105 20.329 10.839 6.002
843 HA HIS 105 HA HIS 105 22.408 12.672 6.686
844 HB2 HIS 105 2HB HIS 105 23.200 10.594 7.849
845 HB3 HIS 105 1HB HIS 105 23.227 9.780 6.288
846 HD1 HIS 105 1HD HIS 105 25.271 11.828 8.513
847 HD2 HIS 105 2HD HIS 105 25.179 10.963 4.442
848 HE1 HIS 105 1HE HIS 105 27.511 12.533 7.612
849 HE2 HIS 105 2HE HIS 105 27.471 11.924 5.166
850 H HIS 106 HN HIS 106 22.099 9.788 4.586
851 HA HIS 106 HA HIS 106 21.560 11.584 2.357
852 HB2 HIS 106 2HB HIS 106 23.071 10.490 0.820
853 HB3 HIS 106 1HB HIS 106 23.987 11.071 2.198
854 HD1 HIS 106 1HD HIS 106 25.487 9.424 3.296
855 HD2 HIS 106 2HD HIS 106 22.679 7.589 0.850
856 HE1 HIS 106 1HE HIS 106 26.132 6.996 3.233
857 HE2 HIS 106 2HE HIS 106 24.302 5.876 1.908
Start of MODEL 8
1 H1 MET 1 H1 MET 1 -15.384 4.795 6.448
2 H2 MET 1 H2 MET 1 -14.029 4.006 7.092
3 H3 MET 1 H3 MET 1 -15.338 3.099 6.519
4 HA MET 1 HA MET 1 -14.923 3.912 4.271
5 HB2 MET 1 2HB MET 1 -13.859 6.021 4.810
6 HB3 MET 1 1HB MET 1 -12.541 5.195 5.630
7 HG2 MET 1 2HG MET 1 -11.809 5.964 3.472
8 HG3 MET 1 1HG MET 1 -11.859 4.204 3.495
9 HE1 MET 1 2HE MET 1 -13.467 7.490 2.128
10 HE2 MET 1 3HE MET 1 -14.802 6.832 3.076
11 HE3 MET 1 1HE MET 1 -14.913 6.891 1.317
12 H THR 2 HN THR 2 -14.081 2.269 3.052
13 HA THR 2 HA THR 2 -12.459 0.305 4.489
14 HB THR 2 HB THR 2 -12.950 -1.207 2.576
15 HG1 THR 2 1HG THR 2 -14.839 0.715 1.674
16 HG21 THR 2 3HG2 THR 2 -14.412 -1.178 4.550
17 HG22 THR 2 1HG2 THR 2 -15.311 -1.546 3.077
18 HG23 THR 2 2HG2 THR 2 -15.403 0.065 3.789
19 H PHE 3 HN PHE 3 -10.649 -0.747 3.317
20 HA PHE 3 HA PHE 3 -8.831 1.264 2.482
21 HB2 PHE 3 2HB PHE 3 -8.127 -0.809 3.652
22 HB3 PHE 3 1HB PHE 3 -8.546 -1.738 2.217
23 HD1 PHE 3 2HD PHE 3 -6.326 0.974 3.434
24 HD2 PHE 3 1HD PHE 3 -6.988 -2.031 0.489
25 HE1 PHE 3 2HE PHE 3 -4.067 1.359 2.538
26 HE2 PHE 3 1HE PHE 3 -4.728 -1.649 -0.412
27 HZ PHE 3 HZ PHE 3 -3.265 0.048 0.610
28 H SER 4 HN SER 4 -10.641 -1.231 0.755
29 HA SER 4 HA SER 4 -9.557 -0.838 -1.790
30 HB2 SER 4 2HB SER 4 -11.027 -2.736 -1.202
31 HB3 SER 4 1HB SER 4 -12.392 -1.631 -1.071
32 HG SER 4 HG SER 4 -11.114 -1.362 -3.451
33 H GLU 5 HN GLU 5 -12.234 0.799 -0.155
34 HA GLU 5 HA GLU 5 -12.965 2.431 -2.357
35 HB2 GLU 5 2HB GLU 5 -13.529 2.452 0.581
36 HB3 GLU 5 1HB GLU 5 -13.988 3.834 -0.395
37 HG2 GLU 5 2HG GLU 5 -15.318 2.382 -1.825
38 HG3 GLU 5 1HG GLU 5 -14.864 0.995 -0.837
39 H CYS 6 HN CYS 6 -10.948 2.968 0.495
40 HA CYS 6 HA CYS 6 -10.371 5.684 0.006
41 HB2 CYS 6 2HB CYS 6 -10.016 4.380 2.152
42 HB3 CYS 6 1HB CYS 6 -8.565 3.722 1.421
43 HG CYS 6 HG CYS 6 -7.847 6.643 0.925
44 H ALA 7 HN ALA 7 -8.537 2.738 -0.719
45 HA ALA 7 HA ALA 7 -6.358 3.916 -2.011
46 HB1 ALA 7 1HB ALA 7 -5.995 1.747 -3.071
47 HB2 ALA 7 2HB ALA 7 -7.626 1.244 -2.624
48 HB3 ALA 7 3HB ALA 7 -6.424 1.552 -1.371
49 H ALA 8 HN ALA 8 -9.485 2.868 -3.315
50 HA ALA 8 HA ALA 8 -8.990 3.495 -6.002
51 HB1 ALA 8 1HB ALA 8 -10.902 2.156 -5.311
52 HB2 ALA 8 2HB ALA 8 -11.426 3.546 -6.261
53 HB3 ALA 8 3HB ALA 8 -11.615 3.555 -4.508
54 H LEU 9 HN LEU 9 -10.247 5.471 -3.335
55 HA LEU 9 HA LEU 9 -10.847 7.774 -4.827
56 HB2 LEU 9 2HB LEU 9 -9.960 7.515 -1.950
57 HB3 LEU 9 1HB LEU 9 -10.563 8.995 -2.666
58 HG LEU 9 HG LEU 9 -12.143 6.440 -2.387
59 HD11 LEU 9 1HD1 LEU 9 -13.385 7.644 -0.669
60 HD12 LEU 9 2HD1 LEU 9 -12.309 9.028 -0.850
61 HD13 LEU 9 3HD1 LEU 9 -11.683 7.499 -0.232
62 HD21 LEU 9 3HD2 LEU 9 -14.047 7.827 -3.050
63 HD22 LEU 9 1HD2 LEU 9 -12.823 7.770 -4.318
64 HD23 LEU 9 2HD2 LEU 9 -12.964 9.199 -3.294
65 H TYR 10 HN TYR 10 -7.858 6.745 -3.236
66 HA TYR 10 HA TYR 10 -6.325 9.041 -3.740
67 HB2 TYR 10 2HB TYR 10 -5.568 7.281 -2.215
68 HB3 TYR 10 1HB TYR 10 -5.437 6.150 -3.555
69 HD1 TYR 10 2HD TYR 10 -3.952 9.155 -2.013
70 HD2 TYR 10 1HD TYR 10 -3.534 6.160 -5.008
71 HE1 TYR 10 2HE TYR 10 -1.620 9.846 -2.373
72 HE2 TYR 10 1HE TYR 10 -1.201 6.839 -5.371
73 HH TYR 10 HH TYR 10 0.476 8.879 -3.257
74 H ILE 11 HN ILE 11 -6.695 6.072 -5.613
75 HA ILE 11 HA ILE 11 -4.956 6.806 -7.713
76 HB ILE 11 HB ILE 11 -7.215 4.798 -7.681
77 HG12 ILE 11 2HG1 ILE 11 -4.231 4.411 -7.369
78 HG13 ILE 11 1HG1 ILE 11 -5.375 4.446 -6.032
79 HG21 ILE 11 1HG2 ILE 11 -6.664 5.427 -9.970
80 HG22 ILE 11 2HG2 ILE 11 -6.110 3.790 -9.623
81 HG23 ILE 11 3HG2 ILE 11 -4.956 5.121 -9.656
82 HD11 ILE 11 3HD1 ILE 11 -6.493 2.470 -6.965
83 HD12 ILE 11 1HD1 ILE 11 -4.794 2.174 -6.595
84 HD13 ILE 11 2HD1 ILE 11 -5.300 2.429 -8.266
85 H LYS 12 HN LYS 12 -8.506 6.936 -7.442
86 HA LYS 12 HA LYS 12 -8.963 7.926 -10.043
87 HB2 LYS 12 2HB LYS 12 -10.640 8.110 -7.537
88 HB3 LYS 12 1HB LYS 12 -11.202 8.613 -9.125
89 HG2 LYS 12 2HG LYS 12 -10.961 6.359 -9.966
90 HG3 LYS 12 1HG LYS 12 -10.275 5.834 -8.427
91 HD2 LYS 12 2HD LYS 12 -12.576 5.168 -8.500
92 HD3 LYS 12 1HD LYS 12 -12.417 6.478 -7.330
93 HE2 LYS 12 2HE LYS 12 -13.226 8.065 -9.019
94 HE3 LYS 12 1HE LYS 12 -13.388 6.743 -10.174
95 HZ1 LYS 12 3HZ LYS 12 -14.854 6.948 -7.598
96 HZ2 LYS 12 1HZ LYS 12 -15.036 5.722 -8.754
97 HZ3 LYS 12 2HZ LYS 12 -15.504 7.309 -9.123
98 H ALA 13 HN ALA 13 -8.277 9.569 -7.007
99 HA ALA 13 HA ALA 13 -8.808 12.197 -7.930
100 HB1 ALA 13 1HB ALA 13 -6.926 11.288 -5.751
101 HB2 ALA 13 2HB ALA 13 -8.634 11.684 -5.552
102 HB3 ALA 13 3HB ALA 13 -7.484 12.942 -6.008
103 H HIS 14 HN HIS 14 -6.139 10.029 -8.352
104 HA HIS 14 HA HIS 14 -4.443 12.195 -9.370
105 HB2 HIS 14 2HB HIS 14 -3.841 9.380 -8.489
106 HB3 HIS 14 1HB HIS 14 -2.690 10.305 -9.447
107 HD1 HIS 14 1HD HIS 14 -4.253 10.136 -6.052
108 HD2 HIS 14 2HD HIS 14 -1.375 12.355 -8.073
109 HE1 HIS 14 1HE HIS 14 -3.047 11.456 -4.282
110 HE2 HIS 14 2HE HIS 14 -1.452 12.941 -5.552
111 H ARG 15 HN ARG 15 -6.735 10.243 -10.589
112 HA ARG 15 HA ARG 15 -5.581 9.072 -12.863
113 HB2 ARG 15 2HB ARG 15 -8.361 10.044 -12.247
114 HB3 ARG 15 1HB ARG 15 -7.963 9.327 -13.800
115 HG2 ARG 15 2HG ARG 15 -7.406 7.929 -11.214
116 HG3 ARG 15 1HG ARG 15 -8.959 7.814 -12.036
117 HD2 ARG 15 2HD ARG 15 -6.281 7.074 -13.210
118 HD3 ARG 15 1HD ARG 15 -7.483 5.938 -12.601
119 HE ARG 15 HE ARG 15 -8.331 7.746 -14.729
120 HH11 ARG 15 1HH1 ARG 15 -7.265 4.542 -13.805
121 HH12 ARG 15 2HH1 ARG 15 -7.855 3.777 -15.249
122 HH21 ARG 15 1HH2 ARG 15 -9.089 6.772 -16.639
123 HH22 ARG 15 2HH2 ARG 15 -8.890 5.059 -16.883
124 H SER 16 HN SER 16 -6.727 12.327 -12.258
125 HA SER 16 HA SER 16 -6.616 13.263 -14.913
126 HB2 SER 16 2HB SER 16 -6.231 14.873 -12.384
127 HB3 SER 16 1HB SER 16 -6.861 15.429 -13.930
128 HG SER 16 HG SER 16 -8.425 13.480 -13.353
129 H SER 17 HN SER 17 -4.255 12.950 -12.351
130 HA SER 17 HA SER 17 -2.212 14.456 -13.692
131 HB2 SER 17 2HB SER 17 -1.882 12.535 -11.379
132 HB3 SER 17 1HB SER 17 -0.864 13.909 -11.797
133 HG SER 17 HG SER 17 -2.791 15.234 -11.398
134 H TRP 18 HN TRP 18 -3.199 11.135 -13.336
135 HA TRP 18 HA TRP 18 -0.889 10.157 -14.828
136 HB2 TRP 18 2HB TRP 18 -3.173 8.685 -13.495
137 HB3 TRP 18 1HB TRP 18 -1.820 7.912 -14.312
138 HD1 TRP 18 1HD TRP 18 0.277 10.165 -12.936
139 HE1 TRP 18 1HE TRP 18 1.032 9.652 -10.531
140 HE3 TRP 18 3HE TRP 18 -3.454 6.941 -11.596
141 HZ2 TRP 18 2HZ TRP 18 0.156 8.078 -8.357
142 HZ3 TRP 18 3HZ TRP 18 -3.414 5.960 -9.345
143 HH2 TRP 18 2HH TRP 18 -1.650 6.525 -7.751
144 H LYS 19 HN LYS 19 -2.339 11.772 -16.380
145 HA LYS 19 HA LYS 19 -3.934 10.004 -18.080
146 HB2 LYS 19 2HB LYS 19 -5.351 11.724 -17.024
147 HB3 LYS 19 1HB LYS 19 -4.274 12.976 -17.626
148 HG2 LYS 19 2HG LYS 19 -4.859 12.360 -19.925
149 HG3 LYS 19 1HG LYS 19 -5.961 11.128 -19.303
150 HD2 LYS 19 2HD LYS 19 -7.301 12.822 -18.222
151 HD3 LYS 19 1HD LYS 19 -6.159 14.076 -18.706
152 HE2 LYS 19 2HE LYS 19 -6.640 13.580 -21.062
153 HE3 LYS 19 1HE LYS 19 -7.815 12.368 -20.557
154 HZ1 LYS 19 3HZ LYS 19 -8.773 14.563 -21.152
155 HZ2 LYS 19 1HZ LYS 19 -7.985 15.231 -19.810
156 HZ3 LYS 19 2HZ LYS 19 -9.175 14.039 -19.587
157 H ASN 20 HN ASN 20 -1.821 10.504 -20.610
158 HA ASN 20 HA ASN 20 -4.075 9.311 -19.177
159 HB2 ASN 20 2HB ASN 20 -4.706 8.256 -21.362
160 HB3 ASN 20 1HB ASN 20 -4.846 10.008 -21.336
161 HD21 ASN 20 1HD2 ASN 20 -4.653 10.328 -23.493
162 HD22 ASN 20 2HD2 ASN 20 -3.198 10.028 -24.383
163 H THR 21 HN THR 21 -1.144 8.939 -18.839
164 HA THR 21 HA THR 21 -0.308 6.422 -19.763
165 HB THR 21 HB THR 21 1.239 6.513 -17.762
166 HG1 THR 21 1HG THR 21 -0.564 8.208 -16.901
167 HG21 THR 21 3HG2 THR 21 1.113 8.950 -19.546
168 HG22 THR 21 1HG2 THR 21 1.897 7.418 -19.931
169 HG23 THR 21 2HG2 THR 21 2.521 8.425 -18.624
170 H LYS 22 HN LYS 22 -0.796 4.384 -19.125
171 HA LYS 22 HA LYS 22 -3.007 4.187 -17.248
172 HB2 LYS 22 2HB LYS 22 -1.915 2.351 -19.349
173 HB3 LYS 22 1HB LYS 22 -3.077 1.791 -18.155
174 HG2 LYS 22 2HG LYS 22 -4.636 3.552 -18.877
175 HG3 LYS 22 1HG LYS 22 -3.476 4.049 -20.107
176 HD2 LYS 22 2HD LYS 22 -4.648 1.279 -19.932
177 HD3 LYS 22 1HD LYS 22 -5.326 2.569 -20.926
178 HE2 LYS 22 2HE LYS 22 -3.219 2.731 -22.154
179 HE3 LYS 22 1HE LYS 22 -2.534 1.449 -21.154
180 HZ1 LYS 22 3HZ LYS 22 -4.104 -0.099 -22.023
181 HZ2 LYS 22 1HZ LYS 22 -3.371 0.684 -23.339
182 HZ3 LYS 22 2HZ LYS 22 -4.942 1.114 -22.862
183 H HIS 23 HN HIS 23 0.031 4.273 -16.513
184 HA HIS 23 HA HIS 23 0.442 1.970 -14.960
185 HB2 HIS 23 2HB HIS 23 2.005 3.247 -13.610
186 HB3 HIS 23 1HB HIS 23 2.251 3.579 -15.313
187 HD1 HIS 23 1HD HIS 23 2.533 5.261 -12.348
188 HD2 HIS 23 2HD HIS 23 0.515 6.140 -15.871
189 HE1 HIS 23 1HE HIS 23 2.277 7.756 -12.371
190 HE2 HIS 23 2HE HIS 23 1.318 8.273 -14.642
191 H ALA 24 HN ALA 24 -1.646 4.688 -14.510
192 HA ALA 24 HA ALA 24 -2.429 4.407 -11.848
193 HB1 ALA 24 1HB ALA 24 -4.161 5.019 -14.246
194 HB2 ALA 24 2HB ALA 24 -3.222 6.190 -13.324
195 HB3 ALA 24 3HB ALA 24 -4.572 5.345 -12.564
196 H ASP 25 HN ASP 25 -3.293 2.523 -14.693
197 HA ASP 25 HA ASP 25 -5.315 0.930 -13.476
198 HB2 ASP 25 2HB ASP 25 -5.203 1.184 -15.893
199 HB3 ASP 25 1HB ASP 25 -3.599 0.472 -15.924
200 H GLN 26 HN GLN 26 -1.892 0.465 -14.158
201 HA GLN 26 HA GLN 26 -1.548 -2.081 -13.088
202 HB2 GLN 26 2HB GLN 26 0.370 0.256 -13.139
203 HB3 GLN 26 1HB GLN 26 0.819 -1.410 -12.828
204 HG2 GLN 26 2HG GLN 26 0.214 -2.066 -15.042
205 HG3 GLN 26 1HG GLN 26 -0.484 -0.480 -15.369
206 HE21 GLN 26 1HE2 GLN 26 0.822 -0.160 -17.135
207 HE22 GLN 26 2HE2 GLN 26 2.516 0.197 -16.995
208 H TRP 27 HN TRP 27 -1.357 1.104 -11.535
209 HA TRP 27 HA TRP 27 -0.701 0.362 -8.941
210 HB2 TRP 27 2HB TRP 27 -2.257 2.593 -10.157
211 HB3 TRP 27 1HB TRP 27 -2.390 2.361 -8.419
212 HD1 TRP 27 1HD TRP 27 0.426 2.907 -11.061
213 HE1 TRP 27 1HE TRP 27 2.284 4.292 -9.917
214 HE3 TRP 27 3HE TRP 27 -1.522 3.166 -6.338
215 HZ2 TRP 27 2HZ TRP 27 2.842 5.349 -7.355
216 HZ3 TRP 27 3HZ TRP 27 -0.273 4.383 -4.603
217 HH2 TRP 27 2HH TRP 27 1.866 5.452 -5.099
218 H THR 28 HN THR 28 -3.921 0.654 -10.398
219 HA THR 28 HA THR 28 -5.375 -0.090 -8.117
220 HB THR 28 HB THR 28 -6.221 -0.453 -10.998
221 HG1 THR 28 1HG THR 28 -5.547 1.695 -10.652
222 HG21 THR 28 3HG2 THR 28 -8.484 -0.105 -10.108
223 HG22 THR 28 1HG2 THR 28 -7.824 -0.004 -8.477
224 HG23 THR 28 2HG2 THR 28 -7.715 -1.515 -9.380
225 H ASN 29 HN ASN 29 -4.308 -1.985 -10.928
226 HA ASN 29 HA ASN 29 -5.585 -4.367 -10.202
227 HB2 ASN 29 2HB ASN 29 -3.460 -3.588 -12.125
228 HB3 ASN 29 1HB ASN 29 -3.660 -5.295 -11.771
229 HD21 ASN 29 1HD2 ASN 29 -4.176 -3.757 -14.223
230 HD22 ASN 29 2HD2 ASN 29 -5.831 -4.059 -14.625
231 H THR 30 HN THR 30 -2.252 -3.271 -9.601
232 HA THR 30 HA THR 30 -1.340 -5.713 -8.540
233 HB THR 30 HB THR 30 0.418 -4.263 -7.397
234 HG1 THR 30 1HG THR 30 -0.685 -2.207 -9.033
235 HG21 THR 30 3HG2 THR 30 1.550 -3.767 -9.514
236 HG22 THR 30 1HG2 THR 30 0.028 -3.990 -10.378
237 HG23 THR 30 2HG2 THR 30 0.782 -5.353 -9.552
238 H ILE 31 HN ILE 31 -2.599 -2.806 -6.910
239 HA ILE 31 HA ILE 31 -2.335 -3.843 -4.297
240 HB ILE 31 HB ILE 31 -4.205 -1.695 -5.307
241 HG12 ILE 31 2HG1 ILE 31 -1.504 -1.468 -3.964
242 HG13 ILE 31 1HG1 ILE 31 -1.784 -1.268 -5.688
243 HG21 ILE 31 1HG2 ILE 31 -3.340 -2.337 -2.488
244 HG22 ILE 31 2HG2 ILE 31 -4.952 -2.580 -3.161
245 HG23 ILE 31 3HG2 ILE 31 -4.313 -0.948 -2.973
246 HD11 ILE 31 3HD1 ILE 31 -3.196 0.666 -5.241
247 HD12 ILE 31 1HD1 ILE 31 -1.579 0.874 -4.564
248 HD13 ILE 31 2HD1 ILE 31 -2.931 0.459 -3.508
249 H LYS 32 HN LYS 32 -5.010 -3.850 -6.611
250 HA LYS 32 HA LYS 32 -6.961 -4.955 -4.914
251 HB2 LYS 32 2HB LYS 32 -7.145 -3.902 -7.297
252 HB3 LYS 32 1HB LYS 32 -6.867 -5.540 -7.858
253 HG2 LYS 32 2HG LYS 32 -9.098 -4.805 -5.976
254 HG3 LYS 32 1HG LYS 32 -9.269 -4.814 -7.731
255 HD2 LYS 32 2HD LYS 32 -8.658 -7.189 -7.767
256 HD3 LYS 32 1HD LYS 32 -8.510 -7.173 -6.008
257 HE2 LYS 32 2HE LYS 32 -10.648 -8.088 -6.592
258 HE3 LYS 32 1HE LYS 32 -10.894 -6.500 -5.869
259 HZ1 LYS 32 3HZ LYS 32 -11.210 -5.559 -8.050
260 HZ2 LYS 32 1HZ LYS 32 -12.263 -6.872 -7.853
261 HZ3 LYS 32 2HZ LYS 32 -10.864 -7.045 -8.790
262 H THR 33 HN THR 33 -4.370 -6.408 -6.774
263 HA THR 33 HA THR 33 -5.405 -9.082 -6.511
264 HB THR 33 HB THR 33 -2.641 -8.185 -7.367
265 HG1 THR 33 1HG THR 33 -4.292 -7.378 -8.746
266 HG21 THR 33 3HG2 THR 33 -2.519 -10.388 -8.441
267 HG22 THR 33 1HG2 THR 33 -4.096 -10.803 -7.772
268 HG23 THR 33 2HG2 THR 33 -2.724 -10.542 -6.695
269 H TYR 34 HN TYR 34 -2.646 -7.310 -5.103
270 HA TYR 34 HA TYR 34 -1.953 -9.555 -3.440
271 HB2 TYR 34 2HB TYR 34 -0.843 -6.757 -3.620
272 HB3 TYR 34 1HB TYR 34 -0.220 -7.977 -2.514
273 HD1 TYR 34 2HD TYR 34 0.380 -10.286 -3.677
274 HD2 TYR 34 1HD TYR 34 0.187 -6.541 -5.684
275 HE1 TYR 34 2HE TYR 34 1.831 -11.172 -5.448
276 HE2 TYR 34 1HE TYR 34 1.643 -7.418 -7.465
277 HH TYR 34 HH TYR 34 2.376 -10.744 -7.773
278 H CYS 35 HN CYS 35 -3.287 -6.308 -2.817
279 HA CYS 35 HA CYS 35 -3.490 -7.000 0.022
280 HB2 CYS 35 2HB CYS 35 -3.985 -4.342 -1.333
281 HB3 CYS 35 1HB CYS 35 -3.873 -4.627 0.400
282 HG CYS 35 HG CYS 35 -1.130 -5.816 -0.603
283 H GLY 36 HN GLY 36 -5.389 -7.083 -2.712
284 HA2 GLY 36 2HA GLY 36 -7.830 -5.984 -1.997
285 HA3 GLY 36 1HA GLY 36 -7.632 -7.327 -3.109
286 HA PRO 37 HA PRO 37 -9.648 -10.092 -0.382
287 HB2 PRO 37 2HB PRO 37 -7.404 -12.003 -0.295
288 HB3 PRO 37 1HB PRO 37 -9.030 -12.205 -0.952
289 HG2 PRO 37 2HG PRO 37 -6.894 -11.985 -2.555
290 HG3 PRO 37 1HG PRO 37 -8.467 -11.295 -2.997
291 HD2 PRO 37 2HD PRO 37 -6.038 -9.926 -1.897
292 HD3 PRO 37 1HD PRO 37 -7.146 -9.396 -3.180
293 H VAL 38 HN VAL 38 -6.625 -8.872 0.591
294 HA VAL 38 HA VAL 38 -6.694 -10.151 3.202
295 HB VAL 38 HB VAL 38 -4.716 -8.112 2.174
296 HG11 VAL 38 1HG1 VAL 38 -4.626 -10.005 4.524
297 HG12 VAL 38 2HG1 VAL 38 -4.736 -8.246 4.589
298 HG13 VAL 38 3HG1 VAL 38 -3.276 -9.017 3.970
299 HG21 VAL 38 3HG2 VAL 38 -4.501 -11.125 2.199
300 HG22 VAL 38 1HG2 VAL 38 -3.230 -10.000 1.721
301 HG23 VAL 38 2HG2 VAL 38 -4.707 -10.118 0.765
302 H ILE 39 HN ILE 39 -6.221 -6.742 2.202
303 HA ILE 39 HA ILE 39 -7.735 -5.981 4.621
304 HB ILE 39 HB ILE 39 -6.375 -3.889 4.640
305 HG12 ILE 39 2HG1 ILE 39 -4.717 -5.351 2.570
306 HG13 ILE 39 1HG1 ILE 39 -5.712 -3.936 2.256
307 HG21 ILE 39 1HG2 ILE 39 -4.839 -6.471 4.850
308 HG22 ILE 39 2HG2 ILE 39 -5.825 -5.737 6.114
309 HG23 ILE 39 3HG2 ILE 39 -4.355 -4.931 5.561
310 HD11 ILE 39 3HD1 ILE 39 -3.326 -4.032 4.082
311 HD12 ILE 39 1HD1 ILE 39 -4.313 -2.613 3.740
312 HD13 ILE 39 2HD1 ILE 39 -3.359 -3.353 2.455
313 H GLY 40 HN GLY 40 -8.096 -6.130 1.416
314 HA2 GLY 40 2HA GLY 40 -8.748 -3.589 0.490
315 HA3 GLY 40 1HA GLY 40 -9.447 -5.081 -0.119
316 HA PRO 41 HA PRO 41 -13.299 -3.991 1.687
317 HB2 PRO 41 2HB PRO 41 -13.879 -6.526 2.947
318 HB3 PRO 41 1HB PRO 41 -14.483 -5.897 1.413
319 HG2 PRO 41 2HG PRO 41 -12.770 -8.026 1.629
320 HG3 PRO 41 1HG PRO 41 -12.875 -6.982 0.199
321 HD2 PRO 41 2HD PRO 41 -10.882 -6.949 2.435
322 HD3 PRO 41 1HD PRO 41 -10.626 -6.719 0.690
323 H LEU 42 HN LEU 42 -10.800 -4.514 3.739
324 HA LEU 42 HA LEU 42 -12.305 -4.271 6.217
325 HB2 LEU 42 2HB LEU 42 -9.332 -4.243 5.665
326 HB3 LEU 42 1HB LEU 42 -10.040 -4.115 7.264
327 HG LEU 42 HG LEU 42 -10.237 -6.494 5.416
328 HD11 LEU 42 1HD1 LEU 42 -8.791 -6.098 8.033
329 HD12 LEU 42 2HD1 LEU 42 -8.044 -6.230 6.441
330 HD13 LEU 42 3HD1 LEU 42 -8.898 -7.608 7.131
331 HD21 LEU 42 3HD2 LEU 42 -12.284 -6.184 6.729
332 HD22 LEU 42 1HD2 LEU 42 -11.322 -6.115 8.205
333 HD23 LEU 42 2HD2 LEU 42 -11.379 -7.602 7.257
334 H SER 43 HN SER 43 -12.110 -2.438 7.600
335 HA SER 43 HA SER 43 -12.330 0.042 6.405
336 HB2 SER 43 2HB SER 43 -11.403 -0.151 9.223
337 HB3 SER 43 1HB SER 43 -12.739 0.752 8.528
338 HG SER 43 HG SER 43 -12.784 -1.640 9.723
339 H VAL 44 HN VAL 44 -10.932 1.759 6.149
340 HA VAL 44 HA VAL 44 -8.180 1.188 5.790
341 HB VAL 44 HB VAL 44 -9.392 2.948 4.530
342 HG11 VAL 44 1HG1 VAL 44 -9.254 4.498 7.107
343 HG12 VAL 44 2HG1 VAL 44 -10.715 3.891 6.325
344 HG13 VAL 44 3HG1 VAL 44 -9.747 5.144 5.543
345 HG21 VAL 44 3HG2 VAL 44 -6.965 3.925 6.027
346 HG22 VAL 44 1HG2 VAL 44 -7.587 4.601 4.521
347 HG23 VAL 44 2HG2 VAL 44 -6.966 2.951 4.557
348 H GLN 45 HN GLN 45 -10.039 2.218 8.479
349 HA GLN 45 HA GLN 45 -7.800 3.159 10.046
350 HB2 GLN 45 2HB GLN 45 -10.158 4.033 10.258
351 HB3 GLN 45 1HB GLN 45 -10.602 2.486 10.963
352 HG2 GLN 45 2HG GLN 45 -10.276 3.897 12.783
353 HG3 GLN 45 1HG GLN 45 -8.794 2.945 12.694
354 HE21 GLN 45 1HE2 GLN 45 -10.232 6.061 12.236
355 HE22 GLN 45 2HE2 GLN 45 -8.753 6.960 12.158
356 H ASP 46 HN ASP 46 -9.315 0.190 9.309
357 HA ASP 46 HA ASP 46 -8.585 -1.189 11.735
358 HB2 ASP 46 2HB ASP 46 -10.102 -1.811 9.300
359 HB3 ASP 46 1HB ASP 46 -9.145 -3.159 9.903
360 H VAL 47 HN VAL 47 -7.202 -0.585 8.629
361 HA VAL 47 HA VAL 47 -5.352 -2.709 8.519
362 HB VAL 47 HB VAL 47 -5.044 0.067 7.353
363 HG11 VAL 47 1HG1 VAL 47 -3.736 -2.545 6.594
364 HG12 VAL 47 2HG1 VAL 47 -2.950 -1.185 7.396
365 HG13 VAL 47 3HG1 VAL 47 -3.547 -1.011 5.744
366 HG21 VAL 47 3HG2 VAL 47 -6.273 -2.420 6.165
367 HG22 VAL 47 1HG2 VAL 47 -5.960 -0.920 5.290
368 HG23 VAL 47 2HG2 VAL 47 -7.124 -0.942 6.615
369 H ASP 48 HN ASP 48 -3.922 -3.127 10.052
370 HA ASP 48 HA ASP 48 -2.458 -0.878 11.262
371 HB2 ASP 48 2HB ASP 48 -2.483 -1.910 13.361
372 HB3 ASP 48 1HB ASP 48 -4.104 -2.202 12.749
373 H THR 49 HN THR 49 -0.507 -2.097 12.563
374 HA THR 49 HA THR 49 1.350 -2.653 10.542
375 HB THR 49 HB THR 49 1.723 -3.401 13.436
376 HG1 THR 49 1HG THR 49 2.180 -1.239 13.834
377 HG21 THR 49 3HG2 THR 49 3.522 -4.003 11.870
378 HG22 THR 49 1HG2 THR 49 4.041 -2.752 12.999
379 HG23 THR 49 2HG2 THR 49 3.618 -2.324 11.340
380 H LYS 50 HN LYS 50 -0.470 -4.799 12.702
381 HA LYS 50 HA LYS 50 1.007 -7.145 12.180
382 HB2 LYS 50 2HB LYS 50 -0.699 -6.642 14.061
383 HB3 LYS 50 1HB LYS 50 -1.919 -7.121 12.893
384 HG2 LYS 50 2HG LYS 50 0.381 -8.914 13.568
385 HG3 LYS 50 1HG LYS 50 -1.070 -8.857 14.563
386 HD2 LYS 50 2HD LYS 50 -1.384 -9.243 11.627
387 HD3 LYS 50 1HD LYS 50 -0.798 -10.597 12.591
388 HE2 LYS 50 2HE LYS 50 -3.171 -10.788 12.426
389 HE3 LYS 50 1HE LYS 50 -2.779 -10.313 14.077
390 HZ1 LYS 50 3HZ LYS 50 -3.369 -8.028 13.513
391 HZ2 LYS 50 1HZ LYS 50 -4.667 -9.085 13.236
392 HZ3 LYS 50 2HZ LYS 50 -3.756 -8.505 11.936
393 H LEU 51 HN LEU 51 -1.973 -5.844 10.740
394 HA LEU 51 HA LEU 51 -2.393 -7.945 8.921
395 HB2 LEU 51 2HB LEU 51 -3.168 -5.036 8.816
396 HB3 LEU 51 1HB LEU 51 -3.717 -6.226 7.658
397 HG LEU 51 HG LEU 51 -4.302 -6.241 10.611
398 HD11 LEU 51 1HD1 LEU 51 -6.080 -5.708 8.241
399 HD12 LEU 51 2HD1 LEU 51 -5.498 -4.500 9.387
400 HD13 LEU 51 3HD1 LEU 51 -6.590 -5.775 9.929
401 HD21 LEU 51 3HD2 LEU 51 -5.808 -8.100 10.081
402 HD22 LEU 51 1HD2 LEU 51 -4.126 -8.501 9.730
403 HD23 LEU 51 2HD2 LEU 51 -5.227 -8.086 8.416
404 H ILE 52 HN ILE 52 -0.569 -4.939 8.684
405 HA ILE 52 HA ILE 52 0.085 -5.075 5.965
406 HB ILE 52 HB ILE 52 1.500 -3.770 8.286
407 HG12 ILE 52 2HG1 ILE 52 -0.172 -2.627 6.036
408 HG13 ILE 52 1HG1 ILE 52 -0.747 -2.925 7.674
409 HG21 ILE 52 1HG2 ILE 52 2.106 -3.435 5.351
410 HG22 ILE 52 2HG2 ILE 52 3.137 -4.238 6.533
411 HG23 ILE 52 3HG2 ILE 52 2.817 -2.509 6.674
412 HD11 ILE 52 3HD1 ILE 52 0.828 -1.290 8.535
413 HD12 ILE 52 1HD1 ILE 52 -0.211 -0.577 7.301
414 HD13 ILE 52 2HD1 ILE 52 1.452 -1.017 6.908
415 H MET 53 HN MET 53 1.744 -6.405 8.801
416 HA MET 53 HA MET 53 4.042 -7.340 7.474
417 HB2 MET 53 2HB MET 53 2.628 -8.414 9.921
418 HB3 MET 53 1HB MET 53 4.201 -8.972 9.375
419 HG2 MET 53 2HG MET 53 5.117 -6.734 9.699
420 HG3 MET 53 1HG MET 53 3.535 -6.156 10.220
421 HE1 MET 53 3HE MET 53 4.823 -5.179 12.402
422 HE2 MET 53 1HE MET 53 6.339 -5.884 11.843
423 HE3 MET 53 2HE MET 53 5.776 -6.189 13.486
424 H LYS 54 HN LYS 54 0.860 -8.799 7.939
425 HA LYS 54 HA LYS 54 1.567 -11.325 6.869
426 HB2 LYS 54 2HB LYS 54 -1.085 -9.981 7.336
427 HB3 LYS 54 1HB LYS 54 -0.960 -11.585 6.630
428 HG2 LYS 54 2HG LYS 54 0.254 -10.885 9.292
429 HG3 LYS 54 1HG LYS 54 -1.396 -11.481 9.115
430 HD2 LYS 54 2HD LYS 54 -0.066 -13.375 9.623
431 HD3 LYS 54 1HD LYS 54 -0.415 -13.470 7.896
432 HE2 LYS 54 2HE LYS 54 1.801 -12.484 7.432
433 HE3 LYS 54 1HE LYS 54 2.144 -12.491 9.159
434 HZ1 LYS 54 3HZ LYS 54 1.997 -14.886 9.169
435 HZ2 LYS 54 1HZ LYS 54 3.118 -14.392 7.995
436 HZ3 LYS 54 2HZ LYS 54 1.574 -14.911 7.527
437 H VAL 55 HN VAL 55 0.214 -8.388 5.445
438 HA VAL 55 HA VAL 55 -0.344 -9.366 2.888
439 HB VAL 55 HB VAL 55 0.677 -6.619 3.649
440 HG11 VAL 55 1HG1 VAL 55 -0.723 -7.528 1.132
441 HG12 VAL 55 2HG1 VAL 55 0.967 -7.037 1.259
442 HG13 VAL 55 3HG1 VAL 55 -0.317 -5.859 1.540
443 HG21 VAL 55 3HG2 VAL 55 -1.700 -5.979 3.547
444 HG22 VAL 55 1HG2 VAL 55 -1.377 -7.170 4.805
445 HG23 VAL 55 2HG2 VAL 55 -2.126 -7.669 3.288
446 H LEU 56 HN LEU 56 2.677 -8.231 4.304
447 HA LEU 56 HA LEU 56 4.149 -8.422 1.838
448 HB2 LEU 56 2HB LEU 56 4.923 -7.870 4.688
449 HB3 LEU 56 1HB LEU 56 6.120 -8.026 3.420
450 HG LEU 56 HG LEU 56 3.944 -5.948 3.609
451 HD11 LEU 56 1HD1 LEU 56 5.826 -4.394 3.773
452 HD12 LEU 56 2HD1 LEU 56 6.951 -5.753 3.740
453 HD13 LEU 56 3HD1 LEU 56 5.831 -5.564 5.091
454 HD21 LEU 56 3HD2 LEU 56 5.996 -6.375 1.438
455 HD22 LEU 56 1HD2 LEU 56 4.904 -4.998 1.569
456 HD23 LEU 56 2HD2 LEU 56 4.255 -6.613 1.286
457 H ASP 57 HN ASP 57 3.378 -10.552 4.408
458 HA ASP 57 HA ASP 57 5.572 -12.102 4.824
459 HB2 ASP 57 2HB ASP 57 3.259 -12.268 5.878
460 HB3 ASP 57 1HB ASP 57 2.843 -13.327 4.554
461 HA PRO 58 HA PRO 58 4.704 -15.166 1.253
462 HB2 PRO 58 2HB PRO 58 2.782 -14.701 -0.562
463 HB3 PRO 58 1HB PRO 58 2.417 -15.433 1.006
464 HG2 PRO 58 2HG PRO 58 2.119 -12.576 0.139
465 HG3 PRO 58 1HG PRO 58 0.967 -13.598 1.022
466 HD2 PRO 58 2HD PRO 58 2.577 -11.803 2.269
467 HD3 PRO 58 1HD PRO 58 2.061 -13.320 3.024
468 H ILE 59 HN ILE 59 4.600 -11.751 0.626
469 HA ILE 59 HA ILE 59 5.144 -11.877 -2.166
470 HB ILE 59 HB ILE 59 5.697 -9.520 -0.368
471 HG12 ILE 59 2HG1 ILE 59 3.429 -10.326 0.082
472 HG13 ILE 59 1HG1 ILE 59 3.380 -8.814 -0.809
473 HG21 ILE 59 1HG2 ILE 59 4.966 -9.735 -3.293
474 HG22 ILE 59 2HG2 ILE 59 6.545 -9.305 -2.633
475 HG23 ILE 59 3HG2 ILE 59 5.169 -8.230 -2.395
476 HD11 ILE 59 3HD1 ILE 59 1.713 -10.336 -1.649
477 HD12 ILE 59 1HD1 ILE 59 2.947 -11.562 -1.943
478 HD13 ILE 59 2HD1 ILE 59 2.952 -10.065 -2.876
479 H TRP 60 HN TRP 60 7.155 -11.833 0.688
480 HA TRP 60 HA TRP 60 9.564 -10.976 -0.501
481 HB2 TRP 60 2HB TRP 60 9.104 -12.766 1.894
482 HB3 TRP 60 1HB TRP 60 10.673 -12.116 1.434
483 HD1 TRP 60 1HD TRP 60 7.820 -11.385 3.606
484 HE1 TRP 60 1HE TRP 60 7.903 -8.959 4.452
485 HE3 TRP 60 3HE TRP 60 11.338 -9.522 0.403
486 HZ2 TRP 60 2HZ TRP 60 9.271 -6.571 3.844
487 HZ3 TRP 60 3HZ TRP 60 11.978 -7.155 0.598
488 HH2 TRP 60 2HH TRP 60 10.964 -5.710 2.285
489 H GLU 61 HN GLU 61 7.963 -14.074 -0.525
490 HA GLU 61 HA GLU 61 10.288 -15.531 -1.345
491 HB2 GLU 61 2HB GLU 61 7.361 -16.184 -1.141
492 HB3 GLU 61 1HB GLU 61 8.549 -17.319 -1.727
493 HG2 GLU 61 2HG GLU 61 8.442 -16.080 1.003
494 HG3 GLU 61 1HG GLU 61 8.084 -17.756 0.587
495 H GLN 62 HN GLN 62 7.784 -13.743 -2.873
496 HA GLN 62 HA GLN 62 8.341 -14.968 -5.465
497 HB2 GLN 62 2HB GLN 62 6.111 -13.245 -4.437
498 HB3 GLN 62 1HB GLN 62 6.372 -13.452 -6.161
499 HG2 GLN 62 2HG GLN 62 5.870 -15.667 -4.184
500 HG3 GLN 62 1HG GLN 62 4.688 -14.995 -5.307
501 HE21 GLN 62 1HE2 GLN 62 5.736 -17.722 -5.055
502 HE22 GLN 62 2HE2 GLN 62 6.411 -18.114 -6.606
503 H LYS 63 HN LYS 63 7.940 -11.671 -4.137
504 HA LYS 63 HA LYS 63 10.016 -10.724 -5.967
505 HB2 LYS 63 2HB LYS 63 7.232 -9.538 -5.884
506 HB3 LYS 63 1HB LYS 63 8.597 -8.863 -6.758
507 HG2 LYS 63 2HG LYS 63 8.668 -10.832 -8.192
508 HG3 LYS 63 1HG LYS 63 7.319 -11.536 -7.297
509 HD2 LYS 63 2HD LYS 63 5.900 -9.656 -7.967
510 HD3 LYS 63 1HD LYS 63 7.246 -8.962 -8.871
511 HE2 LYS 63 2HE LYS 63 5.958 -11.637 -9.391
512 HE3 LYS 63 1HE LYS 63 5.696 -10.170 -10.332
513 HZ1 LYS 63 3HZ LYS 63 8.281 -11.610 -10.035
514 HZ2 LYS 63 1HZ LYS 63 8.048 -10.184 -10.924
515 HZ3 LYS 63 2HZ LYS 63 7.289 -11.621 -11.409
516 HA PRO 64 HA PRO 64 10.416 -8.903 -1.735
517 HB2 PRO 64 2HB PRO 64 13.223 -8.734 -2.652
518 HB3 PRO 64 1HB PRO 64 12.571 -9.391 -1.150
519 HG2 PRO 64 2HG PRO 64 13.523 -10.987 -3.080
520 HG3 PRO 64 1HG PRO 64 12.129 -11.456 -2.090
521 HD2 PRO 64 2HD PRO 64 12.206 -10.424 -4.893
522 HD3 PRO 64 1HD PRO 64 11.160 -11.669 -4.176
523 H GLU 65 HN GLU 65 11.844 -7.899 -4.793
524 HA GLU 65 HA GLU 65 12.381 -5.219 -4.113
525 HB2 GLU 65 2HB GLU 65 12.949 -6.794 -6.231
526 HB3 GLU 65 1HB GLU 65 11.617 -5.870 -6.905
527 HG2 GLU 65 2HG GLU 65 14.119 -4.699 -5.715
528 HG3 GLU 65 1HG GLU 65 13.805 -4.912 -7.434
529 H THR 66 HN THR 66 9.593 -6.814 -5.571
530 HA THR 66 HA THR 66 8.123 -4.420 -6.032
531 HB THR 66 HB THR 66 7.089 -7.258 -5.887
532 HG1 THR 66 1HG THR 66 8.622 -5.888 -7.759
533 HG21 THR 66 3HG2 THR 66 5.319 -6.437 -7.368
534 HG22 THR 66 1HG2 THR 66 5.998 -4.813 -7.289
535 HG23 THR 66 2HG2 THR 66 5.322 -5.558 -5.840
536 H ALA 67 HN ALA 67 8.292 -6.764 -3.422
537 HA ALA 67 HA ALA 67 6.111 -5.916 -1.893
538 HB1 ALA 67 1HB ALA 67 8.785 -6.940 -0.927
539 HB2 ALA 67 2HB ALA 67 7.383 -7.922 -1.353
540 HB3 ALA 67 3HB ALA 67 7.311 -6.842 0.038
541 H SER 68 HN SER 68 9.400 -4.676 -2.133
542 HA SER 68 HA SER 68 9.170 -2.715 -0.098
543 HB2 SER 68 2HB SER 68 11.022 -2.781 -2.498
544 HB3 SER 68 1HB SER 68 11.236 -1.790 -1.054
545 HG SER 68 HG SER 68 11.276 -4.632 -1.206
546 H ARG 69 HN ARG 69 8.533 -2.720 -3.569
547 HA ARG 69 HA ARG 69 8.074 0.056 -3.833
548 HB2 ARG 69 2HB ARG 69 6.979 -2.218 -5.494
549 HB3 ARG 69 1HB ARG 69 7.066 -0.538 -5.969
550 HG2 ARG 69 2HG ARG 69 9.564 -0.711 -5.726
551 HG3 ARG 69 1HG ARG 69 9.325 -2.452 -5.575
552 HD2 ARG 69 2HD ARG 69 9.818 -2.023 -7.855
553 HD3 ARG 69 1HD ARG 69 8.091 -2.368 -7.758
554 HE ARG 69 HE ARG 69 8.855 0.433 -7.653
555 HH11 ARG 69 1HH1 ARG 69 7.681 -2.239 -9.576
556 HH12 ARG 69 2HH1 ARG 69 7.134 -1.234 -10.877
557 HH21 ARG 69 1HH2 ARG 69 8.123 1.771 -9.341
558 HH22 ARG 69 2HH2 ARG 69 7.401 1.053 -10.759
559 H LEU 70 HN LEU 70 5.925 -2.720 -3.343
560 HA LEU 70 HA LEU 70 3.489 -1.319 -3.386
561 HB2 LEU 70 2HB LEU 70 3.739 -3.785 -3.555
562 HB3 LEU 70 1HB LEU 70 4.168 -3.834 -1.856
563 HG LEU 70 HG LEU 70 1.924 -2.956 -1.289
564 HD11 LEU 70 1HD1 LEU 70 1.470 -1.762 -3.376
565 HD12 LEU 70 2HD1 LEU 70 0.184 -2.907 -2.992
566 HD13 LEU 70 3HD1 LEU 70 1.373 -3.300 -4.234
567 HD21 LEU 70 3HD2 LEU 70 0.713 -5.015 -1.781
568 HD22 LEU 70 1HD2 LEU 70 2.373 -5.361 -1.295
569 HD23 LEU 70 2HD2 LEU 70 1.917 -5.442 -2.996
570 H ARG 71 HN ARG 71 5.817 -1.931 -0.850
571 HA ARG 71 HA ARG 71 4.405 -1.119 1.399
572 HB2 ARG 71 2HB ARG 71 6.682 -2.133 1.375
573 HB3 ARG 71 1HB ARG 71 7.323 -0.596 0.811
574 HG2 ARG 71 2HG ARG 71 7.725 -0.759 3.151
575 HG3 ARG 71 1HG ARG 71 6.470 0.451 2.901
576 HD2 ARG 71 2HD ARG 71 5.866 -2.419 3.574
577 HD3 ARG 71 1HD ARG 71 6.112 -1.187 4.808
578 HE ARG 71 HE ARG 71 4.196 0.005 3.746
579 HH11 ARG 71 1HH1 ARG 71 4.562 -3.447 3.368
580 HH12 ARG 71 2HH1 ARG 71 2.867 -3.743 3.185
581 HH21 ARG 71 1HH2 ARG 71 1.954 -0.375 3.509
582 HH22 ARG 71 2HH2 ARG 71 1.378 -1.990 3.256
583 H GLY 72 HN GLY 72 6.339 0.829 -0.861
584 HA2 GLY 72 2HA GLY 72 5.842 3.308 0.442
585 HA3 GLY 72 1HA GLY 72 6.474 3.099 -1.184
586 H ARG 73 HN ARG 73 4.225 1.583 -2.161
587 HA ARG 73 HA ARG 73 2.588 3.716 -3.005
588 HB2 ARG 73 2HB ARG 73 2.106 0.736 -3.192
589 HB3 ARG 73 1HB ARG 73 1.141 1.957 -4.012
590 HG2 ARG 73 2HG ARG 73 3.249 2.719 -5.147
591 HG3 ARG 73 1HG ARG 73 4.039 1.294 -4.468
592 HD2 ARG 73 2HD ARG 73 2.389 -0.135 -5.635
593 HD3 ARG 73 1HD ARG 73 1.667 1.309 -6.339
594 HE ARG 73 HE ARG 73 4.384 1.358 -6.956
595 HH11 ARG 73 1HH1 ARG 73 1.594 -0.649 -7.693
596 HH12 ARG 73 2HH1 ARG 73 2.204 -1.135 -9.246
597 HH21 ARG 73 1HH2 ARG 73 5.170 0.711 -8.977
598 HH22 ARG 73 2HH2 ARG 73 4.228 -0.345 -9.983
599 H ILE 74 HN ILE 74 2.025 1.122 -0.645
600 HA ILE 74 HA ILE 74 -0.602 1.958 0.031
601 HB ILE 74 HB ILE 74 1.361 0.358 1.679
602 HG12 ILE 74 2HG1 ILE 74 -0.902 -0.510 -0.132
603 HG13 ILE 74 1HG1 ILE 74 0.813 -0.654 -0.496
604 HG21 ILE 74 1HG2 ILE 74 -0.395 1.323 3.075
605 HG22 ILE 74 2HG2 ILE 74 -0.607 -0.423 2.921
606 HG23 ILE 74 3HG2 ILE 74 -1.623 0.676 1.986
607 HD11 ILE 74 3HD1 ILE 74 1.083 -2.200 1.369
608 HD12 ILE 74 1HD1 ILE 74 -0.118 -2.778 0.211
609 HD13 ILE 74 2HD1 ILE 74 -0.636 -2.055 1.734
610 H GLU 75 HN GLU 75 2.587 2.721 1.375
611 HA GLU 75 HA GLU 75 1.834 4.311 3.555
612 HB2 GLU 75 2HB GLU 75 4.170 3.647 3.004
613 HB3 GLU 75 1HB GLU 75 4.151 4.776 1.660
614 HG2 GLU 75 2HG GLU 75 3.677 6.591 3.337
615 HG3 GLU 75 1HG GLU 75 4.016 5.401 4.591
616 H SER 76 HN SER 76 2.274 5.168 0.149
617 HA SER 76 HA SER 76 1.731 7.899 0.369
618 HB2 SER 76 2HB SER 76 1.229 6.057 -1.960
619 HB3 SER 76 1HB SER 76 1.284 7.815 -2.052
620 HG SER 76 HG SER 76 3.405 6.057 -1.332
621 H VAL 77 HN VAL 77 -0.443 5.153 -0.181
622 HA VAL 77 HA VAL 77 -2.781 6.731 -0.519
623 HB VAL 77 HB VAL 77 -2.560 3.846 0.363
624 HG11 VAL 77 1HG1 VAL 77 -4.905 5.391 -0.745
625 HG12 VAL 77 2HG1 VAL 77 -4.745 4.757 0.895
626 HG13 VAL 77 3HG1 VAL 77 -4.871 3.650 -0.473
627 HG21 VAL 77 3HG2 VAL 77 -2.984 3.308 -1.988
628 HG22 VAL 77 1HG2 VAL 77 -1.493 4.230 -1.797
629 HG23 VAL 77 2HG2 VAL 77 -2.954 5.026 -2.387
630 H LEU 78 HN LEU 78 -1.429 4.990 2.277
631 HA LEU 78 HA LEU 78 -3.524 5.631 4.050
632 HB2 LEU 78 2HB LEU 78 -0.655 4.887 4.598
633 HB3 LEU 78 1HB LEU 78 -1.866 5.080 5.853
634 HG LEU 78 HG LEU 78 -1.887 3.022 3.644
635 HD11 LEU 78 1HD1 LEU 78 -0.307 2.558 5.446
636 HD12 LEU 78 2HD1 LEU 78 -1.661 1.426 5.471
637 HD13 LEU 78 3HD1 LEU 78 -1.599 2.754 6.632
638 HD21 LEU 78 3HD2 LEU 78 -4.153 3.808 4.140
639 HD22 LEU 78 1HD2 LEU 78 -3.888 3.487 5.854
640 HD23 LEU 78 2HD2 LEU 78 -3.905 2.153 4.698
641 H ASP 79 HN ASP 79 -0.495 7.293 3.302
642 HA ASP 79 HA ASP 79 -0.708 9.244 5.348
643 HB2 ASP 79 2HB ASP 79 1.400 8.820 4.123
644 HB3 ASP 79 1HB ASP 79 0.676 9.489 2.663
645 H TRP 80 HN TRP 80 -1.772 9.147 1.993
646 HA TRP 80 HA TRP 80 -2.905 11.703 1.812
647 HB2 TRP 80 2HB TRP 80 -2.545 10.238 -0.122
648 HB3 TRP 80 1HB TRP 80 -3.739 9.106 0.494
649 HD1 TRP 80 1HD TRP 80 -3.486 12.591 -1.118
650 HE1 TRP 80 1HE TRP 80 -5.766 13.161 -2.172
651 HE3 TRP 80 3HE TRP 80 -6.186 8.606 0.609
652 HZ2 TRP 80 2HZ TRP 80 -8.366 12.050 -2.256
653 HZ3 TRP 80 3HZ TRP 80 -8.559 8.434 -0.005
654 HH2 TRP 80 2HH TRP 80 -9.625 10.122 -1.408
655 H ALA 81 HN ALA 81 -4.283 8.605 2.834
656 HA ALA 81 HA ALA 81 -6.866 9.531 3.454
657 HB1 ALA 81 1HB ALA 81 -6.331 7.162 3.213
658 HB2 ALA 81 2HB ALA 81 -7.080 7.487 4.776
659 HB3 ALA 81 3HB ALA 81 -5.340 7.233 4.672
660 H THR 82 HN THR 82 -3.862 9.596 5.224
661 HA THR 82 HA THR 82 -4.934 10.230 7.775
662 HB THR 82 HB THR 82 -2.176 10.836 6.676
663 HG1 THR 82 1HG THR 82 -2.730 8.582 6.637
664 HG21 THR 82 3HG2 THR 82 -2.694 12.094 8.711
665 HG22 THR 82 1HG2 THR 82 -1.485 10.849 9.023
666 HG23 THR 82 2HG2 THR 82 -3.158 10.595 9.520
667 H VAL 83 HN VAL 83 -3.910 12.155 5.002
668 HA VAL 83 HA VAL 83 -4.242 14.691 6.313
669 HB VAL 83 HB VAL 83 -4.171 14.078 3.345
670 HG11 VAL 83 1HG1 VAL 83 -3.778 16.666 4.851
671 HG12 VAL 83 2HG1 VAL 83 -5.139 16.256 3.807
672 HG13 VAL 83 3HG1 VAL 83 -3.527 16.447 3.118
673 HG21 VAL 83 3HG2 VAL 83 -1.812 14.739 3.471
674 HG22 VAL 83 1HG2 VAL 83 -2.146 13.314 4.453
675 HG23 VAL 83 2HG2 VAL 83 -1.953 14.888 5.223
676 H ARG 84 HN ARG 84 -6.174 12.678 4.153
677 HA ARG 84 HA ARG 84 -8.342 14.503 3.910
678 HB2 ARG 84 2HB ARG 84 -8.091 11.545 3.410
679 HB3 ARG 84 1HB ARG 84 -9.590 12.422 3.142
680 HG2 ARG 84 2HG ARG 84 -6.961 12.991 1.791
681 HG3 ARG 84 1HG ARG 84 -8.327 12.129 1.077
682 HD2 ARG 84 2HD ARG 84 -8.202 15.014 1.928
683 HD3 ARG 84 1HD ARG 84 -8.409 14.379 0.296
684 HE ARG 84 HE ARG 84 -10.560 13.385 1.505
685 HH11 ARG 84 1HH1 ARG 84 -9.186 16.602 1.537
686 HH12 ARG 84 2HH1 ARG 84 -10.709 17.389 1.854
687 HH21 ARG 84 1HH2 ARG 84 -12.564 14.402 1.944
688 HH22 ARG 84 2HH2 ARG 84 -12.634 16.133 2.086
689 H GLY 85 HN GLY 85 -7.439 12.195 6.315
690 HA2 GLY 85 2HA GLY 85 -8.271 12.164 8.498
691 HA3 GLY 85 1HA GLY 85 -9.665 13.086 7.960
692 H TYR 86 HN TYR 86 -8.587 10.152 6.367
693 HA TYR 86 HA TYR 86 -11.143 8.918 7.011
694 HB2 TYR 86 2HB TYR 86 -8.907 8.040 5.170
695 HB3 TYR 86 1HB TYR 86 -10.386 7.121 5.433
696 HD1 TYR 86 2HD TYR 86 -12.520 8.972 5.363
697 HD2 TYR 86 1HD TYR 86 -8.931 9.034 3.082
698 HE1 TYR 86 2HE TYR 86 -13.654 10.295 3.632
699 HE2 TYR 86 1HE TYR 86 -10.054 10.368 1.346
700 HH TYR 86 HH TYR 86 -13.126 11.818 1.846
701 H ARG 87 HN ARG 87 -7.803 8.715 7.866
702 HA ARG 87 HA ARG 87 -8.586 6.924 10.020
703 HB2 ARG 87 2HB ARG 87 -6.557 5.575 9.832
704 HB3 ARG 87 1HB ARG 87 -7.552 5.426 8.394
705 HG2 ARG 87 2HG ARG 87 -6.067 6.767 7.122
706 HG3 ARG 87 1HG ARG 87 -5.179 7.262 8.567
707 HD2 ARG 87 2HD ARG 87 -5.374 4.411 7.608
708 HD3 ARG 87 1HD ARG 87 -4.050 5.497 7.188
709 HE ARG 87 HE ARG 87 -3.666 5.655 9.669
710 HH11 ARG 87 1HH1 ARG 87 -5.167 2.808 8.258
711 HH12 ARG 87 2HH1 ARG 87 -4.577 1.738 9.492
712 HH21 ARG 87 1HH2 ARG 87 -2.920 4.240 11.291
713 HH22 ARG 87 2HH2 ARG 87 -3.335 2.555 11.223
714 H GLU 88 HN GLU 88 -6.577 6.802 11.607
715 HA GLU 88 HA GLU 88 -6.279 9.506 12.456
716 HB2 GLU 88 2HB GLU 88 -5.015 6.991 13.550
717 HB3 GLU 88 1HB GLU 88 -5.070 8.550 14.362
718 HG2 GLU 88 2HG GLU 88 -7.369 6.727 13.718
719 HG3 GLU 88 1HG GLU 88 -6.766 7.200 15.306
720 H GLY 89 HN GLY 89 -4.024 10.174 13.343
721 HA2 GLY 89 2HA GLY 89 -2.420 10.628 11.019
722 HA3 GLY 89 1HA GLY 89 -2.107 11.218 12.637
723 H ASP 90 HN ASP 90 -2.516 7.855 12.251
724 HA ASP 90 HA ASP 90 0.375 7.453 12.501
725 HB2 ASP 90 2HB ASP 90 -1.903 5.681 13.376
726 HB3 ASP 90 1HB ASP 90 -0.208 5.280 13.520
727 H ASN 91 HN ASN 91 1.354 6.559 10.848
728 HA ASN 91 HA ASN 91 -0.199 4.913 8.956
729 HB2 ASN 91 2HB ASN 91 0.679 7.032 7.950
730 HB3 ASN 91 1HB ASN 91 2.313 6.485 8.313
731 HD21 ASN 91 1HD2 ASN 91 1.307 7.087 5.698
732 HD22 ASN 91 2HD2 ASN 91 1.369 5.638 4.775
733 HA PRO 92 HA PRO 92 2.681 2.031 11.077
734 HB2 PRO 92 2HB PRO 92 1.217 -0.190 10.435
735 HB3 PRO 92 1HB PRO 92 0.909 0.825 11.846
736 HG2 PRO 92 2HG PRO 92 -0.457 0.832 9.182
737 HG3 PRO 92 1HG PRO 92 -1.165 0.951 10.805
738 HD2 PRO 92 2HD PRO 92 -0.821 3.113 9.255
739 HD3 PRO 92 1HD PRO 92 -0.619 3.187 11.018
740 H ALA 93 HN ALA 93 1.851 2.484 7.826
741 HA ALA 93 HA ALA 93 3.252 0.153 6.830
742 HB1 ALA 93 1HB ALA 93 2.617 0.915 4.625
743 HB2 ALA 93 2HB ALA 93 2.052 2.449 5.289
744 HB3 ALA 93 3HB ALA 93 1.220 0.948 5.702
745 H ARG 94 HN ARG 94 4.141 3.263 7.811
746 HA ARG 94 HA ARG 94 6.326 3.518 5.947
747 HB2 ARG 94 2HB ARG 94 6.919 5.521 7.182
748 HB3 ARG 94 1HB ARG 94 5.213 5.521 6.803
749 HG2 ARG 94 2HG ARG 94 5.068 6.220 8.937
750 HG3 ARG 94 1HG ARG 94 5.090 4.486 9.257
751 HD2 ARG 94 2HD ARG 94 7.459 4.557 9.712
752 HD3 ARG 94 1HD ARG 94 7.527 6.259 9.251
753 HE ARG 94 HE ARG 94 5.660 5.809 11.364
754 HH11 ARG 94 1HH1 ARG 94 9.092 6.162 10.688
755 HH12 ARG 94 2HH1 ARG 94 9.464 6.756 12.280
756 HH21 ARG 94 1HH2 ARG 94 6.172 6.551 13.469
757 HH22 ARG 94 2HH2 ARG 94 7.817 6.961 13.851
758 H TRP 95 HN TRP 95 5.778 2.315 9.160
759 HA TRP 95 HA TRP 95 6.946 0.855 10.447
760 HB2 TRP 95 2HB TRP 95 7.736 0.292 7.811
761 HB3 TRP 95 1HB TRP 95 9.214 0.298 8.771
762 HD1 TRP 95 1HD TRP 95 8.632 -1.112 11.306
763 HE1 TRP 95 1HE TRP 95 7.776 -3.533 11.434
764 HE3 TRP 95 3HE TRP 95 6.602 -1.476 6.643
765 HZ2 TRP 95 2HZ TRP 95 6.386 -5.351 9.769
766 HZ3 TRP 95 3HZ TRP 95 5.519 -3.580 5.986
767 HH2 TRP 95 2HH TRP 95 5.413 -5.480 7.516
768 H ARG 96 HN ARG 96 8.672 0.749 11.899
769 HA ARG 96 HA ARG 96 10.404 3.059 12.007
770 HB2 ARG 96 2HB ARG 96 10.157 0.622 13.771
771 HB3 ARG 96 1HB ARG 96 11.277 1.940 14.070
772 HG2 ARG 96 2HG ARG 96 9.346 3.487 14.226
773 HG3 ARG 96 1HG ARG 96 8.272 2.093 14.061
774 HD2 ARG 96 2HD ARG 96 8.607 2.755 16.413
775 HD3 ARG 96 1HD ARG 96 9.173 1.116 16.082
776 HE ARG 96 HE ARG 96 11.272 3.010 15.787
777 HH11 ARG 96 1HH1 ARG 96 9.435 1.262 18.232
778 HH12 ARG 96 2HH1 ARG 96 10.720 1.346 19.407
779 HH21 ARG 96 1HH2 ARG 96 12.923 3.081 17.297
780 HH22 ARG 96 2HH2 ARG 96 12.707 2.374 18.873
781 H GLY 97 HN GLY 97 10.554 -0.309 11.166
782 HA2 GLY 97 2HA GLY 97 12.462 -0.444 9.369
783 HA3 GLY 97 1HA GLY 97 13.454 -0.182 10.796
784 H TYR 98 HN TYR 98 10.765 -2.280 9.746
785 HA TYR 98 HA TYR 98 12.254 -4.559 10.858
786 HB2 TYR 98 2HB TYR 98 10.130 -3.786 12.128
787 HB3 TYR 98 1HB TYR 98 9.253 -4.485 10.774
788 HD1 TYR 98 1HD TYR 98 11.906 -5.370 13.245
789 HD2 TYR 98 2HD TYR 98 8.616 -6.716 10.904
790 HE1 TYR 98 1HE TYR 98 12.024 -7.559 14.351
791 HE2 TYR 98 2HE TYR 98 8.735 -8.919 11.997
792 HH TYR 98 HH TYR 98 10.251 -10.299 13.218
793 H LEU 99 HN LEU 99 12.023 -6.527 9.674
794 HA LEU 99 HA LEU 99 12.028 -7.800 7.854
795 HB2 LEU 99 2HB LEU 99 9.945 -5.899 6.805
796 HB3 LEU 99 1HB LEU 99 10.369 -7.456 6.145
797 HG LEU 99 HG LEU 99 9.145 -7.017 8.854
798 HD11 LEU 99 1HD1 LEU 99 7.155 -8.062 7.881
799 HD12 LEU 99 2HD1 LEU 99 7.946 -8.087 6.305
800 HD13 LEU 99 3HD1 LEU 99 7.564 -6.548 7.076
801 HD21 LEU 99 3HD2 LEU 99 9.799 -9.558 7.363
802 HD22 LEU 99 1HD2 LEU 99 8.881 -9.464 8.867
803 HD23 LEU 99 2HD2 LEU 99 10.574 -8.974 8.835
804 H GLU 100 HN GLU 100 12.100 -4.335 7.162
805 HA GLU 100 HA GLU 100 13.746 -4.643 4.827
806 HB2 GLU 100 2HB GLU 100 12.297 -2.699 5.033
807 HB3 GLU 100 1HB GLU 100 13.079 -2.234 6.535
808 HG2 GLU 100 2HG GLU 100 13.877 -0.813 4.802
809 HG3 GLU 100 1HG GLU 100 15.186 -1.894 5.269
810 H HIS 101 HN HIS 101 15.919 -4.759 4.738
811 HA HIS 101 HA HIS 101 17.443 -5.008 7.143
812 HB2 HIS 101 2HB HIS 101 18.222 -4.927 4.232
813 HB3 HIS 101 1HB HIS 101 19.417 -5.032 5.519
814 HD1 HIS 101 1HD HIS 101 17.424 -7.089 3.341
815 HD2 HIS 101 2HD HIS 101 18.965 -7.449 7.192
816 HE1 HIS 101 1HE HIS 101 17.391 -9.555 3.863
817 HE2 HIS 101 2HE HIS 101 18.475 -9.758 6.127
818 H HIS 102 HN HIS 102 18.940 -3.619 8.024
819 HA HIS 102 HA HIS 102 18.517 -0.820 7.343
820 HB2 HIS 102 2HB HIS 102 18.543 -1.697 9.729
821 HB3 HIS 102 1HB HIS 102 20.280 -1.917 9.539
822 HD1 HIS 102 1HD HIS 102 17.771 0.546 10.480
823 HD2 HIS 102 2HD HIS 102 21.672 0.630 9.028
824 HE1 HIS 102 1HE HIS 102 18.625 2.863 10.958
825 HE2 HIS 102 2HE HIS 102 20.893 2.955 9.864
826 H HIS 103 HN HIS 103 21.183 -3.159 7.513
827 HA HIS 103 HA HIS 103 22.574 -1.495 5.531
828 HB2 HIS 103 2HB HIS 103 23.562 -1.019 7.764
829 HB3 HIS 103 1HB HIS 103 23.984 -2.724 7.905
830 HD1 HIS 103 1HD HIS 103 24.746 0.293 5.757
831 HD2 HIS 103 2HD HIS 103 26.350 -3.422 6.717
832 HE1 HIS 103 1HE HIS 103 27.020 0.232 4.675
833 HE2 HIS 103 2HE HIS 103 27.837 -2.126 5.043
834 H HIS 104 HN HIS 104 23.388 -4.507 7.273
835 HA HIS 104 HA HIS 104 23.862 -5.699 4.619
836 HB2 HIS 104 2HB HIS 104 25.915 -5.228 5.989
837 HB3 HIS 104 1HB HIS 104 25.319 -6.370 7.187
838 HD1 HIS 104 1HD HIS 104 26.133 -6.392 3.464
839 HD2 HIS 104 2HD HIS 104 26.307 -8.865 6.806
840 HE1 HIS 104 1HE HIS 104 27.278 -8.499 2.693
841 HE2 HIS 104 2HE HIS 104 27.235 -10.034 4.693
842 H HIS 105 HN HIS 105 24.017 -7.394 7.702
843 HA HIS 105 HA HIS 105 21.859 -9.147 6.776
844 HB2 HIS 105 2HB HIS 105 24.148 -9.939 7.768
845 HB3 HIS 105 1HB HIS 105 23.410 -9.560 9.321
846 HD1 HIS 105 1HD HIS 105 23.724 -12.205 6.876
847 HD2 HIS 105 2HD HIS 105 20.931 -11.113 9.761
848 HE1 HIS 105 1HE HIS 105 22.313 -14.245 7.261
849 HE2 HIS 105 2HE HIS 105 20.492 -13.494 8.828
850 H HIS 106 HN HIS 106 22.556 -6.622 8.925
851 HA HIS 106 HA HIS 106 20.013 -6.940 10.353
852 HB2 HIS 106 2HB HIS 106 22.194 -4.874 10.780
853 HB3 HIS 106 1HB HIS 106 20.787 -5.136 11.803
854 HD1 HIS 106 1HD HIS 106 20.792 -7.356 13.259
855 HD2 HIS 106 2HD HIS 106 24.361 -6.471 11.314
856 HE1 HIS 106 1HE HIS 106 22.539 -8.799 14.351
857 HE2 HIS 106 2HE HIS 106 24.713 -8.107 13.284
Start of MODEL 9
1 H1 MET 1 H1 MET 1 -15.574 4.245 5.639
2 H2 MET 1 H2 MET 1 -14.336 3.519 6.545
3 H3 MET 1 H3 MET 1 -15.464 2.554 5.734
4 HA MET 1 HA MET 1 -14.671 3.329 3.606
5 HB2 MET 1 2HB MET 1 -13.912 5.556 4.393
6 HB3 MET 1 1HB MET 1 -12.588 4.787 5.255
7 HG2 MET 1 2HG MET 1 -11.728 5.662 3.221
8 HG3 MET 1 1HG MET 1 -11.755 3.908 3.089
9 HE1 MET 1 2HE MET 1 -13.501 7.271 2.006
10 HE2 MET 1 3HE MET 1 -14.788 6.383 2.824
11 HE3 MET 1 1HE MET 1 -14.875 6.654 1.086
12 H THR 2 HN THR 2 -13.659 1.626 2.713
13 HA THR 2 HA THR 2 -11.927 0.032 4.464
14 HB THR 2 HB THR 2 -12.150 -1.748 2.749
15 HG1 THR 2 1HG THR 2 -14.054 0.010 1.541
16 HG21 THR 2 3HG2 THR 2 -14.496 -2.285 3.209
17 HG22 THR 2 1HG2 THR 2 -14.775 -0.624 3.732
18 HG23 THR 2 2HG2 THR 2 -13.690 -1.666 4.650
19 H PHE 3 HN PHE 3 -10.006 -0.996 3.410
20 HA PHE 3 HA PHE 3 -8.262 1.037 2.571
21 HB2 PHE 3 2HB PHE 3 -7.530 -1.016 3.737
22 HB3 PHE 3 1HB PHE 3 -7.909 -1.954 2.298
23 HD1 PHE 3 1HD PHE 3 -5.714 0.718 3.609
24 HD2 PHE 3 2HD PHE 3 -6.361 -2.167 0.550
25 HE1 PHE 3 1HE PHE 3 -3.438 1.112 2.766
26 HE2 PHE 3 2HE PHE 3 -4.085 -1.774 -0.301
27 HZ PHE 3 HZ PHE 3 -2.621 -0.135 0.804
28 H SER 4 HN SER 4 -9.965 -1.475 0.746
29 HA SER 4 HA SER 4 -8.742 -0.983 -1.741
30 HB2 SER 4 2HB SER 4 -11.518 -2.049 -1.166
31 HB3 SER 4 1HB SER 4 -10.676 -2.170 -2.711
32 HG SER 4 HG SER 4 -8.963 -3.218 -1.313
33 H GLU 5 HN GLU 5 -11.669 0.368 -0.268
34 HA GLU 5 HA GLU 5 -12.487 1.911 -2.477
35 HB2 GLU 5 2HB GLU 5 -12.981 2.196 0.486
36 HB3 GLU 5 1HB GLU 5 -13.761 3.201 -0.720
37 HG2 GLU 5 2HG GLU 5 -14.828 1.288 -1.700
38 HG3 GLU 5 1HG GLU 5 -13.954 0.210 -0.613
39 H CYS 6 HN CYS 6 -10.579 2.716 0.392
40 HA CYS 6 HA CYS 6 -10.171 5.439 -0.174
41 HB2 CYS 6 2HB CYS 6 -9.738 4.216 2.004
42 HB3 CYS 6 1HB CYS 6 -8.247 3.634 1.291
43 HG CYS 6 HG CYS 6 -7.503 6.458 0.763
44 H ALA 7 HN ALA 7 -8.187 2.591 -0.850
45 HA ALA 7 HA ALA 7 -6.069 3.849 -2.165
46 HB1 ALA 7 1HB ALA 7 -7.210 1.116 -2.735
47 HB2 ALA 7 2HB ALA 7 -6.033 1.496 -1.476
48 HB3 ALA 7 3HB ALA 7 -5.603 1.687 -3.177
49 H ALA 8 HN ALA 8 -9.103 2.555 -3.486
50 HA ALA 8 HA ALA 8 -8.602 3.125 -6.183
51 HB1 ALA 8 1HB ALA 8 -10.405 1.649 -5.423
52 HB2 ALA 8 2HB ALA 8 -11.005 2.901 -6.509
53 HB3 ALA 8 3HB ALA 8 -11.267 3.041 -4.770
54 H LEU 9 HN LEU 9 -10.100 5.074 -3.630
55 HA LEU 9 HA LEU 9 -10.796 7.298 -5.195
56 HB2 LEU 9 2HB LEU 9 -10.008 7.098 -2.292
57 HB3 LEU 9 1HB LEU 9 -10.595 8.574 -3.027
58 HG LEU 9 HG LEU 9 -12.152 5.998 -2.826
59 HD11 LEU 9 1HD1 LEU 9 -13.504 7.229 -1.188
60 HD12 LEU 9 2HD1 LEU 9 -12.374 8.579 -1.283
61 HD13 LEU 9 3HD1 LEU 9 -11.838 7.022 -0.650
62 HD21 LEU 9 3HD2 LEU 9 -12.745 7.342 -4.791
63 HD22 LEU 9 1HD2 LEU 9 -13.001 8.742 -3.750
64 HD23 LEU 9 2HD2 LEU 9 -14.041 7.325 -3.595
65 H TYR 10 HN TYR 10 -7.831 6.558 -3.398
66 HA TYR 10 HA TYR 10 -6.420 8.906 -3.945
67 HB2 TYR 10 2HB TYR 10 -5.645 7.263 -2.311
68 HB3 TYR 10 1HB TYR 10 -5.379 6.086 -3.589
69 HD1 TYR 10 1HD TYR 10 -4.199 9.310 -2.216
70 HD2 TYR 10 2HD TYR 10 -3.370 6.074 -4.849
71 HE1 TYR 10 1HE TYR 10 -1.904 10.135 -2.503
72 HE2 TYR 10 2HE TYR 10 -1.070 6.890 -5.134
73 HH TYR 10 HH TYR 10 0.335 9.173 -3.146
74 H ILE 11 HN ILE 11 -6.511 5.849 -5.711
75 HA ILE 11 HA ILE 11 -4.668 6.513 -7.724
76 HB ILE 11 HB ILE 11 -6.965 4.544 -7.759
77 HG12 ILE 11 2HG1 ILE 11 -4.000 4.093 -7.357
78 HG13 ILE 11 1HG1 ILE 11 -5.166 4.214 -6.043
79 HG21 ILE 11 1HG2 ILE 11 -4.622 4.694 -9.657
80 HG22 ILE 11 2HG2 ILE 11 -6.269 5.190 -10.040
81 HG23 ILE 11 3HG2 ILE 11 -5.919 3.500 -9.672
82 HD11 ILE 11 3HD1 ILE 11 -6.338 2.255 -6.933
83 HD12 ILE 11 1HD1 ILE 11 -4.662 1.906 -6.514
84 HD13 ILE 11 2HD1 ILE 11 -5.122 2.122 -8.204
85 H LYS 12 HN LYS 12 -8.235 6.704 -7.724
86 HA LYS 12 HA LYS 12 -8.357 7.634 -10.410
87 HB2 LYS 12 2HB LYS 12 -10.411 7.613 -8.202
88 HB3 LYS 12 1HB LYS 12 -10.755 8.140 -9.845
89 HG2 LYS 12 2HG LYS 12 -10.101 5.932 -10.685
90 HG3 LYS 12 1HG LYS 12 -9.792 5.405 -9.032
91 HD2 LYS 12 2HD LYS 12 -12.461 6.343 -10.083
92 HD3 LYS 12 1HD LYS 12 -11.983 4.656 -9.896
93 HE2 LYS 12 2HE LYS 12 -11.554 5.235 -7.448
94 HE3 LYS 12 1HE LYS 12 -12.447 6.721 -7.765
95 HZ1 LYS 12 3HZ LYS 12 -13.964 5.129 -6.904
96 HZ2 LYS 12 1HZ LYS 12 -13.445 3.938 -7.995
97 HZ3 LYS 12 2HZ LYS 12 -14.307 5.285 -8.557
98 H ALA 13 HN ALA 13 -8.217 9.269 -7.293
99 HA ALA 13 HA ALA 13 -8.882 11.837 -8.413
100 HB1 ALA 13 1HB ALA 13 -9.435 11.306 -6.099
101 HB2 ALA 13 2HB ALA 13 -8.389 12.722 -6.201
102 HB3 ALA 13 3HB ALA 13 -7.719 11.163 -5.716
103 H HIS 14 HN HIS 14 -6.169 10.023 -8.769
104 HA HIS 14 HA HIS 14 -4.559 12.442 -9.229
105 HB2 HIS 14 2HB HIS 14 -3.586 9.918 -7.880
106 HB3 HIS 14 1HB HIS 14 -2.524 11.184 -8.478
107 HD1 HIS 14 1HD HIS 14 -4.577 10.215 -5.607
108 HD2 HIS 14 2HD HIS 14 -2.780 13.685 -7.032
109 HE1 HIS 14 1HE HIS 14 -4.557 11.817 -3.662
110 HE2 HIS 14 2HE HIS 14 -3.604 13.960 -4.589
111 H ARG 15 HN ARG 15 -6.100 10.160 -10.732
112 HA ARG 15 HA ARG 15 -4.112 8.790 -12.231
113 HB2 ARG 15 2HB ARG 15 -5.911 7.959 -13.587
114 HB3 ARG 15 1HB ARG 15 -6.429 7.946 -11.909
115 HG2 ARG 15 2HG ARG 15 -7.719 9.971 -12.278
116 HG3 ARG 15 1HG ARG 15 -7.168 10.028 -13.955
117 HD2 ARG 15 2HD ARG 15 -8.232 7.821 -14.327
118 HD3 ARG 15 1HD ARG 15 -8.859 7.880 -12.678
119 HE ARG 15 HE ARG 15 -9.525 10.133 -14.391
120 HH11 ARG 15 1HH1 ARG 15 -10.533 7.038 -13.096
121 HH12 ARG 15 2HH1 ARG 15 -12.219 7.336 -13.354
122 HH21 ARG 15 1HH2 ARG 15 -11.754 10.541 -14.687
123 HH22 ARG 15 2HH2 ARG 15 -12.921 9.333 -14.225
124 H SER 16 HN SER 16 -5.442 11.907 -12.422
125 HA SER 16 HA SER 16 -5.195 12.550 -15.110
126 HB2 SER 16 2HB SER 16 -4.406 14.491 -12.971
127 HB3 SER 16 1HB SER 16 -5.404 14.745 -14.399
128 HG SER 16 HG SER 16 -7.086 14.349 -13.217
129 H SER 17 HN SER 17 -2.800 12.304 -12.564
130 HA SER 17 HA SER 17 -0.669 13.479 -14.085
131 HB2 SER 17 2HB SER 17 -0.743 13.531 -11.600
132 HB3 SER 17 1HB SER 17 -0.545 11.780 -11.578
133 HG SER 17 HG SER 17 1.382 12.708 -13.095
134 H TRP 18 HN TRP 18 -2.154 10.429 -13.911
135 HA TRP 18 HA TRP 18 0.152 9.107 -15.160
136 HB2 TRP 18 2HB TRP 18 -2.314 7.812 -13.965
137 HB3 TRP 18 1HB TRP 18 -0.839 7.001 -14.483
138 HD1 TRP 18 1HD TRP 18 1.221 9.039 -13.030
139 HE1 TRP 18 1HE TRP 18 1.469 8.933 -10.466
140 HE3 TRP 18 3HE TRP 18 -3.174 6.695 -11.900
141 HZ2 TRP 18 2HZ TRP 18 -0.005 7.961 -8.265
142 HZ3 TRP 18 3HZ TRP 18 -3.676 6.205 -9.548
143 HH2 TRP 18 2HH TRP 18 -2.126 6.823 -7.765
144 H LYS 19 HN LYS 19 -1.583 10.966 -16.475
145 HA LYS 19 HA LYS 19 -2.923 9.270 -18.461
146 HB2 LYS 19 2HB LYS 19 -4.546 10.609 -17.189
147 HB3 LYS 19 1HB LYS 19 -3.614 12.061 -17.500
148 HG2 LYS 19 2HG LYS 19 -5.533 12.069 -18.913
149 HG3 LYS 19 1HG LYS 19 -4.108 11.799 -19.918
150 HD2 LYS 19 2HD LYS 19 -4.608 9.494 -20.161
151 HD3 LYS 19 1HD LYS 19 -5.830 9.554 -18.891
152 HE2 LYS 19 2HE LYS 19 -6.798 9.472 -21.163
153 HE3 LYS 19 1HE LYS 19 -7.266 10.911 -20.263
154 HZ1 LYS 19 3HZ LYS 19 -5.629 12.188 -21.482
155 HZ2 LYS 19 1HZ LYS 19 -6.682 11.418 -22.564
156 HZ3 LYS 19 2HZ LYS 19 -5.123 10.808 -22.321
157 H ASN 20 HN ASN 20 -0.762 10.396 -20.760
158 HA ASN 20 HA ASN 20 -2.950 8.751 -19.759
159 HB2 ASN 20 2HB ASN 20 -3.480 9.803 -21.922
160 HB3 ASN 20 1HB ASN 20 -2.026 9.100 -22.623
161 HD21 ASN 20 1HD2 ASN 20 -3.087 7.940 -24.159
162 HD22 ASN 20 2HD2 ASN 20 -4.086 6.573 -23.803
163 H THR 21 HN THR 21 -1.660 7.437 -18.500
164 HA THR 21 HA THR 21 0.018 5.574 -20.038
165 HB THR 21 HB THR 21 1.486 5.296 -18.082
166 HG1 THR 21 1HG THR 21 -0.364 7.085 -16.963
167 HG21 THR 21 3HG2 THR 21 1.242 8.166 -19.005
168 HG22 THR 21 1HG2 THR 21 2.185 6.891 -19.778
169 HG23 THR 21 2HG2 THR 21 2.641 7.477 -18.179
170 H LYS 22 HN LYS 22 0.177 3.429 -19.056
171 HA LYS 22 HA LYS 22 -2.356 2.532 -18.041
172 HB2 LYS 22 2HB LYS 22 0.212 1.218 -18.821
173 HB3 LYS 22 1HB LYS 22 -0.951 0.315 -17.861
174 HG2 LYS 22 2HG LYS 22 -1.815 1.690 -20.369
175 HG3 LYS 22 1HG LYS 22 -0.999 0.128 -20.440
176 HD2 LYS 22 2HD LYS 22 -3.479 0.687 -18.808
177 HD3 LYS 22 1HD LYS 22 -3.486 -0.042 -20.416
178 HE2 LYS 22 2HE LYS 22 -2.079 -1.877 -19.569
179 HE3 LYS 22 1HE LYS 22 -2.130 -1.158 -17.961
180 HZ1 LYS 22 3HZ LYS 22 -3.727 -3.016 -18.373
181 HZ2 LYS 22 1HZ LYS 22 -4.568 -1.993 -19.433
182 HZ3 LYS 22 2HZ LYS 22 -4.432 -1.597 -17.784
183 H HIS 23 HN HIS 23 0.004 4.095 -16.479
184 HA HIS 23 HA HIS 23 0.719 2.469 -14.308
185 HB2 HIS 23 2HB HIS 23 0.542 5.476 -14.536
186 HB3 HIS 23 1HB HIS 23 1.174 4.655 -13.115
187 HD1 HIS 23 1HD HIS 23 3.225 6.353 -14.137
188 HD2 HIS 23 2HD HIS 23 2.524 2.669 -15.948
189 HE1 HIS 23 1HE HIS 23 5.319 5.815 -15.418
190 HE2 HIS 23 2HE HIS 23 4.943 3.507 -16.365
191 H ALA 24 HN ALA 24 -1.983 4.748 -14.670
192 HA ALA 24 HA ALA 24 -2.991 4.590 -12.063
193 HB1 ALA 24 1HB ALA 24 -3.715 6.258 -13.712
194 HB2 ALA 24 2HB ALA 24 -5.084 5.411 -12.990
195 HB3 ALA 24 3HB ALA 24 -4.548 4.994 -14.618
196 H ASP 25 HN ASP 25 -3.551 2.550 -14.876
197 HA ASP 25 HA ASP 25 -5.578 0.938 -13.681
198 HB2 ASP 25 2HB ASP 25 -5.264 1.195 -16.142
199 HB3 ASP 25 1HB ASP 25 -3.761 0.291 -16.018
200 H GLN 26 HN GLN 26 -2.098 0.570 -14.205
201 HA GLN 26 HA GLN 26 -1.843 -2.008 -13.139
202 HB2 GLN 26 2HB GLN 26 0.172 0.233 -13.315
203 HB3 GLN 26 1HB GLN 26 0.561 -1.436 -12.951
204 HG2 GLN 26 2HG GLN 26 -0.704 -0.471 -15.498
205 HG3 GLN 26 1HG GLN 26 1.001 -0.860 -15.288
206 HE21 GLN 26 1HE2 GLN 26 0.874 -2.412 -16.919
207 HE22 GLN 26 2HE2 GLN 26 0.102 -3.946 -16.672
208 H TRP 27 HN TRP 27 -1.645 1.182 -11.594
209 HA TRP 27 HA TRP 27 -0.883 0.428 -9.026
210 HB2 TRP 27 2HB TRP 27 -2.513 2.634 -10.172
211 HB3 TRP 27 1HB TRP 27 -2.691 2.342 -8.448
212 HD1 TRP 27 1HD TRP 27 0.100 3.166 -11.004
213 HE1 TRP 27 1HE TRP 27 1.912 4.524 -9.781
214 HE3 TRP 27 3HE TRP 27 -1.806 2.957 -6.269
215 HZ2 TRP 27 2HZ TRP 27 2.460 5.390 -7.148
216 HZ3 TRP 27 3HZ TRP 27 -0.581 4.082 -4.454
217 HH2 TRP 27 2HH TRP 27 1.505 5.271 -4.886
218 H THR 28 HN THR 28 -4.137 0.619 -10.406
219 HA THR 28 HA THR 28 -5.550 -0.298 -8.173
220 HB THR 28 HB THR 28 -6.329 -0.657 -11.073
221 HG1 THR 28 1HG THR 28 -6.038 1.496 -10.910
222 HG21 THR 28 3HG2 THR 28 -8.620 -0.515 -10.209
223 HG22 THR 28 1HG2 THR 28 -7.991 -0.402 -8.565
224 HG23 THR 28 2HG2 THR 28 -7.751 -1.876 -9.501
225 H ASN 29 HN ASN 29 -4.402 -2.075 -11.049
226 HA ASN 29 HA ASN 29 -5.429 -4.571 -10.433
227 HB2 ASN 29 2HB ASN 29 -2.899 -3.833 -11.910
228 HB3 ASN 29 1HB ASN 29 -3.628 -5.425 -11.920
229 HD21 ASN 29 1HD2 ASN 29 -3.106 -3.520 -14.085
230 HD22 ASN 29 2HD2 ASN 29 -4.637 -3.231 -14.848
231 H THR 30 HN THR 30 -2.289 -3.175 -9.561
232 HA THR 30 HA THR 30 -1.214 -5.517 -8.420
233 HB THR 30 HB THR 30 -0.493 -2.691 -7.647
234 HG1 THR 30 1HG THR 30 -0.412 -2.947 -9.940
235 HG21 THR 30 3HG2 THR 30 1.109 -5.248 -7.682
236 HG22 THR 30 1HG2 THR 30 0.499 -4.428 -6.245
237 HG23 THR 30 2HG2 THR 30 1.728 -3.653 -7.247
238 H ILE 31 HN ILE 31 -2.690 -2.658 -6.862
239 HA ILE 31 HA ILE 31 -2.414 -3.640 -4.231
240 HB ILE 31 HB ILE 31 -4.345 -1.573 -5.298
241 HG12 ILE 31 2HG1 ILE 31 -1.650 -1.225 -3.959
242 HG13 ILE 31 1HG1 ILE 31 -1.943 -1.066 -5.687
243 HG21 ILE 31 1HG2 ILE 31 -4.428 -0.768 -2.962
244 HG22 ILE 31 2HG2 ILE 31 -3.494 -2.181 -2.471
245 HG23 ILE 31 3HG2 ILE 31 -5.105 -2.384 -3.160
246 HD11 ILE 31 3HD1 ILE 31 -3.453 0.813 -5.244
247 HD12 ILE 31 1HD1 ILE 31 -1.821 1.107 -4.645
248 HD13 ILE 31 2HD1 ILE 31 -3.106 0.664 -3.521
249 H LYS 32 HN LYS 32 -5.038 -3.774 -6.576
250 HA LYS 32 HA LYS 32 -7.055 -4.842 -4.955
251 HB2 LYS 32 2HB LYS 32 -7.332 -3.941 -7.269
252 HB3 LYS 32 1HB LYS 32 -6.558 -5.386 -7.888
253 HG2 LYS 32 2HG LYS 32 -8.372 -6.753 -7.015
254 HG3 LYS 32 1HG LYS 32 -9.151 -5.309 -6.364
255 HD2 LYS 32 2HD LYS 32 -9.337 -4.389 -8.618
256 HD3 LYS 32 1HD LYS 32 -8.556 -5.828 -9.273
257 HE2 LYS 32 2HE LYS 32 -10.388 -7.206 -8.445
258 HE3 LYS 32 1HE LYS 32 -11.169 -5.775 -7.772
259 HZ1 LYS 32 3HZ LYS 32 -12.104 -6.425 -9.918
260 HZ2 LYS 32 1HZ LYS 32 -10.591 -6.209 -10.652
261 HZ3 LYS 32 2HZ LYS 32 -11.405 -4.880 -9.984
262 H THR 33 HN THR 33 -4.354 -6.342 -6.603
263 HA THR 33 HA THR 33 -5.357 -9.023 -6.242
264 HB THR 33 HB THR 33 -2.659 -8.045 -7.219
265 HG1 THR 33 1HG THR 33 -4.090 -7.464 -8.760
266 HG21 THR 33 3HG2 THR 33 -3.929 -10.789 -7.376
267 HG22 THR 33 1HG2 THR 33 -2.526 -10.350 -6.402
268 HG23 THR 33 2HG2 THR 33 -2.425 -10.308 -8.161
269 H TYR 34 HN TYR 34 -2.576 -7.180 -4.945
270 HA TYR 34 HA TYR 34 -1.846 -9.395 -3.253
271 HB2 TYR 34 2HB TYR 34 -0.697 -6.623 -3.546
272 HB3 TYR 34 1HB TYR 34 -0.040 -7.843 -2.459
273 HD1 TYR 34 2HD TYR 34 0.697 -10.071 -3.497
274 HD2 TYR 34 1HD TYR 34 -0.035 -6.570 -5.796
275 HE1 TYR 34 2HE TYR 34 2.008 -11.019 -5.345
276 HE2 TYR 34 1HE TYR 34 1.271 -7.515 -7.653
277 HH TYR 34 HH TYR 34 2.091 -10.745 -7.855
278 H CYS 35 HN CYS 35 -3.106 -6.113 -2.666
279 HA CYS 35 HA CYS 35 -3.120 -6.644 0.196
280 HB2 CYS 35 2HB CYS 35 -3.954 -4.136 -1.270
281 HB3 CYS 35 1HB CYS 35 -3.617 -4.295 0.452
282 HG CYS 35 HG CYS 35 -0.863 -5.157 -0.288
283 H GLY 36 HN GLY 36 -5.256 -6.768 -2.440
284 HA2 GLY 36 2HA GLY 36 -7.682 -5.899 -1.448
285 HA3 GLY 36 1HA GLY 36 -7.494 -7.147 -2.662
286 HA PRO 37 HA PRO 37 -9.067 -10.299 -0.157
287 HB2 PRO 37 2HB PRO 37 -6.598 -11.883 0.059
288 HB3 PRO 37 1HB PRO 37 -8.124 -12.285 -0.731
289 HG2 PRO 37 2HG PRO 37 -5.900 -11.714 -2.133
290 HG3 PRO 37 1HG PRO 37 -7.517 -11.271 -2.712
291 HD2 PRO 37 2HD PRO 37 -5.423 -9.567 -1.434
292 HD3 PRO 37 1HD PRO 37 -6.536 -9.183 -2.763
293 H VAL 38 HN VAL 38 -6.164 -8.888 1.100
294 HA VAL 38 HA VAL 38 -6.496 -10.222 3.676
295 HB VAL 38 HB VAL 38 -4.300 -8.323 2.857
296 HG11 VAL 38 1HG1 VAL 38 -3.085 -9.331 4.736
297 HG12 VAL 38 2HG1 VAL 38 -4.509 -10.291 5.131
298 HG13 VAL 38 3HG1 VAL 38 -4.569 -8.533 5.261
299 HG21 VAL 38 3HG2 VAL 38 -4.256 -10.229 1.376
300 HG22 VAL 38 1HG2 VAL 38 -4.378 -11.336 2.744
301 HG23 VAL 38 2HG2 VAL 38 -2.928 -10.355 2.531
302 H ILE 39 HN ILE 39 -5.645 -6.858 2.801
303 HA ILE 39 HA ILE 39 -7.149 -6.012 5.183
304 HB ILE 39 HB ILE 39 -5.779 -3.943 5.103
305 HG12 ILE 39 2HG1 ILE 39 -4.184 -5.426 2.999
306 HG13 ILE 39 1HG1 ILE 39 -5.217 -4.035 2.690
307 HG21 ILE 39 1HG2 ILE 39 -4.213 -6.517 5.295
308 HG22 ILE 39 2HG2 ILE 39 -5.162 -5.776 6.580
309 HG23 ILE 39 3HG2 ILE 39 -3.724 -4.964 5.968
310 HD11 ILE 39 3HD1 ILE 39 -2.912 -3.354 2.792
311 HD12 ILE 39 1HD1 ILE 39 -2.740 -4.072 4.392
312 HD13 ILE 39 2HD1 ILE 39 -3.796 -2.680 4.160
313 H GLY 40 HN GLY 40 -7.603 -6.239 2.000
314 HA2 GLY 40 2HA GLY 40 -8.326 -3.746 1.042
315 HA3 GLY 40 1HA GLY 40 -9.027 -5.261 0.504
316 HA PRO 41 HA PRO 41 -12.866 -4.256 2.398
317 HB2 PRO 41 2HB PRO 41 -13.695 -6.439 3.727
318 HB3 PRO 41 1HB PRO 41 -13.516 -6.430 1.968
319 HG2 PRO 41 2HG PRO 41 -11.642 -7.487 4.053
320 HG3 PRO 41 1HG PRO 41 -12.157 -8.241 2.531
321 HD2 PRO 41 2HD PRO 41 -9.791 -6.933 2.809
322 HD3 PRO 41 1HD PRO 41 -10.682 -7.001 1.276
323 H LEU 42 HN LEU 42 -10.259 -4.423 4.364
324 HA LEU 42 HA LEU 42 -11.692 -4.128 6.876
325 HB2 LEU 42 2HB LEU 42 -8.743 -3.960 6.249
326 HB3 LEU 42 1HB LEU 42 -9.436 -3.872 7.856
327 HG LEU 42 HG LEU 42 -9.525 -6.260 6.016
328 HD11 LEU 42 1HD1 LEU 42 -8.084 -7.305 7.677
329 HD12 LEU 42 2HD1 LEU 42 -8.055 -5.806 8.608
330 HD13 LEU 42 3HD1 LEU 42 -7.327 -5.860 7.002
331 HD21 LEU 42 3HD2 LEU 42 -10.597 -5.916 8.812
332 HD22 LEU 42 1HD2 LEU 42 -10.531 -7.433 7.915
333 HD23 LEU 42 2HD2 LEU 42 -11.555 -6.115 7.346
334 H SER 43 HN SER 43 -11.537 -2.208 8.162
335 HA SER 43 HA SER 43 -11.914 0.178 6.774
336 HB2 SER 43 2HB SER 43 -11.144 -0.231 9.666
337 HB3 SER 43 1HB SER 43 -11.995 1.133 8.982
338 HG SER 43 HG SER 43 -13.383 -0.393 10.023
339 H VAL 44 HN VAL 44 -10.557 1.941 6.444
340 HA VAL 44 HA VAL 44 -7.831 1.303 5.990
341 HB VAL 44 HB VAL 44 -9.054 2.894 4.582
342 HG11 VAL 44 1HG1 VAL 44 -9.472 5.184 5.333
343 HG12 VAL 44 2HG1 VAL 44 -8.955 4.741 6.961
344 HG13 VAL 44 3HG1 VAL 44 -10.399 4.007 6.263
345 HG21 VAL 44 3HG2 VAL 44 -7.309 4.584 4.369
346 HG22 VAL 44 1HG2 VAL 44 -6.632 2.972 4.601
347 HG23 VAL 44 2HG2 VAL 44 -6.661 4.117 5.943
348 H GLN 45 HN GLN 45 -9.506 2.812 8.650
349 HA GLN 45 HA GLN 45 -7.088 3.739 9.929
350 HB2 GLN 45 2HB GLN 45 -9.319 4.807 10.291
351 HB3 GLN 45 1HB GLN 45 -9.830 3.355 11.141
352 HG2 GLN 45 2HG GLN 45 -8.140 3.702 12.830
353 HG3 GLN 45 1HG GLN 45 -7.515 5.098 11.954
354 HE21 GLN 45 1HE2 GLN 45 -7.860 6.485 13.651
355 HE22 GLN 45 2HE2 GLN 45 -9.442 6.990 14.135
356 H ASP 46 HN ASP 46 -8.816 0.805 9.676
357 HA ASP 46 HA ASP 46 -7.815 -0.309 12.161
358 HB2 ASP 46 2HB ASP 46 -9.713 -1.221 10.053
359 HB3 ASP 46 1HB ASP 46 -8.930 -2.438 11.051
360 H VAL 47 HN VAL 47 -6.399 0.266 9.311
361 HA VAL 47 HA VAL 47 -5.038 -2.218 8.898
362 HB VAL 47 HB VAL 47 -4.258 0.554 7.974
363 HG11 VAL 47 1HG1 VAL 47 -3.338 -2.154 7.010
364 HG12 VAL 47 2HG1 VAL 47 -2.380 -1.016 7.956
365 HG13 VAL 47 3HG1 VAL 47 -2.879 -0.598 6.317
366 HG21 VAL 47 3HG2 VAL 47 -5.752 -1.615 6.506
367 HG22 VAL 47 1HG2 VAL 47 -5.275 -0.049 5.852
368 HG23 VAL 47 2HG2 VAL 47 -6.464 -0.136 7.153
369 H ASP 48 HN ASP 48 -3.877 -2.980 10.548
370 HA ASP 48 HA ASP 48 -2.099 -1.173 12.019
371 HB2 ASP 48 2HB ASP 48 -3.132 -3.939 12.619
372 HB3 ASP 48 1HB ASP 48 -1.755 -3.267 13.479
373 H THR 49 HN THR 49 0.023 -2.242 12.680
374 HA THR 49 HA THR 49 1.527 -2.750 10.343
375 HB THR 49 HB THR 49 3.045 -3.618 12.532
376 HG1 THR 49 1HG THR 49 2.486 -1.464 13.786
377 HG21 THR 49 3HG2 THR 49 2.822 -0.867 11.299
378 HG22 THR 49 1HG2 THR 49 3.833 -2.187 10.714
379 HG23 THR 49 2HG2 THR 49 4.170 -1.444 12.276
380 H LYS 50 HN LYS 50 0.150 -4.804 12.835
381 HA LYS 50 HA LYS 50 1.442 -7.215 12.213
382 HB2 LYS 50 2HB LYS 50 -0.165 -6.509 14.188
383 HB3 LYS 50 1HB LYS 50 -1.412 -7.156 13.136
384 HG2 LYS 50 2HG LYS 50 1.003 -8.715 14.030
385 HG3 LYS 50 1HG LYS 50 -0.553 -8.741 14.854
386 HD2 LYS 50 2HD LYS 50 -1.617 -9.616 12.848
387 HD3 LYS 50 1HD LYS 50 -0.079 -9.547 11.985
388 HE2 LYS 50 2HE LYS 50 0.866 -11.124 13.641
389 HE3 LYS 50 1HE LYS 50 -0.722 -11.244 14.397
390 HZ1 LYS 50 3HZ LYS 50 -0.369 -13.084 12.903
391 HZ2 LYS 50 1HZ LYS 50 -0.036 -12.030 11.614
392 HZ3 LYS 50 2HZ LYS 50 -1.595 -12.088 12.283
393 H LEU 51 HN LEU 51 -1.515 -5.734 10.977
394 HA LEU 51 HA LEU 51 -2.282 -7.880 9.305
395 HB2 LEU 51 2HB LEU 51 -2.966 -4.944 9.215
396 HB3 LEU 51 1HB LEU 51 -3.753 -6.171 8.250
397 HG LEU 51 HG LEU 51 -3.803 -5.991 11.255
398 HD11 LEU 51 1HD1 LEU 51 -6.169 -5.472 10.950
399 HD12 LEU 51 2HD1 LEU 51 -5.954 -5.512 9.200
400 HD13 LEU 51 3HD1 LEU 51 -5.145 -4.272 10.158
401 HD21 LEU 51 3HD2 LEU 51 -5.427 -7.821 11.127
402 HD22 LEU 51 1HD2 LEU 51 -3.855 -8.307 10.495
403 HD23 LEU 51 2HD2 LEU 51 -5.171 -7.920 9.386
404 H ILE 52 HN ILE 52 -0.364 -4.969 8.813
405 HA ILE 52 HA ILE 52 0.020 -5.176 6.039
406 HB ILE 52 HB ILE 52 1.786 -3.980 8.179
407 HG12 ILE 52 2HG1 ILE 52 -0.105 -2.684 6.203
408 HG13 ILE 52 1HG1 ILE 52 -0.488 -3.004 7.890
409 HG21 ILE 52 1HG2 ILE 52 2.897 -2.755 6.367
410 HG22 ILE 52 2HG2 ILE 52 1.976 -3.682 5.182
411 HG23 ILE 52 3HG2 ILE 52 3.137 -4.495 6.233
412 HD11 ILE 52 3HD1 ILE 52 1.690 -1.182 6.891
413 HD12 ILE 52 1HD1 ILE 52 1.297 -1.498 8.581
414 HD13 ILE 52 2HD1 ILE 52 0.129 -0.683 7.543
415 H MET 53 HN MET 53 1.751 -6.602 8.764
416 HA MET 53 HA MET 53 3.895 -7.735 7.350
417 HB2 MET 53 2HB MET 53 2.502 -8.667 9.866
418 HB3 MET 53 1HB MET 53 4.003 -9.355 9.263
419 HG2 MET 53 2HG MET 53 5.133 -7.244 9.546
420 HG3 MET 53 1HG MET 53 3.625 -6.467 10.032
421 HE1 MET 53 3HE MET 53 6.311 -6.278 11.721
422 HE2 MET 53 1HE MET 53 5.704 -6.532 13.359
423 HE3 MET 53 2HE MET 53 4.802 -5.522 12.229
424 H LYS 54 HN LYS 54 0.623 -8.908 7.972
425 HA LYS 54 HA LYS 54 0.928 -11.517 6.989
426 HB2 LYS 54 2HB LYS 54 -1.522 -9.744 6.953
427 HB3 LYS 54 1HB LYS 54 -1.532 -11.474 6.646
428 HG2 LYS 54 2HG LYS 54 -0.622 -11.815 8.942
429 HG3 LYS 54 1HG LYS 54 -0.830 -10.085 9.221
430 HD2 LYS 54 2HD LYS 54 -2.733 -11.290 10.113
431 HD3 LYS 54 1HD LYS 54 -3.239 -10.324 8.724
432 HE2 LYS 54 2HE LYS 54 -3.086 -12.327 7.303
433 HE3 LYS 54 1HE LYS 54 -2.631 -13.279 8.713
434 HZ1 LYS 54 3HZ LYS 54 -4.773 -12.824 9.698
435 HZ2 LYS 54 1HZ LYS 54 -4.985 -13.491 8.156
436 HZ3 LYS 54 2HZ LYS 54 -5.208 -11.828 8.395
437 H VAL 55 HN VAL 55 0.265 -8.473 5.365
438 HA VAL 55 HA VAL 55 -0.335 -9.620 2.822
439 HB VAL 55 HB VAL 55 0.596 -6.808 3.408
440 HG11 VAL 55 1HG1 VAL 55 -0.639 -6.243 1.356
441 HG12 VAL 55 2HG1 VAL 55 -0.970 -7.957 1.102
442 HG13 VAL 55 3HG1 VAL 55 0.690 -7.363 1.056
443 HG21 VAL 55 3HG2 VAL 55 -1.327 -7.353 4.788
444 HG22 VAL 55 1HG2 VAL 55 -2.211 -7.899 3.363
445 HG23 VAL 55 2HG2 VAL 55 -1.763 -6.201 3.526
446 H LEU 56 HN LEU 56 2.556 -8.186 4.275
447 HA LEU 56 HA LEU 56 4.022 -8.167 1.821
448 HB2 LEU 56 2HB LEU 56 4.890 -7.744 4.673
449 HB3 LEU 56 1HB LEU 56 5.950 -7.550 3.293
450 HG LEU 56 HG LEU 56 3.473 -5.927 3.873
451 HD11 LEU 56 1HD1 LEU 56 6.404 -5.232 3.961
452 HD12 LEU 56 2HD1 LEU 56 5.311 -5.363 5.338
453 HD13 LEU 56 3HD1 LEU 56 5.080 -4.083 4.146
454 HD21 LEU 56 3HD2 LEU 56 4.133 -4.578 1.944
455 HD22 LEU 56 1HD2 LEU 56 3.785 -6.240 1.471
456 HD23 LEU 56 2HD2 LEU 56 5.457 -5.695 1.611
457 H ASP 57 HN ASP 57 3.823 -10.362 4.548
458 HA ASP 57 HA ASP 57 6.219 -11.689 4.427
459 HB2 ASP 57 2HB ASP 57 4.331 -12.037 6.082
460 HB3 ASP 57 1HB ASP 57 3.614 -13.120 4.910
461 HA PRO 58 HA PRO 58 4.551 -14.968 1.299
462 HB2 PRO 58 2HB PRO 58 2.401 -14.221 -0.232
463 HB3 PRO 58 1HB PRO 58 2.284 -15.180 1.245
464 HG2 PRO 58 2HG PRO 58 1.797 -12.271 0.827
465 HG3 PRO 58 1HG PRO 58 0.932 -13.418 1.864
466 HD2 PRO 58 2HD PRO 58 2.744 -11.635 2.812
467 HD3 PRO 58 1HD PRO 58 2.464 -13.213 3.573
468 H ILE 59 HN ILE 59 4.583 -11.559 0.631
469 HA ILE 59 HA ILE 59 5.088 -11.861 -2.190
470 HB ILE 59 HB ILE 59 5.469 -9.381 -0.502
471 HG12 ILE 59 2HG1 ILE 59 3.030 -10.280 -2.056
472 HG13 ILE 59 1HG1 ILE 59 3.173 -10.279 -0.301
473 HG21 ILE 59 1HG2 ILE 59 6.556 -9.245 -2.660
474 HG22 ILE 59 2HG2 ILE 59 5.120 -8.220 -2.658
475 HG23 ILE 59 3HG2 ILE 59 5.083 -9.787 -3.466
476 HD11 ILE 59 3HD1 ILE 59 3.370 -7.859 -0.304
477 HD12 ILE 59 1HD1 ILE 59 1.900 -8.365 -1.135
478 HD13 ILE 59 2HD1 ILE 59 3.305 -7.842 -2.066
479 H TRP 60 HN TRP 60 6.971 -11.602 0.732
480 HA TRP 60 HA TRP 60 9.441 -10.800 -0.326
481 HB2 TRP 60 2HB TRP 60 8.837 -12.593 2.034
482 HB3 TRP 60 1HB TRP 60 10.448 -12.012 1.640
483 HD1 TRP 60 1HD TRP 60 7.588 -11.191 3.741
484 HE1 TRP 60 1HE TRP 60 7.741 -8.779 4.618
485 HE3 TRP 60 3HE TRP 60 11.239 -9.424 0.633
486 HZ2 TRP 60 2HZ TRP 60 9.207 -6.439 4.069
487 HZ3 TRP 60 3HZ TRP 60 11.961 -7.084 0.878
488 HH2 TRP 60 2HH TRP 60 10.964 -5.625 2.561
489 H GLU 61 HN GLU 61 7.823 -13.884 -0.389
490 HA GLU 61 HA GLU 61 10.106 -15.464 -0.977
491 HB2 GLU 61 2HB GLU 61 7.147 -15.851 -0.969
492 HB3 GLU 61 1HB GLU 61 8.164 -17.045 -1.747
493 HG2 GLU 61 2HG GLU 61 8.409 -16.146 1.106
494 HG3 GLU 61 1HG GLU 61 7.643 -17.638 0.565
495 H GLN 62 HN GLN 62 8.094 -13.431 -2.843
496 HA GLN 62 HA GLN 62 8.967 -14.740 -5.320
497 HB2 GLN 62 2HB GLN 62 6.529 -13.138 -4.631
498 HB3 GLN 62 1HB GLN 62 7.065 -13.276 -6.298
499 HG2 GLN 62 2HG GLN 62 6.448 -15.605 -4.501
500 HG3 GLN 62 1HG GLN 62 5.331 -14.918 -5.680
501 HE21 GLN 62 1HE2 GLN 62 6.546 -17.601 -5.483
502 HE22 GLN 62 2HE2 GLN 62 7.332 -17.857 -7.011
503 H LYS 63 HN LYS 63 8.297 -11.493 -3.994
504 HA LYS 63 HA LYS 63 10.501 -10.470 -5.631
505 HB2 LYS 63 2HB LYS 63 7.841 -9.057 -5.530
506 HB3 LYS 63 1HB LYS 63 9.216 -8.692 -6.559
507 HG2 LYS 63 2HG LYS 63 8.869 -10.858 -7.711
508 HG3 LYS 63 1HG LYS 63 7.415 -11.099 -6.743
509 HD2 LYS 63 2HD LYS 63 6.610 -8.876 -7.651
510 HD3 LYS 63 1HD LYS 63 7.952 -8.967 -8.794
511 HE2 LYS 63 2HE LYS 63 5.653 -10.892 -8.512
512 HE3 LYS 63 1HE LYS 63 5.981 -9.814 -9.863
513 HZ1 LYS 63 3HZ LYS 63 7.476 -12.241 -9.071
514 HZ2 LYS 63 1HZ LYS 63 8.120 -11.097 -10.142
515 HZ3 LYS 63 2HZ LYS 63 6.693 -11.925 -10.536
516 HA PRO 64 HA PRO 64 10.751 -8.980 -1.268
517 HB2 PRO 64 2HB PRO 64 13.476 -8.552 -1.447
518 HB3 PRO 64 1HB PRO 64 12.726 -10.057 -0.906
519 HG2 PRO 64 2HG PRO 64 13.819 -9.343 -3.593
520 HG3 PRO 64 1HG PRO 64 13.942 -10.870 -2.700
521 HD2 PRO 64 2HD PRO 64 12.207 -10.567 -4.727
522 HD3 PRO 64 1HD PRO 64 11.798 -11.532 -3.292
523 H GLU 65 HN GLU 65 12.547 -7.603 -4.023
524 HA GLU 65 HA GLU 65 12.746 -5.007 -3.036
525 HB2 GLU 65 2HB GLU 65 12.760 -6.173 -5.799
526 HB3 GLU 65 1HB GLU 65 12.978 -4.464 -5.514
527 HG2 GLU 65 2HG GLU 65 14.727 -6.660 -4.453
528 HG3 GLU 65 1HG GLU 65 15.111 -5.586 -5.798
529 H THR 66 HN THR 66 10.287 -6.593 -4.999
530 HA THR 66 HA THR 66 8.826 -4.216 -5.547
531 HB THR 66 HB THR 66 7.721 -7.021 -5.664
532 HG1 THR 66 1HG THR 66 8.623 -6.454 -8.023
533 HG21 THR 66 3HG2 THR 66 6.461 -6.099 -7.580
534 HG22 THR 66 1HG2 THR 66 7.186 -4.519 -7.277
535 HG23 THR 66 2HG2 THR 66 6.112 -5.240 -6.079
536 H ALA 67 HN ALA 67 8.649 -6.719 -3.081
537 HA ALA 67 HA ALA 67 6.210 -5.999 -1.902
538 HB1 ALA 67 1HB ALA 67 7.015 -7.128 0.090
539 HB2 ALA 67 2HB ALA 67 8.669 -7.067 -0.517
540 HB3 ALA 67 3HB ALA 67 7.463 -8.053 -1.344
541 H SER 68 HN SER 68 9.497 -4.830 -1.366
542 HA SER 68 HA SER 68 8.853 -3.035 0.730
543 HB2 SER 68 2HB SER 68 11.191 -2.944 -1.191
544 HB3 SER 68 1HB SER 68 11.098 -2.143 0.377
545 HG SER 68 HG SER 68 11.234 -4.918 -0.183
546 H ARG 69 HN ARG 69 9.031 -2.710 -2.780
547 HA ARG 69 HA ARG 69 8.671 0.110 -2.787
548 HB2 ARG 69 2HB ARG 69 8.373 -1.950 -4.972
549 HB3 ARG 69 1HB ARG 69 8.336 -0.217 -5.223
550 HG2 ARG 69 2HG ARG 69 10.634 -0.160 -4.143
551 HG3 ARG 69 1HG ARG 69 10.632 -1.912 -4.343
552 HD2 ARG 69 2HD ARG 69 11.759 -0.982 -6.221
553 HD3 ARG 69 1HD ARG 69 10.182 -1.544 -6.777
554 HE ARG 69 HE ARG 69 10.002 1.168 -6.028
555 HH11 ARG 69 1HH1 ARG 69 11.414 -0.851 -8.530
556 HH12 ARG 69 2HH1 ARG 69 11.347 0.396 -9.746
557 HH21 ARG 69 1HH2 ARG 69 9.969 2.816 -7.600
558 HH22 ARG 69 2HH2 ARG 69 10.515 2.485 -9.218
559 H LEU 70 HN LEU 70 6.500 -2.662 -3.219
560 HA LEU 70 HA LEU 70 4.163 -1.180 -3.791
561 HB2 LEU 70 2HB LEU 70 4.318 -3.589 -4.174
562 HB3 LEU 70 1HB LEU 70 4.485 -3.872 -2.453
563 HG LEU 70 HG LEU 70 2.191 -2.993 -2.111
564 HD11 LEU 70 1HD1 LEU 70 2.116 -2.930 -5.122
565 HD12 LEU 70 2HD1 LEU 70 2.036 -1.536 -4.043
566 HD13 LEU 70 3HD1 LEU 70 0.727 -2.720 -4.056
567 HD21 LEU 70 3HD2 LEU 70 2.399 -5.257 -4.090
568 HD22 LEU 70 1HD2 LEU 70 1.031 -4.930 -3.028
569 HD23 LEU 70 2HD2 LEU 70 2.590 -5.391 -2.343
570 H ARG 71 HN ARG 71 5.742 -2.142 -0.835
571 HA ARG 71 HA ARG 71 3.893 -1.413 1.092
572 HB2 ARG 71 2HB ARG 71 6.318 -2.434 1.193
573 HB3 ARG 71 1HB ARG 71 6.803 -0.761 1.407
574 HG2 ARG 71 2HG ARG 71 4.836 -2.196 3.166
575 HG3 ARG 71 1HG ARG 71 6.558 -2.039 3.507
576 HD2 ARG 71 2HD ARG 71 6.211 0.467 3.343
577 HD3 ARG 71 1HD ARG 71 4.481 0.123 3.365
578 HE ARG 71 HE ARG 71 6.385 -0.297 5.551
579 HH11 ARG 71 1HH1 ARG 71 3.093 -0.380 4.357
580 HH12 ARG 71 2HH1 ARG 71 2.391 -0.565 5.929
581 HH21 ARG 71 1HH2 ARG 71 5.473 -0.536 7.613
582 HH22 ARG 71 2HH2 ARG 71 3.751 -0.610 7.803
583 H GLY 72 HN GLY 72 6.147 0.575 -0.757
584 HA2 GLY 72 2HA GLY 72 5.696 3.025 0.570
585 HA3 GLY 72 1HA GLY 72 6.313 2.841 -1.064
586 H ARG 73 HN ARG 73 3.918 1.383 -1.974
587 HA ARG 73 HA ARG 73 2.350 3.617 -2.758
588 HB2 ARG 73 2HB ARG 73 1.646 0.679 -2.949
589 HB3 ARG 73 1HB ARG 73 0.855 1.988 -3.815
590 HG2 ARG 73 2HG ARG 73 3.093 2.464 -4.887
591 HG3 ARG 73 1HG ARG 73 3.650 0.941 -4.190
592 HD2 ARG 73 2HD ARG 73 1.725 -0.183 -5.356
593 HD3 ARG 73 1HD ARG 73 1.414 1.348 -6.171
594 HE ARG 73 HE ARG 73 4.092 0.686 -6.592
595 HH11 ARG 73 1HH1 ARG 73 0.914 -0.494 -7.445
596 HH12 ARG 73 2HH1 ARG 73 1.446 -1.260 -8.908
597 HH21 ARG 73 1HH2 ARG 73 4.804 -0.324 -8.534
598 HH22 ARG 73 2HH2 ARG 73 3.639 -1.158 -9.533
599 H ILE 74 HN ILE 74 2.068 1.173 -0.263
600 HA ILE 74 HA ILE 74 -0.572 1.739 0.554
601 HB ILE 74 HB ILE 74 1.717 0.690 2.234
602 HG12 ILE 74 2HG1 ILE 74 -0.386 -0.822 0.664
603 HG13 ILE 74 1HG1 ILE 74 1.302 -0.648 0.191
604 HG21 ILE 74 1HG2 ILE 74 -1.267 0.475 2.635
605 HG22 ILE 74 2HG2 ILE 74 -0.170 1.492 3.568
606 HG23 ILE 74 3HG2 ILE 74 -0.030 -0.264 3.653
607 HD11 ILE 74 3HD1 ILE 74 1.992 -1.881 2.168
608 HD12 ILE 74 1HD1 ILE 74 0.855 -2.818 1.199
609 HD13 ILE 74 2HD1 ILE 74 0.308 -2.025 2.676
610 H GLU 75 HN GLU 75 2.583 2.955 1.597
611 HA GLU 75 HA GLU 75 1.792 4.761 3.568
612 HB2 GLU 75 2HB GLU 75 4.108 4.335 3.263
613 HB3 GLU 75 1HB GLU 75 4.054 4.782 1.575
614 HG2 GLU 75 2HG GLU 75 5.197 6.450 2.947
615 HG3 GLU 75 1HG GLU 75 3.773 7.103 2.144
616 H SER 76 HN SER 76 2.060 5.149 0.091
617 HA SER 76 HA SER 76 1.467 7.862 -0.097
618 HB2 SER 76 2HB SER 76 0.783 5.704 -2.087
619 HB3 SER 76 1HB SER 76 0.943 7.423 -2.435
620 HG SER 76 HG SER 76 3.007 5.704 -1.488
621 H VAL 77 HN VAL 77 -0.697 5.063 -0.093
622 HA VAL 77 HA VAL 77 -3.083 6.586 -0.438
623 HB VAL 77 HB VAL 77 -2.729 3.786 0.640
624 HG11 VAL 77 1HG1 VAL 77 -4.874 4.714 1.299
625 HG12 VAL 77 2HG1 VAL 77 -5.094 3.481 0.055
626 HG13 VAL 77 3HG1 VAL 77 -5.199 5.189 -0.370
627 HG21 VAL 77 3HG2 VAL 77 -3.390 4.754 -2.139
628 HG22 VAL 77 1HG2 VAL 77 -3.332 3.068 -1.625
629 HG23 VAL 77 2HG2 VAL 77 -1.860 4.041 -1.627
630 H LEU 78 HN LEU 78 -1.512 5.107 2.397
631 HA LEU 78 HA LEU 78 -3.553 5.732 4.231
632 HB2 LEU 78 2HB LEU 78 -0.639 5.112 4.602
633 HB3 LEU 78 1HB LEU 78 -1.720 5.380 5.955
634 HG LEU 78 HG LEU 78 -1.953 3.182 3.899
635 HD11 LEU 78 1HD1 LEU 78 -0.131 2.797 5.432
636 HD12 LEU 78 2HD1 LEU 78 -1.469 1.717 5.824
637 HD13 LEU 78 3HD1 LEU 78 -1.172 3.148 6.811
638 HD21 LEU 78 3HD2 LEU 78 -4.146 3.967 4.677
639 HD22 LEU 78 1HD2 LEU 78 -3.637 3.718 6.346
640 HD23 LEU 78 2HD2 LEU 78 -3.786 2.340 5.254
641 H ASP 79 HN ASP 79 -0.523 7.439 3.472
642 HA ASP 79 HA ASP 79 -0.794 9.493 5.371
643 HB2 ASP 79 2HB ASP 79 1.270 9.014 4.061
644 HB3 ASP 79 1HB ASP 79 0.485 9.685 2.636
645 H TRP 80 HN TRP 80 -2.026 9.147 2.103
646 HA TRP 80 HA TRP 80 -3.216 11.700 1.862
647 HB2 TRP 80 2HB TRP 80 -2.802 10.237 -0.058
648 HB3 TRP 80 1HB TRP 80 -3.934 9.052 0.576
649 HD1 TRP 80 1HD TRP 80 -3.936 12.647 -0.853
650 HE1 TRP 80 1HE TRP 80 -6.216 13.048 -1.989
651 HE3 TRP 80 3HE TRP 80 -6.245 8.269 0.417
652 HZ2 TRP 80 2HZ TRP 80 -8.674 11.681 -2.291
653 HZ3 TRP 80 3HZ TRP 80 -8.559 7.896 -0.328
654 HH2 TRP 80 2HH TRP 80 -9.745 9.565 -1.652
655 H ALA 81 HN ALA 81 -4.334 8.600 3.111
656 HA ALA 81 HA ALA 81 -7.006 9.326 3.617
657 HB1 ALA 81 1HB ALA 81 -6.250 7.010 3.561
658 HB2 ALA 81 2HB ALA 81 -7.069 7.373 5.079
659 HB3 ALA 81 3HB ALA 81 -5.309 7.270 5.028
660 H THR 82 HN THR 82 -4.055 9.680 5.517
661 HA THR 82 HA THR 82 -5.175 10.555 7.926
662 HB THR 82 HB THR 82 -2.583 11.446 6.648
663 HG1 THR 82 1HG THR 82 -1.725 9.749 8.030
664 HG21 THR 82 3HG2 THR 82 -3.415 11.456 9.551
665 HG22 THR 82 1HG2 THR 82 -3.288 12.881 8.518
666 HG23 THR 82 2HG2 THR 82 -1.845 11.944 8.912
667 H VAL 83 HN VAL 83 -4.233 12.376 5.022
668 HA VAL 83 HA VAL 83 -4.994 14.926 5.981
669 HB VAL 83 HB VAL 83 -4.887 13.954 3.119
670 HG11 VAL 83 1HG1 VAL 83 -4.760 16.742 4.261
671 HG12 VAL 83 2HG1 VAL 83 -6.095 16.056 3.334
672 HG13 VAL 83 3HG1 VAL 83 -4.527 16.320 2.566
673 HG21 VAL 83 3HG2 VAL 83 -2.620 14.862 3.080
674 HG22 VAL 83 1HG2 VAL 83 -2.767 13.570 4.270
675 HG23 VAL 83 2HG2 VAL 83 -2.740 15.255 4.794
676 H ARG 84 HN ARG 84 -6.700 12.402 4.222
677 HA ARG 84 HA ARG 84 -9.081 13.838 3.711
678 HB2 ARG 84 2HB ARG 84 -8.489 10.890 3.912
679 HB3 ARG 84 1HB ARG 84 -10.068 11.516 3.463
680 HG2 ARG 84 2HG ARG 84 -7.586 12.290 1.977
681 HG3 ARG 84 1HG ARG 84 -8.488 10.821 1.596
682 HD2 ARG 84 2HD ARG 84 -9.735 13.560 1.683
683 HD3 ARG 84 1HD ARG 84 -9.066 12.841 0.219
684 HE ARG 84 HE ARG 84 -10.783 10.946 1.099
685 HH11 ARG 84 1HH1 ARG 84 -11.142 14.378 0.559
686 HH12 ARG 84 2HH1 ARG 84 -12.785 14.256 0.015
687 HH21 ARG 84 1HH2 ARG 84 -12.955 10.768 0.415
688 HH22 ARG 84 2HH2 ARG 84 -13.834 12.199 -0.040
689 H GLY 85 HN GLY 85 -7.862 12.284 6.542
690 HA2 GLY 85 2HA GLY 85 -8.715 12.773 8.697
691 HA3 GLY 85 1HA GLY 85 -10.276 13.126 7.971
692 H TYR 86 HN TYR 86 -8.631 10.262 6.973
693 HA TYR 86 HA TYR 86 -10.695 8.642 8.231
694 HB2 TYR 86 2HB TYR 86 -8.429 7.810 6.400
695 HB3 TYR 86 1HB TYR 86 -9.771 6.792 6.911
696 HD1 TYR 86 1HD TYR 86 -12.030 8.724 6.638
697 HD2 TYR 86 2HD TYR 86 -8.730 7.927 4.078
698 HE1 TYR 86 1HE TYR 86 -13.348 9.492 4.709
699 HE2 TYR 86 2HE TYR 86 -10.034 8.704 2.146
700 HH TYR 86 HH TYR 86 -12.989 10.398 2.498
701 H ARG 87 HN ARG 87 -7.435 9.546 8.676
702 HA ARG 87 HA ARG 87 -7.365 8.350 11.273
703 HB2 ARG 87 2HB ARG 87 -5.311 7.038 10.952
704 HB3 ARG 87 1HB ARG 87 -6.618 6.410 9.956
705 HG2 ARG 87 2HG ARG 87 -5.660 7.204 7.983
706 HG3 ARG 87 1HG ARG 87 -4.613 8.338 8.840
707 HD2 ARG 87 2HD ARG 87 -3.340 6.447 7.992
708 HD3 ARG 87 1HD ARG 87 -3.328 6.474 9.752
709 HE ARG 87 HE ARG 87 -5.053 4.671 8.170
710 HH11 ARG 87 1HH1 ARG 87 -3.033 5.344 10.950
711 HH12 ARG 87 2HH1 ARG 87 -3.098 3.715 11.546
712 HH21 ARG 87 1HH2 ARG 87 -5.136 2.518 8.950
713 HH22 ARG 87 2HH2 ARG 87 -4.286 2.100 10.408
714 H GLU 88 HN GLU 88 -5.097 8.845 12.273
715 HA GLU 88 HA GLU 88 -3.473 10.794 10.977
716 HB2 GLU 88 2HB GLU 88 -3.809 12.655 12.488
717 HB3 GLU 88 1HB GLU 88 -5.334 12.251 11.716
718 HG2 GLU 88 2HG GLU 88 -6.149 11.208 13.698
719 HG3 GLU 88 1HG GLU 88 -4.567 11.319 14.470
720 H GLY 89 HN GLY 89 -1.962 11.789 12.874
721 HA2 GLY 89 2HA GLY 89 -0.370 11.368 14.458
722 HA3 GLY 89 1HA GLY 89 -1.475 10.203 15.151
723 H ASP 90 HN ASP 90 1.230 10.720 13.139
724 HA ASP 90 HA ASP 90 2.784 9.386 12.159
725 HB2 ASP 90 2HB ASP 90 2.923 8.692 14.577
726 HB3 ASP 90 1HB ASP 90 1.866 7.345 14.192
727 H ASN 91 HN ASN 91 2.847 6.607 11.620
728 HA ASN 91 HA ASN 91 0.312 5.807 10.498
729 HB2 ASN 91 2HB ASN 91 1.448 7.471 8.851
730 HB3 ASN 91 1HB ASN 91 2.583 6.163 8.541
731 HD21 ASN 91 1HD2 ASN 91 1.965 5.930 6.397
732 HD22 ASN 91 2HD2 ASN 91 0.433 5.267 5.958
733 HA PRO 92 HA PRO 92 2.310 1.912 11.375
734 HB2 PRO 92 2HB PRO 92 0.637 0.260 9.996
735 HB3 PRO 92 1HB PRO 92 0.234 0.968 11.565
736 HG2 PRO 92 2HG PRO 92 -0.573 1.850 8.823
737 HG3 PRO 92 1HG PRO 92 -1.549 1.751 10.300
738 HD2 PRO 92 2HD PRO 92 -0.538 4.084 9.395
739 HD3 PRO 92 1HD PRO 92 -0.722 3.745 11.128
740 H ALA 93 HN ALA 93 2.440 3.465 8.482
741 HA ALA 93 HA ALA 93 3.685 1.287 7.002
742 HB1 ALA 93 1HB ALA 93 3.366 4.185 6.219
743 HB2 ALA 93 2HB ALA 93 2.251 2.884 5.801
744 HB3 ALA 93 3HB ALA 93 3.898 2.868 5.173
745 H ARG 94 HN ARG 94 4.602 3.294 9.423
746 HA ARG 94 HA ARG 94 7.330 3.733 8.550
747 HB2 ARG 94 2HB ARG 94 5.772 4.324 11.018
748 HB3 ARG 94 1HB ARG 94 7.510 4.158 11.182
749 HG2 ARG 94 2HG ARG 94 6.985 6.464 10.923
750 HG3 ARG 94 1HG ARG 94 7.788 5.913 9.455
751 HD2 ARG 94 2HD ARG 94 5.647 5.745 8.322
752 HD3 ARG 94 1HD ARG 94 4.808 6.223 9.800
753 HE ARG 94 HE ARG 94 6.394 8.308 9.486
754 HH11 ARG 94 1HH1 ARG 94 4.514 6.591 7.099
755 HH12 ARG 94 2HH1 ARG 94 4.291 7.973 6.078
756 HH21 ARG 94 1HH2 ARG 94 6.148 10.128 8.136
757 HH22 ARG 94 2HH2 ARG 94 5.213 9.996 6.673
758 H TRP 95 HN TRP 95 9.136 2.663 9.339
759 HA TRP 95 HA TRP 95 8.710 0.372 11.103
760 HB2 TRP 95 2HB TRP 95 9.169 0.097 8.324
761 HB3 TRP 95 1HB TRP 95 10.664 -0.360 9.140
762 HD1 TRP 95 1HD TRP 95 9.995 -2.029 11.464
763 HE1 TRP 95 1HE TRP 95 8.579 -4.181 11.365
764 HE3 TRP 95 3HE TRP 95 7.507 -1.146 7.100
765 HZ2 TRP 95 2HZ TRP 95 6.644 -5.340 9.654
766 HZ3 TRP 95 3HZ TRP 95 5.882 -2.807 6.302
767 HH2 TRP 95 2HH TRP 95 5.464 -4.871 7.551
768 H ARG 96 HN ARG 96 9.848 0.971 12.786
769 HA ARG 96 HA ARG 96 12.214 2.592 12.579
770 HB2 ARG 96 2HB ARG 96 10.544 1.480 14.755
771 HB3 ARG 96 1HB ARG 96 12.231 1.779 15.151
772 HG2 ARG 96 2HG ARG 96 12.008 4.102 14.562
773 HG3 ARG 96 1HG ARG 96 10.353 3.832 13.999
774 HD2 ARG 96 2HD ARG 96 9.534 3.537 16.140
775 HD3 ARG 96 1HD ARG 96 11.108 3.094 16.794
776 HE ARG 96 HE ARG 96 10.433 5.860 15.997
777 HH11 ARG 96 1HH1 ARG 96 11.813 3.517 18.203
778 HH12 ARG 96 2HH1 ARG 96 12.375 4.709 19.340
779 HH21 ARG 96 1HH2 ARG 96 11.164 7.455 17.505
780 HH22 ARG 96 2HH2 ARG 96 12.006 6.943 18.937
781 H GLY 97 HN GLY 97 11.532 -0.757 12.644
782 HA2 GLY 97 2HA GLY 97 14.414 -1.330 12.952
783 HA3 GLY 97 1HA GLY 97 13.158 -2.413 13.543
784 H TYR 98 HN TYR 98 12.717 -4.078 12.276
785 HA TYR 98 HA TYR 98 12.663 -3.696 9.403
786 HB2 TYR 98 2HB TYR 98 13.744 -6.040 9.248
787 HB3 TYR 98 1HB TYR 98 14.784 -4.650 9.486
788 HD1 TYR 98 2HD TYR 98 15.671 -4.209 11.821
789 HD2 TYR 98 1HD TYR 98 13.710 -7.838 10.767
790 HE1 TYR 98 2HE TYR 98 16.665 -5.308 13.782
791 HE2 TYR 98 1HE TYR 98 14.709 -8.949 12.722
792 HH TYR 98 HH TYR 98 16.780 -8.606 14.188
793 H LEU 99 HN LEU 99 12.055 -6.016 12.035
794 HA LEU 99 HA LEU 99 9.342 -6.312 11.010
795 HB2 LEU 99 2HB LEU 99 11.252 -8.529 11.712
796 HB3 LEU 99 1HB LEU 99 9.522 -8.759 11.672
797 HG LEU 99 HG LEU 99 11.195 -7.905 9.313
798 HD11 LEU 99 1HD1 LEU 99 9.992 -10.589 9.972
799 HD12 LEU 99 2HD1 LEU 99 11.710 -10.189 9.971
800 HD13 LEU 99 3HD1 LEU 99 10.797 -10.166 8.462
801 HD21 LEU 99 3HD2 LEU 99 8.897 -7.092 9.204
802 HD22 LEU 99 1HD2 LEU 99 8.299 -8.727 9.488
803 HD23 LEU 99 2HD2 LEU 99 9.181 -8.356 8.007
804 H GLU 100 HN GLU 100 11.180 -7.882 13.609
805 HA GLU 100 HA GLU 100 9.196 -7.007 15.550
806 HB2 GLU 100 2HB GLU 100 10.096 -9.341 15.534
807 HB3 GLU 100 1HB GLU 100 11.680 -8.696 15.940
808 HG2 GLU 100 2HG GLU 100 10.699 -7.782 18.033
809 HG3 GLU 100 1HG GLU 100 9.193 -8.608 17.632
810 H HIS 101 HN HIS 101 9.893 -5.973 17.591
811 HA HIS 101 HA HIS 101 11.915 -3.942 17.084
812 HB2 HIS 101 2HB HIS 101 10.065 -4.326 19.453
813 HB3 HIS 101 1HB HIS 101 11.159 -2.965 19.235
814 HD1 HIS 101 1HD HIS 101 7.780 -4.093 18.486
815 HD2 HIS 101 2HD HIS 101 10.445 -1.310 16.924
816 HE1 HIS 101 1HE HIS 101 6.389 -2.547 17.073
817 HE2 HIS 101 2HE HIS 101 7.992 -0.768 16.291
818 H HIS 102 HN HIS 102 13.550 -5.698 17.031
819 HA HIS 102 HA HIS 102 14.234 -7.023 19.477
820 HB2 HIS 102 2HB HIS 102 14.689 -7.990 17.229
821 HB3 HIS 102 1HB HIS 102 15.873 -6.718 16.950
822 HD1 HIS 102 1HD HIS 102 18.207 -7.232 17.635
823 HD2 HIS 102 2HD HIS 102 15.433 -9.715 19.494
824 HE1 HIS 102 1HE HIS 102 19.557 -8.933 18.908
825 HE2 HIS 102 2HE HIS 102 17.857 -10.540 19.853
826 H HIS 103 HN HIS 103 15.333 -6.222 21.098
827 HA HIS 103 HA HIS 103 17.136 -3.939 20.606
828 HB2 HIS 103 2HB HIS 103 16.437 -2.906 22.645
829 HB3 HIS 103 1HB HIS 103 14.970 -3.333 21.777
830 HD1 HIS 103 1HD HIS 103 13.542 -5.315 22.779
831 HD2 HIS 103 2HD HIS 103 16.777 -4.116 25.100
832 HE1 HIS 103 1HE HIS 103 13.171 -6.343 25.039
833 HE2 HIS 103 2HE HIS 103 15.188 -5.684 26.404
834 H HIS 104 HN HIS 104 19.067 -3.906 21.802
835 HA HIS 104 HA HIS 104 19.634 -5.693 23.914
836 HB2 HIS 104 2HB HIS 104 19.609 -7.304 21.963
837 HB3 HIS 104 1HB HIS 104 20.998 -6.436 21.317
838 HD1 HIS 104 1HD HIS 104 23.166 -7.486 21.908
839 HD2 HIS 104 2HD HIS 104 20.231 -8.247 24.760
840 HE1 HIS 104 1HE HIS 104 24.264 -8.944 23.643
841 HE2 HIS 104 2HE HIS 104 22.419 -9.527 25.265
842 H HIS 105 HN HIS 105 21.245 -4.845 25.057
843 HA HIS 105 HA HIS 105 23.280 -3.246 23.652
844 HB2 HIS 105 2HB HIS 105 21.812 -2.623 26.207
845 HB3 HIS 105 1HB HIS 105 23.396 -1.936 25.879
846 HD1 HIS 105 1HD HIS 105 19.966 -1.104 25.575
847 HD2 HIS 105 2HD HIS 105 23.314 -0.589 23.155
848 HE1 HIS 105 1HE HIS 105 19.399 0.792 24.020
849 HE2 HIS 105 2HE HIS 105 21.400 1.025 22.503
850 H HIS 106 HN HIS 106 25.159 -2.844 25.397
851 HA HIS 106 HA HIS 106 25.673 -5.205 26.995
852 HB2 HIS 106 2HB HIS 106 27.717 -5.830 25.927
853 HB3 HIS 106 1HB HIS 106 26.494 -5.739 24.668
854 HD1 HIS 106 1HD HIS 106 26.600 -3.471 23.170
855 HD2 HIS 106 2HD HIS 106 29.954 -4.385 25.450
856 HE1 HIS 106 1HE HIS 106 28.481 -2.137 22.172
857 HE2 HIS 106 2HE HIS 106 30.538 -2.911 23.407
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -16.118 3.977 4.483
2 H2 MET 1 H2 MET 1 -15.096 3.426 5.717
3 H3 MET 1 H3 MET 1 -15.899 2.311 4.723
4 HA MET 1 HA MET 1 -14.666 3.104 2.809
5 HB2 MET 1 2HB MET 1 -14.241 5.372 3.533
6 HB3 MET 1 1HB MET 1 -13.282 4.797 4.890
7 HG2 MET 1 2HG MET 1 -11.626 3.889 3.344
8 HG3 MET 1 1HG MET 1 -12.577 4.468 1.978
9 HE1 MET 1 2HE MET 1 -13.054 7.083 1.534
10 HE2 MET 1 3HE MET 1 -12.418 8.364 2.566
11 HE3 MET 1 1HE MET 1 -13.633 7.255 3.190
12 H THR 2 HN THR 2 -13.933 1.108 2.549
13 HA THR 2 HA THR 2 -12.079 -0.117 4.399
14 HB THR 2 HB THR 2 -11.963 -1.915 2.655
15 HG1 THR 2 1HG THR 2 -14.097 -1.159 1.210
16 HG21 THR 2 3HG2 THR 2 -14.271 -2.699 2.936
17 HG22 THR 2 1HG2 THR 2 -14.752 -1.092 3.476
18 HG23 THR 2 2HG2 THR 2 -13.629 -2.045 4.443
19 H PHE 3 HN PHE 3 -10.031 -1.129 3.245
20 HA PHE 3 HA PHE 3 -8.375 1.024 2.485
21 HB2 PHE 3 2HB PHE 3 -7.510 -1.044 3.532
22 HB3 PHE 3 1HB PHE 3 -7.896 -1.934 2.063
23 HD1 PHE 3 1HD PHE 3 -5.861 0.899 3.333
24 HD2 PHE 3 2HD PHE 3 -6.342 -2.078 0.330
25 HE1 PHE 3 1HE PHE 3 -3.648 1.467 2.416
26 HE2 PHE 3 2HE PHE 3 -4.130 -1.517 -0.589
27 HZ PHE 3 HZ PHE 3 -2.781 0.259 0.453
28 H SER 4 HN SER 4 -10.084 -1.453 0.651
29 HA SER 4 HA SER 4 -9.101 -0.880 -1.898
30 HB2 SER 4 2HB SER 4 -11.888 -1.791 -1.137
31 HB3 SER 4 1HB SER 4 -11.145 -1.951 -2.727
32 HG SER 4 HG SER 4 -11.047 -3.849 -1.305
33 H GLU 5 HN GLU 5 -11.874 0.507 -0.151
34 HA GLU 5 HA GLU 5 -12.777 2.189 -2.208
35 HB2 GLU 5 2HB GLU 5 -13.025 2.409 0.791
36 HB3 GLU 5 1HB GLU 5 -13.864 3.454 -0.339
37 HG2 GLU 5 2HG GLU 5 -15.006 1.520 -1.291
38 HG3 GLU 5 1HG GLU 5 -14.167 0.473 -0.149
39 H CYS 6 HN CYS 6 -10.548 2.760 0.478
40 HA CYS 6 HA CYS 6 -10.117 5.513 -0.008
41 HB2 CYS 6 2HB CYS 6 -9.595 4.316 2.114
42 HB3 CYS 6 1HB CYS 6 -8.256 3.529 1.312
43 HG CYS 6 HG CYS 6 -7.462 6.429 0.647
44 H ALA 7 HN ALA 7 -8.261 2.631 -0.870
45 HA ALA 7 HA ALA 7 -6.177 3.860 -2.262
46 HB1 ALA 7 1HB ALA 7 -7.430 1.191 -2.894
47 HB2 ALA 7 2HB ALA 7 -6.211 1.474 -1.650
48 HB3 ALA 7 3HB ALA 7 -5.812 1.727 -3.351
49 H ALA 8 HN ALA 8 -9.334 2.753 -3.452
50 HA ALA 8 HA ALA 8 -8.965 3.408 -6.155
51 HB1 ALA 8 1HB ALA 8 -10.809 2.008 -5.348
52 HB2 ALA 8 2HB ALA 8 -11.392 3.342 -6.339
53 HB3 ALA 8 3HB ALA 8 -11.539 3.418 -4.584
54 H LEU 9 HN LEU 9 -10.224 5.311 -3.447
55 HA LEU 9 HA LEU 9 -10.911 7.617 -4.897
56 HB2 LEU 9 2HB LEU 9 -10.011 7.325 -2.032
57 HB3 LEU 9 1HB LEU 9 -10.655 8.801 -2.709
58 HG LEU 9 HG LEU 9 -12.148 6.195 -2.466
59 HD11 LEU 9 1HD1 LEU 9 -11.792 7.275 -0.315
60 HD12 LEU 9 2HD1 LEU 9 -13.485 7.378 -0.804
61 HD13 LEU 9 3HD1 LEU 9 -12.434 8.787 -0.959
62 HD21 LEU 9 3HD2 LEU 9 -12.858 7.452 -4.422
63 HD22 LEU 9 1HD2 LEU 9 -13.059 8.901 -3.435
64 HD23 LEU 9 2HD2 LEU 9 -14.097 7.500 -3.170
65 H TYR 10 HN TYR 10 -7.883 6.647 -3.359
66 HA TYR 10 HA TYR 10 -6.436 9.005 -3.687
67 HB2 TYR 10 2HB TYR 10 -5.645 7.093 -2.364
68 HB3 TYR 10 1HB TYR 10 -5.448 6.148 -3.833
69 HD1 TYR 10 1HD TYR 10 -4.201 9.140 -2.041
70 HD2 TYR 10 2HD TYR 10 -3.452 6.268 -5.083
71 HE1 TYR 10 1HE TYR 10 -1.893 9.959 -2.239
72 HE2 TYR 10 2HE TYR 10 -1.141 7.083 -5.296
73 HH TYR 10 HH TYR 10 0.158 9.082 -4.825
74 H ILE 11 HN ILE 11 -6.770 6.241 -5.855
75 HA ILE 11 HA ILE 11 -5.078 7.293 -7.892
76 HB ILE 11 HB ILE 11 -7.153 5.095 -7.977
77 HG12 ILE 11 2HG1 ILE 11 -4.138 4.932 -7.764
78 HG13 ILE 11 1HG1 ILE 11 -5.233 4.822 -6.391
79 HG21 ILE 11 1HG2 ILE 11 -6.749 5.916 -10.222
80 HG22 ILE 11 2HG2 ILE 11 -6.005 4.330 -10.016
81 HG23 ILE 11 3HG2 ILE 11 -5.008 5.783 -9.983
82 HD11 ILE 11 3HD1 ILE 11 -6.241 2.822 -7.359
83 HD12 ILE 11 1HD1 ILE 11 -4.509 2.626 -7.100
84 HD13 ILE 11 2HD1 ILE 11 -5.130 2.929 -8.723
85 H LYS 12 HN LYS 12 -8.631 7.039 -7.570
86 HA LYS 12 HA LYS 12 -9.123 8.119 -10.162
87 HB2 LYS 12 2HB LYS 12 -10.968 7.623 -7.828
88 HB3 LYS 12 1HB LYS 12 -11.510 8.169 -9.411
89 HG2 LYS 12 2HG LYS 12 -10.636 6.145 -10.435
90 HG3 LYS 12 1HG LYS 12 -10.042 5.594 -8.866
91 HD2 LYS 12 2HD LYS 12 -12.357 5.561 -8.026
92 HD3 LYS 12 1HD LYS 12 -12.927 6.070 -9.617
93 HE2 LYS 12 2HE LYS 12 -12.048 4.047 -10.618
94 HE3 LYS 12 1HE LYS 12 -11.367 3.547 -9.072
95 HZ1 LYS 12 3HZ LYS 12 -13.380 2.369 -9.422
96 HZ2 LYS 12 1HZ LYS 12 -14.244 3.787 -9.763
97 HZ3 LYS 12 2HZ LYS 12 -13.674 3.500 -8.193
98 H ALA 13 HN ALA 13 -9.044 9.567 -6.934
99 HA ALA 13 HA ALA 13 -10.303 11.995 -7.788
100 HB1 ALA 13 1HB ALA 13 -9.706 12.869 -5.606
101 HB2 ALA 13 2HB ALA 13 -8.632 11.499 -5.332
102 HB3 ALA 13 3HB ALA 13 -10.372 11.243 -5.453
103 H HIS 14 HN HIS 14 -7.226 10.741 -8.304
104 HA HIS 14 HA HIS 14 -6.150 13.450 -8.722
105 HB2 HIS 14 2HB HIS 14 -4.727 10.871 -8.081
106 HB3 HIS 14 1HB HIS 14 -3.888 12.309 -8.647
107 HD1 HIS 14 1HD HIS 14 -5.044 10.664 -5.633
108 HD2 HIS 14 2HD HIS 14 -4.211 14.570 -6.793
109 HE1 HIS 14 1HE HIS 14 -4.760 11.962 -3.493
110 HE2 HIS 14 2HE HIS 14 -4.097 14.287 -4.218
111 H ARG 15 HN ARG 15 -7.503 10.980 -10.387
112 HA ARG 15 HA ARG 15 -5.623 10.234 -12.311
113 HB2 ARG 15 2HB ARG 15 -7.451 9.356 -13.605
114 HB3 ARG 15 1HB ARG 15 -7.715 9.026 -11.902
115 HG2 ARG 15 2HG ARG 15 -9.431 10.586 -11.735
116 HG3 ARG 15 1HG ARG 15 -8.977 11.381 -13.242
117 HD2 ARG 15 2HD ARG 15 -10.050 8.570 -13.024
118 HD3 ARG 15 1HD ARG 15 -11.009 9.984 -13.462
119 HE ARG 15 HE ARG 15 -9.391 10.202 -15.394
120 HH11 ARG 15 1HH1 ARG 15 -10.145 7.094 -13.948
121 HH12 ARG 15 2HH1 ARG 15 -9.789 6.204 -15.393
122 HH21 ARG 15 1HH2 ARG 15 -8.938 9.030 -17.278
123 HH22 ARG 15 2HH2 ARG 15 -9.095 7.297 -17.283
124 H SER 16 HN SER 16 -7.387 13.176 -12.060
125 HA SER 16 HA SER 16 -7.380 13.989 -14.742
126 HB2 SER 16 2HB SER 16 -7.059 15.841 -12.379
127 HB3 SER 16 1HB SER 16 -7.899 16.139 -13.896
128 HG SER 16 HG SER 16 -8.903 15.193 -11.635
129 H SER 17 HN SER 17 -5.096 14.808 -12.129
130 HA SER 17 HA SER 17 -3.110 15.807 -13.933
131 HB2 SER 17 2HB SER 17 -2.532 14.807 -11.154
132 HB3 SER 17 1HB SER 17 -1.842 16.190 -12.000
133 HG SER 17 HG SER 17 -3.379 17.395 -11.252
134 H TRP 18 HN TRP 18 -4.140 12.821 -12.729
135 HA TRP 18 HA TRP 18 -1.667 11.386 -13.235
136 HB2 TRP 18 2HB TRP 18 -4.082 11.025 -11.666
137 HB3 TRP 18 1HB TRP 18 -3.647 9.575 -12.557
138 HD1 TRP 18 1HD TRP 18 -1.059 11.939 -10.936
139 HE1 TRP 18 1HE TRP 18 0.156 10.601 -9.094
140 HE3 TRP 18 3HE TRP 18 -3.811 7.673 -11.156
141 HZ2 TRP 18 2HZ TRP 18 -0.052 8.025 -7.893
142 HZ3 TRP 18 3HZ TRP 18 -3.249 5.806 -9.649
143 HH2 TRP 18 2HH TRP 18 -1.425 5.989 -8.047
144 H LYS 19 HN LYS 19 -2.855 12.375 -15.642
145 HA LYS 19 HA LYS 19 -4.153 10.509 -17.168
146 HB2 LYS 19 2HB LYS 19 -1.655 12.048 -17.960
147 HB3 LYS 19 1HB LYS 19 -2.762 11.262 -19.081
148 HG2 LYS 19 2HG LYS 19 -3.425 13.570 -17.253
149 HG3 LYS 19 1HG LYS 19 -3.189 13.649 -19.000
150 HD2 LYS 19 2HD LYS 19 -5.138 12.353 -19.410
151 HD3 LYS 19 1HD LYS 19 -5.289 11.927 -17.705
152 HE2 LYS 19 2HE LYS 19 -6.932 13.604 -18.280
153 HE3 LYS 19 1HE LYS 19 -5.739 14.288 -17.178
154 HZ1 LYS 19 3HZ LYS 19 -5.705 14.646 -20.126
155 HZ2 LYS 19 1HZ LYS 19 -4.686 15.403 -19.002
156 HZ3 LYS 19 2HZ LYS 19 -6.336 15.773 -19.030
157 H ASN 20 HN ASN 20 -2.686 7.894 -16.013
158 HA ASN 20 HA ASN 20 -4.615 7.188 -16.959
159 HB2 ASN 20 2HB ASN 20 -5.367 9.585 -17.222
160 HB3 ASN 20 1HB ASN 20 -4.574 9.607 -18.793
161 HD21 ASN 20 1HD2 ASN 20 -6.496 9.981 -19.894
162 HD22 ASN 20 2HD2 ASN 20 -7.710 8.763 -20.080
163 H THR 21 HN THR 21 -1.690 7.350 -17.950
164 HA THR 21 HA THR 21 -2.022 5.668 -20.285
165 HB THR 21 HB THR 21 0.399 5.124 -19.833
166 HG1 THR 21 1HG THR 21 1.046 7.083 -18.190
167 HG21 THR 21 3HG2 THR 21 -0.230 8.075 -19.968
168 HG22 THR 21 1HG2 THR 21 -0.214 6.968 -21.342
169 HG23 THR 21 2HG2 THR 21 1.277 7.311 -20.467
170 H LYS 22 HN LYS 22 -0.402 3.475 -19.519
171 HA LYS 22 HA LYS 22 -2.273 1.986 -17.957
172 HB2 LYS 22 2HB LYS 22 0.441 1.266 -19.044
173 HB3 LYS 22 1HB LYS 22 -0.551 0.146 -18.123
174 HG2 LYS 22 2HG LYS 22 -2.366 0.658 -19.879
175 HG3 LYS 22 1HG LYS 22 -1.026 1.277 -20.848
176 HD2 LYS 22 2HD LYS 22 -1.452 -1.060 -21.384
177 HD3 LYS 22 1HD LYS 22 0.126 -0.880 -20.612
178 HE2 LYS 22 2HE LYS 22 -0.897 -1.518 -18.455
179 HE3 LYS 22 1HE LYS 22 -2.427 -1.785 -19.285
180 HZ1 LYS 22 3HZ LYS 22 -1.453 -3.554 -20.541
181 HZ2 LYS 22 1HZ LYS 22 -1.129 -3.827 -18.898
182 HZ3 LYS 22 2HZ LYS 22 0.089 -3.228 -19.914
183 H HIS 23 HN HIS 23 0.082 4.122 -16.965
184 HA HIS 23 HA HIS 23 1.188 2.672 -14.799
185 HB2 HIS 23 2HB HIS 23 2.372 4.548 -14.271
186 HB3 HIS 23 1HB HIS 23 1.942 4.943 -15.927
187 HD1 HIS 23 1HD HIS 23 1.547 6.047 -12.438
188 HD2 HIS 23 2HD HIS 23 -0.046 6.983 -16.159
189 HE1 HIS 23 1HE HIS 23 0.404 8.267 -12.142
190 HE2 HIS 23 2HE HIS 23 -0.269 8.945 -14.472
191 H ALA 24 HN ALA 24 -1.768 4.481 -15.156
192 HA ALA 24 HA ALA 24 -2.447 4.588 -12.380
193 HB1 ALA 24 1HB ALA 24 -3.518 6.051 -14.012
194 HB2 ALA 24 2HB ALA 24 -4.719 5.060 -13.184
195 HB3 ALA 24 3HB ALA 24 -4.222 4.655 -14.826
196 H ASP 25 HN ASP 25 -3.044 2.314 -15.013
197 HA ASP 25 HA ASP 25 -4.649 0.461 -13.643
198 HB2 ASP 25 2HB ASP 25 -4.304 0.382 -16.075
199 HB3 ASP 25 1HB ASP 25 -2.617 -0.041 -15.834
200 H GLN 26 HN GLN 26 -1.145 0.694 -14.016
201 HA GLN 26 HA GLN 26 -0.440 -1.651 -12.706
202 HB2 GLN 26 2HB GLN 26 1.038 0.965 -12.975
203 HB3 GLN 26 1HB GLN 26 1.756 -0.498 -12.329
204 HG2 GLN 26 2HG GLN 26 0.571 -0.270 -15.080
205 HG3 GLN 26 1HG GLN 26 2.283 -0.075 -14.710
206 HE21 GLN 26 1HE2 GLN 26 2.867 -1.792 -16.000
207 HE22 GLN 26 2HE2 GLN 26 2.565 -3.441 -15.552
208 H TRP 27 HN TRP 27 -1.316 1.478 -11.378
209 HA TRP 27 HA TRP 27 -0.510 0.835 -8.708
210 HB2 TRP 27 2HB TRP 27 -2.159 2.995 -9.958
211 HB3 TRP 27 1HB TRP 27 -2.227 2.761 -8.217
212 HD1 TRP 27 1HD TRP 27 0.450 3.439 -10.954
213 HE1 TRP 27 1HE TRP 27 2.309 4.868 -9.887
214 HE3 TRP 27 3HE TRP 27 -1.270 3.556 -6.136
215 HZ2 TRP 27 2HZ TRP 27 2.961 5.905 -7.338
216 HZ3 TRP 27 3HZ TRP 27 0.026 4.785 -4.446
217 HH2 TRP 27 2HH TRP 27 2.098 5.938 -5.032
218 H THR 28 HN THR 28 -3.623 0.915 -10.396
219 HA THR 28 HA THR 28 -5.175 0.104 -8.184
220 HB THR 28 HB THR 28 -5.904 -0.325 -11.084
221 HG1 THR 28 1HG THR 28 -5.302 1.820 -10.978
222 HG21 THR 28 3HG2 THR 28 -7.446 -1.280 -9.451
223 HG22 THR 28 1HG2 THR 28 -8.187 0.096 -10.266
224 HG23 THR 28 2HG2 THR 28 -7.561 0.274 -8.627
225 H ASN 29 HN ASN 29 -3.795 -1.656 -10.913
226 HA ASN 29 HA ASN 29 -5.167 -4.076 -10.457
227 HB2 ASN 29 2HB ASN 29 -4.143 -3.289 -12.617
228 HB3 ASN 29 1HB ASN 29 -2.569 -3.690 -11.948
229 HD21 ASN 29 1HD2 ASN 29 -2.294 -5.126 -13.695
230 HD22 ASN 29 2HD2 ASN 29 -3.039 -6.684 -13.686
231 H THR 30 HN THR 30 -1.838 -3.073 -9.637
232 HA THR 30 HA THR 30 -1.002 -5.598 -8.714
233 HB THR 30 HB THR 30 0.787 -4.323 -7.485
234 HG1 THR 30 1HG THR 30 0.025 -1.996 -8.831
235 HG21 THR 30 3HG2 THR 30 1.134 -5.104 -9.766
236 HG22 THR 30 1HG2 THR 30 1.897 -3.531 -9.526
237 HG23 THR 30 2HG2 THR 30 0.366 -3.646 -10.396
238 H ILE 31 HN ILE 31 -2.099 -2.748 -6.889
239 HA ILE 31 HA ILE 31 -1.907 -3.917 -4.350
240 HB ILE 31 HB ILE 31 -3.765 -1.704 -5.244
241 HG12 ILE 31 2HG1 ILE 31 -1.025 -1.580 -3.960
242 HG13 ILE 31 1HG1 ILE 31 -1.371 -1.242 -5.653
243 HG21 ILE 31 1HG2 ILE 31 -2.866 -2.479 -2.470
244 HG22 ILE 31 2HG2 ILE 31 -4.483 -2.692 -3.135
245 HG23 ILE 31 3HG2 ILE 31 -3.841 -1.071 -2.882
246 HD11 ILE 31 3HD1 ILE 31 -1.099 0.797 -4.347
247 HD12 ILE 31 1HD1 ILE 31 -2.436 0.311 -3.304
248 HD13 ILE 31 2HD1 ILE 31 -2.729 0.663 -5.008
249 H LYS 32 HN LYS 32 -4.634 -3.697 -6.595
250 HA LYS 32 HA LYS 32 -6.597 -4.829 -4.958
251 HB2 LYS 32 2HB LYS 32 -6.942 -3.675 -7.175
252 HB3 LYS 32 1HB LYS 32 -6.382 -5.146 -7.955
253 HG2 LYS 32 2HG LYS 32 -8.225 -6.384 -6.865
254 HG3 LYS 32 1HG LYS 32 -8.823 -4.853 -6.221
255 HD2 LYS 32 2HD LYS 32 -9.113 -4.008 -8.499
256 HD3 LYS 32 1HD LYS 32 -8.499 -5.535 -9.144
257 HE2 LYS 32 2HE LYS 32 -10.994 -5.165 -7.488
258 HE3 LYS 32 1HE LYS 32 -10.930 -5.495 -9.218
259 HZ1 LYS 32 3HZ LYS 32 -9.903 -7.633 -8.742
260 HZ2 LYS 32 1HZ LYS 32 -11.395 -7.500 -7.940
261 HZ3 LYS 32 2HZ LYS 32 -9.949 -7.313 -7.078
262 H THR 33 HN THR 33 -4.096 -6.299 -6.913
263 HA THR 33 HA THR 33 -5.261 -8.936 -6.755
264 HB THR 33 HB THR 33 -2.514 -8.155 -7.751
265 HG1 THR 33 1HG THR 33 -3.982 -7.100 -9.042
266 HG21 THR 33 3HG2 THR 33 -2.675 -10.256 -9.033
267 HG22 THR 33 1HG2 THR 33 -4.210 -10.610 -8.242
268 HG23 THR 33 2HG2 THR 33 -2.726 -10.545 -7.293
269 H TYR 34 HN TYR 34 -2.347 -7.364 -5.444
270 HA TYR 34 HA TYR 34 -1.571 -9.743 -4.033
271 HB2 TYR 34 2HB TYR 34 -0.462 -6.940 -4.047
272 HB3 TYR 34 1HB TYR 34 0.211 -8.232 -3.059
273 HD1 TYR 34 1HD TYR 34 1.280 -10.188 -4.146
274 HD2 TYR 34 2HD TYR 34 -0.033 -6.827 -6.402
275 HE1 TYR 34 1HE TYR 34 2.679 -10.912 -6.036
276 HE2 TYR 34 2HE TYR 34 1.360 -7.546 -8.295
277 HH TYR 34 HH TYR 34 2.763 -10.627 -8.483
278 H CYS 35 HN CYS 35 -2.849 -6.560 -3.033
279 HA CYS 35 HA CYS 35 -2.923 -7.567 -0.272
280 HB2 CYS 35 2HB CYS 35 -3.095 -4.723 -1.281
281 HB3 CYS 35 1HB CYS 35 -3.058 -5.216 0.411
282 HG CYS 35 HG CYS 35 -0.493 -6.242 -1.529
283 H GLY 36 HN GLY 36 -4.918 -6.728 -2.886
284 HA2 GLY 36 2HA GLY 36 -7.193 -5.635 -1.830
285 HA3 GLY 36 1HA GLY 36 -7.188 -6.756 -3.178
286 HA PRO 37 HA PRO 37 -9.285 -9.954 -1.045
287 HB2 PRO 37 2HB PRO 37 -6.874 -11.681 -0.854
288 HB3 PRO 37 1HB PRO 37 -8.461 -12.032 -1.547
289 HG2 PRO 37 2HG PRO 37 -6.366 -11.568 -3.120
290 HG3 PRO 37 1HG PRO 37 -7.973 -10.943 -3.541
291 HD2 PRO 37 2HD PRO 37 -5.618 -9.508 -2.389
292 HD3 PRO 37 1HD PRO 37 -6.799 -8.954 -3.594
293 H VAL 38 HN VAL 38 -6.269 -8.961 0.409
294 HA VAL 38 HA VAL 38 -6.934 -10.325 2.906
295 HB VAL 38 HB VAL 38 -4.420 -8.768 2.310
296 HG11 VAL 38 1HG1 VAL 38 -4.938 -9.134 4.686
297 HG12 VAL 38 2HG1 VAL 38 -3.494 -10.010 4.177
298 HG13 VAL 38 3HG1 VAL 38 -5.019 -10.871 4.389
299 HG21 VAL 38 3HG2 VAL 38 -3.360 -10.932 1.854
300 HG22 VAL 38 1HG2 VAL 38 -4.643 -10.581 0.698
301 HG23 VAL 38 2HG2 VAL 38 -4.926 -11.726 2.006
302 H ILE 39 HN ILE 39 -5.523 -7.095 2.219
303 HA ILE 39 HA ILE 39 -6.848 -6.152 4.651
304 HB ILE 39 HB ILE 39 -5.377 -4.169 4.471
305 HG12 ILE 39 2HG1 ILE 39 -4.106 -5.677 2.174
306 HG13 ILE 39 1HG1 ILE 39 -5.069 -4.212 2.017
307 HG21 ILE 39 1HG2 ILE 39 -4.716 -6.043 5.845
308 HG22 ILE 39 2HG2 ILE 39 -3.296 -5.339 5.068
309 HG23 ILE 39 3HG2 ILE 39 -3.985 -6.842 4.453
310 HD11 ILE 39 3HD1 ILE 39 -3.410 -2.977 3.306
311 HD12 ILE 39 1HD1 ILE 39 -2.691 -3.733 1.884
312 HD13 ILE 39 2HD1 ILE 39 -2.449 -4.447 3.479
313 H GLY 40 HN GLY 40 -7.490 -6.209 1.445
314 HA2 GLY 40 2HA GLY 40 -8.366 -3.675 0.746
315 HA3 GLY 40 1HA GLY 40 -9.052 -5.175 0.143
316 HA PRO 41 HA PRO 41 -12.780 -4.530 2.378
317 HB2 PRO 41 2HB PRO 41 -13.300 -6.795 3.770
318 HB3 PRO 41 1HB PRO 41 -13.374 -6.720 2.005
319 HG2 PRO 41 2HG PRO 41 -11.172 -7.736 3.765
320 HG3 PRO 41 1HG PRO 41 -11.841 -8.454 2.287
321 HD2 PRO 41 2HD PRO 41 -9.534 -7.035 2.317
322 HD3 PRO 41 1HD PRO 41 -10.624 -7.064 0.917
323 H LEU 42 HN LEU 42 -9.972 -4.638 4.114
324 HA LEU 42 HA LEU 42 -11.156 -4.409 6.747
325 HB2 LEU 42 2HB LEU 42 -8.314 -3.914 5.851
326 HB3 LEU 42 1HB LEU 42 -8.867 -3.989 7.510
327 HG LEU 42 HG LEU 42 -8.815 -6.279 5.541
328 HD11 LEU 42 1HD1 LEU 42 -7.223 -5.752 8.047
329 HD12 LEU 42 2HD1 LEU 42 -6.617 -5.675 6.393
330 HD13 LEU 42 3HD1 LEU 42 -7.146 -7.214 7.067
331 HD21 LEU 42 3HD2 LEU 42 -9.538 -7.671 7.413
332 HD22 LEU 42 1HD2 LEU 42 -10.749 -6.449 7.018
333 HD23 LEU 42 2HD2 LEU 42 -9.703 -6.233 8.421
334 H SER 43 HN SER 43 -11.048 -2.484 8.020
335 HA SER 43 HA SER 43 -11.744 -0.142 6.571
336 HB2 SER 43 2HB SER 43 -12.651 -0.636 8.811
337 HB3 SER 43 1HB SER 43 -11.040 -0.459 9.499
338 HG SER 43 HG SER 43 -12.865 1.451 8.779
339 H VAL 44 HN VAL 44 -10.609 1.799 6.320
340 HA VAL 44 HA VAL 44 -7.798 1.620 6.071
341 HB VAL 44 HB VAL 44 -9.160 3.165 4.718
342 HG11 VAL 44 1HG1 VAL 44 -10.755 3.913 6.367
343 HG12 VAL 44 2HG1 VAL 44 -9.912 5.301 5.670
344 HG13 VAL 44 3HG1 VAL 44 -9.475 4.718 7.279
345 HG21 VAL 44 3HG2 VAL 44 -6.773 3.574 4.903
346 HG22 VAL 44 1HG2 VAL 44 -7.031 4.531 6.363
347 HG23 VAL 44 2HG2 VAL 44 -7.650 5.102 4.815
348 H GLN 45 HN GLN 45 -9.889 2.446 8.690
349 HA GLN 45 HA GLN 45 -7.842 3.627 10.336
350 HB2 GLN 45 2HB GLN 45 -10.683 2.730 10.783
351 HB3 GLN 45 1HB GLN 45 -9.664 3.253 12.107
352 HG2 GLN 45 2HG GLN 45 -10.130 4.982 9.710
353 HG3 GLN 45 1HG GLN 45 -11.248 4.955 11.073
354 HE21 GLN 45 1HE2 GLN 45 -10.852 7.082 11.595
355 HE22 GLN 45 2HE2 GLN 45 -9.379 7.596 12.338
356 H ASP 46 HN ASP 46 -9.023 0.490 9.579
357 HA ASP 46 HA ASP 46 -8.108 -0.734 12.042
358 HB2 ASP 46 2HB ASP 46 -10.203 -1.471 10.990
359 HB3 ASP 46 1HB ASP 46 -9.310 -1.961 9.554
360 H VAL 47 HN VAL 47 -7.012 -0.322 8.768
361 HA VAL 47 HA VAL 47 -5.156 -2.369 8.517
362 HB VAL 47 HB VAL 47 -4.933 0.459 7.461
363 HG11 VAL 47 1HG1 VAL 47 -3.387 -0.459 5.810
364 HG12 VAL 47 2HG1 VAL 47 -3.489 -2.040 6.583
365 HG13 VAL 47 3HG1 VAL 47 -2.767 -0.682 7.446
366 HG21 VAL 47 3HG2 VAL 47 -5.806 -0.508 5.378
367 HG22 VAL 47 1HG2 VAL 47 -6.951 -0.670 6.710
368 HG23 VAL 47 2HG2 VAL 47 -6.000 -2.061 6.191
369 H ASP 48 HN ASP 48 -3.562 -2.918 9.798
370 HA ASP 48 HA ASP 48 -1.904 -0.825 11.030
371 HB2 ASP 48 2HB ASP 48 -3.286 -1.779 12.771
372 HB3 ASP 48 1HB ASP 48 -2.858 -3.413 12.291
373 H THR 49 HN THR 49 0.238 -1.780 11.759
374 HA THR 49 HA THR 49 1.619 -2.638 9.478
375 HB THR 49 HB THR 49 2.585 -2.842 12.338
376 HG1 THR 49 1HG THR 49 3.010 -0.641 10.600
377 HG21 THR 49 3HG2 THR 49 4.026 -3.955 10.697
378 HG22 THR 49 1HG2 THR 49 4.799 -2.496 11.323
379 HG23 THR 49 2HG2 THR 49 4.059 -2.487 9.721
380 H LYS 50 HN LYS 50 0.359 -4.449 12.240
381 HA LYS 50 HA LYS 50 1.645 -6.887 11.749
382 HB2 LYS 50 2HB LYS 50 -0.626 -5.909 13.334
383 HB3 LYS 50 1HB LYS 50 -0.739 -7.592 12.870
384 HG2 LYS 50 2HG LYS 50 1.672 -6.421 14.223
385 HG3 LYS 50 1HG LYS 50 0.322 -7.150 15.098
386 HD2 LYS 50 2HD LYS 50 1.909 -8.577 12.969
387 HD3 LYS 50 1HD LYS 50 2.262 -8.686 14.695
388 HE2 LYS 50 2HE LYS 50 0.057 -9.613 15.113
389 HE3 LYS 50 1HE LYS 50 -0.367 -9.427 13.414
390 HZ1 LYS 50 3HZ LYS 50 0.300 -11.712 14.066
391 HZ2 LYS 50 1HZ LYS 50 1.865 -11.132 14.372
392 HZ3 LYS 50 2HZ LYS 50 1.230 -11.059 12.804
393 H LEU 51 HN LEU 51 -1.438 -5.599 10.589
394 HA LEU 51 HA LEU 51 -2.242 -7.904 9.164
395 HB2 LEU 51 2HB LEU 51 -2.950 -5.020 8.615
396 HB3 LEU 51 1HB LEU 51 -3.856 -6.429 8.112
397 HG LEU 51 HG LEU 51 -3.487 -5.482 10.945
398 HD11 LEU 51 1HD1 LEU 51 -5.896 -5.483 9.139
399 HD12 LEU 51 2HD1 LEU 51 -4.993 -4.070 9.683
400 HD13 LEU 51 3HD1 LEU 51 -5.896 -5.040 10.847
401 HD21 LEU 51 3HD2 LEU 51 -3.595 -7.909 10.842
402 HD22 LEU 51 1HD2 LEU 51 -5.060 -7.814 9.863
403 HD23 LEU 51 2HD2 LEU 51 -5.076 -7.247 11.533
404 H ILE 52 HN ILE 52 -0.392 -5.052 8.373
405 HA ILE 52 HA ILE 52 -0.111 -5.445 5.614
406 HB ILE 52 HB ILE 52 1.431 -3.931 7.681
407 HG12 ILE 52 2HG1 ILE 52 -0.153 -3.141 5.233
408 HG13 ILE 52 1HG1 ILE 52 -0.699 -3.047 6.902
409 HG21 ILE 52 1HG2 ILE 52 2.214 -4.095 4.779
410 HG22 ILE 52 2HG2 ILE 52 3.140 -4.716 6.143
411 HG23 ILE 52 3HG2 ILE 52 2.879 -2.981 5.971
412 HD11 ILE 52 3HD1 ILE 52 0.999 -1.368 7.369
413 HD12 ILE 52 1HD1 ILE 52 -0.054 -0.868 6.047
414 HD13 ILE 52 2HD1 ILE 52 1.566 -1.471 5.703
415 H MET 53 HN MET 53 1.700 -6.725 8.342
416 HA MET 53 HA MET 53 3.836 -7.853 6.867
417 HB2 MET 53 2HB MET 53 2.668 -8.636 9.541
418 HB3 MET 53 1HB MET 53 4.161 -9.286 8.885
419 HG2 MET 53 2HG MET 53 5.161 -7.073 8.910
420 HG3 MET 53 1HG MET 53 3.655 -6.387 9.518
421 HE1 MET 53 3HE MET 53 6.494 -5.942 10.894
422 HE2 MET 53 1HE MET 53 6.084 -6.141 12.598
423 HE3 MET 53 2HE MET 53 5.002 -5.251 11.531
424 H LYS 54 HN LYS 54 0.699 -9.094 7.890
425 HA LYS 54 HA LYS 54 1.027 -11.781 7.250
426 HB2 LYS 54 2HB LYS 54 -1.465 -10.075 7.140
427 HB3 LYS 54 1HB LYS 54 -1.460 -11.829 7.033
428 HG2 LYS 54 2HG LYS 54 -0.500 -11.985 9.260
429 HG3 LYS 54 1HG LYS 54 -0.451 -10.226 9.369
430 HD2 LYS 54 2HD LYS 54 -2.377 -11.168 10.564
431 HD3 LYS 54 1HD LYS 54 -2.873 -10.122 9.233
432 HE2 LYS 54 2HE LYS 54 -3.415 -12.000 7.866
433 HE3 LYS 54 1HE LYS 54 -2.679 -13.122 9.010
434 HZ1 LYS 54 3HZ LYS 54 -5.167 -12.972 9.066
435 HZ2 LYS 54 1HZ LYS 54 -5.002 -11.410 9.695
436 HZ3 LYS 54 2HZ LYS 54 -4.396 -12.740 10.557
437 H VAL 55 HN VAL 55 0.108 -9.074 5.197
438 HA VAL 55 HA VAL 55 -0.557 -10.639 2.917
439 HB VAL 55 HB VAL 55 0.364 -7.765 2.909
440 HG11 VAL 55 1HG1 VAL 55 -1.091 -7.613 0.916
441 HG12 VAL 55 2HG1 VAL 55 -1.370 -9.351 1.021
442 HG13 VAL 55 3HG1 VAL 55 0.253 -8.736 0.706
443 HG21 VAL 55 3HG2 VAL 55 -1.997 -7.146 3.115
444 HG22 VAL 55 1HG2 VAL 55 -1.413 -8.008 4.541
445 HG23 VAL 55 2HG2 VAL 55 -2.413 -8.845 3.353
446 H LEU 56 HN LEU 56 2.406 -9.127 4.069
447 HA LEU 56 HA LEU 56 3.784 -9.479 1.564
448 HB2 LEU 56 2HB LEU 56 4.705 -8.561 4.279
449 HB3 LEU 56 1HB LEU 56 5.786 -8.717 2.908
450 HG LEU 56 HG LEU 56 3.425 -6.853 3.135
451 HD11 LEU 56 1HD1 LEU 56 5.136 -5.112 2.998
452 HD12 LEU 56 2HD1 LEU 56 6.392 -6.352 2.981
453 HD13 LEU 56 3HD1 LEU 56 5.371 -6.149 4.406
454 HD21 LEU 56 3HD2 LEU 56 5.329 -7.292 0.834
455 HD22 LEU 56 1HD2 LEU 56 4.133 -5.998 0.942
456 HD23 LEU 56 2HD2 LEU 56 3.608 -7.680 0.855
457 H ASP 57 HN ASP 57 3.330 -11.334 4.418
458 HA ASP 57 HA ASP 57 5.617 -12.771 4.758
459 HB2 ASP 57 2HB ASP 57 3.390 -12.956 6.014
460 HB3 ASP 57 1HB ASP 57 2.941 -14.142 4.809
461 HA PRO 58 HA PRO 58 4.624 -15.947 1.328
462 HB2 PRO 58 2HB PRO 58 2.548 -15.576 -0.343
463 HB3 PRO 58 1HB PRO 58 2.354 -16.354 1.232
464 HG2 PRO 58 2HG PRO 58 1.770 -13.528 0.432
465 HG3 PRO 58 1HG PRO 58 0.802 -14.632 1.428
466 HD2 PRO 58 2HD PRO 58 2.412 -12.694 2.474
467 HD3 PRO 58 1HD PRO 58 2.041 -14.211 3.313
468 H ILE 59 HN ILE 59 4.481 -12.552 0.817
469 HA ILE 59 HA ILE 59 5.087 -12.662 -2.008
470 HB ILE 59 HB ILE 59 5.092 -10.286 -0.138
471 HG12 ILE 59 2HG1 ILE 59 2.999 -11.317 -2.070
472 HG13 ILE 59 1HG1 ILE 59 2.880 -11.310 -0.314
473 HG21 ILE 59 1HG2 ILE 59 4.961 -8.961 -2.225
474 HG22 ILE 59 2HG2 ILE 59 5.195 -10.442 -3.151
475 HG23 ILE 59 3HG2 ILE 59 6.469 -9.861 -2.079
476 HD11 ILE 59 3HD1 ILE 59 1.569 -9.521 -1.318
477 HD12 ILE 59 1HD1 ILE 59 3.023 -8.870 -2.074
478 HD13 ILE 59 2HD1 ILE 59 2.870 -8.878 -0.316
479 H TRP 60 HN TRP 60 6.831 -11.979 1.010
480 HA TRP 60 HA TRP 60 9.267 -11.150 -0.086
481 HB2 TRP 60 2HB TRP 60 8.643 -12.614 2.477
482 HB3 TRP 60 1HB TRP 60 10.273 -12.105 2.060
483 HD1 TRP 60 1HD TRP 60 7.266 -10.921 3.811
484 HE1 TRP 60 1HE TRP 60 7.447 -8.409 4.329
485 HE3 TRP 60 3HE TRP 60 11.235 -9.753 0.810
486 HZ2 TRP 60 2HZ TRP 60 9.049 -6.223 3.572
487 HZ3 TRP 60 3HZ TRP 60 12.029 -7.425 0.767
488 HH2 TRP 60 2HH TRP 60 10.956 -5.697 2.121
489 H GLU 61 HN GLU 61 7.874 -14.304 0.165
490 HA GLU 61 HA GLU 61 10.198 -15.849 -0.195
491 HB2 GLU 61 2HB GLU 61 7.295 -16.406 -0.798
492 HB3 GLU 61 1HB GLU 61 8.562 -17.604 -0.786
493 HG2 GLU 61 2HG GLU 61 7.639 -15.983 1.563
494 HG3 GLU 61 1HG GLU 61 7.281 -17.683 1.262
495 H GLN 62 HN GLN 62 8.134 -14.097 -2.348
496 HA GLN 62 HA GLN 62 9.250 -15.503 -4.667
497 HB2 GLN 62 2HB GLN 62 6.632 -14.043 -4.322
498 HB3 GLN 62 1HB GLN 62 7.201 -14.722 -5.837
499 HG2 GLN 62 2HG GLN 62 7.147 -16.943 -4.936
500 HG3 GLN 62 1HG GLN 62 6.751 -16.326 -3.335
501 HE21 GLN 62 1HE2 GLN 62 4.674 -15.618 -2.910
502 HE22 GLN 62 2HE2 GLN 62 3.341 -15.976 -3.960
503 H LYS 63 HN LYS 63 8.164 -12.253 -3.636
504 HA LYS 63 HA LYS 63 10.105 -11.126 -5.533
505 HB2 LYS 63 2HB LYS 63 7.309 -10.053 -5.126
506 HB3 LYS 63 1HB LYS 63 8.529 -9.410 -6.218
507 HG2 LYS 63 2HG LYS 63 8.461 -11.556 -7.465
508 HG3 LYS 63 1HG LYS 63 7.120 -12.063 -6.434
509 HD2 LYS 63 2HD LYS 63 5.862 -10.054 -7.181
510 HD3 LYS 63 1HD LYS 63 7.181 -9.690 -8.297
511 HE2 LYS 63 2HE LYS 63 5.422 -12.140 -8.300
512 HE3 LYS 63 1HE LYS 63 5.413 -10.832 -9.481
513 HZ1 LYS 63 3HZ LYS 63 7.693 -11.446 -10.089
514 HZ2 LYS 63 1HZ LYS 63 6.606 -12.725 -10.339
515 HZ3 LYS 63 2HZ LYS 63 7.638 -12.742 -8.996
516 HA PRO 64 HA PRO 64 10.866 -9.470 -1.288
517 HB2 PRO 64 2HB PRO 64 13.489 -9.018 -2.602
518 HB3 PRO 64 1HB PRO 64 13.128 -9.724 -1.023
519 HG2 PRO 64 2HG PRO 64 13.891 -11.256 -3.068
520 HG3 PRO 64 1HG PRO 64 12.665 -11.812 -1.915
521 HD2 PRO 64 2HD PRO 64 12.320 -10.774 -4.696
522 HD3 PRO 64 1HD PRO 64 11.445 -12.069 -3.855
523 H GLU 65 HN GLU 65 12.280 -8.037 -4.254
524 HA GLU 65 HA GLU 65 12.383 -5.414 -3.266
525 HB2 GLU 65 2HB GLU 65 13.580 -6.255 -5.287
526 HB3 GLU 65 1HB GLU 65 12.046 -6.243 -6.141
527 HG2 GLU 65 2HG GLU 65 11.895 -3.790 -5.623
528 HG3 GLU 65 1HG GLU 65 13.562 -3.891 -5.056
529 H THR 66 HN THR 66 9.863 -7.161 -4.965
530 HA THR 66 HA THR 66 8.245 -4.911 -5.554
531 HB THR 66 HB THR 66 7.438 -7.819 -5.351
532 HG1 THR 66 1HG THR 66 8.559 -6.250 -7.444
533 HG21 THR 66 3HG2 THR 66 5.531 -6.263 -5.396
534 HG22 THR 66 1HG2 THR 66 5.638 -7.205 -6.884
535 HG23 THR 66 2HG2 THR 66 6.175 -5.526 -6.863
536 H ALA 67 HN ALA 67 8.386 -7.159 -2.858
537 HA ALA 67 HA ALA 67 5.990 -6.500 -1.582
538 HB1 ALA 67 1HB ALA 67 7.380 -8.391 -0.912
539 HB2 ALA 67 2HB ALA 67 7.039 -7.336 0.460
540 HB3 ALA 67 3HB ALA 67 8.619 -7.283 -0.323
541 H SER 68 HN SER 68 9.209 -5.055 -1.249
542 HA SER 68 HA SER 68 8.414 -3.105 0.666
543 HB2 SER 68 2HB SER 68 10.757 -3.999 0.252
544 HB3 SER 68 1HB SER 68 10.810 -2.971 -1.178
545 HG SER 68 HG SER 68 11.244 -2.325 1.387
546 H ARG 69 HN ARG 69 8.936 -3.010 -2.856
547 HA ARG 69 HA ARG 69 8.487 -0.257 -3.173
548 HB2 ARG 69 2HB ARG 69 8.244 -2.575 -5.082
549 HB3 ARG 69 1HB ARG 69 8.071 -0.905 -5.572
550 HG2 ARG 69 2HG ARG 69 10.344 -0.442 -4.772
551 HG3 ARG 69 1HG ARG 69 10.513 -2.144 -4.348
552 HD2 ARG 69 2HD ARG 69 11.563 -1.797 -6.469
553 HD3 ARG 69 1HD ARG 69 10.081 -2.715 -6.731
554 HE ARG 69 HE ARG 69 9.377 -0.076 -7.076
555 HH11 ARG 69 1HH1 ARG 69 11.668 -2.300 -8.562
556 HH12 ARG 69 2HH1 ARG 69 11.624 -1.483 -10.101
557 HH21 ARG 69 1HH2 ARG 69 9.332 0.971 -9.071
558 HH22 ARG 69 2HH2 ARG 69 10.327 0.402 -10.385
559 H LEU 70 HN LEU 70 6.297 -3.003 -3.077
560 HA LEU 70 HA LEU 70 3.983 -1.630 -3.964
561 HB2 LEU 70 2HB LEU 70 4.158 -4.086 -3.908
562 HB3 LEU 70 1HB LEU 70 4.217 -4.038 -2.158
563 HG LEU 70 HG LEU 70 1.933 -3.151 -2.094
564 HD11 LEU 70 1HD1 LEU 70 1.906 -1.952 -4.206
565 HD12 LEU 70 2HD1 LEU 70 0.578 -3.111 -4.137
566 HD13 LEU 70 3HD1 LEU 70 2.017 -3.474 -5.091
567 HD21 LEU 70 3HD2 LEU 70 2.303 -5.554 -1.982
568 HD22 LEU 70 1HD2 LEU 70 2.226 -5.658 -3.740
569 HD23 LEU 70 2HD2 LEU 70 0.797 -5.186 -2.823
570 H ARG 71 HN ARG 71 5.481 -2.090 -0.820
571 HA ARG 71 HA ARG 71 3.406 -0.917 0.703
572 HB2 ARG 71 2HB ARG 71 6.325 -1.408 1.240
573 HB3 ARG 71 1HB ARG 71 5.273 -0.643 2.418
574 HG2 ARG 71 2HG ARG 71 5.079 -3.421 1.298
575 HG3 ARG 71 1HG ARG 71 5.352 -2.935 2.975
576 HD2 ARG 71 2HD ARG 71 3.107 -1.959 3.053
577 HD3 ARG 71 1HD ARG 71 2.837 -2.444 1.381
578 HE ARG 71 HE ARG 71 3.282 -4.379 3.557
579 HH11 ARG 71 1HH1 ARG 71 1.659 -3.366 0.648
580 HH12 ARG 71 2HH1 ARG 71 0.560 -4.707 0.622
581 HH21 ARG 71 1HH2 ARG 71 1.824 -6.163 3.558
582 HH22 ARG 71 2HH2 ARG 71 0.655 -6.295 2.283
583 H GLY 72 HN GLY 72 6.250 0.367 -0.916
584 HA2 GLY 72 2HA GLY 72 6.200 2.972 0.114
585 HA3 GLY 72 1HA GLY 72 6.838 2.518 -1.458
586 H ARG 73 HN ARG 73 4.277 1.470 -2.400
587 HA ARG 73 HA ARG 73 3.099 3.881 -3.381
588 HB2 ARG 73 2HB ARG 73 1.913 1.098 -3.459
589 HB3 ARG 73 1HB ARG 73 1.509 2.449 -4.506
590 HG2 ARG 73 2HG ARG 73 3.743 2.359 -5.488
591 HG3 ARG 73 1HG ARG 73 4.142 0.993 -4.439
592 HD2 ARG 73 2HD ARG 73 2.143 -0.186 -5.442
593 HD3 ARG 73 1HD ARG 73 2.088 1.108 -6.637
594 HE ARG 73 HE ARG 73 4.588 -0.376 -6.326
595 HH11 ARG 73 1HH1 ARG 73 1.740 0.353 -8.223
596 HH12 ARG 73 2HH1 ARG 73 2.323 -0.447 -9.645
597 HH21 ARG 73 1HH2 ARG 73 5.354 -1.462 -8.196
598 HH22 ARG 73 2HH2 ARG 73 4.365 -1.481 -9.634
599 H ILE 74 HN ILE 74 2.103 1.390 -1.080
600 HA ILE 74 HA ILE 74 -0.417 2.440 -0.434
601 HB ILE 74 HB ILE 74 1.423 0.661 1.164
602 HG12 ILE 74 2HG1 ILE 74 -0.989 0.117 -0.581
603 HG13 ILE 74 1HG1 ILE 74 0.680 -0.297 -0.951
604 HG21 ILE 74 1HG2 ILE 74 -1.483 1.313 1.660
605 HG22 ILE 74 2HG2 ILE 74 -0.121 1.792 2.672
606 HG23 ILE 74 3HG2 ILE 74 -0.544 0.087 2.513
607 HD11 ILE 74 3HD1 ILE 74 0.698 -1.843 0.948
608 HD12 ILE 74 1HD1 ILE 74 -0.540 -2.247 -0.239
609 HD13 ILE 74 2HD1 ILE 74 -0.990 -1.449 1.265
610 H GLU 75 HN GLU 75 2.785 3.031 0.939
611 HA GLU 75 HA GLU 75 2.168 4.514 3.192
612 HB2 GLU 75 2HB GLU 75 4.466 3.923 2.498
613 HB3 GLU 75 1HB GLU 75 4.361 5.086 1.184
614 HG2 GLU 75 2HG GLU 75 3.770 6.709 3.211
615 HG3 GLU 75 1HG GLU 75 4.740 5.520 4.081
616 H SER 76 HN SER 76 2.482 5.642 -0.153
617 HA SER 76 HA SER 76 1.937 8.349 0.344
618 HB2 SER 76 2HB SER 76 1.532 6.742 -2.172
619 HB3 SER 76 1HB SER 76 1.582 8.500 -2.089
620 HG SER 76 HG SER 76 3.748 8.079 -1.043
621 H VAL 77 HN VAL 77 -0.164 5.616 -0.384
622 HA VAL 77 HA VAL 77 -2.533 7.125 -0.778
623 HB VAL 77 HB VAL 77 -2.284 4.253 0.143
624 HG11 VAL 77 1HG1 VAL 77 -4.590 5.688 -1.170
625 HG12 VAL 77 2HG1 VAL 77 -4.509 5.193 0.521
626 HG13 VAL 77 3HG1 VAL 77 -4.536 3.976 -0.755
627 HG21 VAL 77 3HG2 VAL 77 -2.526 5.376 -2.648
628 HG22 VAL 77 1HG2 VAL 77 -2.553 3.666 -2.219
629 HG23 VAL 77 2HG2 VAL 77 -1.094 4.620 -1.952
630 H LEU 78 HN LEU 78 -1.251 5.366 2.038
631 HA LEU 78 HA LEU 78 -3.380 6.064 3.768
632 HB2 LEU 78 2HB LEU 78 -0.560 5.186 4.378
633 HB3 LEU 78 1HB LEU 78 -1.827 5.340 5.581
634 HG LEU 78 HG LEU 78 -1.835 3.431 3.240
635 HD11 LEU 78 1HD1 LEU 78 -1.594 1.696 4.898
636 HD12 LEU 78 2HD1 LEU 78 -1.603 2.889 6.195
637 HD13 LEU 78 3HD1 LEU 78 -0.265 2.844 5.047
638 HD21 LEU 78 3HD2 LEU 78 -4.085 4.243 3.815
639 HD22 LEU 78 1HD2 LEU 78 -3.826 3.739 5.485
640 HD23 LEU 78 2HD2 LEU 78 -3.875 2.536 4.197
641 H ASP 79 HN ASP 79 -0.338 7.610 2.967
642 HA ASP 79 HA ASP 79 -0.320 9.527 5.046
643 HB2 ASP 79 2HB ASP 79 1.643 9.015 3.618
644 HB3 ASP 79 1HB ASP 79 0.824 9.756 2.249
645 H TRP 80 HN TRP 80 -1.488 9.663 1.698
646 HA TRP 80 HA TRP 80 -2.646 12.213 1.791
647 HB2 TRP 80 2HB TRP 80 -2.355 11.191 -0.331
648 HB3 TRP 80 1HB TRP 80 -3.234 9.748 0.153
649 HD1 TRP 80 1HD TRP 80 -3.896 13.445 -0.771
650 HE1 TRP 80 1HE TRP 80 -6.308 13.621 -1.677
651 HE3 TRP 80 3HE TRP 80 -5.430 8.650 0.109
652 HZ2 TRP 80 2HZ TRP 80 -8.560 11.921 -1.973
653 HZ3 TRP 80 3HZ TRP 80 -7.721 8.006 -0.512
654 HH2 TRP 80 2HH TRP 80 -9.250 9.611 -1.530
655 H ALA 81 HN ALA 81 -3.995 9.028 2.558
656 HA ALA 81 HA ALA 81 -6.625 9.815 3.084
657 HB1 ALA 81 1HB ALA 81 -5.070 7.570 4.368
658 HB2 ALA 81 2HB ALA 81 -5.932 7.482 2.832
659 HB3 ALA 81 3HB ALA 81 -6.827 7.733 4.330
660 H THR 82 HN THR 82 -3.760 9.887 5.120
661 HA THR 82 HA THR 82 -5.088 10.444 7.555
662 HB THR 82 HB THR 82 -2.258 11.191 6.773
663 HG1 THR 82 1HG THR 82 -2.461 8.982 6.542
664 HG21 THR 82 3HG2 THR 82 -1.823 11.093 9.191
665 HG22 THR 82 1HG2 THR 82 -3.534 10.770 9.482
666 HG23 THR 82 2HG2 THR 82 -3.031 12.318 8.803
667 H VAL 83 HN VAL 83 -3.600 12.516 5.080
668 HA VAL 83 HA VAL 83 -4.108 14.972 6.401
669 HB VAL 83 HB VAL 83 -3.773 14.493 3.430
670 HG11 VAL 83 1HG1 VAL 83 -4.695 16.703 3.953
671 HG12 VAL 83 2HG1 VAL 83 -3.046 16.821 3.342
672 HG13 VAL 83 3HG1 VAL 83 -3.359 16.996 5.067
673 HG21 VAL 83 3HG2 VAL 83 -1.408 15.018 3.799
674 HG22 VAL 83 1HG2 VAL 83 -1.898 13.582 4.699
675 HG23 VAL 83 2HG2 VAL 83 -1.703 15.123 5.535
676 H ARG 84 HN ARG 84 -5.953 12.995 4.173
677 HA ARG 84 HA ARG 84 -8.058 14.867 3.749
678 HB2 ARG 84 2HB ARG 84 -7.813 11.898 3.329
679 HB3 ARG 84 1HB ARG 84 -9.303 12.767 2.997
680 HG2 ARG 84 2HG ARG 84 -6.657 13.461 1.754
681 HG3 ARG 84 1HG ARG 84 -7.845 12.382 1.017
682 HD2 ARG 84 2HD ARG 84 -8.352 15.245 1.809
683 HD3 ARG 84 1HD ARG 84 -7.996 14.691 0.173
684 HE ARG 84 HE ARG 84 -10.116 13.209 0.691
685 HH11 ARG 84 1HH1 ARG 84 -9.575 16.571 1.515
686 HH12 ARG 84 2HH1 ARG 84 -11.248 17.013 1.318
687 HH21 ARG 84 1HH2 ARG 84 -12.325 13.791 0.456
688 HH22 ARG 84 2HH2 ARG 84 -12.810 15.432 0.783
689 H GLY 85 HN GLY 85 -7.207 13.000 6.420
690 HA2 GLY 85 2HA GLY 85 -8.227 12.944 8.491
691 HA3 GLY 85 1HA GLY 85 -9.597 13.800 7.803
692 H TYR 86 HN TYR 86 -8.452 10.884 6.304
693 HA TYR 86 HA TYR 86 -10.961 9.568 6.910
694 HB2 TYR 86 2HB TYR 86 -8.568 8.538 5.360
695 HB3 TYR 86 1HB TYR 86 -10.143 7.760 5.454
696 HD1 TYR 86 1HD TYR 86 -11.655 10.525 5.259
697 HD2 TYR 86 2HD TYR 86 -8.622 8.637 2.952
698 HE1 TYR 86 1HE TYR 86 -12.391 11.784 3.273
699 HE2 TYR 86 2HE TYR 86 -9.339 9.891 0.967
700 HH TYR 86 HH TYR 86 -11.473 11.016 0.157
701 H ARG 87 HN ARG 87 -7.624 9.429 7.840
702 HA ARG 87 HA ARG 87 -8.301 7.760 10.116
703 HB2 ARG 87 2HB ARG 87 -6.179 6.386 9.680
704 HB3 ARG 87 1HB ARG 87 -7.596 6.006 8.713
705 HG2 ARG 87 2HG ARG 87 -6.595 6.594 6.795
706 HG3 ARG 87 1HG ARG 87 -5.815 8.001 7.517
707 HD2 ARG 87 2HD ARG 87 -4.874 5.252 8.209
708 HD3 ARG 87 1HD ARG 87 -4.372 5.999 6.690
709 HE ARG 87 HE ARG 87 -3.599 7.906 8.175
710 HH11 ARG 87 1HH1 ARG 87 -3.616 4.551 9.270
711 HH12 ARG 87 2HH1 ARG 87 -2.342 4.822 10.420
712 HH21 ARG 87 1HH2 ARG 87 -1.936 8.209 9.670
713 HH22 ARG 87 2HH2 ARG 87 -1.392 6.879 10.644
714 H GLU 88 HN GLU 88 -6.704 7.872 11.811
715 HA GLU 88 HA GLU 88 -4.911 10.196 11.534
716 HB2 GLU 88 2HB GLU 88 -6.467 9.330 13.981
717 HB3 GLU 88 1HB GLU 88 -5.303 10.644 13.936
718 HG2 GLU 88 2HG GLU 88 -6.731 11.806 12.295
719 HG3 GLU 88 1HG GLU 88 -7.920 10.513 12.456
720 H GLY 89 HN GLY 89 -3.218 10.168 13.364
721 HA2 GLY 89 2HA GLY 89 -1.788 8.951 14.798
722 HA3 GLY 89 1HA GLY 89 -2.435 7.452 14.139
723 H ASP 90 HN ASP 90 -0.165 6.849 14.023
724 HA ASP 90 HA ASP 90 1.439 8.158 11.983
725 HB2 ASP 90 2HB ASP 90 2.274 7.131 14.228
726 HB3 ASP 90 1HB ASP 90 2.173 5.593 13.378
727 H ASN 91 HN ASN 91 2.599 6.538 10.420
728 HA ASN 91 HA ASN 91 0.439 5.202 8.974
729 HB2 ASN 91 2HB ASN 91 2.037 6.842 7.883
730 HB3 ASN 91 1HB ASN 91 3.322 5.673 8.140
731 HD21 ASN 91 1HD2 ASN 91 2.227 6.854 5.692
732 HD22 ASN 91 2HD2 ASN 91 1.774 5.521 4.694
733 HA PRO 92 HA PRO 92 2.090 1.281 10.373
734 HB2 PRO 92 2HB PRO 92 0.383 -0.363 9.142
735 HB3 PRO 92 1HB PRO 92 -0.142 0.695 10.458
736 HG2 PRO 92 2HG PRO 92 -0.486 1.027 7.507
737 HG3 PRO 92 1HG PRO 92 -1.636 1.361 8.813
738 HD2 PRO 92 2HD PRO 92 -0.078 3.269 7.556
739 HD3 PRO 92 1HD PRO 92 -0.790 3.450 9.170
740 H ALA 93 HN ALA 93 2.239 2.384 7.155
741 HA ALA 93 HA ALA 93 3.325 -0.108 6.099
742 HB1 ALA 93 1HB ALA 93 1.712 1.147 4.757
743 HB2 ALA 93 2HB ALA 93 3.263 0.998 3.935
744 HB3 ALA 93 3HB ALA 93 2.820 2.518 4.710
745 H ARG 94 HN ARG 94 4.627 2.270 7.874
746 HA ARG 94 HA ARG 94 7.113 2.376 6.334
747 HB2 ARG 94 2HB ARG 94 7.713 4.139 8.149
748 HB3 ARG 94 1HB ARG 94 6.645 4.576 6.830
749 HG2 ARG 94 2HG ARG 94 5.331 5.406 8.424
750 HG3 ARG 94 1HG ARG 94 4.872 3.738 8.733
751 HD2 ARG 94 2HD ARG 94 7.175 5.098 10.113
752 HD3 ARG 94 1HD ARG 94 5.533 5.099 10.748
753 HE ARG 94 HE ARG 94 7.037 2.608 10.268
754 HH11 ARG 94 1HH1 ARG 94 4.913 4.605 12.205
755 HH12 ARG 94 2HH1 ARG 94 4.846 3.474 13.529
756 HH21 ARG 94 1HH2 ARG 94 6.968 1.111 12.012
757 HH22 ARG 94 2HH2 ARG 94 6.010 1.483 13.414
758 H TRP 95 HN TRP 95 9.124 1.951 7.342
759 HA TRP 95 HA TRP 95 8.880 0.198 9.702
760 HB2 TRP 95 2HB TRP 95 9.957 -0.378 7.029
761 HB3 TRP 95 1HB TRP 95 10.980 -0.896 8.370
762 HD1 TRP 95 1HD TRP 95 9.556 -2.370 10.317
763 HE1 TRP 95 1HE TRP 95 7.880 -4.277 9.903
764 HE3 TRP 95 3HE TRP 95 8.311 -1.305 5.479
765 HZ2 TRP 95 2HZ TRP 95 6.241 -5.202 7.803
766 HZ3 TRP 95 3HZ TRP 95 6.675 -2.748 4.341
767 HH2 TRP 95 2HH TRP 95 5.664 -4.654 5.481
768 H ARG 96 HN ARG 96 9.982 0.974 11.336
769 HA ARG 96 HA ARG 96 12.564 2.265 10.826
770 HB2 ARG 96 2HB ARG 96 11.092 3.586 12.237
771 HB3 ARG 96 1HB ARG 96 10.836 2.216 13.311
772 HG2 ARG 96 2HG ARG 96 13.059 2.293 14.096
773 HG3 ARG 96 1HG ARG 96 13.532 3.418 12.824
774 HD2 ARG 96 2HD ARG 96 12.211 5.166 13.800
775 HD3 ARG 96 1HD ARG 96 11.526 4.051 14.981
776 HE ARG 96 HE ARG 96 13.721 3.899 16.000
777 HH11 ARG 96 1HH1 ARG 96 13.241 6.502 13.698
778 HH12 ARG 96 2HH1 ARG 96 14.495 7.496 14.373
779 HH21 ARG 96 1HH2 ARG 96 15.385 5.205 16.882
780 HH22 ARG 96 2HH2 ARG 96 15.706 6.770 16.187
781 H GLY 97 HN GLY 97 14.082 0.767 10.687
782 HA2 GLY 97 2HA GLY 97 15.496 -0.766 12.019
783 HA3 GLY 97 1HA GLY 97 13.995 -1.510 12.567
784 H TYR 98 HN TYR 98 12.515 -2.034 10.539
785 HA TYR 98 HA TYR 98 12.123 -3.242 8.657
786 HB2 TYR 98 2HB TYR 98 13.523 -1.278 7.782
787 HB3 TYR 98 1HB TYR 98 14.872 -2.396 7.755
788 HD1 TYR 98 2HD TYR 98 11.308 -2.422 6.603
789 HD2 TYR 98 1HD TYR 98 15.386 -3.202 5.662
790 HE1 TYR 98 2HE TYR 98 10.647 -3.114 4.336
791 HE2 TYR 98 1HE TYR 98 14.737 -3.891 3.395
792 HH TYR 98 HH TYR 98 12.801 -4.704 2.200
793 H LEU 99 HN LEU 99 13.718 -4.863 7.067
794 HA LEU 99 HA LEU 99 14.279 -7.086 8.732
795 HB2 LEU 99 2HB LEU 99 14.950 -6.514 5.847
796 HB3 LEU 99 1HB LEU 99 15.368 -8.020 6.637
797 HG LEU 99 HG LEU 99 12.884 -8.303 7.115
798 HD11 LEU 99 1HD1 LEU 99 12.679 -6.141 5.029
799 HD12 LEU 99 2HD1 LEU 99 12.190 -6.002 6.716
800 HD13 LEU 99 3HD1 LEU 99 11.347 -7.119 5.645
801 HD21 LEU 99 3HD2 LEU 99 13.846 -8.284 4.263
802 HD22 LEU 99 1HD2 LEU 99 12.444 -9.165 4.869
803 HD23 LEU 99 2HD2 LEU 99 14.062 -9.587 5.432
804 H GLU 100 HN GLU 100 16.591 -5.585 6.505
805 HA GLU 100 HA GLU 100 18.461 -5.073 8.648
806 HB2 GLU 100 2HB GLU 100 18.972 -7.404 8.115
807 HB3 GLU 100 1HB GLU 100 19.130 -6.999 6.411
808 HG2 GLU 100 2HG GLU 100 21.315 -7.230 7.376
809 HG3 GLU 100 1HG GLU 100 21.040 -5.536 6.973
810 H HIS 101 HN HIS 101 18.727 -2.971 8.193
811 HA HIS 101 HA HIS 101 18.912 -1.998 5.494
812 HB2 HIS 101 2HB HIS 101 17.957 -0.603 7.306
813 HB3 HIS 101 1HB HIS 101 19.526 -0.584 8.105
814 HD1 HIS 101 1HD HIS 101 17.716 0.807 5.114
815 HD2 HIS 101 2HD HIS 101 21.379 1.225 7.050
816 HE1 HIS 101 1HE HIS 101 18.792 2.846 4.105
817 HE2 HIS 101 2HE HIS 101 21.019 3.062 5.253
818 H HIS 102 HN HIS 102 20.661 -2.568 4.353
819 HA HIS 102 HA HIS 102 23.287 -2.132 5.565
820 HB2 HIS 102 2HB HIS 102 24.141 -4.260 4.783
821 HB3 HIS 102 1HB HIS 102 22.744 -4.542 5.810
822 HD1 HIS 102 1HD HIS 102 20.594 -5.489 4.657
823 HD2 HIS 102 2HD HIS 102 23.868 -5.071 2.123
824 HE1 HIS 102 1HE HIS 102 20.016 -6.786 2.580
825 HE2 HIS 102 2HE HIS 102 22.085 -6.669 1.149
826 H HIS 103 HN HIS 103 24.669 -1.141 4.260
827 HA HIS 103 HA HIS 103 23.960 -0.727 1.469
828 HB2 HIS 103 2HB HIS 103 25.717 0.564 3.419
829 HB3 HIS 103 1HB HIS 103 26.471 0.374 1.841
830 HD1 HIS 103 1HD HIS 103 24.096 2.445 3.693
831 HD2 HIS 103 2HD HIS 103 24.993 1.663 -0.291
832 HE1 HIS 103 1HE HIS 103 23.078 4.335 2.383
833 HE2 HIS 103 2HE HIS 103 23.894 3.983 0.025
834 H HIS 104 HN HIS 104 26.942 -1.700 3.153
835 HA HIS 104 HA HIS 104 28.631 -3.117 2.600
836 HB2 HIS 104 2HB HIS 104 26.578 -4.694 2.627
837 HB3 HIS 104 1HB HIS 104 26.689 -4.648 0.872
838 HD1 HIS 104 1HD HIS 104 28.557 -5.835 3.920
839 HD2 HIS 104 2HD HIS 104 28.695 -6.222 -0.222
840 HE1 HIS 104 1HE HIS 104 30.199 -7.686 3.462
841 HE2 HIS 104 2HE HIS 104 30.166 -7.996 0.962
842 H HIS 105 HN HIS 105 27.818 -0.829 0.886
843 HA HIS 105 HA HIS 105 29.715 -0.992 -1.173
844 HB2 HIS 105 2HB HIS 105 27.917 -2.546 -2.103
845 HB3 HIS 105 1HB HIS 105 26.868 -1.135 -2.190
846 HD1 HIS 105 1HD HIS 105 27.346 0.597 -4.064
847 HD2 HIS 105 2HD HIS 105 29.949 -2.650 -4.016
848 HE1 HIS 105 1HE HIS 105 28.605 0.698 -6.239
849 HE2 HIS 105 2HE HIS 105 30.048 -1.373 -6.260
850 H HIS 106 HN HIS 106 30.286 1.087 -1.396
851 HA HIS 106 HA HIS 106 28.158 3.096 -1.474
852 HB2 HIS 106 2HB HIS 106 29.378 4.625 -0.018
853 HB3 HIS 106 1HB HIS 106 29.029 3.129 0.829
854 HD1 HIS 106 1HD HIS 106 31.098 1.506 1.232
855 HD2 HIS 106 2HD HIS 106 32.032 5.310 -0.167
856 HE1 HIS 106 1HE HIS 106 33.544 1.817 1.698
857 HE2 HIS 106 2HE HIS 106 34.066 4.162 0.952
Start of MODEL 11
1 H1 MET 1 H1 MET 1 -16.073 2.616 5.052
2 H2 MET 1 H2 MET 1 -16.116 4.309 5.038
3 H3 MET 1 H3 MET 1 -14.991 3.494 6.014
4 HA MET 1 HA MET 1 -15.056 3.455 3.055
5 HB2 MET 1 2HB MET 1 -14.315 5.615 3.935
6 HB3 MET 1 1HB MET 1 -13.165 4.810 4.994
7 HG2 MET 1 2HG MET 1 -11.950 5.655 3.145
8 HG3 MET 1 1HG MET 1 -12.040 3.909 2.957
9 HE1 MET 1 2HE MET 1 -13.504 7.363 1.771
10 HE2 MET 1 3HE MET 1 -14.931 6.480 2.313
11 HE3 MET 1 1HE MET 1 -14.713 6.839 0.601
12 H THR 2 HN THR 2 -14.029 1.776 2.183
13 HA THR 2 HA THR 2 -12.420 0.081 3.956
14 HB THR 2 HB THR 2 -12.515 -1.597 2.141
15 HG1 THR 2 1HG THR 2 -14.360 0.170 0.862
16 HG21 THR 2 3HG2 THR 2 -15.225 -0.510 2.907
17 HG22 THR 2 1HG2 THR 2 -14.228 -1.575 3.899
18 HG23 THR 2 2HG2 THR 2 -14.877 -2.153 2.364
19 H PHE 3 HN PHE 3 -10.396 -0.862 2.985
20 HA PHE 3 HA PHE 3 -8.666 1.232 2.225
21 HB2 PHE 3 2HB PHE 3 -7.909 -0.793 3.419
22 HB3 PHE 3 1HB PHE 3 -8.225 -1.754 1.978
23 HD1 PHE 3 2HD PHE 3 -6.204 1.119 3.198
24 HD2 PHE 3 1HD PHE 3 -6.561 -2.050 0.383
25 HE1 PHE 3 2HE PHE 3 -3.925 1.583 2.391
26 HE2 PHE 3 1HE PHE 3 -4.284 -1.590 -0.430
27 HZ PHE 3 HZ PHE 3 -2.963 0.227 0.574
28 H SER 4 HN SER 4 -10.362 -1.236 0.380
29 HA SER 4 HA SER 4 -9.117 -0.821 -2.100
30 HB2 SER 4 2HB SER 4 -10.561 -2.761 -1.639
31 HB3 SER 4 1HB SER 4 -11.960 -1.692 -1.525
32 HG SER 4 HG SER 4 -10.640 -1.293 -3.847
33 H GLU 5 HN GLU 5 -12.034 0.643 -0.693
34 HA GLU 5 HA GLU 5 -12.678 2.306 -2.863
35 HB2 GLU 5 2HB GLU 5 -13.230 2.524 0.091
36 HB3 GLU 5 1HB GLU 5 -13.921 3.609 -1.097
37 HG2 GLU 5 2HG GLU 5 -15.104 1.812 -2.140
38 HG3 GLU 5 1HG GLU 5 -14.293 0.632 -1.109
39 H CYS 6 HN CYS 6 -10.824 2.900 0.089
40 HA CYS 6 HA CYS 6 -10.316 5.626 -0.329
41 HB2 CYS 6 2HB CYS 6 -9.985 4.287 1.789
42 HB3 CYS 6 1HB CYS 6 -8.492 3.695 1.095
43 HG CYS 6 HG CYS 6 -7.803 6.619 0.702
44 H ALA 7 HN ALA 7 -8.392 2.765 -1.129
45 HA ALA 7 HA ALA 7 -6.208 4.055 -2.312
46 HB1 ALA 7 1HB ALA 7 -7.383 1.384 -3.074
47 HB2 ALA 7 2HB ALA 7 -6.240 1.665 -1.761
48 HB3 ALA 7 3HB ALA 7 -5.751 1.947 -3.432
49 H ALA 8 HN ALA 8 -9.289 3.016 -3.727
50 HA ALA 8 HA ALA 8 -8.715 3.743 -6.382
51 HB1 ALA 8 1HB ALA 8 -11.407 3.693 -5.023
52 HB2 ALA 8 2HB ALA 8 -10.597 2.300 -5.740
53 HB3 ALA 8 3HB ALA 8 -11.106 3.645 -6.760
54 H LEU 9 HN LEU 9 -9.984 5.568 -3.655
55 HA LEU 9 HA LEU 9 -10.671 7.919 -5.055
56 HB2 LEU 9 2HB LEU 9 -9.729 7.646 -2.199
57 HB3 LEU 9 1HB LEU 9 -10.536 9.042 -2.875
58 HG LEU 9 HG LEU 9 -11.756 6.302 -2.537
59 HD11 LEU 9 1HD1 LEU 9 -11.458 7.442 -0.422
60 HD12 LEU 9 2HD1 LEU 9 -13.164 7.423 -0.868
61 HD13 LEU 9 3HD1 LEU 9 -12.216 8.896 -1.072
62 HD21 LEU 9 3HD2 LEU 9 -13.836 7.363 -3.239
63 HD22 LEU 9 1HD2 LEU 9 -12.618 7.464 -4.510
64 HD23 LEU 9 2HD2 LEU 9 -12.979 8.879 -3.521
65 H TYR 10 HN TYR 10 -7.683 6.894 -3.461
66 HA TYR 10 HA TYR 10 -6.170 9.213 -3.815
67 HB2 TYR 10 2HB TYR 10 -5.442 7.294 -2.453
68 HB3 TYR 10 1HB TYR 10 -5.238 6.335 -3.909
69 HD1 TYR 10 2HD TYR 10 -3.933 9.256 -2.055
70 HD2 TYR 10 1HD TYR 10 -3.251 6.473 -5.199
71 HE1 TYR 10 2HE TYR 10 -1.610 10.030 -2.228
72 HE2 TYR 10 1HE TYR 10 -0.924 7.248 -5.383
73 HH TYR 10 HH TYR 10 0.529 9.275 -3.035
74 H ILE 11 HN ILE 11 -6.650 6.451 -5.934
75 HA ILE 11 HA ILE 11 -4.994 7.306 -8.055
76 HB ILE 11 HB ILE 11 -7.402 5.481 -8.057
77 HG12 ILE 11 2HG1 ILE 11 -4.441 4.863 -8.065
78 HG13 ILE 11 1HG1 ILE 11 -5.482 4.786 -6.648
79 HG21 ILE 11 1HG2 ILE 11 -5.317 5.853 -10.205
80 HG22 ILE 11 2HG2 ILE 11 -7.003 6.360 -10.302
81 HG23 ILE 11 3HG2 ILE 11 -6.604 4.644 -10.209
82 HD11 ILE 11 3HD1 ILE 11 -6.794 3.025 -7.716
83 HD12 ILE 11 1HD1 ILE 11 -5.093 2.581 -7.568
84 HD13 ILE 11 2HD1 ILE 11 -5.736 3.100 -9.125
85 H LYS 12 HN LYS 12 -8.514 7.606 -7.547
86 HA LYS 12 HA LYS 12 -8.997 8.916 -10.008
87 HB2 LYS 12 2HB LYS 12 -10.652 8.630 -7.516
88 HB3 LYS 12 1HB LYS 12 -11.219 9.538 -8.911
89 HG2 LYS 12 2HG LYS 12 -10.831 7.481 -10.286
90 HG3 LYS 12 1HG LYS 12 -10.536 6.616 -8.777
91 HD2 LYS 12 2HD LYS 12 -12.766 7.153 -7.996
92 HD3 LYS 12 1HD LYS 12 -13.065 8.124 -9.436
93 HE2 LYS 12 2HE LYS 12 -12.810 6.116 -10.830
94 HE3 LYS 12 1HE LYS 12 -12.539 5.154 -9.379
95 HZ1 LYS 12 3HZ LYS 12 -15.024 6.664 -9.998
96 HZ2 LYS 12 1HZ LYS 12 -14.760 5.702 -8.623
97 HZ3 LYS 12 2HZ LYS 12 -14.825 4.991 -10.163
98 H ALA 13 HN ALA 13 -8.235 10.135 -6.804
99 HA ALA 13 HA ALA 13 -8.930 12.832 -7.262
100 HB1 ALA 13 1HB ALA 13 -7.554 13.351 -5.338
101 HB2 ALA 13 2HB ALA 13 -6.778 11.770 -5.433
102 HB3 ALA 13 3HB ALA 13 -8.491 11.888 -5.028
103 H HIS 14 HN HIS 14 -6.444 10.957 -8.605
104 HA HIS 14 HA HIS 14 -4.986 13.395 -9.412
105 HB2 HIS 14 2HB HIS 14 -3.876 10.622 -8.915
106 HB3 HIS 14 1HB HIS 14 -2.957 11.945 -9.620
107 HD1 HIS 14 1HD HIS 14 -4.256 10.645 -6.385
108 HD2 HIS 14 2HD HIS 14 -2.188 13.962 -7.803
109 HE1 HIS 14 1HE HIS 14 -3.320 11.783 -4.348
110 HE2 HIS 14 2HE HIS 14 -1.877 13.635 -5.257
111 H ARG 15 HN ARG 15 -7.145 11.329 -10.543
112 HA ARG 15 HA ARG 15 -5.941 9.776 -12.532
113 HB2 ARG 15 2HB ARG 15 -8.166 9.342 -13.335
114 HB3 ARG 15 1HB ARG 15 -8.194 9.407 -11.579
115 HG2 ARG 15 2HG ARG 15 -9.026 11.738 -11.734
116 HG3 ARG 15 1HG ARG 15 -9.120 11.542 -13.483
117 HD2 ARG 15 2HD ARG 15 -10.582 9.859 -11.457
118 HD3 ARG 15 1HD ARG 15 -11.283 11.194 -12.368
119 HE ARG 15 HE ARG 15 -10.221 8.761 -13.675
120 HH11 ARG 15 1HH1 ARG 15 -12.656 11.245 -13.299
121 HH12 ARG 15 2HH1 ARG 15 -13.667 10.635 -14.570
122 HH21 ARG 15 1HH2 ARG 15 -11.564 7.938 -15.339
123 HH22 ARG 15 2HH2 ARG 15 -13.072 8.730 -15.705
124 H SER 16 HN SER 16 -6.824 13.158 -12.674
125 HA SER 16 HA SER 16 -6.936 13.266 -15.527
126 HB2 SER 16 2HB SER 16 -6.594 15.479 -13.485
127 HB3 SER 16 1HB SER 16 -7.002 15.696 -15.180
128 HG SER 16 HG SER 16 -9.001 15.329 -14.703
129 H SER 17 HN SER 17 -4.495 14.121 -13.093
130 HA SER 17 HA SER 17 -2.445 14.650 -15.016
131 HB2 SER 17 2HB SER 17 -2.064 13.764 -12.150
132 HB3 SER 17 1HB SER 17 -1.004 14.778 -13.121
133 HG SER 17 HG SER 17 -3.129 16.144 -13.153
134 H TRP 18 HN TRP 18 -4.049 11.994 -13.881
135 HA TRP 18 HA TRP 18 -1.881 10.094 -14.344
136 HB2 TRP 18 2HB TRP 18 -4.180 10.221 -12.515
137 HB3 TRP 18 1HB TRP 18 -3.884 8.645 -13.231
138 HD1 TRP 18 1HD TRP 18 -0.989 10.971 -12.251
139 HE1 TRP 18 1HE TRP 18 0.308 9.831 -10.329
140 HE3 TRP 18 3HE TRP 18 -4.143 7.096 -11.439
141 HZ2 TRP 18 2HZ TRP 18 -0.008 7.528 -8.681
142 HZ3 TRP 18 3HZ TRP 18 -3.596 5.439 -9.698
143 HH2 TRP 18 2HH TRP 18 -1.578 5.662 -8.339
144 H LYS 19 HN LYS 19 -2.769 10.841 -16.718
145 HA LYS 19 HA LYS 19 -4.630 9.390 -18.042
146 HB2 LYS 19 2HB LYS 19 -1.672 9.458 -18.741
147 HB3 LYS 19 1HB LYS 19 -2.975 9.073 -19.855
148 HG2 LYS 19 2HG LYS 19 -2.516 11.728 -18.506
149 HG3 LYS 19 1HG LYS 19 -2.195 11.343 -20.196
150 HD2 LYS 19 2HD LYS 19 -4.588 10.889 -20.528
151 HD3 LYS 19 1HD LYS 19 -4.892 11.323 -18.846
152 HE2 LYS 19 2HE LYS 19 -3.706 13.165 -20.919
153 HE3 LYS 19 1HE LYS 19 -5.401 13.149 -20.442
154 HZ1 LYS 19 3HZ LYS 19 -3.062 13.896 -18.773
155 HZ2 LYS 19 1HZ LYS 19 -4.609 13.627 -18.131
156 HZ3 LYS 19 2HZ LYS 19 -4.362 14.872 -19.246
157 H ASN 20 HN ASN 20 -4.647 6.392 -16.902
158 HA ASN 20 HA ASN 20 -6.001 6.165 -18.688
159 HB2 ASN 20 2HB ASN 20 -6.000 8.703 -18.880
160 HB3 ASN 20 1HB ASN 20 -4.651 8.547 -19.994
161 HD21 ASN 20 1HD2 ASN 20 -5.022 7.923 -22.081
162 HD22 ASN 20 2HD2 ASN 20 -6.606 7.691 -22.735
163 H THR 21 HN THR 21 -2.892 5.926 -18.329
164 HA THR 21 HA THR 21 -2.552 4.147 -20.647
165 HB THR 21 HB THR 21 -0.134 4.149 -20.017
166 HG1 THR 21 1HG THR 21 -0.670 6.377 -18.349
167 HG21 THR 21 3HG2 THR 21 -0.866 5.690 -21.751
168 HG22 THR 21 1HG2 THR 21 0.383 6.449 -20.764
169 HG23 THR 21 2HG2 THR 21 -1.311 6.885 -20.533
170 H LYS 22 HN LYS 22 -0.757 2.335 -19.495
171 HA LYS 22 HA LYS 22 -2.536 0.927 -17.731
172 HB2 LYS 22 2HB LYS 22 0.203 0.239 -18.777
173 HB3 LYS 22 1HB LYS 22 -0.717 -0.809 -17.706
174 HG2 LYS 22 2HG LYS 22 -2.537 -0.831 -19.403
175 HG3 LYS 22 1HG LYS 22 -1.463 0.056 -20.488
176 HD2 LYS 22 2HD LYS 22 -0.917 -2.652 -19.278
177 HD3 LYS 22 1HD LYS 22 -1.410 -2.345 -20.944
178 HE2 LYS 22 2HE LYS 22 1.109 -1.284 -19.674
179 HE3 LYS 22 1HE LYS 22 1.029 -2.732 -20.674
180 HZ1 LYS 22 3HZ LYS 22 0.324 -1.412 -22.534
181 HZ2 LYS 22 1HZ LYS 22 1.749 -0.744 -21.900
182 HZ3 LYS 22 2HZ LYS 22 0.256 -0.010 -21.579
183 H HIS 23 HN HIS 23 -0.439 3.361 -17.057
184 HA HIS 23 HA HIS 23 0.980 2.464 -14.802
185 HB2 HIS 23 2HB HIS 23 -0.024 5.191 -15.596
186 HB3 HIS 23 1HB HIS 23 0.825 4.936 -14.077
187 HD1 HIS 23 1HD HIS 23 3.330 4.893 -14.154
188 HD2 HIS 23 2HD HIS 23 1.602 4.684 -17.938
189 HE1 HIS 23 1HE HIS 23 5.224 5.173 -15.788
190 HE2 HIS 23 2HE HIS 23 4.107 5.305 -18.043
191 H ALA 24 HN ALA 24 -2.248 3.924 -15.049
192 HA ALA 24 HA ALA 24 -2.832 3.893 -12.282
193 HB1 ALA 24 1HB ALA 24 -5.153 4.205 -12.972
194 HB2 ALA 24 2HB ALA 24 -4.724 3.799 -14.633
195 HB3 ALA 24 3HB ALA 24 -4.074 5.258 -13.888
196 H ASP 25 HN ASP 25 -3.268 1.531 -14.873
197 HA ASP 25 HA ASP 25 -4.819 -0.320 -13.379
198 HB2 ASP 25 2HB ASP 25 -4.619 -0.313 -15.877
199 HB3 ASP 25 1HB ASP 25 -2.983 -0.934 -15.707
200 H GLN 26 HN GLN 26 -1.352 -0.008 -14.009
201 HA GLN 26 HA GLN 26 -0.459 -2.269 -12.660
202 HB2 GLN 26 2HB GLN 26 0.757 0.419 -13.228
203 HB3 GLN 26 1HB GLN 26 1.622 -0.749 -12.253
204 HG2 GLN 26 2HG GLN 26 1.433 -2.370 -14.123
205 HG3 GLN 26 1HG GLN 26 0.711 -1.092 -15.092
206 HE21 GLN 26 1HE2 GLN 26 1.989 0.545 -15.883
207 HE22 GLN 26 2HE2 GLN 26 3.717 0.494 -15.833
208 H TRP 27 HN TRP 27 -1.226 0.963 -11.440
209 HA TRP 27 HA TRP 27 -0.509 0.467 -8.750
210 HB2 TRP 27 2HB TRP 27 -2.158 2.495 -10.178
211 HB3 TRP 27 1HB TRP 27 -2.379 2.342 -8.439
212 HD1 TRP 27 1HD TRP 27 0.538 2.936 -10.937
213 HE1 TRP 27 1HE TRP 27 2.240 4.494 -9.788
214 HE3 TRP 27 3HE TRP 27 -1.696 3.328 -6.364
215 HZ2 TRP 27 2HZ TRP 27 2.582 5.724 -7.258
216 HZ3 TRP 27 3HZ TRP 27 -0.626 4.708 -4.633
217 HH2 TRP 27 2HH TRP 27 1.468 5.881 -5.070
218 H THR 28 HN THR 28 -3.621 0.294 -10.443
219 HA THR 28 HA THR 28 -5.147 -0.352 -8.158
220 HB THR 28 HB THR 28 -5.830 -0.988 -11.034
221 HG1 THR 28 1HG THR 28 -5.211 1.273 -10.577
222 HG21 THR 28 3HG2 THR 28 -7.322 -2.006 -9.367
223 HG22 THR 28 1HG2 THR 28 -8.144 -0.739 -10.281
224 HG23 THR 28 2HG2 THR 28 -7.586 -0.422 -8.639
225 H ASN 29 HN ASN 29 -3.832 -2.386 -10.769
226 HA ASN 29 HA ASN 29 -5.238 -4.714 -10.087
227 HB2 ASN 29 2HB ASN 29 -4.032 -4.147 -12.269
228 HB3 ASN 29 1HB ASN 29 -2.556 -4.671 -11.468
229 HD21 ASN 29 1HD2 ASN 29 -4.006 -5.743 -13.793
230 HD22 ASN 29 2HD2 ASN 29 -4.305 -7.405 -13.423
231 H THR 30 HN THR 30 -1.872 -3.792 -9.307
232 HA THR 30 HA THR 30 -1.206 -6.199 -8.029
233 HB THR 30 HB THR 30 -0.044 -3.486 -7.390
234 HG1 THR 30 1HG THR 30 0.642 -5.347 -9.446
235 HG21 THR 30 3HG2 THR 30 1.993 -4.785 -6.896
236 HG22 THR 30 1HG2 THR 30 1.103 -6.276 -7.203
237 HG23 THR 30 2HG2 THR 30 0.653 -5.242 -5.848
238 H ILE 31 HN ILE 31 -2.378 -3.121 -6.679
239 HA ILE 31 HA ILE 31 -2.261 -3.985 -3.985
240 HB ILE 31 HB ILE 31 -3.898 -1.752 -5.207
241 HG12 ILE 31 2HG1 ILE 31 -1.221 -1.693 -3.791
242 HG13 ILE 31 1HG1 ILE 31 -1.453 -1.537 -5.528
243 HG21 ILE 31 1HG2 ILE 31 -3.209 -2.291 -2.319
244 HG22 ILE 31 2HG2 ILE 31 -4.809 -2.398 -3.052
245 HG23 ILE 31 3HG2 ILE 31 -3.999 -0.836 -2.927
246 HD11 ILE 31 3HD1 ILE 31 -2.426 0.371 -3.419
247 HD12 ILE 31 1HD1 ILE 31 -2.743 0.518 -5.148
248 HD13 ILE 31 2HD1 ILE 31 -1.089 0.627 -4.542
249 H LYS 32 HN LYS 32 -4.859 -3.887 -6.382
250 HA LYS 32 HA LYS 32 -6.948 -4.726 -4.695
251 HB2 LYS 32 2HB LYS 32 -7.202 -3.780 -7.012
252 HB3 LYS 32 1HB LYS 32 -6.670 -5.332 -7.641
253 HG2 LYS 32 2HG LYS 32 -8.575 -6.368 -6.349
254 HG3 LYS 32 1HG LYS 32 -9.165 -4.726 -6.088
255 HD2 LYS 32 2HD LYS 32 -9.310 -4.387 -8.499
256 HD3 LYS 32 1HD LYS 32 -8.678 -6.013 -8.773
257 HE2 LYS 32 2HE LYS 32 -10.636 -6.877 -7.454
258 HE3 LYS 32 1HE LYS 32 -11.295 -5.244 -7.497
259 HZ1 LYS 32 3HZ LYS 32 -11.260 -5.367 -9.935
260 HZ2 LYS 32 1HZ LYS 32 -12.240 -6.571 -9.244
261 HZ3 LYS 32 2HZ LYS 32 -10.703 -6.965 -9.844
262 H THR 33 HN THR 33 -4.481 -6.481 -6.427
263 HA THR 33 HA THR 33 -5.797 -9.023 -6.094
264 HB THR 33 HB THR 33 -3.029 -8.392 -7.135
265 HG1 THR 33 1HG THR 33 -4.352 -7.600 -8.651
266 HG21 THR 33 3HG2 THR 33 -4.668 -10.926 -7.320
267 HG22 THR 33 1HG2 THR 33 -3.210 -10.708 -6.352
268 HG23 THR 33 2HG2 THR 33 -3.118 -10.643 -8.110
269 H TYR 34 HN TYR 34 -2.781 -7.560 -4.811
270 HA TYR 34 HA TYR 34 -2.379 -9.839 -3.099
271 HB2 TYR 34 2HB TYR 34 -0.889 -7.251 -3.449
272 HB3 TYR 34 1HB TYR 34 -0.460 -8.419 -2.199
273 HD1 TYR 34 2HD TYR 34 0.155 -10.765 -2.909
274 HD2 TYR 34 1HD TYR 34 -0.162 -7.553 -5.677
275 HE1 TYR 34 2HE TYR 34 1.476 -12.046 -4.536
276 HE2 TYR 34 1HE TYR 34 1.154 -8.829 -7.316
277 HH TYR 34 HH TYR 34 1.724 -12.121 -7.029
278 H CYS 35 HN CYS 35 -3.265 -6.434 -2.563
279 HA CYS 35 HA CYS 35 -3.482 -6.923 0.296
280 HB2 CYS 35 2HB CYS 35 -3.972 -4.372 -1.258
281 HB3 CYS 35 1HB CYS 35 -3.817 -4.518 0.490
282 HG CYS 35 HG CYS 35 -1.104 -5.574 0.131
283 H GLY 36 HN GLY 36 -5.525 -6.545 -2.476
284 HA2 GLY 36 2HA GLY 36 -7.910 -5.649 -1.457
285 HA3 GLY 36 1HA GLY 36 -7.782 -6.792 -2.780
286 HA PRO 37 HA PRO 37 -9.552 -10.159 -0.594
287 HB2 PRO 37 2HB PRO 37 -6.943 -11.567 -0.321
288 HB3 PRO 37 1HB PRO 37 -8.475 -12.144 -0.991
289 HG2 PRO 37 2HG PRO 37 -6.474 -11.486 -2.603
290 HG3 PRO 37 1HG PRO 37 -8.147 -11.068 -3.020
291 HD2 PRO 37 2HD PRO 37 -5.965 -9.324 -1.951
292 HD3 PRO 37 1HD PRO 37 -7.219 -8.957 -3.154
293 H VAL 38 HN VAL 38 -6.626 -8.880 0.854
294 HA VAL 38 HA VAL 38 -7.285 -10.092 3.425
295 HB VAL 38 HB VAL 38 -4.905 -8.349 2.780
296 HG11 VAL 38 1HG1 VAL 38 -3.948 -9.368 4.796
297 HG12 VAL 38 2HG1 VAL 38 -5.461 -10.235 5.069
298 HG13 VAL 38 3HG1 VAL 38 -5.425 -8.473 5.146
299 HG21 VAL 38 3HG2 VAL 38 -3.622 -10.411 2.561
300 HG22 VAL 38 1HG2 VAL 38 -4.916 -10.344 1.366
301 HG23 VAL 38 2HG2 VAL 38 -5.090 -11.360 2.796
302 H ILE 39 HN ILE 39 -6.146 -6.814 2.563
303 HA ILE 39 HA ILE 39 -7.748 -5.809 4.813
304 HB ILE 39 HB ILE 39 -6.300 -3.800 4.716
305 HG12 ILE 39 2HG1 ILE 39 -4.728 -5.389 2.671
306 HG13 ILE 39 1HG1 ILE 39 -5.695 -3.961 2.320
307 HG21 ILE 39 1HG2 ILE 39 -4.840 -6.422 5.002
308 HG22 ILE 39 2HG2 ILE 39 -5.774 -5.603 6.253
309 HG23 ILE 39 3HG2 ILE 39 -4.292 -4.871 5.636
310 HD11 ILE 39 3HD1 ILE 39 -3.347 -3.398 2.445
311 HD12 ILE 39 1HD1 ILE 39 -3.253 -4.071 4.071
312 HD13 ILE 39 2HD1 ILE 39 -4.228 -2.633 3.768
313 H GLY 40 HN GLY 40 -8.102 -6.124 1.610
314 HA2 GLY 40 2HA GLY 40 -8.720 -3.614 0.581
315 HA3 GLY 40 1HA GLY 40 -9.417 -5.126 0.026
316 HA PRO 41 HA PRO 41 -13.303 -3.998 1.788
317 HB2 PRO 41 2HB PRO 41 -13.794 -6.471 3.218
318 HB3 PRO 41 1HB PRO 41 -14.478 -5.925 1.685
319 HG2 PRO 41 2HG PRO 41 -12.733 -8.015 1.897
320 HG3 PRO 41 1HG PRO 41 -12.892 -7.013 0.444
321 HD2 PRO 41 2HD PRO 41 -10.834 -6.894 2.616
322 HD3 PRO 41 1HD PRO 41 -10.631 -6.726 0.858
323 H LEU 42 HN LEU 42 -10.769 -4.580 3.868
324 HA LEU 42 HA LEU 42 -12.208 -4.099 6.324
325 HB2 LEU 42 2HB LEU 42 -9.247 -4.095 5.709
326 HB3 LEU 42 1HB LEU 42 -9.924 -3.872 7.310
327 HG LEU 42 HG LEU 42 -10.139 -6.363 5.616
328 HD11 LEU 42 1HD1 LEU 42 -7.931 -6.049 6.590
329 HD12 LEU 42 2HD1 LEU 42 -8.779 -7.375 7.387
330 HD13 LEU 42 3HD1 LEU 42 -8.651 -5.806 8.182
331 HD21 LEU 42 3HD2 LEU 42 -11.249 -7.363 7.547
332 HD22 LEU 42 1HD2 LEU 42 -12.174 -5.997 6.921
333 HD23 LEU 42 2HD2 LEU 42 -11.207 -5.810 8.385
334 H SER 43 HN SER 43 -11.785 -2.171 7.645
335 HA SER 43 HA SER 43 -12.164 0.203 6.151
336 HB2 SER 43 2HB SER 43 -13.042 -0.152 8.454
337 HB3 SER 43 1HB SER 43 -11.396 -0.063 9.065
338 HG SER 43 HG SER 43 -13.075 1.949 8.161
339 H VAL 44 HN VAL 44 -10.791 1.927 5.778
340 HA VAL 44 HA VAL 44 -8.009 1.453 5.600
341 HB VAL 44 HB VAL 44 -9.201 3.126 4.215
342 HG11 VAL 44 1HG1 VAL 44 -9.779 5.309 5.119
343 HG12 VAL 44 2HG1 VAL 44 -9.298 4.785 6.732
344 HG13 VAL 44 3HG1 VAL 44 -10.678 4.031 5.938
345 HG21 VAL 44 3HG2 VAL 44 -6.939 4.279 5.844
346 HG22 VAL 44 1HG2 VAL 44 -7.481 4.856 4.267
347 HG23 VAL 44 2HG2 VAL 44 -6.781 3.245 4.423
348 H GLN 45 HN GLN 45 -10.072 2.368 8.153
349 HA GLN 45 HA GLN 45 -8.153 3.521 9.905
350 HB2 GLN 45 2HB GLN 45 -10.832 2.201 10.361
351 HB3 GLN 45 1HB GLN 45 -9.908 2.995 11.618
352 HG2 GLN 45 2HG GLN 45 -10.705 4.433 9.124
353 HG3 GLN 45 1HG GLN 45 -11.792 4.297 10.505
354 HE21 GLN 45 1HE2 GLN 45 -11.768 6.522 10.768
355 HE22 GLN 45 2HE2 GLN 45 -10.407 7.346 11.464
356 H ASP 46 HN ASP 46 -9.242 0.279 9.141
357 HA ASP 46 HA ASP 46 -8.042 -0.846 11.516
358 HB2 ASP 46 2HB ASP 46 -9.784 -1.876 9.349
359 HB3 ASP 46 1HB ASP 46 -8.761 -3.038 10.195
360 H VAL 47 HN VAL 47 -6.828 -0.016 8.524
361 HA VAL 47 HA VAL 47 -5.053 -2.164 8.053
362 HB VAL 47 HB VAL 47 -4.617 0.755 7.376
363 HG11 VAL 47 1HG1 VAL 47 -3.426 -1.757 6.206
364 HG12 VAL 47 2HG1 VAL 47 -2.586 -0.578 7.217
365 HG13 VAL 47 3HG1 VAL 47 -3.157 -0.119 5.612
366 HG21 VAL 47 3HG2 VAL 47 -6.719 0.016 6.448
367 HG22 VAL 47 1HG2 VAL 47 -5.963 -1.445 5.811
368 HG23 VAL 47 2HG2 VAL 47 -5.524 0.131 5.155
369 H ASP 48 HN ASP 48 -3.643 -2.888 9.489
370 HA ASP 48 HA ASP 48 -2.095 -0.952 11.072
371 HB2 ASP 48 2HB ASP 48 -3.701 -1.809 12.612
372 HB3 ASP 48 1HB ASP 48 -3.485 -3.451 12.030
373 H THR 49 HN THR 49 -0.154 -2.007 12.063
374 HA THR 49 HA THR 49 1.530 -2.850 9.996
375 HB THR 49 HB THR 49 2.059 -3.221 12.947
376 HG1 THR 49 1HG THR 49 2.734 -0.903 11.475
377 HG21 THR 49 3HG2 THR 49 3.722 -4.211 11.438
378 HG22 THR 49 1HG2 THR 49 4.385 -2.827 12.308
379 HG23 THR 49 2HG2 THR 49 3.902 -2.659 10.619
380 H LYS 50 HN LYS 50 -0.085 -4.698 12.553
381 HA LYS 50 HA LYS 50 1.210 -7.152 12.184
382 HB2 LYS 50 2HB LYS 50 -0.377 -6.435 14.046
383 HB3 LYS 50 1HB LYS 50 -1.694 -6.794 12.946
384 HG2 LYS 50 2HG LYS 50 0.366 -8.834 13.737
385 HG3 LYS 50 1HG LYS 50 -1.117 -8.559 14.648
386 HD2 LYS 50 2HD LYS 50 -2.414 -9.052 12.588
387 HD3 LYS 50 1HD LYS 50 -0.900 -9.433 11.766
388 HE2 LYS 50 2HE LYS 50 -2.096 -10.860 14.138
389 HE3 LYS 50 1HE LYS 50 -1.941 -11.477 12.494
390 HZ1 LYS 50 3HZ LYS 50 -0.201 -12.425 13.732
391 HZ2 LYS 50 1HZ LYS 50 0.221 -10.946 14.450
392 HZ3 LYS 50 2HZ LYS 50 0.526 -11.208 12.802
393 H LEU 51 HN LEU 51 -1.685 -5.802 10.667
394 HA LEU 51 HA LEU 51 -2.335 -8.069 9.112
395 HB2 LEU 51 2HB LEU 51 -3.006 -5.154 8.732
396 HB3 LEU 51 1HB LEU 51 -3.741 -6.464 7.838
397 HG LEU 51 HG LEU 51 -3.971 -5.982 10.801
398 HD11 LEU 51 1HD1 LEU 51 -6.014 -5.794 8.595
399 HD12 LEU 51 2HD1 LEU 51 -5.273 -4.430 9.431
400 HD13 LEU 51 3HD1 LEU 51 -6.318 -5.544 10.314
401 HD21 LEU 51 3HD2 LEU 51 -3.933 -8.367 10.320
402 HD22 LEU 51 1HD2 LEU 51 -5.180 -8.149 9.090
403 HD23 LEU 51 2HD2 LEU 51 -5.555 -7.851 10.786
404 H ILE 52 HN ILE 52 -0.497 -5.122 8.430
405 HA ILE 52 HA ILE 52 -0.027 -5.575 5.709
406 HB ILE 52 HB ILE 52 1.715 -4.119 7.709
407 HG12 ILE 52 2HG1 ILE 52 -0.393 -3.080 5.798
408 HG13 ILE 52 1HG1 ILE 52 -0.612 -3.281 7.535
409 HG21 ILE 52 1HG2 ILE 52 1.693 -3.997 4.696
410 HG22 ILE 52 2HG2 ILE 52 2.978 -4.655 5.708
411 HG23 ILE 52 3HG2 ILE 52 2.617 -2.929 5.751
412 HD11 ILE 52 3HD1 ILE 52 -0.178 -0.969 6.978
413 HD12 ILE 52 1HD1 ILE 52 1.333 -1.420 6.190
414 HD13 ILE 52 2HD1 ILE 52 1.150 -1.630 7.931
415 H MET 53 HN MET 53 1.775 -6.598 8.578
416 HA MET 53 HA MET 53 3.958 -7.775 7.237
417 HB2 MET 53 2HB MET 53 2.727 -8.345 9.935
418 HB3 MET 53 1HB MET 53 4.183 -9.145 9.362
419 HG2 MET 53 2HG MET 53 5.306 -6.979 9.195
420 HG3 MET 53 1HG MET 53 3.842 -6.182 9.769
421 HE1 MET 53 3HE MET 53 6.794 -5.900 11.065
422 HE2 MET 53 1HE MET 53 6.390 -5.931 12.779
423 HE3 MET 53 2HE MET 53 5.392 -5.006 11.661
424 H LYS 54 HN LYS 54 0.773 -9.014 8.090
425 HA LYS 54 HA LYS 54 1.329 -11.718 7.443
426 HB2 LYS 54 2HB LYS 54 -0.894 -10.225 8.411
427 HB3 LYS 54 1HB LYS 54 -1.430 -11.177 7.036
428 HG2 LYS 54 2HG LYS 54 0.031 -12.309 9.414
429 HG3 LYS 54 1HG LYS 54 -1.722 -12.300 9.231
430 HD2 LYS 54 2HD LYS 54 -1.202 -14.409 8.468
431 HD3 LYS 54 1HD LYS 54 -1.201 -13.492 6.962
432 HE2 LYS 54 2HE LYS 54 0.732 -14.869 6.926
433 HE3 LYS 54 1HE LYS 54 1.282 -13.225 7.245
434 HZ1 LYS 54 3HZ LYS 54 1.409 -13.789 9.616
435 HZ2 LYS 54 1HZ LYS 54 2.411 -14.786 8.676
436 HZ3 LYS 54 2HZ LYS 54 0.939 -15.381 9.263
437 H VAL 55 HN VAL 55 0.073 -8.985 5.613
438 HA VAL 55 HA VAL 55 -0.563 -10.428 3.251
439 HB VAL 55 HB VAL 55 0.185 -7.506 3.499
440 HG11 VAL 55 1HG1 VAL 55 0.280 -8.309 1.201
441 HG12 VAL 55 2HG1 VAL 55 -1.099 -7.232 1.426
442 HG13 VAL 55 3HG1 VAL 55 -1.344 -8.976 1.358
443 HG21 VAL 55 3HG2 VAL 55 -1.668 -8.040 4.970
444 HG22 VAL 55 1HG2 VAL 55 -2.512 -8.843 3.644
445 HG23 VAL 55 2HG2 VAL 55 -2.238 -7.101 3.589
446 H LEU 56 HN LEU 56 2.290 -8.572 4.247
447 HA LEU 56 HA LEU 56 3.645 -8.895 1.755
448 HB2 LEU 56 2HB LEU 56 4.621 -7.988 4.459
449 HB3 LEU 56 1HB LEU 56 5.590 -7.938 3.000
450 HG LEU 56 HG LEU 56 3.016 -6.423 3.424
451 HD11 LEU 56 1HD1 LEU 56 5.880 -5.494 3.453
452 HD12 LEU 56 2HD1 LEU 56 4.810 -5.609 4.848
453 HD13 LEU 56 3HD1 LEU 56 4.457 -4.458 3.559
454 HD21 LEU 56 3HD2 LEU 56 3.413 -6.984 1.081
455 HD22 LEU 56 1HD2 LEU 56 5.040 -6.312 1.188
456 HD23 LEU 56 2HD2 LEU 56 3.636 -5.258 1.367
457 H ASP 57 HN ASP 57 3.431 -10.798 4.607
458 HA ASP 57 HA ASP 57 5.921 -11.902 4.889
459 HB2 ASP 57 2HB ASP 57 3.748 -12.252 6.266
460 HB3 ASP 57 1HB ASP 57 3.493 -13.632 5.211
461 HA PRO 58 HA PRO 58 5.050 -15.433 1.760
462 HB2 PRO 58 2HB PRO 58 2.876 -15.315 0.158
463 HB3 PRO 58 1HB PRO 58 2.835 -16.052 1.764
464 HG2 PRO 58 2HG PRO 58 1.913 -13.347 0.893
465 HG3 PRO 58 1HG PRO 58 1.147 -14.483 2.016
466 HD2 PRO 58 2HD PRO 58 2.607 -12.322 2.817
467 HD3 PRO 58 1HD PRO 58 2.439 -13.802 3.781
468 H ILE 59 HN ILE 59 4.506 -12.121 1.016
469 HA ILE 59 HA ILE 59 4.978 -12.306 -1.804
470 HB ILE 59 HB ILE 59 5.046 -9.882 0.005
471 HG12 ILE 59 2HG1 ILE 59 2.863 -10.966 -1.791
472 HG13 ILE 59 1HG1 ILE 59 2.863 -11.016 -0.032
473 HG21 ILE 59 1HG2 ILE 59 4.774 -8.586 -2.068
474 HG22 ILE 59 2HG2 ILE 59 4.927 -10.074 -3.006
475 HG23 ILE 59 3HG2 ILE 59 6.289 -9.491 -2.048
476 HD11 ILE 59 3HD1 ILE 59 2.796 -8.539 -1.736
477 HD12 ILE 59 1HD1 ILE 59 2.824 -8.573 0.026
478 HD13 ILE 59 2HD1 ILE 59 1.443 -9.238 -0.845
479 H TRP 60 HN TRP 60 6.934 -11.596 1.044
480 HA TRP 60 HA TRP 60 9.237 -10.634 -0.221
481 HB2 TRP 60 2HB TRP 60 8.931 -12.198 2.344
482 HB3 TRP 60 1HB TRP 60 10.450 -11.482 1.823
483 HD1 TRP 60 1HD TRP 60 7.546 -10.738 3.907
484 HE1 TRP 60 1HE TRP 60 7.415 -8.230 4.461
485 HE3 TRP 60 3HE TRP 60 10.904 -8.981 0.480
486 HZ2 TRP 60 2HZ TRP 60 8.585 -5.816 3.560
487 HZ3 TRP 60 3HZ TRP 60 11.345 -6.564 0.390
488 HH2 TRP 60 2HH TRP 60 10.210 -5.014 1.898
489 H GLU 61 HN GLU 61 8.042 -13.890 0.123
490 HA GLU 61 HA GLU 61 10.480 -15.200 -0.478
491 HB2 GLU 61 2HB GLU 61 7.605 -16.087 -0.555
492 HB3 GLU 61 1HB GLU 61 8.964 -17.146 -0.842
493 HG2 GLU 61 2HG GLU 61 9.817 -16.489 1.433
494 HG3 GLU 61 1HG GLU 61 8.247 -15.726 1.688
495 H GLN 62 HN GLN 62 7.933 -13.804 -2.381
496 HA GLN 62 HA GLN 62 8.901 -15.193 -4.772
497 HB2 GLN 62 2HB GLN 62 6.296 -13.746 -4.268
498 HB3 GLN 62 1HB GLN 62 6.741 -14.532 -5.773
499 HG2 GLN 62 2HG GLN 62 6.386 -15.881 -3.110
500 HG3 GLN 62 1HG GLN 62 5.252 -15.926 -4.458
501 HE21 GLN 62 1HE2 GLN 62 7.362 -16.149 -6.467
502 HE22 GLN 62 2HE2 GLN 62 7.953 -17.770 -6.353
503 H LYS 63 HN LYS 63 7.941 -11.952 -3.640
504 HA LYS 63 HA LYS 63 9.543 -10.800 -5.817
505 HB2 LYS 63 2HB LYS 63 6.728 -9.938 -5.116
506 HB3 LYS 63 1HB LYS 63 7.771 -9.166 -6.300
507 HG2 LYS 63 2HG LYS 63 7.702 -11.120 -7.706
508 HG3 LYS 63 1HG LYS 63 6.787 -12.005 -6.483
509 HD2 LYS 63 2HD LYS 63 4.933 -10.434 -6.717
510 HD3 LYS 63 1HD LYS 63 5.847 -9.520 -7.921
511 HE2 LYS 63 2HE LYS 63 5.860 -11.449 -9.398
512 HE3 LYS 63 1HE LYS 63 5.009 -12.405 -8.186
513 HZ1 LYS 63 3HZ LYS 63 3.547 -11.536 -9.942
514 HZ2 LYS 63 1HZ LYS 63 3.915 -9.953 -9.463
515 HZ3 LYS 63 2HZ LYS 63 3.099 -10.994 -8.402
516 HA PRO 64 HA PRO 64 10.463 -8.776 -1.730
517 HB2 PRO 64 2HB PRO 64 13.168 -8.693 -2.897
518 HB3 PRO 64 1HB PRO 64 12.644 -9.285 -1.319
519 HG2 PRO 64 2HG PRO 64 13.424 -10.973 -3.248
520 HG3 PRO 64 1HG PRO 64 12.108 -11.382 -2.130
521 HD2 PRO 64 2HD PRO 64 11.956 -10.410 -4.963
522 HD3 PRO 64 1HD PRO 64 11.009 -11.679 -4.156
523 H GLU 65 HN GLU 65 11.775 -8.001 -4.943
524 HA GLU 65 HA GLU 65 12.154 -5.253 -4.505
525 HB2 GLU 65 2HB GLU 65 13.143 -6.478 -6.387
526 HB3 GLU 65 1HB GLU 65 11.546 -6.705 -7.075
527 HG2 GLU 65 2HG GLU 65 11.318 -4.297 -7.365
528 HG3 GLU 65 1HG GLU 65 12.922 -4.066 -6.668
529 H THR 66 HN THR 66 9.385 -7.092 -5.659
530 HA THR 66 HA THR 66 7.795 -4.823 -6.305
531 HB THR 66 HB THR 66 6.800 -7.611 -5.694
532 HG1 THR 66 1HG THR 66 7.073 -7.386 -8.265
533 HG21 THR 66 3HG2 THR 66 5.750 -5.418 -7.496
534 HG22 THR 66 1HG2 THR 66 5.048 -5.919 -5.956
535 HG23 THR 66 2HG2 THR 66 5.048 -7.027 -7.327
536 H ALA 67 HN ALA 67 8.278 -6.765 -3.438
537 HA ALA 67 HA ALA 67 6.013 -5.986 -1.981
538 HB1 ALA 67 1HB ALA 67 8.723 -6.784 -0.943
539 HB2 ALA 67 2HB ALA 67 7.386 -7.872 -1.314
540 HB3 ALA 67 3HB ALA 67 7.238 -6.709 0.004
541 H SER 68 HN SER 68 9.227 -4.476 -2.225
542 HA SER 68 HA SER 68 8.638 -2.461 -0.301
543 HB2 SER 68 2HB SER 68 10.646 -1.312 -1.501
544 HB3 SER 68 1HB SER 68 10.919 -2.799 -0.596
545 HG SER 68 HG SER 68 10.760 -2.432 -3.397
546 H ARG 69 HN ARG 69 8.265 -2.724 -3.780
547 HA ARG 69 HA ARG 69 7.553 -0.032 -4.263
548 HB2 ARG 69 2HB ARG 69 7.041 -2.601 -5.755
549 HB3 ARG 69 1HB ARG 69 6.495 -1.049 -6.347
550 HG2 ARG 69 2HG ARG 69 8.812 -0.255 -6.393
551 HG3 ARG 69 1HG ARG 69 9.342 -1.840 -5.831
552 HD2 ARG 69 2HD ARG 69 8.477 -2.888 -7.828
553 HD3 ARG 69 1HD ARG 69 7.806 -1.351 -8.375
554 HE ARG 69 HE ARG 69 10.273 -0.618 -8.324
555 HH11 ARG 69 1HH1 ARG 69 9.124 -3.811 -9.181
556 HH12 ARG 69 2HH1 ARG 69 10.495 -4.179 -10.179
557 HH21 ARG 69 1HH2 ARG 69 12.067 -1.086 -9.668
558 HH22 ARG 69 2HH2 ARG 69 12.153 -2.618 -10.476
559 H LEU 70 HN LEU 70 5.781 -2.878 -3.275
560 HA LEU 70 HA LEU 70 3.180 -1.770 -3.564
561 HB2 LEU 70 2HB LEU 70 3.636 -4.197 -3.415
562 HB3 LEU 70 1HB LEU 70 4.129 -3.992 -1.745
563 HG LEU 70 HG LEU 70 1.832 -3.239 -1.191
564 HD11 LEU 70 1HD1 LEU 70 1.195 -2.393 -3.388
565 HD12 LEU 70 2HD1 LEU 70 0.036 -3.587 -2.803
566 HD13 LEU 70 3HD1 LEU 70 1.218 -4.033 -4.034
567 HD21 LEU 70 3HD2 LEU 70 0.796 -5.454 -1.367
568 HD22 LEU 70 1HD2 LEU 70 2.479 -5.553 -0.850
569 HD23 LEU 70 2HD2 LEU 70 2.045 -5.940 -2.515
570 H ARG 71 HN ARG 71 5.484 -1.982 -0.887
571 HA ARG 71 HA ARG 71 3.823 -0.978 1.130
572 HB2 ARG 71 2HB ARG 71 6.805 -1.068 0.786
573 HB3 ARG 71 1HB ARG 71 6.072 -0.303 2.186
574 HG2 ARG 71 2HG ARG 71 4.901 -2.440 2.673
575 HG3 ARG 71 1HG ARG 71 5.810 -3.179 1.352
576 HD2 ARG 71 2HD ARG 71 7.110 -1.790 3.685
577 HD3 ARG 71 1HD ARG 71 6.755 -3.516 3.663
578 HE ARG 71 HE ARG 71 8.238 -3.627 1.672
579 HH11 ARG 71 1HH1 ARG 71 8.531 -0.902 3.844
580 HH12 ARG 71 2HH1 ARG 71 10.246 -0.714 3.588
581 HH21 ARG 71 1HH2 ARG 71 10.510 -3.402 1.341
582 HH22 ARG 71 2HH2 ARG 71 11.366 -2.138 2.168
583 H GLY 72 HN GLY 72 5.999 0.676 -1.124
584 HA2 GLY 72 2HA GLY 72 5.768 3.260 -0.052
585 HA3 GLY 72 1HA GLY 72 6.138 2.886 -1.730
586 H ARG 73 HN ARG 73 3.737 1.524 -2.347
587 HA ARG 73 HA ARG 73 2.072 3.748 -2.944
588 HB2 ARG 73 2HB ARG 73 1.749 0.779 -3.363
589 HB3 ARG 73 1HB ARG 73 0.521 1.942 -3.852
590 HG2 ARG 73 2HG ARG 73 2.190 3.071 -5.269
591 HG3 ARG 73 1HG ARG 73 3.370 1.841 -4.822
592 HD2 ARG 73 2HD ARG 73 0.740 1.082 -6.037
593 HD3 ARG 73 1HD ARG 73 2.087 1.598 -7.047
594 HE ARG 73 HE ARG 73 3.017 -0.390 -5.324
595 HH11 ARG 73 1HH1 ARG 73 0.760 -0.044 -7.972
596 HH12 ARG 73 2HH1 ARG 73 0.993 -1.655 -8.571
597 HH21 ARG 73 1HH2 ARG 73 3.346 -2.524 -6.110
598 HH22 ARG 73 2HH2 ARG 73 2.477 -3.066 -7.508
599 H ILE 74 HN ILE 74 1.796 1.013 -0.700
600 HA ILE 74 HA ILE 74 -0.764 1.607 0.295
601 HB ILE 74 HB ILE 74 1.553 0.304 1.741
602 HG12 ILE 74 2HG1 ILE 74 -0.777 -0.929 0.253
603 HG13 ILE 74 1HG1 ILE 74 0.873 -0.833 -0.353
604 HG21 ILE 74 1HG2 ILE 74 -0.117 1.079 3.321
605 HG22 ILE 74 2HG2 ILE 74 -0.167 -0.679 3.200
606 HG23 ILE 74 3HG2 ILE 74 -1.395 0.297 2.391
607 HD11 ILE 74 3HD1 ILE 74 1.618 -2.231 1.524
608 HD12 ILE 74 1HD1 ILE 74 0.425 -3.039 0.507
609 HD13 ILE 74 2HD1 ILE 74 -0.057 -2.364 2.064
610 H GLU 75 HN GLU 75 2.448 2.575 1.446
611 HA GLU 75 HA GLU 75 1.745 4.115 3.655
612 HB2 GLU 75 2HB GLU 75 4.050 3.545 3.088
613 HB3 GLU 75 1HB GLU 75 3.970 4.536 1.644
614 HG2 GLU 75 2HG GLU 75 3.538 6.497 3.166
615 HG3 GLU 75 1HG GLU 75 3.966 5.435 4.506
616 H SER 76 HN SER 76 2.058 5.072 0.266
617 HA SER 76 HA SER 76 1.566 7.801 0.606
618 HB2 SER 76 2HB SER 76 0.981 6.081 -1.799
619 HB3 SER 76 1HB SER 76 1.108 7.837 -1.802
620 HG SER 76 HG SER 76 3.178 5.996 -1.128
621 H VAL 77 HN VAL 77 -0.668 5.126 -0.078
622 HA VAL 77 HA VAL 77 -2.968 6.762 -0.336
623 HB VAL 77 HB VAL 77 -2.774 3.830 0.384
624 HG11 VAL 77 1HG1 VAL 77 -4.921 4.775 1.061
625 HG12 VAL 77 2HG1 VAL 77 -5.111 3.680 -0.308
626 HG13 VAL 77 3HG1 VAL 77 -5.155 5.426 -0.562
627 HG21 VAL 77 3HG2 VAL 77 -1.792 4.340 -1.781
628 HG22 VAL 77 1HG2 VAL 77 -3.255 5.198 -2.261
629 HG23 VAL 77 2HG2 VAL 77 -3.307 3.457 -1.983
630 H LEU 78 HN LEU 78 -1.650 4.887 2.390
631 HA LEU 78 HA LEU 78 -3.714 5.453 4.210
632 HB2 LEU 78 2HB LEU 78 -0.811 4.806 4.698
633 HB3 LEU 78 1HB LEU 78 -2.010 4.908 5.971
634 HG LEU 78 HG LEU 78 -2.003 2.929 3.694
635 HD11 LEU 78 1HD1 LEU 78 -1.624 1.289 5.476
636 HD12 LEU 78 2HD1 LEU 78 -1.519 2.600 6.649
637 HD13 LEU 78 3HD1 LEU 78 -0.313 2.464 5.371
638 HD21 LEU 78 3HD2 LEU 78 -3.918 1.914 4.825
639 HD22 LEU 78 1HD2 LEU 78 -4.281 3.562 4.313
640 HD23 LEU 78 2HD2 LEU 78 -3.920 3.225 6.005
641 H ASP 79 HN ASP 79 -0.671 7.158 3.570
642 HA ASP 79 HA ASP 79 -0.972 9.051 5.666
643 HB2 ASP 79 2HB ASP 79 1.198 8.565 4.561
644 HB3 ASP 79 1HB ASP 79 0.602 9.335 3.092
645 H TRP 80 HN TRP 80 -1.797 9.081 2.234
646 HA TRP 80 HA TRP 80 -2.836 11.674 2.041
647 HB2 TRP 80 2HB TRP 80 -2.394 10.273 0.089
648 HB3 TRP 80 1HB TRP 80 -3.632 9.132 0.596
649 HD1 TRP 80 1HD TRP 80 -3.270 12.683 -0.860
650 HE1 TRP 80 1HE TRP 80 -5.470 13.292 -2.057
651 HE3 TRP 80 3HE TRP 80 -6.071 8.625 0.500
652 HZ2 TRP 80 2HZ TRP 80 -8.055 12.177 -2.372
653 HZ3 TRP 80 3HZ TRP 80 -8.391 8.477 -0.292
654 HH2 TRP 80 2HH TRP 80 -9.359 10.217 -1.697
655 H ALA 81 HN ALA 81 -4.387 8.612 2.917
656 HA ALA 81 HA ALA 81 -6.981 9.620 3.359
657 HB1 ALA 81 1HB ALA 81 -5.644 7.241 4.645
658 HB2 ALA 81 2HB ALA 81 -6.485 7.235 3.095
659 HB3 ALA 81 3HB ALA 81 -7.378 7.552 4.582
660 H THR 82 HN THR 82 -4.108 9.531 5.350
661 HA THR 82 HA THR 82 -5.301 10.121 7.838
662 HB THR 82 HB THR 82 -2.529 10.896 6.893
663 HG1 THR 82 1HG THR 82 -3.098 8.592 6.738
664 HG21 THR 82 3HG2 THR 82 -3.660 10.487 9.666
665 HG22 THR 82 1HG2 THR 82 -3.155 12.021 8.952
666 HG23 THR 82 2HG2 THR 82 -1.959 10.770 9.292
667 H VAL 83 HN VAL 83 -3.975 12.187 5.273
668 HA VAL 83 HA VAL 83 -4.478 14.634 6.652
669 HB VAL 83 HB VAL 83 -4.021 14.172 3.698
670 HG11 VAL 83 1HG1 VAL 83 -5.014 16.339 4.135
671 HG12 VAL 83 2HG1 VAL 83 -3.328 16.514 3.644
672 HG13 VAL 83 3HG1 VAL 83 -3.775 16.682 5.342
673 HG21 VAL 83 3HG2 VAL 83 -2.043 14.856 5.874
674 HG22 VAL 83 1HG2 VAL 83 -1.688 14.730 4.150
675 HG23 VAL 83 2HG2 VAL 83 -2.185 13.299 5.054
676 H ARG 84 HN ARG 84 -6.162 12.897 4.043
677 HA ARG 84 HA ARG 84 -8.239 14.764 3.714
678 HB2 ARG 84 2HB ARG 84 -7.582 12.070 2.800
679 HB3 ARG 84 1HB ARG 84 -9.311 12.352 2.957
680 HG2 ARG 84 2HG ARG 84 -8.519 12.848 0.716
681 HG3 ARG 84 1HG ARG 84 -9.149 14.282 1.520
682 HD2 ARG 84 2HD ARG 84 -6.757 14.834 2.122
683 HD3 ARG 84 1HD ARG 84 -6.278 13.557 1.002
684 HE ARG 84 HE ARG 84 -8.053 15.265 -0.324
685 HH11 ARG 84 1HH1 ARG 84 -4.770 15.277 0.941
686 HH12 ARG 84 2HH1 ARG 84 -4.251 16.556 -0.117
687 HH21 ARG 84 1HH2 ARG 84 -7.349 16.932 -1.693
688 HH22 ARG 84 2HH2 ARG 84 -5.703 17.479 -1.612
689 H GLY 85 HN GLY 85 -7.691 12.384 6.140
690 HA2 GLY 85 2HA GLY 85 -8.839 12.283 8.173
691 HA3 GLY 85 1HA GLY 85 -10.128 13.246 7.466
692 H TYR 86 HN TYR 86 -8.872 10.361 5.947
693 HA TYR 86 HA TYR 86 -11.474 9.087 6.294
694 HB2 TYR 86 2HB TYR 86 -9.082 8.309 4.617
695 HB3 TYR 86 1HB TYR 86 -10.563 7.361 4.720
696 HD1 TYR 86 2HD TYR 86 -12.735 9.114 4.461
697 HD2 TYR 86 1HD TYR 86 -8.909 9.443 2.624
698 HE1 TYR 86 2HE TYR 86 -13.723 10.466 2.661
699 HE2 TYR 86 1HE TYR 86 -9.888 10.795 0.819
700 HH TYR 86 HH TYR 86 -12.109 11.147 -0.233
701 H ARG 87 HN ARG 87 -8.156 8.818 7.324
702 HA ARG 87 HA ARG 87 -9.094 6.919 9.335
703 HB2 ARG 87 2HB ARG 87 -7.057 5.605 9.252
704 HB3 ARG 87 1HB ARG 87 -7.860 5.572 7.691
705 HG2 ARG 87 2HG ARG 87 -6.233 6.874 6.685
706 HG3 ARG 87 1HG ARG 87 -5.653 7.513 8.228
707 HD2 ARG 87 2HD ARG 87 -5.456 4.591 7.547
708 HD3 ARG 87 1HD ARG 87 -4.212 5.740 7.056
709 HE ARG 87 HE ARG 87 -3.702 6.119 9.351
710 HH11 ARG 87 1HH1 ARG 87 -5.981 3.493 8.849
711 HH12 ARG 87 2HH1 ARG 87 -5.719 2.814 10.429
712 HH21 ARG 87 1HH2 ARG 87 -3.357 5.194 11.400
713 HH22 ARG 87 2HH2 ARG 87 -4.250 3.781 11.881
714 H GLU 88 HN GLU 88 -7.364 6.706 11.099
715 HA GLU 88 HA GLU 88 -7.040 9.324 12.164
716 HB2 GLU 88 2HB GLU 88 -6.162 6.633 13.225
717 HB3 GLU 88 1HB GLU 88 -6.153 8.136 14.145
718 HG2 GLU 88 2HG GLU 88 -8.553 8.320 13.939
719 HG3 GLU 88 1HG GLU 88 -8.603 6.891 12.916
720 H GLY 89 HN GLY 89 -4.816 9.591 13.497
721 HA2 GLY 89 2HA GLY 89 -3.173 10.507 11.329
722 HA3 GLY 89 1HA GLY 89 -2.975 10.874 13.021
723 H ASP 90 HN ASP 90 -3.030 7.583 11.903
724 HA ASP 90 HA ASP 90 -0.123 7.484 12.391
725 HB2 ASP 90 2HB ASP 90 -1.478 6.352 14.152
726 HB3 ASP 90 1HB ASP 90 -2.067 5.236 12.923
727 H ASN 91 HN ASN 91 1.150 6.310 11.023
728 HA ASN 91 HA ASN 91 -0.162 5.016 8.724
729 HB2 ASN 91 2HB ASN 91 0.883 7.104 7.978
730 HB3 ASN 91 1HB ASN 91 2.410 6.618 8.708
731 HD21 ASN 91 1HD2 ASN 91 0.287 6.232 5.998
732 HD22 ASN 91 2HD2 ASN 91 1.356 5.279 5.040
733 HA PRO 92 HA PRO 92 2.334 1.885 10.951
734 HB2 PRO 92 2HB PRO 92 0.717 -0.202 10.415
735 HB3 PRO 92 1HB PRO 92 0.359 0.964 11.695
736 HG2 PRO 92 2HG PRO 92 -0.725 0.826 8.904
737 HG3 PRO 92 1HG PRO 92 -1.594 1.098 10.427
738 HD2 PRO 92 2HD PRO 92 -0.908 3.118 8.762
739 HD3 PRO 92 1HD PRO 92 -0.986 3.317 10.524
740 H ALA 93 HN ALA 93 1.963 2.579 7.775
741 HA ALA 93 HA ALA 93 3.044 0.080 6.726
742 HB1 ALA 93 1HB ALA 93 2.778 1.108 4.528
743 HB2 ALA 93 2HB ALA 93 2.300 2.627 5.287
744 HB3 ALA 93 3HB ALA 93 1.277 1.200 5.451
745 H ARG 94 HN ARG 94 4.071 3.203 7.728
746 HA ARG 94 HA ARG 94 6.576 3.065 6.277
747 HB2 ARG 94 2HB ARG 94 5.474 5.232 6.545
748 HB3 ARG 94 1HB ARG 94 5.583 5.085 8.291
749 HG2 ARG 94 2HG ARG 94 7.958 5.265 8.227
750 HG3 ARG 94 1HG ARG 94 7.971 5.157 6.466
751 HD2 ARG 94 2HD ARG 94 6.691 7.376 8.063
752 HD3 ARG 94 1HD ARG 94 8.273 7.467 7.291
753 HE ARG 94 HE ARG 94 6.609 6.773 5.249
754 HH11 ARG 94 1HH1 ARG 94 6.574 9.361 7.617
755 HH12 ARG 94 2HH1 ARG 94 5.767 10.485 6.572
756 HH21 ARG 94 1HH2 ARG 94 5.553 8.270 3.866
757 HH22 ARG 94 2HH2 ARG 94 5.175 9.863 4.449
758 H TRP 95 HN TRP 95 8.404 2.360 7.046
759 HA TRP 95 HA TRP 95 8.495 1.473 9.852
760 HB2 TRP 95 2HB TRP 95 9.216 0.136 7.322
761 HB3 TRP 95 1HB TRP 95 10.373 -0.058 8.636
762 HD1 TRP 95 1HD TRP 95 9.055 -0.827 11.077
763 HE1 TRP 95 1HE TRP 95 7.379 -2.760 11.331
764 HE3 TRP 95 3HE TRP 95 7.538 -1.204 6.213
765 HZ2 TRP 95 2HZ TRP 95 5.628 -4.245 9.674
766 HZ3 TRP 95 3HZ TRP 95 5.858 -2.905 5.631
767 HH2 TRP 95 2HH TRP 95 4.924 -4.392 7.326
768 H ARG 96 HN ARG 96 9.891 2.545 11.058
769 HA ARG 96 HA ARG 96 12.037 4.091 10.000
770 HB2 ARG 96 2HB ARG 96 12.686 4.412 12.323
771 HB3 ARG 96 1HB ARG 96 10.944 4.585 12.173
772 HG2 ARG 96 2HG ARG 96 10.532 2.535 13.204
773 HG3 ARG 96 1HG ARG 96 12.185 1.976 12.955
774 HD2 ARG 96 2HD ARG 96 12.926 3.790 14.522
775 HD3 ARG 96 1HD ARG 96 11.223 4.074 14.885
776 HE ARG 96 HE ARG 96 11.108 1.941 15.898
777 HH11 ARG 96 1HH1 ARG 96 14.330 2.840 14.896
778 HH12 ARG 96 2HH1 ARG 96 15.112 1.597 15.818
779 HH21 ARG 96 1HH2 ARG 96 12.123 0.291 17.119
780 HH22 ARG 96 2HH2 ARG 96 13.855 0.164 17.110
781 H GLY 97 HN GLY 97 11.622 0.801 10.939
782 HA2 GLY 97 2HA GLY 97 14.036 -0.084 9.847
783 HA3 GLY 97 1HA GLY 97 14.276 0.126 11.574
784 H TYR 98 HN TYR 98 12.500 -1.623 9.111
785 HA TYR 98 HA TYR 98 11.897 -3.720 11.095
786 HB2 TYR 98 2HB TYR 98 9.945 -3.033 9.804
787 HB3 TYR 98 1HB TYR 98 10.812 -3.304 8.296
788 HD1 TYR 98 1HD TYR 98 10.040 -5.219 11.417
789 HD2 TYR 98 2HD TYR 98 10.257 -5.243 7.168
790 HE1 TYR 98 1HE TYR 98 9.234 -7.543 11.397
791 HE2 TYR 98 2HE TYR 98 9.455 -7.568 7.135
792 HH TYR 98 HH TYR 98 8.166 -9.121 9.926
793 H LEU 99 HN LEU 99 13.195 -3.120 7.874
794 HA LEU 99 HA LEU 99 14.666 -5.661 7.929
795 HB2 LEU 99 2HB LEU 99 14.212 -3.656 5.717
796 HB3 LEU 99 1HB LEU 99 15.131 -5.136 5.558
797 HG LEU 99 HG LEU 99 12.185 -4.986 6.190
798 HD11 LEU 99 1HD1 LEU 99 13.619 -5.690 3.636
799 HD12 LEU 99 2HD1 LEU 99 12.638 -4.253 3.927
800 HD13 LEU 99 3HD1 LEU 99 11.886 -5.848 3.916
801 HD21 LEU 99 3HD2 LEU 99 13.309 -6.965 7.128
802 HD22 LEU 99 1HD2 LEU 99 13.920 -7.361 5.522
803 HD23 LEU 99 2HD2 LEU 99 12.185 -7.382 5.835
804 H GLU 100 HN GLU 100 15.202 -3.096 9.389
805 HA GLU 100 HA GLU 100 17.291 -1.642 8.284
806 HB2 GLU 100 2HB GLU 100 15.973 -0.897 10.229
807 HB3 GLU 100 1HB GLU 100 16.737 -2.138 11.213
808 HG2 GLU 100 2HG GLU 100 18.884 -1.080 10.971
809 HG3 GLU 100 1HG GLU 100 18.217 0.098 9.842
810 H HIS 101 HN HIS 101 19.248 -2.165 7.788
811 HA HIS 101 HA HIS 101 20.943 -3.642 9.587
812 HB2 HIS 101 2HB HIS 101 21.582 -5.404 8.054
813 HB3 HIS 101 1HB HIS 101 19.843 -5.474 8.287
814 HD1 HIS 101 1HD HIS 101 18.348 -4.669 6.252
815 HD2 HIS 101 2HD HIS 101 22.415 -5.019 5.447
816 HE1 HIS 101 1HE HIS 101 18.547 -4.670 3.744
817 HE2 HIS 101 2HE HIS 101 21.027 -4.741 3.280
818 H HIS 102 HN HIS 102 23.122 -3.127 9.218
819 HA HIS 102 HA HIS 102 23.366 -0.762 7.567
820 HB2 HIS 102 2HB HIS 102 24.391 -1.344 9.995
821 HB3 HIS 102 1HB HIS 102 25.763 -1.758 8.969
822 HD1 HIS 102 1HD HIS 102 23.413 1.144 9.586
823 HD2 HIS 102 2HD HIS 102 27.242 0.386 8.163
824 HE1 HIS 102 1HE HIS 102 24.443 3.400 9.180
825 HE2 HIS 102 2HE HIS 102 26.818 2.922 8.501
826 H HIS 103 HN HIS 103 24.266 -0.626 5.667
827 HA HIS 103 HA HIS 103 25.633 -2.998 4.586
828 HB2 HIS 103 2HB HIS 103 23.604 -2.449 3.383
829 HB3 HIS 103 1HB HIS 103 24.109 -0.774 3.211
830 HD1 HIS 103 1HD HIS 103 24.982 -4.237 1.956
831 HD2 HIS 103 2HD HIS 103 25.650 -0.243 1.004
832 HE1 HIS 103 1HE HIS 103 26.082 -4.254 -0.306
833 HE2 HIS 103 2HE HIS 103 26.268 -1.821 -0.953
834 H HIS 104 HN HIS 104 27.668 -2.856 3.898
835 HA HIS 104 HA HIS 104 28.846 -0.299 3.205
836 HB2 HIS 104 2HB HIS 104 29.533 -1.772 5.690
837 HB3 HIS 104 1HB HIS 104 30.880 -1.145 4.750
838 HD1 HIS 104 1HD HIS 104 29.222 -0.211 7.594
839 HD2 HIS 104 2HD HIS 104 29.907 1.795 4.012
840 HE1 HIS 104 1HE HIS 104 29.018 2.240 8.131
841 HE2 HIS 104 2HE HIS 104 29.515 3.438 5.970
842 H HIS 105 HN HIS 105 30.474 -0.490 1.749
843 HA HIS 105 HA HIS 105 31.707 -3.129 1.436
844 HB2 HIS 105 2HB HIS 105 31.667 -3.006 -0.987
845 HB3 HIS 105 1HB HIS 105 30.027 -2.908 -0.368
846 HD1 HIS 105 1HD HIS 105 32.295 -1.330 -2.688
847 HD2 HIS 105 2HD HIS 105 29.027 -0.109 -0.419
848 HE1 HIS 105 1HE HIS 105 31.482 0.797 -3.755
849 HE2 HIS 105 2HE HIS 105 29.361 1.367 -2.518
850 H HIS 106 HN HIS 106 33.753 -2.934 1.831
851 HA HIS 106 HA HIS 106 35.832 -2.088 2.168
852 HB2 HIS 106 2HB HIS 106 35.078 -0.137 -0.021
853 HB3 HIS 106 1HB HIS 106 36.691 -0.334 0.643
854 HD1 HIS 106 1HD HIS 106 36.340 -0.719 -2.307
855 HD2 HIS 106 2HD HIS 106 35.963 -3.824 0.435
856 HE1 HIS 106 1HE HIS 106 36.748 -2.832 -3.613
857 HE2 HIS 106 2HE HIS 106 36.659 -4.684 -1.905
Start of MODEL 12
1 H1 MET 1 H1 MET 1 -15.187 4.546 5.481
2 H2 MET 1 H2 MET 1 -13.904 3.729 6.236
3 H3 MET 1 H3 MET 1 -15.191 2.851 5.568
4 HA MET 1 HA MET 1 -14.605 3.524 3.364
5 HB2 MET 1 2HB MET 1 -13.705 5.748 3.992
6 HB3 MET 1 1HB MET 1 -12.303 4.968 4.709
7 HG2 MET 1 2HG MET 1 -11.758 5.833 2.523
8 HG3 MET 1 1HG MET 1 -11.685 4.072 2.522
9 HE1 MET 1 2HE MET 1 -14.905 6.329 2.458
10 HE2 MET 1 3HE MET 1 -15.212 6.459 0.725
11 HE3 MET 1 1HE MET 1 -13.792 7.233 1.429
12 H THR 2 HN THR 2 -13.589 1.867 2.308
13 HA THR 2 HA THR 2 -11.955 0.094 3.963
14 HB THR 2 HB THR 2 -12.181 -1.540 2.144
15 HG1 THR 2 1HG THR 2 -14.041 0.061 0.789
16 HG21 THR 2 3HG2 THR 2 -14.615 -1.880 2.279
17 HG22 THR 2 1HG2 THR 2 -14.796 -0.253 2.931
18 HG23 THR 2 2HG2 THR 2 -13.920 -1.478 3.848
19 H PHE 3 HN PHE 3 -10.033 -0.930 2.907
20 HA PHE 3 HA PHE 3 -8.168 1.056 2.226
21 HB2 PHE 3 2HB PHE 3 -7.537 -1.055 3.301
22 HB3 PHE 3 1HB PHE 3 -7.986 -1.938 1.846
23 HD1 PHE 3 1HD PHE 3 -5.694 0.740 3.047
24 HD2 PHE 3 2HD PHE 3 -6.396 -2.364 0.215
25 HE1 PHE 3 1HE PHE 3 -3.412 1.023 2.176
26 HE2 PHE 3 2HE PHE 3 -4.115 -2.079 -0.661
27 HZ PHE 3 HZ PHE 3 -2.619 -0.387 0.317
28 H SER 4 HN SER 4 -9.913 -1.299 0.230
29 HA SER 4 HA SER 4 -8.582 -0.695 -2.189
30 HB2 SER 4 2HB SER 4 -11.367 -1.800 -1.762
31 HB3 SER 4 1HB SER 4 -10.458 -1.857 -3.273
32 HG SER 4 HG SER 4 -8.996 -2.832 -1.218
33 H GLU 5 HN GLU 5 -11.569 0.559 -0.749
34 HA GLU 5 HA GLU 5 -12.259 2.227 -2.925
35 HB2 GLU 5 2HB GLU 5 -13.025 2.219 -0.013
36 HB3 GLU 5 1HB GLU 5 -13.690 3.367 -1.156
37 HG2 GLU 5 2HG GLU 5 -14.618 1.574 -2.470
38 HG3 GLU 5 1HG GLU 5 -13.892 0.383 -1.396
39 H CYS 6 HN CYS 6 -10.508 2.799 0.084
40 HA CYS 6 HA CYS 6 -10.079 5.561 -0.230
41 HB2 CYS 6 2HB CYS 6 -9.661 4.134 1.830
42 HB3 CYS 6 1HB CYS 6 -8.157 3.641 1.079
43 HG CYS 6 HG CYS 6 -7.745 6.684 0.812
44 H ALA 7 HN ALA 7 -8.151 2.769 -1.186
45 HA ALA 7 HA ALA 7 -6.008 4.110 -2.380
46 HB1 ALA 7 1HB ALA 7 -5.635 2.047 -3.654
47 HB2 ALA 7 2HB ALA 7 -7.234 1.469 -3.182
48 HB3 ALA 7 3HB ALA 7 -5.984 1.706 -1.959
49 H ALA 8 HN ALA 8 -9.115 3.086 -3.731
50 HA ALA 8 HA ALA 8 -8.697 3.932 -6.369
51 HB1 ALA 8 1HB ALA 8 -11.298 3.824 -4.843
52 HB2 ALA 8 2HB ALA 8 -10.554 2.482 -5.707
53 HB3 ALA 8 3HB ALA 8 -11.125 3.893 -6.595
54 H LEU 9 HN LEU 9 -9.893 5.670 -3.530
55 HA LEU 9 HA LEU 9 -10.610 8.072 -4.792
56 HB2 LEU 9 2HB LEU 9 -9.478 7.648 -2.021
57 HB3 LEU 9 1HB LEU 9 -10.262 9.112 -2.575
58 HG LEU 9 HG LEU 9 -11.622 6.425 -2.387
59 HD11 LEU 9 1HD1 LEU 9 -10.986 7.273 -0.181
60 HD12 LEU 9 2HD1 LEU 9 -12.733 7.338 -0.419
61 HD13 LEU 9 3HD1 LEU 9 -11.770 8.809 -0.548
62 HD21 LEU 9 3HD2 LEU 9 -13.671 7.775 -2.630
63 HD22 LEU 9 1HD2 LEU 9 -12.628 7.868 -4.051
64 HD23 LEU 9 2HD2 LEU 9 -12.674 9.204 -2.900
65 H TYR 10 HN TYR 10 -7.541 7.024 -3.374
66 HA TYR 10 HA TYR 10 -6.058 9.351 -3.850
67 HB2 TYR 10 2HB TYR 10 -5.246 7.593 -2.385
68 HB3 TYR 10 1HB TYR 10 -5.180 6.457 -3.724
69 HD1 TYR 10 2HD TYR 10 -3.541 9.323 -2.126
70 HD2 TYR 10 1HD TYR 10 -3.382 6.552 -5.356
71 HE1 TYR 10 2HE TYR 10 -1.214 9.984 -2.577
72 HE2 TYR 10 1HE TYR 10 -1.060 7.205 -5.810
73 HH TYR 10 HH TYR 10 0.838 8.845 -3.693
74 H ILE 11 HN ILE 11 -6.400 6.413 -5.789
75 HA ILE 11 HA ILE 11 -4.694 7.157 -7.887
76 HB ILE 11 HB ILE 11 -7.048 5.262 -7.893
77 HG12 ILE 11 2HG1 ILE 11 -4.081 4.718 -7.679
78 HG13 ILE 11 1HG1 ILE 11 -5.175 4.785 -6.303
79 HG21 ILE 11 1HG2 ILE 11 -4.825 5.544 -9.912
80 HG22 ILE 11 2HG2 ILE 11 -6.518 5.964 -10.168
81 HG23 ILE 11 3HG2 ILE 11 -6.057 4.282 -9.901
82 HD11 ILE 11 3HD1 ILE 11 -6.415 2.894 -7.193
83 HD12 ILE 11 1HD1 ILE 11 -4.711 2.497 -6.972
84 HD13 ILE 11 2HD1 ILE 11 -5.337 2.833 -8.586
85 H LYS 12 HN LYS 12 -8.229 7.475 -7.583
86 HA LYS 12 HA LYS 12 -8.623 8.677 -10.098
87 HB2 LYS 12 2HB LYS 12 -10.278 8.806 -7.576
88 HB3 LYS 12 1HB LYS 12 -10.796 9.478 -9.118
89 HG2 LYS 12 2HG LYS 12 -10.592 7.220 -10.115
90 HG3 LYS 12 1HG LYS 12 -10.219 6.585 -8.511
91 HD2 LYS 12 2HD LYS 12 -12.389 7.375 -7.698
92 HD3 LYS 12 1HD LYS 12 -12.761 8.006 -9.306
93 HE2 LYS 12 2HE LYS 12 -12.474 5.682 -10.190
94 HE3 LYS 12 1HE LYS 12 -12.334 5.126 -8.525
95 HZ1 LYS 12 3HZ LYS 12 -14.688 6.562 -9.631
96 HZ2 LYS 12 1HZ LYS 12 -14.554 5.884 -8.080
97 HZ3 LYS 12 2HZ LYS 12 -14.583 4.879 -9.448
98 H ALA 13 HN ALA 13 -7.740 10.010 -6.977
99 HA ALA 13 HA ALA 13 -8.125 12.734 -7.659
100 HB1 ALA 13 1HB ALA 13 -7.921 11.940 -5.346
101 HB2 ALA 13 2HB ALA 13 -6.775 13.230 -5.708
102 HB3 ALA 13 3HB ALA 13 -6.224 11.556 -5.639
103 H HIS 14 HN HIS 14 -5.809 10.472 -8.705
104 HA HIS 14 HA HIS 14 -4.063 12.661 -9.626
105 HB2 HIS 14 2HB HIS 14 -3.341 9.949 -8.566
106 HB3 HIS 14 1HB HIS 14 -2.262 10.787 -9.675
107 HD1 HIS 14 1HD HIS 14 -1.706 10.108 -6.597
108 HD2 HIS 14 2HD HIS 14 -2.785 13.794 -8.186
109 HE1 HIS 14 1HE HIS 14 -0.870 11.823 -4.958
110 HE2 HIS 14 2HE HIS 14 -1.366 14.049 -6.035
111 H ARG 15 HN ARG 15 -6.358 10.754 -10.795
112 HA ARG 15 HA ARG 15 -5.086 9.448 -12.974
113 HB2 ARG 15 2HB ARG 15 -7.339 9.240 -13.938
114 HB3 ARG 15 1HB ARG 15 -7.301 8.760 -12.247
115 HG2 ARG 15 2HG ARG 15 -8.262 10.903 -11.606
116 HG3 ARG 15 1HG ARG 15 -8.279 11.406 -13.299
117 HD2 ARG 15 2HD ARG 15 -9.929 9.851 -13.863
118 HD3 ARG 15 1HD ARG 15 -9.668 8.905 -12.397
119 HE ARG 15 HE ARG 15 -10.518 11.169 -11.333
120 HH11 ARG 15 1HH1 ARG 15 -11.738 9.516 -14.171
121 HH12 ARG 15 2HH1 ARG 15 -13.383 10.020 -13.913
122 HH21 ARG 15 1HH2 ARG 15 -12.654 11.818 -10.983
123 HH22 ARG 15 2HH2 ARG 15 -13.902 11.340 -12.096
124 H SER 16 HN SER 16 -6.195 12.696 -12.443
125 HA SER 16 HA SER 16 -6.092 13.565 -15.137
126 HB2 SER 16 2HB SER 16 -5.843 15.100 -12.537
127 HB3 SER 16 1HB SER 16 -6.121 15.810 -14.119
128 HG SER 16 HG SER 16 -8.135 15.588 -13.540
129 H SER 17 HN SER 17 -3.761 13.071 -12.619
130 HA SER 17 HA SER 17 -1.671 14.590 -13.903
131 HB2 SER 17 2HB SER 17 -1.134 12.594 -11.743
132 HB3 SER 17 1HB SER 17 -0.472 14.212 -11.967
133 HG SER 17 HG SER 17 -2.049 15.022 -10.823
134 H TRP 18 HN TRP 18 -2.788 11.305 -13.685
135 HA TRP 18 HA TRP 18 -0.399 10.266 -14.996
136 HB2 TRP 18 2HB TRP 18 -2.771 8.866 -13.757
137 HB3 TRP 18 1HB TRP 18 -1.398 8.047 -14.491
138 HD1 TRP 18 1HD TRP 18 0.673 10.318 -13.069
139 HE1 TRP 18 1HE TRP 18 1.305 9.860 -10.614
140 HE3 TRP 18 3HE TRP 18 -3.132 7.138 -11.829
141 HZ2 TRP 18 2HZ TRP 18 0.324 8.343 -8.447
142 HZ3 TRP 18 3HZ TRP 18 -3.208 6.222 -9.551
143 HH2 TRP 18 2HH TRP 18 -1.519 6.815 -7.892
144 H LYS 19 HN LYS 19 -1.938 11.875 -16.653
145 HA LYS 19 HA LYS 19 -2.909 9.890 -18.569
146 HB2 LYS 19 2HB LYS 19 -4.431 11.582 -19.501
147 HB3 LYS 19 1HB LYS 19 -4.824 11.226 -17.828
148 HG2 LYS 19 2HG LYS 19 -3.724 13.288 -17.122
149 HG3 LYS 19 1HG LYS 19 -3.303 13.639 -18.801
150 HD2 LYS 19 2HD LYS 19 -5.663 13.749 -19.385
151 HD3 LYS 19 1HD LYS 19 -6.110 13.334 -17.729
152 HE2 LYS 19 2HE LYS 19 -5.010 15.398 -16.947
153 HE3 LYS 19 1HE LYS 19 -4.642 15.812 -18.622
154 HZ1 LYS 19 3HZ LYS 19 -7.371 15.447 -17.509
155 HZ2 LYS 19 1HZ LYS 19 -6.995 15.896 -19.099
156 HZ3 LYS 19 2HZ LYS 19 -6.631 16.944 -17.819
157 H ASN 20 HN ASN 20 -0.635 10.890 -20.763
158 HA ASN 20 HA ASN 20 -3.010 9.421 -19.946
159 HB2 ASN 20 2HB ASN 20 -3.363 10.251 -22.163
160 HB3 ASN 20 1HB ASN 20 -1.751 9.763 -22.671
161 HD21 ASN 20 1HD2 ASN 20 -1.425 7.734 -23.422
162 HD22 ASN 20 2HD2 ASN 20 -2.684 6.553 -23.596
163 H THR 21 HN THR 21 -2.100 8.052 -18.511
164 HA THR 21 HA THR 21 -0.255 6.060 -19.642
165 HB THR 21 HB THR 21 0.831 5.831 -17.427
166 HG1 THR 21 1HG THR 21 -1.102 7.706 -16.773
167 HG21 THR 21 3HG2 THR 21 0.979 8.626 -18.560
168 HG22 THR 21 1HG2 THR 21 1.879 7.228 -19.146
169 HG23 THR 21 2HG2 THR 21 2.185 7.859 -17.530
170 H LYS 22 HN LYS 22 -0.660 3.939 -19.111
171 HA LYS 22 HA LYS 22 -3.198 3.386 -17.830
172 HB2 LYS 22 2HB LYS 22 -1.288 1.824 -19.482
173 HB3 LYS 22 1HB LYS 22 -2.300 0.933 -18.355
174 HG2 LYS 22 2HG LYS 22 -4.243 2.253 -19.420
175 HG3 LYS 22 1HG LYS 22 -3.101 2.558 -20.729
176 HD2 LYS 22 2HD LYS 22 -4.511 0.574 -21.144
177 HD3 LYS 22 1HD LYS 22 -2.792 0.182 -21.063
178 HE2 LYS 22 2HE LYS 22 -3.988 -1.496 -19.843
179 HE3 LYS 22 1HE LYS 22 -3.122 -0.490 -18.686
180 HZ1 LYS 22 3HZ LYS 22 -5.262 -0.823 -17.802
181 HZ2 LYS 22 1HZ LYS 22 -6.029 -0.487 -19.279
182 HZ3 LYS 22 2HZ LYS 22 -5.279 0.761 -18.414
183 H HIS 23 HN HIS 23 -0.118 3.831 -16.659
184 HA HIS 23 HA HIS 23 0.112 1.658 -14.907
185 HB2 HIS 23 2HB HIS 23 1.752 2.919 -13.648
186 HB3 HIS 23 1HB HIS 23 2.039 3.073 -15.367
187 HD1 HIS 23 1HD HIS 23 2.916 5.308 -15.859
188 HD2 HIS 23 2HD HIS 23 0.078 5.414 -12.819
189 HE1 HIS 23 1HE HIS 23 2.794 7.708 -15.126
190 HE2 HIS 23 2HE HIS 23 1.234 7.702 -13.150
191 H ALA 24 HN ALA 24 -1.817 4.541 -14.690
192 HA ALA 24 HA ALA 24 -2.524 4.498 -11.990
193 HB1 ALA 24 1HB ALA 24 -4.276 5.135 -14.362
194 HB2 ALA 24 2HB ALA 24 -3.200 6.263 -13.539
195 HB3 ALA 24 3HB ALA 24 -4.592 5.592 -12.690
196 H ASP 25 HN ASP 25 -3.827 2.670 -14.718
197 HA ASP 25 HA ASP 25 -5.826 1.244 -13.307
198 HB2 ASP 25 2HB ASP 25 -5.879 1.423 -15.723
199 HB3 ASP 25 1HB ASP 25 -4.323 0.628 -15.860
200 H GLN 26 HN GLN 26 -2.493 0.530 -14.169
201 HA GLN 26 HA GLN 26 -2.301 -2.033 -13.086
202 HB2 GLN 26 2HB GLN 26 -0.243 0.126 -13.497
203 HB3 GLN 26 1HB GLN 26 0.164 -1.480 -12.928
204 HG2 GLN 26 2HG GLN 26 -1.279 -0.969 -15.509
205 HG3 GLN 26 1HG GLN 26 0.475 -1.081 -15.380
206 HE21 GLN 26 1HE2 GLN 26 0.547 -2.871 -16.720
207 HE22 GLN 26 2HE2 GLN 26 0.030 -4.437 -16.206
208 H TRP 27 HN TRP 27 -1.994 1.134 -11.563
209 HA TRP 27 HA TRP 27 -1.051 0.396 -9.060
210 HB2 TRP 27 2HB TRP 27 -2.816 2.582 -10.055
211 HB3 TRP 27 1HB TRP 27 -2.763 2.307 -8.320
212 HD1 TRP 27 1HD TRP 27 -0.171 2.898 -11.175
213 HE1 TRP 27 1HE TRP 27 1.708 4.384 -10.219
214 HE3 TRP 27 3HE TRP 27 -1.828 3.291 -6.354
215 HZ2 TRP 27 2HZ TRP 27 2.387 5.556 -7.750
216 HZ3 TRP 27 3HZ TRP 27 -0.506 4.617 -4.760
217 HH2 TRP 27 2HH TRP 27 1.559 5.726 -5.444
218 H THR 28 HN THR 28 -4.418 0.531 -10.190
219 HA THR 28 HA THR 28 -5.526 -0.560 -7.805
220 HB THR 28 HB THR 28 -6.771 -0.661 -10.557
221 HG1 THR 28 1HG THR 28 -6.016 1.508 -9.141
222 HG21 THR 28 3HG2 THR 28 -8.870 -0.460 -9.301
223 HG22 THR 28 1HG2 THR 28 -7.963 -0.440 -7.790
224 HG23 THR 28 2HG2 THR 28 -7.958 -1.883 -8.802
225 H ASN 29 HN ASN 29 -4.572 -1.884 -10.920
226 HA ASN 29 HA ASN 29 -5.714 -4.418 -10.734
227 HB2 ASN 29 2HB ASN 29 -4.543 -3.155 -12.704
228 HB3 ASN 29 1HB ASN 29 -3.090 -3.957 -12.121
229 HD21 ASN 29 1HD2 ASN 29 -6.102 -4.304 -13.738
230 HD22 ASN 29 2HD2 ASN 29 -5.901 -5.948 -14.220
231 H THR 30 HN THR 30 -2.408 -3.381 -9.886
232 HA THR 30 HA THR 30 -1.535 -5.943 -9.063
233 HB THR 30 HB THR 30 -0.429 -3.279 -8.155
234 HG1 THR 30 1HG THR 30 -0.344 -4.605 -10.610
235 HG21 THR 30 3HG2 THR 30 1.678 -4.503 -7.957
236 HG22 THR 30 1HG2 THR 30 0.873 -5.989 -8.467
237 HG23 THR 30 2HG2 THR 30 0.433 -5.227 -6.938
238 H ILE 31 HN ILE 31 -2.780 -3.151 -7.233
239 HA ILE 31 HA ILE 31 -2.402 -4.261 -4.670
240 HB ILE 31 HB ILE 31 -4.364 -2.159 -5.601
241 HG12 ILE 31 2HG1 ILE 31 -1.735 -1.937 -4.118
242 HG13 ILE 31 1HG1 ILE 31 -1.971 -1.586 -5.826
243 HG21 ILE 31 1HG2 ILE 31 -5.197 -3.201 -3.561
244 HG22 ILE 31 2HG2 ILE 31 -4.632 -1.560 -3.240
245 HG23 ILE 31 3HG2 ILE 31 -3.636 -2.941 -2.780
246 HD11 ILE 31 3HD1 ILE 31 -3.486 0.237 -5.238
247 HD12 ILE 31 1HD1 ILE 31 -1.895 0.451 -4.511
248 HD13 ILE 31 2HD1 ILE 31 -3.246 -0.119 -3.528
249 H LYS 32 HN LYS 32 -5.147 -4.351 -6.901
250 HA LYS 32 HA LYS 32 -6.984 -5.580 -5.168
251 HB2 LYS 32 2HB LYS 32 -7.472 -4.500 -7.405
252 HB3 LYS 32 1HB LYS 32 -6.858 -5.963 -8.158
253 HG2 LYS 32 2HG LYS 32 -8.574 -7.277 -7.020
254 HG3 LYS 32 1HG LYS 32 -9.203 -5.807 -6.277
255 HD2 LYS 32 2HD LYS 32 -9.690 -4.906 -8.509
256 HD3 LYS 32 1HD LYS 32 -9.085 -6.396 -9.235
257 HE2 LYS 32 2HE LYS 32 -10.807 -7.665 -8.031
258 HE3 LYS 32 1HE LYS 32 -11.422 -6.164 -7.343
259 HZ1 LYS 32 3HZ LYS 32 -11.919 -5.395 -9.590
260 HZ2 LYS 32 1HZ LYS 32 -12.730 -6.841 -9.234
261 HZ3 LYS 32 2HZ LYS 32 -11.361 -6.865 -10.230
262 H THR 33 HN THR 33 -4.389 -6.864 -7.105
263 HA THR 33 HA THR 33 -5.271 -9.591 -6.928
264 HB THR 33 HB THR 33 -2.519 -8.564 -7.652
265 HG1 THR 33 1HG THR 33 -3.855 -7.655 -9.144
266 HG21 THR 33 3HG2 THR 33 -2.575 -10.958 -7.170
267 HG22 THR 33 1HG2 THR 33 -2.337 -10.677 -8.896
268 HG23 THR 33 2HG2 THR 33 -3.922 -11.165 -8.292
269 H TYR 34 HN TYR 34 -2.595 -7.745 -5.437
270 HA TYR 34 HA TYR 34 -1.878 -9.997 -3.790
271 HB2 TYR 34 2HB TYR 34 -0.808 -7.198 -4.040
272 HB3 TYR 34 1HB TYR 34 -0.222 -8.313 -2.809
273 HD1 TYR 34 1HD TYR 34 -0.412 -7.659 -6.426
274 HD2 TYR 34 2HD TYR 34 1.188 -10.166 -3.385
275 HE1 TYR 34 1HE TYR 34 1.127 -8.655 -8.064
276 HE2 TYR 34 2HE TYR 34 2.731 -11.168 -5.015
277 HH TYR 34 HH TYR 34 3.213 -9.853 -8.144
278 H CYS 35 HN CYS 35 -3.255 -6.776 -3.144
279 HA CYS 35 HA CYS 35 -3.426 -7.432 -0.305
280 HB2 CYS 35 2HB CYS 35 -4.143 -4.845 -1.693
281 HB3 CYS 35 1HB CYS 35 -3.882 -5.087 0.031
282 HG CYS 35 HG CYS 35 -1.207 -5.243 -0.029
283 H GLY 36 HN GLY 36 -5.421 -7.137 -3.094
284 HA2 GLY 36 2HA GLY 36 -7.865 -6.339 -2.193
285 HA3 GLY 36 1HA GLY 36 -7.647 -7.533 -3.458
286 HA PRO 37 HA PRO 37 -9.469 -10.707 -1.097
287 HB2 PRO 37 2HB PRO 37 -7.123 -12.475 -1.033
288 HB3 PRO 37 1HB PRO 37 -8.676 -12.696 -1.845
289 HG2 PRO 37 2HG PRO 37 -6.411 -12.188 -3.211
290 HG3 PRO 37 1HG PRO 37 -7.991 -11.582 -3.740
291 HD2 PRO 37 2HD PRO 37 -5.787 -10.146 -2.312
292 HD3 PRO 37 1HD PRO 37 -6.826 -9.581 -3.637
293 H VAL 38 HN VAL 38 -6.680 -9.298 0.232
294 HA VAL 38 HA VAL 38 -6.987 -10.797 2.744
295 HB VAL 38 HB VAL 38 -4.660 -9.042 1.947
296 HG11 VAL 38 1HG1 VAL 38 -3.505 -10.131 3.804
297 HG12 VAL 38 2HG1 VAL 38 -4.964 -11.050 4.181
298 HG13 VAL 38 3HG1 VAL 38 -4.956 -9.296 4.360
299 HG21 VAL 38 3HG2 VAL 38 -4.921 -12.045 1.818
300 HG22 VAL 38 1HG2 VAL 38 -3.437 -11.130 1.541
301 HG23 VAL 38 2HG2 VAL 38 -4.807 -10.943 0.445
302 H ILE 39 HN ILE 39 -5.875 -7.496 1.961
303 HA ILE 39 HA ILE 39 -7.369 -6.569 4.323
304 HB ILE 39 HB ILE 39 -5.766 -4.683 4.402
305 HG12 ILE 39 2HG1 ILE 39 -4.290 -6.228 2.253
306 HG13 ILE 39 1HG1 ILE 39 -5.144 -4.711 2.001
307 HG21 ILE 39 1HG2 ILE 39 -4.519 -7.429 4.485
308 HG22 ILE 39 2HG2 ILE 39 -5.405 -6.642 5.792
309 HG23 ILE 39 3HG2 ILE 39 -3.861 -5.983 5.250
310 HD11 ILE 39 3HD1 ILE 39 -2.762 -5.108 3.793
311 HD12 ILE 39 1HD1 ILE 39 -3.608 -3.586 3.516
312 HD13 ILE 39 2HD1 ILE 39 -2.747 -4.372 2.192
313 H GLY 40 HN GLY 40 -7.832 -6.691 1.177
314 HA2 GLY 40 2HA GLY 40 -8.154 -4.079 0.242
315 HA3 GLY 40 1HA GLY 40 -9.017 -5.482 -0.361
316 HA PRO 41 HA PRO 41 -12.770 -4.038 1.390
317 HB2 PRO 41 2HB PRO 41 -13.926 -6.142 2.621
318 HB3 PRO 41 1HB PRO 41 -13.712 -6.072 0.868
319 HG2 PRO 41 2HG PRO 41 -12.081 -7.506 2.921
320 HG3 PRO 41 1HG PRO 41 -12.612 -8.064 1.325
321 HD2 PRO 41 2HD PRO 41 -10.106 -7.113 1.823
322 HD3 PRO 41 1HD PRO 41 -10.900 -6.993 0.241
323 H LEU 42 HN LEU 42 -10.301 -4.622 3.487
324 HA LEU 42 HA LEU 42 -11.750 -4.310 5.964
325 HB2 LEU 42 2HB LEU 42 -8.801 -4.152 5.335
326 HB3 LEU 42 1HB LEU 42 -9.472 -4.023 6.949
327 HG LEU 42 HG LEU 42 -9.638 -6.445 5.156
328 HD11 LEU 42 1HD1 LEU 42 -8.160 -7.470 6.808
329 HD12 LEU 42 2HD1 LEU 42 -8.083 -5.947 7.690
330 HD13 LEU 42 3HD1 LEU 42 -7.404 -6.058 6.067
331 HD21 LEU 42 3HD2 LEU 42 -10.606 -6.027 7.981
332 HD22 LEU 42 1HD2 LEU 42 -10.612 -7.558 7.104
333 HD23 LEU 42 2HD2 LEU 42 -11.623 -6.221 6.554
334 H SER 43 HN SER 43 -11.865 -2.439 7.219
335 HA SER 43 HA SER 43 -12.087 -0.010 5.922
336 HB2 SER 43 2HB SER 43 -11.606 -0.482 8.867
337 HB3 SER 43 1HB SER 43 -12.458 0.853 8.119
338 HG SER 43 HG SER 43 -13.333 -1.682 8.703
339 H VAL 44 HN VAL 44 -10.748 1.746 5.731
340 HA VAL 44 HA VAL 44 -7.968 1.151 5.552
341 HB VAL 44 HB VAL 44 -9.316 2.685 4.037
342 HG11 VAL 44 1HG1 VAL 44 -10.393 4.041 5.713
343 HG12 VAL 44 2HG1 VAL 44 -9.402 5.053 4.662
344 HG13 VAL 44 3HG1 VAL 44 -8.831 4.632 6.277
345 HG21 VAL 44 3HG2 VAL 44 -7.405 4.110 3.546
346 HG22 VAL 44 1HG2 VAL 44 -6.901 2.456 3.892
347 HG23 VAL 44 2HG2 VAL 44 -6.699 3.710 5.112
348 H GLN 45 HN GLN 45 -9.906 2.304 8.074
349 HA GLN 45 HA GLN 45 -7.736 3.554 9.553
350 HB2 GLN 45 2HB GLN 45 -10.069 4.344 9.769
351 HB3 GLN 45 1HB GLN 45 -10.517 2.779 10.435
352 HG2 GLN 45 2HG GLN 45 -8.929 3.167 12.290
353 HG3 GLN 45 1HG GLN 45 -8.632 4.782 11.649
354 HE21 GLN 45 1HE2 GLN 45 -9.415 5.819 13.452
355 HE22 GLN 45 2HE2 GLN 45 -11.097 5.854 13.829
356 H ASP 46 HN ASP 46 -9.230 0.481 9.133
357 HA ASP 46 HA ASP 46 -8.235 -0.600 11.633
358 HB2 ASP 46 2HB ASP 46 -10.066 -1.601 9.482
359 HB3 ASP 46 1HB ASP 46 -9.368 -2.723 10.642
360 H VAL 47 HN VAL 47 -7.246 -0.384 8.377
361 HA VAL 47 HA VAL 47 -5.702 -2.691 8.081
362 HB VAL 47 HB VAL 47 -5.051 0.084 7.056
363 HG11 VAL 47 1HG1 VAL 47 -3.117 -1.402 6.973
364 HG12 VAL 47 2HG1 VAL 47 -3.728 -1.083 5.351
365 HG13 VAL 47 3HG1 VAL 47 -4.077 -2.622 6.137
366 HG21 VAL 47 3HG2 VAL 47 -7.262 -0.674 6.346
367 HG22 VAL 47 1HG2 VAL 47 -6.563 -2.179 5.752
368 HG23 VAL 47 2HG2 VAL 47 -6.141 -0.647 4.984
369 H ASP 48 HN ASP 48 -4.326 -3.419 9.538
370 HA ASP 48 HA ASP 48 -2.712 -1.501 11.067
371 HB2 ASP 48 2HB ASP 48 -4.216 -2.809 12.448
372 HB3 ASP 48 1HB ASP 48 -3.600 -4.305 11.773
373 H THR 49 HN THR 49 -0.610 -2.355 11.800
374 HA THR 49 HA THR 49 0.970 -2.952 9.529
375 HB THR 49 HB THR 49 1.751 -3.002 12.452
376 HG1 THR 49 1HG THR 49 1.998 -0.924 10.503
377 HG21 THR 49 3HG2 THR 49 3.469 -2.709 9.980
378 HG22 THR 49 1HG2 THR 49 3.384 -4.142 11.003
379 HG23 THR 49 2HG2 THR 49 4.027 -2.634 11.650
380 H LYS 50 HN LYS 50 -0.289 -4.940 12.174
381 HA LYS 50 HA LYS 50 1.261 -7.251 11.601
382 HB2 LYS 50 2HB LYS 50 -0.310 -6.609 13.645
383 HB3 LYS 50 1HB LYS 50 -1.510 -7.479 12.704
384 HG2 LYS 50 2HG LYS 50 1.140 -8.627 13.550
385 HG3 LYS 50 1HG LYS 50 -0.371 -8.842 14.430
386 HD2 LYS 50 2HD LYS 50 -1.351 -9.979 12.520
387 HD3 LYS 50 1HD LYS 50 0.117 -9.701 11.578
388 HE2 LYS 50 2HE LYS 50 1.383 -11.050 13.206
389 HE3 LYS 50 1HE LYS 50 -0.111 -11.360 14.088
390 HZ1 LYS 50 3HZ LYS 50 0.464 -13.198 12.629
391 HZ2 LYS 50 1HZ LYS 50 0.430 -12.175 11.280
392 HZ3 LYS 50 2HZ LYS 50 -0.995 -12.483 12.142
393 H LEU 51 HN LEU 51 -1.835 -6.037 10.451
394 HA LEU 51 HA LEU 51 -2.555 -8.301 8.927
395 HB2 LEU 51 2HB LEU 51 -3.334 -5.407 8.571
396 HB3 LEU 51 1HB LEU 51 -4.131 -6.774 7.823
397 HG LEU 51 HG LEU 51 -4.038 -6.153 10.766
398 HD11 LEU 51 1HD1 LEU 51 -6.317 -6.141 8.798
399 HD12 LEU 51 2HD1 LEU 51 -5.554 -4.721 9.513
400 HD13 LEU 51 3HD1 LEU 51 -6.448 -5.847 10.533
401 HD21 LEU 51 3HD2 LEU 51 -5.545 -8.074 11.026
402 HD22 LEU 51 1HD2 LEU 51 -3.958 -8.553 10.420
403 HD23 LEU 51 2HD2 LEU 51 -5.330 -8.457 9.316
404 H ILE 52 HN ILE 52 -0.746 -5.355 8.210
405 HA ILE 52 HA ILE 52 -0.334 -5.879 5.456
406 HB ILE 52 HB ILE 52 1.394 -4.269 7.349
407 HG12 ILE 52 2HG1 ILE 52 -0.797 -3.391 5.455
408 HG13 ILE 52 1HG1 ILE 52 -0.952 -3.490 7.205
409 HG21 ILE 52 1HG2 ILE 52 1.282 -4.269 4.333
410 HG22 ILE 52 2HG2 ILE 52 2.604 -4.883 5.324
411 HG23 ILE 52 3HG2 ILE 52 2.229 -3.161 5.327
412 HD11 ILE 52 3HD1 ILE 52 0.924 -1.680 5.705
413 HD12 ILE 52 1HD1 ILE 52 0.753 -1.773 7.458
414 HD13 ILE 52 2HD1 ILE 52 -0.592 -1.205 6.469
415 H MET 53 HN MET 53 1.475 -6.706 8.375
416 HA MET 53 HA MET 53 3.705 -7.917 7.221
417 HB2 MET 53 2HB MET 53 2.228 -8.350 9.792
418 HB3 MET 53 1HB MET 53 3.537 -9.434 9.347
419 HG2 MET 53 2HG MET 53 3.785 -6.448 9.598
420 HG3 MET 53 1HG MET 53 4.236 -7.610 10.844
421 HE1 MET 53 3HE MET 53 6.746 -6.869 11.075
422 HE2 MET 53 1HE MET 53 6.305 -5.518 10.035
423 HE3 MET 53 2HE MET 53 7.755 -6.461 9.689
424 H LYS 54 HN LYS 54 0.460 -9.185 7.784
425 HA LYS 54 HA LYS 54 0.934 -11.866 7.133
426 HB2 LYS 54 2HB LYS 54 -1.548 -10.206 6.659
427 HB3 LYS 54 1HB LYS 54 -1.476 -11.955 6.532
428 HG2 LYS 54 2HG LYS 54 -0.827 -12.059 8.917
429 HG3 LYS 54 1HG LYS 54 -1.050 -10.311 9.015
430 HD2 LYS 54 2HD LYS 54 -3.028 -11.517 9.820
431 HD3 LYS 54 1HD LYS 54 -3.395 -10.562 8.382
432 HE2 LYS 54 2HE LYS 54 -3.122 -12.601 7.007
433 HE3 LYS 54 1HE LYS 54 -2.866 -13.529 8.483
434 HZ1 LYS 54 3HZ LYS 54 -5.055 -13.291 9.120
435 HZ2 LYS 54 1HZ LYS 54 -5.198 -13.451 7.437
436 HZ3 LYS 54 2HZ LYS 54 -5.313 -11.920 8.155
437 H VAL 55 HN VAL 55 0.211 -9.084 5.095
438 HA VAL 55 HA VAL 55 -0.042 -10.600 2.685
439 HB VAL 55 HB VAL 55 0.461 -7.633 2.984
440 HG11 VAL 55 1HG1 VAL 55 -0.692 -9.238 0.708
441 HG12 VAL 55 2HG1 VAL 55 0.879 -8.440 0.737
442 HG13 VAL 55 3HG1 VAL 55 -0.599 -7.479 0.774
443 HG21 VAL 55 3HG2 VAL 55 -1.963 -7.372 2.798
444 HG22 VAL 55 1HG2 VAL 55 -1.515 -8.289 4.236
445 HG23 VAL 55 2HG2 VAL 55 -2.151 -9.125 2.820
446 H LEU 56 HN LEU 56 2.508 -8.591 4.114
447 HA LEU 56 HA LEU 56 4.165 -8.802 1.777
448 HB2 LEU 56 2HB LEU 56 4.627 -7.595 4.492
449 HB3 LEU 56 1HB LEU 56 5.828 -7.574 3.217
450 HG LEU 56 HG LEU 56 3.105 -6.273 3.107
451 HD11 LEU 56 1HD1 LEU 56 4.376 -4.189 3.107
452 HD12 LEU 56 2HD1 LEU 56 5.876 -5.099 3.274
453 HD13 LEU 56 3HD1 LEU 56 4.682 -5.123 4.571
454 HD21 LEU 56 3HD2 LEU 56 3.771 -7.078 0.912
455 HD22 LEU 56 1HD2 LEU 56 5.347 -6.310 1.090
456 HD23 LEU 56 2HD2 LEU 56 3.892 -5.321 0.984
457 H ASP 57 HN ASP 57 3.993 -10.491 4.836
458 HA ASP 57 HA ASP 57 6.570 -11.316 5.249
459 HB2 ASP 57 2HB ASP 57 4.569 -11.830 6.694
460 HB3 ASP 57 1HB ASP 57 4.209 -13.149 5.612
461 HA PRO 58 HA PRO 58 6.131 -15.146 2.388
462 HB2 PRO 58 2HB PRO 58 4.076 -15.168 0.593
463 HB3 PRO 58 1HB PRO 58 3.996 -15.936 2.182
464 HG2 PRO 58 2HG PRO 58 2.898 -13.312 1.283
465 HG3 PRO 58 1HG PRO 58 2.190 -14.513 2.378
466 HD2 PRO 58 2HD PRO 58 3.398 -12.234 3.247
467 HD3 PRO 58 1HD PRO 58 3.366 -13.729 4.194
468 H ILE 59 HN ILE 59 5.036 -12.039 1.141
469 HA ILE 59 HA ILE 59 6.030 -12.398 -1.493
470 HB ILE 59 HB ILE 59 5.494 -9.787 -0.076
471 HG12 ILE 59 2HG1 ILE 59 3.557 -11.307 0.035
472 HG13 ILE 59 1HG1 ILE 59 3.243 -9.915 -0.988
473 HG21 ILE 59 1HG2 ILE 59 5.101 -8.922 -2.332
474 HG22 ILE 59 2HG2 ILE 59 5.522 -10.495 -3.008
475 HG23 ILE 59 3HG2 ILE 59 6.739 -9.545 -2.157
476 HD11 ILE 59 3HD1 ILE 59 3.960 -12.673 -1.947
477 HD12 ILE 59 1HD1 ILE 59 3.623 -11.276 -2.969
478 HD13 ILE 59 2HD1 ILE 59 2.349 -11.959 -1.956
479 H TRP 60 HN TRP 60 7.442 -11.149 1.491
480 HA TRP 60 HA TRP 60 9.714 -9.898 0.492
481 HB2 TRP 60 2HB TRP 60 9.386 -11.553 2.999
482 HB3 TRP 60 1HB TRP 60 10.840 -10.638 2.631
483 HD1 TRP 60 1HD TRP 60 8.051 -10.315 4.775
484 HE1 TRP 60 1HE TRP 60 7.435 -7.869 5.271
485 HE3 TRP 60 3HE TRP 60 10.575 -8.051 0.949
486 HZ2 TRP 60 2HZ TRP 60 7.938 -5.322 4.184
487 HZ3 TRP 60 3HZ TRP 60 10.451 -5.599 0.748
488 HH2 TRP 60 2HH TRP 60 9.159 -4.265 2.333
489 H GLU 61 HN GLU 61 9.076 -13.338 0.939
490 HA GLU 61 HA GLU 61 11.729 -14.080 0.105
491 HB2 GLU 61 2HB GLU 61 9.260 -15.635 0.841
492 HB3 GLU 61 1HB GLU 61 10.728 -16.389 0.276
493 HG2 GLU 61 2HG GLU 61 11.923 -15.260 2.172
494 HG3 GLU 61 1HG GLU 61 10.330 -14.809 2.785
495 H GLN 62 HN GLN 62 8.431 -14.187 -1.177
496 HA GLN 62 HA GLN 62 9.052 -15.655 -3.511
497 HB2 GLN 62 2HB GLN 62 6.770 -13.757 -2.950
498 HB3 GLN 62 1HB GLN 62 6.862 -14.826 -4.338
499 HG2 GLN 62 2HG GLN 62 6.861 -15.773 -1.486
500 HG3 GLN 62 1HG GLN 62 5.414 -15.635 -2.481
501 HE21 GLN 62 1HE2 GLN 62 4.945 -17.798 -2.400
502 HE22 GLN 62 2HE2 GLN 62 5.888 -18.994 -3.234
503 H LYS 63 HN LYS 63 8.398 -12.180 -3.087
504 HA LYS 63 HA LYS 63 10.015 -11.602 -5.454
505 HB2 LYS 63 2HB LYS 63 7.180 -10.612 -5.045
506 HB3 LYS 63 1HB LYS 63 8.255 -10.126 -6.349
507 HG2 LYS 63 2HG LYS 63 8.205 -12.298 -7.311
508 HG3 LYS 63 1HG LYS 63 7.382 -12.967 -5.902
509 HD2 LYS 63 2HD LYS 63 5.409 -11.630 -6.400
510 HD3 LYS 63 1HD LYS 63 6.236 -10.903 -7.779
511 HE2 LYS 63 2HE LYS 63 6.400 -13.076 -8.853
512 HE3 LYS 63 1HE LYS 63 5.637 -13.841 -7.460
513 HZ1 LYS 63 3HZ LYS 63 4.301 -11.734 -9.060
514 HZ2 LYS 63 1HZ LYS 63 3.601 -12.787 -7.933
515 HZ3 LYS 63 2HZ LYS 63 4.156 -13.385 -9.418
516 HA PRO 64 HA PRO 64 11.037 -9.055 -1.736
517 HB2 PRO 64 2HB PRO 64 13.500 -8.721 -3.364
518 HB3 PRO 64 1HB PRO 64 13.326 -9.129 -1.654
519 HG2 PRO 64 2HG PRO 64 14.007 -10.991 -3.426
520 HG3 PRO 64 1HG PRO 64 12.899 -11.366 -2.094
521 HD2 PRO 64 2HD PRO 64 12.295 -10.872 -4.979
522 HD3 PRO 64 1HD PRO 64 11.562 -12.035 -3.857
523 H GLU 65 HN GLU 65 11.872 -8.160 -5.085
524 HA GLU 65 HA GLU 65 11.989 -5.390 -4.563
525 HB2 GLU 65 2HB GLU 65 11.629 -6.896 -7.144
526 HB3 GLU 65 1HB GLU 65 12.063 -5.210 -7.005
527 HG2 GLU 65 2HG GLU 65 14.158 -5.746 -6.005
528 HG3 GLU 65 1HG GLU 65 13.709 -7.446 -5.882
529 H THR 66 HN THR 66 9.467 -7.587 -5.574
530 HA THR 66 HA THR 66 7.607 -5.578 -6.368
531 HB THR 66 HB THR 66 7.005 -8.415 -5.509
532 HG1 THR 66 1HG THR 66 8.255 -7.362 -7.763
533 HG21 THR 66 3HG2 THR 66 5.036 -6.958 -5.743
534 HG22 THR 66 1HG2 THR 66 5.078 -8.196 -7.000
535 HG23 THR 66 2HG2 THR 66 5.547 -6.539 -7.379
536 H ALA 67 HN ALA 67 8.269 -7.321 -3.385
537 HA ALA 67 HA ALA 67 6.006 -6.550 -1.921
538 HB1 ALA 67 1HB ALA 67 7.304 -7.107 0.066
539 HB2 ALA 67 2HB ALA 67 8.786 -7.108 -0.890
540 HB3 ALA 67 3HB ALA 67 7.540 -8.316 -1.195
541 H SER 68 HN SER 68 9.186 -4.999 -2.244
542 HA SER 68 HA SER 68 8.568 -2.864 -0.473
543 HB2 SER 68 2HB SER 68 10.628 -1.819 -1.609
544 HB3 SER 68 1HB SER 68 10.858 -3.331 -0.729
545 HG SER 68 HG SER 68 11.582 -4.110 -2.528
546 H ARG 69 HN ARG 69 8.434 -3.244 -3.991
547 HA ARG 69 HA ARG 69 7.745 -0.572 -4.583
548 HB2 ARG 69 2HB ARG 69 7.390 -3.171 -6.060
549 HB3 ARG 69 1HB ARG 69 6.855 -1.645 -6.724
550 HG2 ARG 69 2HG ARG 69 9.125 -0.782 -6.640
551 HG3 ARG 69 1HG ARG 69 9.672 -2.301 -5.930
552 HD2 ARG 69 2HD ARG 69 8.899 -3.485 -7.956
553 HD3 ARG 69 1HD ARG 69 8.452 -1.935 -8.662
554 HE ARG 69 HE ARG 69 11.117 -1.717 -7.947
555 HH11 ARG 69 1HH1 ARG 69 9.172 -3.656 -10.122
556 HH12 ARG 69 2HH1 ARG 69 10.468 -3.943 -11.240
557 HH21 ARG 69 1HH2 ARG 69 12.840 -2.101 -9.424
558 HH22 ARG 69 2HH2 ARG 69 12.553 -3.085 -10.829
559 H LEU 70 HN LEU 70 5.825 -3.433 -3.845
560 HA LEU 70 HA LEU 70 3.289 -2.233 -4.272
561 HB2 LEU 70 2HB LEU 70 3.627 -4.672 -4.149
562 HB3 LEU 70 1HB LEU 70 4.069 -4.525 -2.460
563 HG LEU 70 HG LEU 70 1.769 -3.671 -1.988
564 HD11 LEU 70 1HD1 LEU 70 0.032 -4.035 -3.672
565 HD12 LEU 70 2HD1 LEU 70 1.267 -4.478 -4.850
566 HD13 LEU 70 3HD1 LEU 70 1.214 -2.839 -4.201
567 HD21 LEU 70 3HD2 LEU 70 2.341 -5.992 -1.581
568 HD22 LEU 70 1HD2 LEU 70 1.974 -6.399 -3.258
569 HD23 LEU 70 2HD2 LEU 70 0.685 -5.864 -2.179
570 H ARG 71 HN ARG 71 5.391 -2.592 -1.450
571 HA ARG 71 HA ARG 71 3.651 -1.443 0.440
572 HB2 ARG 71 2HB ARG 71 5.810 -2.706 0.900
573 HB3 ARG 71 1HB ARG 71 6.663 -1.219 0.502
574 HG2 ARG 71 2HG ARG 71 5.001 -0.221 2.304
575 HG3 ARG 71 1HG ARG 71 5.011 -1.892 2.869
576 HD2 ARG 71 2HD ARG 71 6.722 -0.776 4.055
577 HD3 ARG 71 1HD ARG 71 7.525 -1.766 2.837
578 HE ARG 71 HE ARG 71 7.744 0.314 1.506
579 HH11 ARG 71 1HH1 ARG 71 7.253 0.531 4.960
580 HH12 ARG 71 2HH1 ARG 71 7.939 2.120 5.087
581 HH21 ARG 71 1HH2 ARG 71 8.657 2.412 1.682
582 HH22 ARG 71 2HH2 ARG 71 8.725 3.178 3.241
583 H GLY 72 HN GLY 72 5.951 -0.054 -1.819
584 HA2 GLY 72 2HA GLY 72 6.064 2.557 -0.800
585 HA3 GLY 72 1HA GLY 72 6.375 2.104 -2.468
586 H ARG 73 HN ARG 73 3.844 1.145 -3.197
587 HA ARG 73 HA ARG 73 2.514 3.631 -3.640
588 HB2 ARG 73 2HB ARG 73 0.861 2.341 -4.898
589 HB3 ARG 73 1HB ARG 73 2.496 1.904 -5.360
590 HG2 ARG 73 2HG ARG 73 2.322 -0.101 -3.923
591 HG3 ARG 73 1HG ARG 73 0.638 0.324 -3.602
592 HD2 ARG 73 2HD ARG 73 0.752 -1.330 -5.368
593 HD3 ARG 73 1HD ARG 73 0.167 0.205 -6.014
594 HE ARG 73 HE ARG 73 2.989 -0.039 -6.302
595 HH11 ARG 73 1HH1 ARG 73 -0.046 -1.081 -7.695
596 HH12 ARG 73 2HH1 ARG 73 0.623 -1.377 -9.268
597 HH21 ARG 73 1HH2 ARG 73 3.881 -0.403 -8.382
598 HH22 ARG 73 2HH2 ARG 73 2.859 -0.972 -9.671
599 H ILE 74 HN ILE 74 2.022 0.917 -1.467
600 HA ILE 74 HA ILE 74 -0.525 1.717 -0.499
601 HB ILE 74 HB ILE 74 1.634 0.058 0.824
602 HG12 ILE 74 2HG1 ILE 74 -0.901 -0.781 -0.598
603 HG13 ILE 74 1HG1 ILE 74 0.717 -0.868 -1.289
604 HG21 ILE 74 1HG2 ILE 74 -1.265 0.356 1.594
605 HG22 ILE 74 2HG2 ILE 74 0.110 1.018 2.481
606 HG23 ILE 74 3HG2 ILE 74 -0.095 -0.729 2.347
607 HD11 ILE 74 3HD1 ILE 74 1.358 -2.449 0.473
608 HD12 ILE 74 1HD1 ILE 74 0.008 -3.038 -0.497
609 HD13 ILE 74 2HD1 ILE 74 -0.284 -2.381 1.115
610 H GLU 75 HN GLU 75 2.797 2.376 0.465
611 HA GLU 75 HA GLU 75 2.433 3.797 2.812
612 HB2 GLU 75 2HB GLU 75 4.624 3.186 1.916
613 HB3 GLU 75 1HB GLU 75 4.408 4.297 0.574
614 HG2 GLU 75 2HG GLU 75 4.212 6.117 2.362
615 HG3 GLU 75 1HG GLU 75 4.886 4.917 3.465
616 H SER 76 HN SER 76 2.392 4.977 -0.520
617 HA SER 76 HA SER 76 2.040 7.694 0.135
618 HB2 SER 76 2HB SER 76 2.867 6.672 -2.065
619 HB3 SER 76 1HB SER 76 1.163 6.454 -2.453
620 HG SER 76 HG SER 76 2.679 8.783 -2.278
621 H VAL 77 HN VAL 77 -0.265 5.142 -0.745
622 HA VAL 77 HA VAL 77 -2.567 6.785 -0.761
623 HB VAL 77 HB VAL 77 -2.359 3.822 -0.190
624 HG11 VAL 77 1HG1 VAL 77 -4.759 5.484 -0.956
625 HG12 VAL 77 2HG1 VAL 77 -4.477 4.723 0.610
626 HG13 VAL 77 3HG1 VAL 77 -4.727 3.725 -0.823
627 HG21 VAL 77 3HG2 VAL 77 -1.463 4.406 -2.370
628 HG22 VAL 77 1HG2 VAL 77 -2.932 5.303 -2.753
629 HG23 VAL 77 2HG2 VAL 77 -2.996 3.552 -2.545
630 H LEU 78 HN LEU 78 -1.127 4.745 1.771
631 HA LEU 78 HA LEU 78 -3.055 5.259 3.749
632 HB2 LEU 78 2HB LEU 78 -0.149 4.495 3.939
633 HB3 LEU 78 1HB LEU 78 -1.173 4.669 5.352
634 HG LEU 78 HG LEU 78 -1.658 2.723 3.096
635 HD11 LEU 78 1HD1 LEU 78 -0.597 2.273 5.879
636 HD12 LEU 78 2HD1 LEU 78 0.324 2.136 4.380
637 HD13 LEU 78 3HD1 LEU 78 -0.996 1.013 4.711
638 HD21 LEU 78 3HD2 LEU 78 -3.023 3.061 5.766
639 HD22 LEU 78 1HD2 LEU 78 -3.328 1.762 4.610
640 HD23 LEU 78 2HD2 LEU 78 -3.718 3.428 4.186
641 H ASP 79 HN ASP 79 0.033 6.875 3.052
642 HA ASP 79 HA ASP 79 -0.048 8.713 5.166
643 HB2 ASP 79 2HB ASP 79 1.966 8.293 3.834
644 HB3 ASP 79 1HB ASP 79 1.200 9.026 2.429
645 H TRP 80 HN TRP 80 -1.344 8.892 1.894
646 HA TRP 80 HA TRP 80 -2.276 11.536 1.951
647 HB2 TRP 80 2HB TRP 80 -2.151 10.306 -0.124
648 HB3 TRP 80 1HB TRP 80 -3.284 9.101 0.470
649 HD1 TRP 80 1HD TRP 80 -3.217 12.795 -0.656
650 HE1 TRP 80 1HE TRP 80 -5.575 13.420 -1.476
651 HE3 TRP 80 3HE TRP 80 -5.676 8.476 0.554
652 HZ2 TRP 80 2HZ TRP 80 -8.131 12.238 -1.602
653 HZ3 TRP 80 3HZ TRP 80 -8.078 8.307 0.046
654 HH2 TRP 80 2HH TRP 80 -9.277 10.151 -1.008
655 H ALA 81 HN ALA 81 -3.845 8.495 2.860
656 HA ALA 81 HA ALA 81 -6.369 9.556 3.470
657 HB1 ALA 81 1HB ALA 81 -5.044 7.096 4.600
658 HB2 ALA 81 2HB ALA 81 -5.985 7.176 3.108
659 HB3 ALA 81 3HB ALA 81 -6.768 7.465 4.662
660 H THR 82 HN THR 82 -3.426 9.341 5.367
661 HA THR 82 HA THR 82 -4.560 9.814 7.904
662 HB THR 82 HB THR 82 -1.800 10.640 6.980
663 HG1 THR 82 1HG THR 82 -1.149 8.588 7.454
664 HG21 THR 82 3HG2 THR 82 -1.186 10.372 9.327
665 HG22 THR 82 1HG2 THR 82 -2.847 9.931 9.725
666 HG23 THR 82 2HG2 THR 82 -2.479 11.558 9.157
667 H VAL 83 HN VAL 83 -3.159 12.034 5.502
668 HA VAL 83 HA VAL 83 -3.608 14.371 7.065
669 HB VAL 83 HB VAL 83 -3.210 14.215 4.076
670 HG11 VAL 83 1HG1 VAL 83 -2.726 16.452 6.038
671 HG12 VAL 83 2HG1 VAL 83 -4.019 16.377 4.842
672 HG13 VAL 83 3HG1 VAL 83 -2.339 16.491 4.318
673 HG21 VAL 83 3HG2 VAL 83 -1.419 13.041 5.262
674 HG22 VAL 83 1HG2 VAL 83 -1.141 14.470 6.256
675 HG23 VAL 83 2HG2 VAL 83 -0.831 14.529 4.520
676 H ARG 84 HN ARG 84 -5.409 12.749 4.490
677 HA ARG 84 HA ARG 84 -7.455 14.629 4.207
678 HB2 ARG 84 2HB ARG 84 -6.778 12.013 3.271
679 HB3 ARG 84 1HB ARG 84 -8.476 12.043 3.731
680 HG2 ARG 84 2HG ARG 84 -8.138 12.596 1.387
681 HG3 ARG 84 1HG ARG 84 -8.864 13.916 2.294
682 HD2 ARG 84 2HD ARG 84 -6.598 14.941 2.476
683 HD3 ARG 84 1HD ARG 84 -6.004 13.687 1.385
684 HE ARG 84 HE ARG 84 -8.222 14.922 0.197
685 HH11 ARG 84 1HH1 ARG 84 -4.894 15.675 1.035
686 HH12 ARG 84 2HH1 ARG 84 -4.752 16.914 -0.185
687 HH21 ARG 84 1HH2 ARG 84 -8.017 16.500 -1.389
688 HH22 ARG 84 2HH2 ARG 84 -6.510 17.345 -1.599
689 H GLY 85 HN GLY 85 -6.779 12.463 6.764
690 HA2 GLY 85 2HA GLY 85 -7.808 12.560 8.862
691 HA3 GLY 85 1HA GLY 85 -9.154 13.422 8.134
692 H TYR 86 HN TYR 86 -7.919 10.368 6.900
693 HA TYR 86 HA TYR 86 -10.487 9.134 7.524
694 HB2 TYR 86 2HB TYR 86 -8.180 8.336 5.772
695 HB3 TYR 86 1HB TYR 86 -9.407 7.160 6.232
696 HD1 TYR 86 1HD TYR 86 -11.793 7.573 5.594
697 HD2 TYR 86 2HD TYR 86 -8.606 9.941 4.069
698 HE1 TYR 86 1HE TYR 86 -13.257 8.365 3.789
699 HE2 TYR 86 2HE TYR 86 -10.066 10.739 2.253
700 HH TYR 86 HH TYR 86 -13.435 10.262 2.269
701 H ARG 87 HN ARG 87 -7.574 9.511 9.006
702 HA ARG 87 HA ARG 87 -8.324 7.786 11.134
703 HB2 ARG 87 2HB ARG 87 -6.619 6.186 11.127
704 HB3 ARG 87 1HB ARG 87 -7.103 6.248 9.438
705 HG2 ARG 87 2HG ARG 87 -5.203 7.725 8.962
706 HG3 ARG 87 1HG ARG 87 -4.713 7.621 10.654
707 HD2 ARG 87 2HD ARG 87 -3.394 6.089 9.347
708 HD3 ARG 87 1HD ARG 87 -4.478 5.166 10.386
709 HE ARG 87 HE ARG 87 -5.602 4.410 8.526
710 HH11 ARG 87 1HH1 ARG 87 -3.378 6.957 7.649
711 HH12 ARG 87 2HH1 ARG 87 -3.515 6.678 5.945
712 HH21 ARG 87 1HH2 ARG 87 -5.810 4.025 6.297
713 HH22 ARG 87 2HH2 ARG 87 -4.927 5.004 5.169
714 H GLU 88 HN GLU 88 -6.576 7.881 12.881
715 HA GLU 88 HA GLU 88 -5.159 10.461 12.739
716 HB2 GLU 88 2HB GLU 88 -6.261 9.050 15.181
717 HB3 GLU 88 1HB GLU 88 -5.442 10.607 15.169
718 HG2 GLU 88 2HG GLU 88 -7.217 11.652 14.029
719 HG3 GLU 88 1HG GLU 88 -7.961 10.107 13.617
720 H GLY 89 HN GLY 89 -3.179 10.509 14.179
721 HA2 GLY 89 2HA GLY 89 -1.242 9.494 15.020
722 HA3 GLY 89 1HA GLY 89 -1.903 7.923 14.588
723 H ASP 90 HN ASP 90 -0.271 7.079 13.386
724 HA ASP 90 HA ASP 90 0.520 8.593 10.994
725 HB2 ASP 90 2HB ASP 90 2.089 6.727 12.754
726 HB3 ASP 90 1HB ASP 90 2.558 7.003 11.085
727 H ASN 91 HN ASN 91 1.467 6.873 9.311
728 HA ASN 91 HA ASN 91 -0.742 5.132 8.718
729 HB2 ASN 91 2HB ASN 91 0.452 4.768 6.602
730 HB3 ASN 91 1HB ASN 91 0.232 6.472 6.935
731 HD21 ASN 91 1HD2 ASN 91 2.112 5.243 5.156
732 HD22 ASN 91 2HD2 ASN 91 3.687 5.697 5.701
733 HA PRO 92 HA PRO 92 1.046 1.515 10.457
734 HB2 PRO 92 2HB PRO 92 -0.278 -0.401 9.086
735 HB3 PRO 92 1HB PRO 92 -1.062 0.619 10.300
736 HG2 PRO 92 2HG PRO 92 -1.077 0.872 7.316
737 HG3 PRO 92 1HG PRO 92 -2.421 1.046 8.461
738 HD2 PRO 92 2HD PRO 92 -1.110 3.169 7.392
739 HD3 PRO 92 1HD PRO 92 -1.836 3.200 9.011
740 H ALA 93 HN ALA 93 1.786 2.507 7.385
741 HA ALA 93 HA ALA 93 3.372 0.123 6.740
742 HB1 ALA 93 1HB ALA 93 1.900 0.987 4.959
743 HB2 ALA 93 2HB ALA 93 3.602 1.060 4.500
744 HB3 ALA 93 3HB ALA 93 2.762 2.524 5.009
745 H ARG 94 HN ARG 94 3.920 2.365 8.755
746 HA ARG 94 HA ARG 94 6.169 3.790 7.760
747 HB2 ARG 94 2HB ARG 94 6.540 4.313 10.209
748 HB3 ARG 94 1HB ARG 94 5.010 4.823 9.514
749 HG2 ARG 94 2HG ARG 94 3.887 2.925 10.525
750 HG3 ARG 94 1HG ARG 94 5.423 2.343 11.169
751 HD2 ARG 94 2HD ARG 94 4.174 5.002 11.843
752 HD3 ARG 94 1HD ARG 94 4.042 3.552 12.836
753 HE ARG 94 HE ARG 94 6.633 3.712 12.782
754 HH11 ARG 94 1HH1 ARG 94 4.387 6.395 12.954
755 HH12 ARG 94 2HH1 ARG 94 5.482 7.427 13.824
756 HH21 ARG 94 1HH2 ARG 94 8.065 5.050 13.930
757 HH22 ARG 94 2HH2 ARG 94 7.581 6.660 14.376
758 H TRP 95 HN TRP 95 8.036 2.966 7.306
759 HA TRP 95 HA TRP 95 9.320 1.139 9.191
760 HB2 TRP 95 2HB TRP 95 8.641 0.492 6.362
761 HB3 TRP 95 1HB TRP 95 10.191 -0.064 6.986
762 HD1 TRP 95 1HD TRP 95 9.899 -1.451 9.464
763 HE1 TRP 95 1HE TRP 95 8.207 -3.319 9.974
764 HE3 TRP 95 3HE TRP 95 6.465 -0.435 5.820
765 HZ2 TRP 95 2HZ TRP 95 5.719 -4.233 8.958
766 HZ3 TRP 95 3HZ TRP 95 4.463 -1.851 5.654
767 HH2 TRP 95 2HH TRP 95 4.098 -3.710 7.189
768 H ARG 96 HN ARG 96 10.947 2.461 9.777
769 HA ARG 96 HA ARG 96 12.326 4.140 7.915
770 HB2 ARG 96 2HB ARG 96 13.842 4.614 9.795
771 HB3 ARG 96 1HB ARG 96 12.158 4.810 10.246
772 HG2 ARG 96 2HG ARG 96 12.162 2.805 11.495
773 HG3 ARG 96 1HG ARG 96 13.714 2.305 10.819
774 HD2 ARG 96 2HD ARG 96 13.946 3.131 13.113
775 HD3 ARG 96 1HD ARG 96 14.833 4.126 11.961
776 HE ARG 96 HE ARG 96 12.401 5.361 12.233
777 HH11 ARG 96 1HH1 ARG 96 14.967 4.395 14.410
778 HH12 ARG 96 2HH1 ARG 96 14.688 5.706 15.523
779 HH21 ARG 96 1HH2 ARG 96 12.030 7.080 13.700
780 HH22 ARG 96 2HH2 ARG 96 13.017 7.223 15.120
781 H GLY 97 HN GLY 97 12.546 0.869 8.813
782 HA2 GLY 97 2HA GLY 97 14.825 0.476 7.074
783 HA3 GLY 97 1HA GLY 97 15.128 0.110 8.766
784 H TYR 98 HN TYR 98 12.731 -0.573 6.229
785 HA TYR 98 HA TYR 98 11.948 -3.030 7.412
786 HB2 TYR 98 2HB TYR 98 10.913 -3.432 5.077
787 HB3 TYR 98 1HB TYR 98 10.287 -2.120 6.059
788 HD1 TYR 98 2HD TYR 98 11.199 0.252 5.547
789 HD2 TYR 98 1HD TYR 98 11.588 -3.035 2.877
790 HE1 TYR 98 2HE TYR 98 11.548 1.814 3.685
791 HE2 TYR 98 1HE TYR 98 11.927 -1.476 1.005
792 HH TYR 98 HH TYR 98 11.506 0.803 0.402
793 H LEU 99 HN LEU 99 13.617 -2.540 4.273
794 HA LEU 99 HA LEU 99 15.282 -4.856 4.963
795 HB2 LEU 99 2HB LEU 99 14.154 -4.066 2.287
796 HB3 LEU 99 1HB LEU 99 15.459 -5.212 2.474
797 HG LEU 99 HG LEU 99 12.619 -5.531 3.437
798 HD11 LEU 99 1HD1 LEU 99 12.607 -7.417 1.876
799 HD12 LEU 99 2HD1 LEU 99 14.259 -7.029 1.396
800 HD13 LEU 99 3HD1 LEU 99 12.953 -5.897 1.051
801 HD21 LEU 99 3HD2 LEU 99 14.150 -6.463 5.091
802 HD22 LEU 99 1HD2 LEU 99 14.980 -7.371 3.828
803 HD23 LEU 99 2HD2 LEU 99 13.304 -7.747 4.227
804 H GLU 100 HN GLU 100 15.334 -2.465 2.336
805 HA GLU 100 HA GLU 100 18.038 -1.684 3.208
806 HB2 GLU 100 2HB GLU 100 17.761 -3.280 1.153
807 HB3 GLU 100 1HB GLU 100 17.236 -1.829 0.315
808 HG2 GLU 100 2HG GLU 100 19.885 -2.139 1.704
809 HG3 GLU 100 1HG GLU 100 19.619 -2.389 -0.018
810 H HIS 101 HN HIS 101 18.226 0.459 3.517
811 HA HIS 101 HA HIS 101 16.523 2.270 1.974
812 HB2 HIS 101 2HB HIS 101 15.381 1.787 4.148
813 HB3 HIS 101 1HB HIS 101 16.779 2.451 4.984
814 HD1 HIS 101 1HD HIS 101 16.796 4.923 5.372
815 HD2 HIS 101 2HD HIS 101 13.957 3.767 2.553
816 HE1 HIS 101 1HE HIS 101 15.438 6.984 4.886
817 HE2 HIS 101 2HE HIS 101 13.641 6.235 3.286
818 H HIS 102 HN HIS 102 18.960 2.144 1.162
819 HA HIS 102 HA HIS 102 20.471 4.269 2.492
820 HB2 HIS 102 2HB HIS 102 21.137 2.288 0.348
821 HB3 HIS 102 1HB HIS 102 22.047 3.792 0.429
822 HD1 HIS 102 1HD HIS 102 21.769 0.476 1.929
823 HD2 HIS 102 2HD HIS 102 23.469 4.130 2.930
824 HE1 HIS 102 1HE HIS 102 23.438 -0.027 3.747
825 HE2 HIS 102 2HE HIS 102 24.229 2.239 4.516
826 H HIS 103 HN HIS 103 20.099 3.684 -0.969
827 HA HIS 103 HA HIS 103 19.607 5.053 -2.714
828 HB2 HIS 103 2HB HIS 103 17.367 4.942 -1.530
829 HB3 HIS 103 1HB HIS 103 17.767 6.487 -0.790
830 HD1 HIS 103 1HD HIS 103 16.484 4.951 -3.879
831 HD2 HIS 103 2HD HIS 103 17.844 8.686 -2.650
832 HE1 HIS 103 1HE HIS 103 15.707 6.571 -5.643
833 HE2 HIS 103 2HE HIS 103 16.717 8.784 -4.986
834 H HIS 104 HN HIS 104 21.567 6.108 -3.031
835 HA HIS 104 HA HIS 104 22.613 8.064 -1.322
836 HB2 HIS 104 2HB HIS 104 24.260 8.511 -2.950
837 HB3 HIS 104 1HB HIS 104 23.858 6.815 -3.171
838 HD1 HIS 104 1HD HIS 104 22.527 6.195 -5.356
839 HD2 HIS 104 2HD HIS 104 23.786 10.157 -5.119
840 HE1 HIS 104 1HE HIS 104 22.306 7.125 -7.687
841 HE2 HIS 104 2HE HIS 104 23.005 9.542 -7.510
842 H HIS 105 HN HIS 105 22.169 10.132 -1.000
843 HA HIS 105 HA HIS 105 20.073 11.301 -2.709
844 HB2 HIS 105 2HB HIS 105 19.299 12.534 -0.773
845 HB3 HIS 105 1HB HIS 105 19.410 10.830 -0.355
846 HD1 HIS 105 1HD HIS 105 21.020 14.160 0.360
847 HD2 HIS 105 2HD HIS 105 21.246 10.206 1.638
848 HE1 HIS 105 1HE HIS 105 22.428 14.196 2.442
849 HE2 HIS 105 2HE HIS 105 22.725 11.773 3.063
850 H HIS 106 HN HIS 106 20.039 13.812 -2.370
851 HA HIS 106 HA HIS 106 22.798 14.831 -2.422
852 HB2 HIS 106 2HB HIS 106 21.714 14.726 -4.716
853 HB3 HIS 106 1HB HIS 106 20.549 15.910 -4.134
854 HD1 HIS 106 1HD HIS 106 24.322 15.588 -4.478
855 HD2 HIS 106 2HD HIS 106 21.331 18.476 -4.545
856 HE1 HIS 106 1HE HIS 106 25.471 17.745 -5.077
857 HE2 HIS 106 2HE HIS 106 23.680 19.506 -4.892
Start of MODEL 13
1 H1 MET 1 H1 MET 1 -16.165 3.311 4.960
2 H2 MET 1 H2 MET 1 -14.956 2.654 5.953
3 H3 MET 1 H3 MET 1 -15.936 1.634 5.019
4 HA MET 1 HA MET 1 -15.027 2.547 2.995
5 HB2 MET 1 2HB MET 1 -14.506 4.785 3.920
6 HB3 MET 1 1HB MET 1 -13.198 4.077 4.861
7 HG2 MET 1 2HG MET 1 -12.246 5.088 2.930
8 HG3 MET 1 1HG MET 1 -12.154 3.344 2.725
9 HE1 MET 1 2HE MET 1 -15.424 5.480 2.359
10 HE2 MET 1 3HE MET 1 -15.368 5.939 0.657
11 HE3 MET 1 1HE MET 1 -14.177 6.584 1.784
12 H THR 2 HN THR 2 -13.879 0.937 2.154
13 HA THR 2 HA THR 2 -12.173 -0.607 3.963
14 HB THR 2 HB THR 2 -12.164 -2.330 2.175
15 HG1 THR 2 1HG THR 2 -14.187 -0.815 0.869
16 HG21 THR 2 3HG2 THR 2 -14.520 -2.992 2.401
17 HG22 THR 2 1HG2 THR 2 -14.906 -1.380 3.002
18 HG23 THR 2 2HG2 THR 2 -13.846 -2.436 3.932
19 H PHE 3 HN PHE 3 -10.089 -1.423 3.071
20 HA PHE 3 HA PHE 3 -8.442 0.701 2.296
21 HB2 PHE 3 2HB PHE 3 -7.621 -1.307 3.469
22 HB3 PHE 3 1HB PHE 3 -7.915 -2.268 2.025
23 HD1 PHE 3 1HD PHE 3 -5.912 0.566 3.340
24 HD2 PHE 3 2HD PHE 3 -6.293 -2.443 0.351
25 HE1 PHE 3 1HE PHE 3 -3.649 1.087 2.532
26 HE2 PHE 3 2HE PHE 3 -4.028 -1.926 -0.461
27 HZ PHE 3 HZ PHE 3 -2.705 -0.159 0.629
28 H SER 4 HN SER 4 -9.952 -1.862 0.388
29 HA SER 4 HA SER 4 -8.729 -1.310 -2.075
30 HB2 SER 4 2HB SER 4 -11.526 -2.365 -1.584
31 HB3 SER 4 1HB SER 4 -10.597 -2.530 -3.074
32 HG SER 4 HG SER 4 -9.003 -3.650 -1.699
33 H GLU 5 HN GLU 5 -11.749 -0.075 -0.667
34 HA GLU 5 HA GLU 5 -12.477 1.518 -2.882
35 HB2 GLU 5 2HB GLU 5 -13.235 1.628 0.032
36 HB3 GLU 5 1HB GLU 5 -13.977 2.631 -1.201
37 HG2 GLU 5 2HG GLU 5 -14.801 0.680 -2.350
38 HG3 GLU 5 1HG GLU 5 -13.980 -0.371 -1.200
39 H CYS 6 HN CYS 6 -10.774 2.225 0.125
40 HA CYS 6 HA CYS 6 -10.531 5.006 -0.219
41 HB2 CYS 6 2HB CYS 6 -10.109 3.634 1.879
42 HB3 CYS 6 1HB CYS 6 -8.538 3.251 1.206
43 HG CYS 6 HG CYS 6 -8.152 6.221 0.919
44 H ALA 7 HN ALA 7 -8.355 2.348 -1.038
45 HA ALA 7 HA ALA 7 -6.280 3.849 -2.171
46 HB1 ALA 7 1HB ALA 7 -7.218 1.098 -2.973
47 HB2 ALA 7 2HB ALA 7 -6.089 1.458 -1.668
48 HB3 ALA 7 3HB ALA 7 -5.645 1.804 -3.339
49 H ALA 8 HN ALA 8 -9.254 2.584 -3.592
50 HA ALA 8 HA ALA 8 -8.759 3.389 -6.246
51 HB1 ALA 8 1HB ALA 8 -11.156 3.094 -6.595
52 HB2 ALA 8 2HB ALA 8 -11.414 3.040 -4.853
53 HB3 ALA 8 3HB ALA 8 -10.492 1.763 -5.648
54 H LEU 9 HN LEU 9 -10.089 5.068 -3.462
55 HA LEU 9 HA LEU 9 -11.001 7.363 -4.861
56 HB2 LEU 9 2HB LEU 9 -10.142 7.071 -1.981
57 HB3 LEU 9 1HB LEU 9 -10.952 8.473 -2.646
58 HG LEU 9 HG LEU 9 -12.113 5.697 -2.431
59 HD11 LEU 9 1HD1 LEU 9 -11.937 6.824 -0.287
60 HD12 LEU 9 2HD1 LEU 9 -13.623 6.728 -0.804
61 HD13 LEU 9 3HD1 LEU 9 -12.739 8.248 -0.954
62 HD21 LEU 9 3HD2 LEU 9 -14.197 6.732 -3.202
63 HD22 LEU 9 1HD2 LEU 9 -12.929 6.842 -4.423
64 HD23 LEU 9 2HD2 LEU 9 -13.345 8.256 -3.454
65 H TYR 10 HN TYR 10 -7.969 6.551 -3.235
66 HA TYR 10 HA TYR 10 -6.613 8.968 -3.570
67 HB2 TYR 10 2HB TYR 10 -5.718 7.155 -2.208
68 HB3 TYR 10 1HB TYR 10 -5.556 6.131 -3.627
69 HD1 TYR 10 2HD TYR 10 -4.280 9.264 -2.087
70 HD2 TYR 10 1HD TYR 10 -3.599 6.157 -4.912
71 HE1 TYR 10 2HE TYR 10 -1.988 10.087 -2.437
72 HE2 TYR 10 1HE TYR 10 -1.310 6.975 -5.271
73 HH TYR 10 HH TYR 10 -0.070 9.101 -5.034
74 H ILE 11 HN ILE 11 -6.754 6.142 -5.694
75 HA ILE 11 HA ILE 11 -5.216 7.101 -7.821
76 HB ILE 11 HB ILE 11 -7.555 5.184 -7.843
77 HG12 ILE 11 2HG1 ILE 11 -4.574 4.666 -7.869
78 HG13 ILE 11 1HG1 ILE 11 -5.586 4.573 -6.431
79 HG21 ILE 11 1HG2 ILE 11 -6.664 4.391 -9.991
80 HG22 ILE 11 2HG2 ILE 11 -5.481 5.701 -9.969
81 HG23 ILE 11 3HG2 ILE 11 -7.202 6.069 -10.076
82 HD11 ILE 11 3HD1 ILE 11 -5.136 2.373 -7.365
83 HD12 ILE 11 1HD1 ILE 11 -5.863 2.867 -8.893
84 HD13 ILE 11 2HD1 ILE 11 -6.854 2.757 -7.442
85 H LYS 12 HN LYS 12 -8.739 7.268 -7.330
86 HA LYS 12 HA LYS 12 -9.292 8.649 -9.733
87 HB2 LYS 12 2HB LYS 12 -10.841 8.350 -7.169
88 HB3 LYS 12 1HB LYS 12 -11.464 9.256 -8.540
89 HG2 LYS 12 2HG LYS 12 -11.313 7.241 -9.929
90 HG3 LYS 12 1HG LYS 12 -10.724 6.336 -8.531
91 HD2 LYS 12 2HD LYS 12 -12.793 6.722 -7.353
92 HD3 LYS 12 1HD LYS 12 -13.375 7.767 -8.650
93 HE2 LYS 12 2HE LYS 12 -14.405 5.582 -8.816
94 HE3 LYS 12 1HE LYS 12 -13.333 5.851 -10.186
95 HZ1 LYS 12 3HZ LYS 12 -13.249 3.604 -9.023
96 HZ2 LYS 12 1HZ LYS 12 -12.416 4.402 -7.785
97 HZ3 LYS 12 2HZ LYS 12 -11.767 4.365 -9.350
98 H ALA 13 HN ALA 13 -8.456 9.768 -6.503
99 HA ALA 13 HA ALA 13 -9.135 12.482 -6.889
100 HB1 ALA 13 1HB ALA 13 -7.057 11.296 -5.052
101 HB2 ALA 13 2HB ALA 13 -8.762 11.539 -4.673
102 HB3 ALA 13 3HB ALA 13 -7.714 12.929 -4.948
103 H HIS 14 HN HIS 14 -6.562 10.601 -8.129
104 HA HIS 14 HA HIS 14 -5.048 13.039 -8.794
105 HB2 HIS 14 2HB HIS 14 -4.150 10.194 -8.385
106 HB3 HIS 14 1HB HIS 14 -3.155 11.357 -9.251
107 HD1 HIS 14 1HD HIS 14 -1.420 12.298 -7.798
108 HD2 HIS 14 2HD HIS 14 -4.911 11.497 -5.691
109 HE1 HIS 14 1HE HIS 14 -0.936 12.941 -5.423
110 HE2 HIS 14 2HE HIS 14 -3.120 12.642 -4.208
111 H ARG 15 HN ARG 15 -7.233 10.996 -10.150
112 HA ARG 15 HA ARG 15 -6.018 9.942 -12.425
113 HB2 ARG 15 2HB ARG 15 -8.239 9.650 -13.353
114 HB3 ARG 15 1HB ARG 15 -8.226 9.229 -11.649
115 HG2 ARG 15 2HG ARG 15 -9.358 11.223 -11.056
116 HG3 ARG 15 1HG ARG 15 -9.149 11.896 -12.676
117 HD2 ARG 15 2HD ARG 15 -10.690 10.392 -13.614
118 HD3 ARG 15 1HD ARG 15 -10.653 9.343 -12.198
119 HE ARG 15 HE ARG 15 -12.139 10.739 -11.120
120 HH11 ARG 15 1HH1 ARG 15 -11.063 12.281 -14.094
121 HH12 ARG 15 2HH1 ARG 15 -12.352 13.449 -14.089
122 HH21 ARG 15 1HH2 ARG 15 -13.822 12.251 -11.141
123 HH22 ARG 15 2HH2 ARG 15 -13.945 13.410 -12.430
124 H SER 16 HN SER 16 -7.210 13.194 -11.894
125 HA SER 16 HA SER 16 -7.367 13.933 -14.620
126 HB2 SER 16 2HB SER 16 -6.941 15.714 -12.210
127 HB3 SER 16 1HB SER 16 -7.634 16.171 -13.761
128 HG SER 16 HG SER 16 -8.925 15.279 -11.654
129 H SER 17 HN SER 17 -4.860 14.333 -12.149
130 HA SER 17 HA SER 17 -2.947 15.445 -13.960
131 HB2 SER 17 2HB SER 17 -2.377 13.991 -11.367
132 HB3 SER 17 1HB SER 17 -1.422 15.254 -12.139
133 HG SER 17 HG SER 17 -3.234 16.676 -11.767
134 H TRP 18 HN TRP 18 -4.270 12.436 -13.418
135 HA TRP 18 HA TRP 18 -1.898 10.930 -14.183
136 HB2 TRP 18 2HB TRP 18 -4.322 10.358 -12.616
137 HB3 TRP 18 1HB TRP 18 -3.725 9.034 -13.604
138 HD1 TRP 18 1HD TRP 18 -1.063 11.288 -12.117
139 HE1 TRP 18 1HE TRP 18 0.130 10.014 -10.213
140 HE3 TRP 18 3HE TRP 18 -4.195 7.280 -11.765
141 HZ2 TRP 18 2HZ TRP 18 -0.236 7.622 -8.754
142 HZ3 TRP 18 3HZ TRP 18 -3.702 5.532 -10.102
143 HH2 TRP 18 2HH TRP 18 -1.771 5.711 -8.620
144 H LYS 19 HN LYS 19 -3.077 12.242 -16.437
145 HA LYS 19 HA LYS 19 -4.060 10.153 -18.059
146 HB2 LYS 19 2HB LYS 19 -2.051 12.330 -18.711
147 HB3 LYS 19 1HB LYS 19 -2.677 11.207 -19.909
148 HG2 LYS 19 2HG LYS 19 -4.260 13.240 -18.349
149 HG3 LYS 19 1HG LYS 19 -3.848 13.304 -20.063
150 HD2 LYS 19 2HD LYS 19 -5.125 11.176 -20.366
151 HD3 LYS 19 1HD LYS 19 -5.660 11.324 -18.692
152 HE2 LYS 19 2HE LYS 19 -6.196 13.239 -20.958
153 HE3 LYS 19 1HE LYS 19 -7.365 12.193 -20.158
154 HZ1 LYS 19 3HZ LYS 19 -7.601 14.407 -19.324
155 HZ2 LYS 19 1HZ LYS 19 -5.947 14.514 -18.970
156 HZ3 LYS 19 2HZ LYS 19 -6.934 13.453 -18.087
157 H ASN 20 HN ASN 20 -1.865 8.096 -16.648
158 HA ASN 20 HA ASN 20 -3.757 6.937 -17.103
159 HB2 ASN 20 2HB ASN 20 -5.153 8.896 -17.544
160 HB3 ASN 20 1HB ASN 20 -4.423 9.096 -19.130
161 HD21 ASN 20 1HD2 ASN 20 -6.601 7.174 -17.197
162 HD22 ASN 20 2HD2 ASN 20 -7.375 6.372 -18.522
163 H THR 21 HN THR 21 -2.210 5.614 -17.591
164 HA THR 21 HA THR 21 -2.091 4.595 -20.295
165 HB THR 21 HB THR 21 0.424 4.276 -20.035
166 HG1 THR 21 1HG THR 21 0.725 6.487 -18.451
167 HG21 THR 21 3HG2 THR 21 -0.457 5.934 -21.593
168 HG22 THR 21 1HG2 THR 21 1.015 6.526 -20.823
169 HG23 THR 21 2HG2 THR 21 -0.558 7.121 -20.293
170 H LYS 22 HN LYS 22 -0.117 2.616 -19.669
171 HA LYS 22 HA LYS 22 -1.530 0.732 -18.164
172 HB2 LYS 22 2HB LYS 22 1.313 0.952 -19.059
173 HB3 LYS 22 1HB LYS 22 0.871 -0.314 -17.921
174 HG2 LYS 22 2HG LYS 22 -0.459 0.111 -20.586
175 HG3 LYS 22 1HG LYS 22 0.855 -1.030 -20.292
176 HD2 LYS 22 2HD LYS 22 -1.798 -1.058 -18.856
177 HD3 LYS 22 1HD LYS 22 -1.393 -2.081 -20.235
178 HE2 LYS 22 2HE LYS 22 0.420 -3.101 -18.968
179 HE3 LYS 22 1HE LYS 22 0.078 -2.043 -17.599
180 HZ1 LYS 22 3HZ LYS 22 -0.856 -4.353 -17.462
181 HZ2 LYS 22 1HZ LYS 22 -1.918 -3.928 -18.711
182 HZ3 LYS 22 2HZ LYS 22 -1.982 -3.106 -17.227
183 H HIS 23 HN HIS 23 0.385 3.368 -17.082
184 HA HIS 23 HA HIS 23 1.312 2.397 -14.604
185 HB2 HIS 23 2HB HIS 23 0.551 5.204 -15.448
186 HB3 HIS 23 1HB HIS 23 1.308 4.826 -13.907
187 HD1 HIS 23 1HD HIS 23 3.730 5.201 -13.921
188 HD2 HIS 23 2HD HIS 23 2.318 4.119 -17.680
189 HE1 HIS 23 1HE HIS 23 5.726 5.285 -15.447
190 HE2 HIS 23 2HE HIS 23 4.805 4.828 -17.750
191 H ALA 24 HN ALA 24 -1.645 4.288 -15.304
192 HA ALA 24 HA ALA 24 -2.722 4.168 -12.706
193 HB1 ALA 24 1HB ALA 24 -4.859 4.744 -13.744
194 HB2 ALA 24 2HB ALA 24 -4.198 4.364 -15.335
195 HB3 ALA 24 3HB ALA 24 -3.547 5.717 -14.409
196 H ASP 25 HN ASP 25 -2.907 1.974 -15.438
197 HA ASP 25 HA ASP 25 -4.822 0.174 -14.424
198 HB2 ASP 25 2HB ASP 25 -4.078 0.125 -16.768
199 HB3 ASP 25 1HB ASP 25 -2.469 -0.361 -16.262
200 H GLN 26 HN GLN 26 -1.292 0.156 -14.300
201 HA GLN 26 HA GLN 26 -0.950 -2.193 -12.849
202 HB2 GLN 26 2HB GLN 26 0.751 0.270 -13.186
203 HB3 GLN 26 1HB GLN 26 1.306 -1.130 -12.298
204 HG2 GLN 26 2HG GLN 26 0.465 -1.132 -15.184
205 HG3 GLN 26 1HG GLN 26 2.125 -1.068 -14.606
206 HE21 GLN 26 1HE2 GLN 26 2.672 -2.955 -15.652
207 HE22 GLN 26 2HE2 GLN 26 2.131 -4.511 -15.113
208 H TRP 27 HN TRP 27 -1.284 1.160 -11.712
209 HA TRP 27 HA TRP 27 -0.748 0.700 -9.008
210 HB2 TRP 27 2HB TRP 27 -2.179 2.782 -10.548
211 HB3 TRP 27 1HB TRP 27 -2.578 2.676 -8.836
212 HD1 TRP 27 1HD TRP 27 0.377 3.435 -11.173
213 HE1 TRP 27 1HE TRP 27 2.172 4.700 -9.825
214 HE3 TRP 27 3HE TRP 27 -1.705 3.080 -6.521
215 HZ2 TRP 27 2HZ TRP 27 2.632 5.456 -7.146
216 HZ3 TRP 27 3HZ TRP 27 -0.528 4.105 -4.619
217 HH2 TRP 27 2HH TRP 27 1.597 5.267 -4.926
218 H THR 28 HN THR 28 -3.887 0.679 -10.689
219 HA THR 28 HA THR 28 -5.358 -0.127 -8.395
220 HB THR 28 HB THR 28 -6.160 -0.601 -11.274
221 HG1 THR 28 1HG THR 28 -5.662 1.744 -10.017
222 HG21 THR 28 3HG2 THR 28 -7.777 -0.069 -8.773
223 HG22 THR 28 1HG2 THR 28 -7.616 -1.623 -9.593
224 HG23 THR 28 2HG2 THR 28 -8.434 -0.283 -10.399
225 H ASN 29 HN ASN 29 -3.819 -1.811 -11.053
226 HA ASN 29 HA ASN 29 -5.048 -4.322 -10.739
227 HB2 ASN 29 2HB ASN 29 -3.878 -3.436 -12.766
228 HB3 ASN 29 1HB ASN 29 -2.349 -3.695 -11.944
229 HD21 ASN 29 1HD2 ASN 29 -1.735 -5.030 -13.642
230 HD22 ASN 29 2HD2 ASN 29 -2.321 -6.645 -13.783
231 H THR 30 HN THR 30 -1.878 -3.131 -9.618
232 HA THR 30 HA THR 30 -1.075 -5.614 -8.522
233 HB THR 30 HB THR 30 0.623 -4.205 -7.264
234 HG1 THR 30 1HG THR 30 -0.315 -2.092 -8.924
235 HG21 THR 30 3HG2 THR 30 1.136 -5.246 -9.408
236 HG22 THR 30 1HG2 THR 30 1.887 -3.654 -9.298
237 HG23 THR 30 2HG2 THR 30 0.424 -3.874 -10.259
238 H ILE 31 HN ILE 31 -2.370 -2.676 -6.985
239 HA ILE 31 HA ILE 31 -2.269 -3.651 -4.351
240 HB ILE 31 HB ILE 31 -4.094 -1.540 -5.516
241 HG12 ILE 31 2HG1 ILE 31 -1.445 -1.299 -4.070
242 HG13 ILE 31 1HG1 ILE 31 -1.685 -1.077 -5.799
243 HG21 ILE 31 1HG2 ILE 31 -3.387 -2.138 -2.645
244 HG22 ILE 31 2HG2 ILE 31 -4.968 -2.343 -3.402
245 HG23 ILE 31 3HG2 ILE 31 -4.288 -0.727 -3.197
246 HD11 ILE 31 3HD1 ILE 31 -3.119 0.854 -5.347
247 HD12 ILE 31 1HD1 ILE 31 -1.505 1.055 -4.661
248 HD13 ILE 31 2HD1 ILE 31 -2.860 0.630 -3.616
249 H LYS 32 HN LYS 32 -4.816 -3.750 -6.795
250 HA LYS 32 HA LYS 32 -6.865 -4.762 -5.153
251 HB2 LYS 32 2HB LYS 32 -6.972 -3.793 -7.553
252 HB3 LYS 32 1HB LYS 32 -6.569 -5.417 -8.078
253 HG2 LYS 32 2HG LYS 32 -8.927 -4.901 -6.300
254 HG3 LYS 32 1HG LYS 32 -9.031 -4.716 -8.050
255 HD2 LYS 32 2HD LYS 32 -8.171 -7.231 -6.620
256 HD3 LYS 32 1HD LYS 32 -9.786 -6.933 -7.263
257 HE2 LYS 32 2HE LYS 32 -7.240 -6.992 -8.881
258 HE3 LYS 32 1HE LYS 32 -8.410 -8.306 -8.770
259 HZ1 LYS 32 3HZ LYS 32 -8.830 -5.622 -9.966
260 HZ2 LYS 32 1HZ LYS 32 -10.087 -6.725 -9.683
261 HZ3 LYS 32 2HZ LYS 32 -8.840 -7.119 -10.759
262 H THR 33 HN THR 33 -4.219 -6.299 -6.851
263 HA THR 33 HA THR 33 -5.310 -8.951 -6.545
264 HB THR 33 HB THR 33 -2.548 -8.145 -7.467
265 HG1 THR 33 1HG THR 33 -4.059 -7.263 -8.876
266 HG21 THR 33 3HG2 THR 33 -2.529 -10.351 -8.540
267 HG22 THR 33 1HG2 THR 33 -4.108 -10.704 -7.836
268 HG23 THR 33 2HG2 THR 33 -2.705 -10.492 -6.790
269 H TYR 34 HN TYR 34 -2.486 -7.203 -5.223
270 HA TYR 34 HA TYR 34 -1.768 -9.464 -3.603
271 HB2 TYR 34 2HB TYR 34 -0.651 -6.661 -3.723
272 HB3 TYR 34 1HB TYR 34 0.008 -7.941 -2.713
273 HD1 TYR 34 1HD TYR 34 0.725 -10.122 -3.944
274 HD2 TYR 34 2HD TYR 34 0.144 -6.386 -5.897
275 HE1 TYR 34 1HE TYR 34 2.127 -10.887 -5.816
276 HE2 TYR 34 2HE TYR 34 1.539 -7.143 -7.773
277 HH TYR 34 HH TYR 34 2.439 -10.377 -8.221
278 H CYS 35 HN CYS 35 -3.055 -6.214 -2.898
279 HA CYS 35 HA CYS 35 -3.093 -6.845 -0.059
280 HB2 CYS 35 2HB CYS 35 -3.991 -4.319 -1.459
281 HB3 CYS 35 1HB CYS 35 -3.673 -4.517 0.262
282 HG CYS 35 HG CYS 35 -0.886 -5.276 -0.475
283 H GLY 36 HN GLY 36 -5.245 -6.786 -2.723
284 HA2 GLY 36 2HA GLY 36 -7.682 -6.089 -1.678
285 HA3 GLY 36 1HA GLY 36 -7.467 -7.268 -2.956
286 HA PRO 37 HA PRO 37 -8.931 -10.615 -0.633
287 HB2 PRO 37 2HB PRO 37 -6.345 -12.035 -0.432
288 HB3 PRO 37 1HB PRO 37 -7.860 -12.544 -1.184
289 HG2 PRO 37 2HG PRO 37 -5.759 -11.820 -2.662
290 HG3 PRO 37 1HG PRO 37 -7.416 -11.425 -3.154
291 HD2 PRO 37 2HD PRO 37 -5.340 -9.671 -1.899
292 HD3 PRO 37 1HD PRO 37 -6.509 -9.295 -3.183
293 H VAL 38 HN VAL 38 -6.060 -9.185 0.750
294 HA VAL 38 HA VAL 38 -6.506 -10.588 3.283
295 HB VAL 38 HB VAL 38 -4.206 -8.756 2.586
296 HG11 VAL 38 1HG1 VAL 38 -4.590 -9.033 4.984
297 HG12 VAL 38 2HG1 VAL 38 -3.104 -9.840 4.486
298 HG13 VAL 38 3HG1 VAL 38 -4.559 -10.787 4.793
299 HG21 VAL 38 3HG2 VAL 38 -4.249 -10.670 1.070
300 HG22 VAL 38 1HG2 VAL 38 -4.360 -11.768 2.444
301 HG23 VAL 38 2HG2 VAL 38 -2.907 -10.798 2.207
302 H ILE 39 HN ILE 39 -5.561 -7.223 2.474
303 HA ILE 39 HA ILE 39 -7.049 -6.375 4.866
304 HB ILE 39 HB ILE 39 -5.687 -4.307 4.764
305 HG12 ILE 39 2HG1 ILE 39 -4.181 -5.775 2.585
306 HG13 ILE 39 1HG1 ILE 39 -5.180 -4.345 2.352
307 HG21 ILE 39 1HG2 ILE 39 -3.587 -5.350 5.536
308 HG22 ILE 39 2HG2 ILE 39 -4.154 -6.900 4.918
309 HG23 ILE 39 3HG2 ILE 39 -5.021 -6.105 6.231
310 HD11 ILE 39 3HD1 ILE 39 -2.690 -4.462 4.036
311 HD12 ILE 39 1HD1 ILE 39 -3.672 -3.034 3.708
312 HD13 ILE 39 2HD1 ILE 39 -2.793 -3.819 2.394
313 H GLY 40 HN GLY 40 -7.513 -6.575 1.668
314 HA2 GLY 40 2HA GLY 40 -8.343 -4.101 0.748
315 HA3 GLY 40 1HA GLY 40 -9.011 -5.636 0.220
316 HA PRO 41 HA PRO 41 -12.841 -4.792 2.164
317 HB2 PRO 41 2HB PRO 41 -12.995 -7.235 3.743
318 HB3 PRO 41 1HB PRO 41 -13.866 -6.806 2.270
319 HG2 PRO 41 2HG PRO 41 -11.958 -8.731 2.336
320 HG3 PRO 41 1HG PRO 41 -12.273 -7.739 0.900
321 HD2 PRO 41 2HD PRO 41 -10.117 -7.456 2.963
322 HD3 PRO 41 1HD PRO 41 -10.010 -7.316 1.195
323 H LEU 42 HN LEU 42 -10.198 -4.798 4.099
324 HA LEU 42 HA LEU 42 -11.614 -4.480 6.620
325 HB2 LEU 42 2HB LEU 42 -8.677 -4.259 5.942
326 HB3 LEU 42 1HB LEU 42 -9.344 -4.095 7.555
327 HG LEU 42 HG LEU 42 -9.440 -6.595 5.857
328 HD11 LEU 42 1HD1 LEU 42 -7.836 -5.949 8.328
329 HD12 LEU 42 2HD1 LEU 42 -7.201 -6.098 6.689
330 HD13 LEU 42 3HD1 LEU 42 -7.886 -7.506 7.500
331 HD21 LEU 42 3HD2 LEU 42 -10.374 -6.091 8.680
332 HD22 LEU 42 1HD2 LEU 42 -10.292 -7.668 7.896
333 HD23 LEU 42 2HD2 LEU 42 -11.393 -6.435 7.282
334 H SER 43 HN SER 43 -11.823 -2.523 7.700
335 HA SER 43 HA SER 43 -12.034 -0.183 6.222
336 HB2 SER 43 2HB SER 43 -11.687 -0.458 9.213
337 HB3 SER 43 1HB SER 43 -12.512 0.814 8.338
338 HG SER 43 HG SER 43 -14.011 -0.796 7.599
339 H VAL 44 HN VAL 44 -10.672 1.495 5.886
340 HA VAL 44 HA VAL 44 -7.920 0.989 5.833
341 HB VAL 44 HB VAL 44 -9.035 2.532 4.291
342 HG11 VAL 44 1HG1 VAL 44 -10.597 3.572 5.827
343 HG12 VAL 44 2HG1 VAL 44 -9.634 4.787 4.985
344 HG13 VAL 44 3HG1 VAL 44 -9.264 4.374 6.660
345 HG21 VAL 44 3HG2 VAL 44 -6.864 3.866 5.908
346 HG22 VAL 44 1HG2 VAL 44 -7.341 4.298 4.265
347 HG23 VAL 44 2HG2 VAL 44 -6.619 2.720 4.588
348 H GLN 45 HN GLN 45 -9.902 2.376 8.321
349 HA GLN 45 HA GLN 45 -7.801 3.653 9.774
350 HB2 GLN 45 2HB GLN 45 -10.170 4.292 10.032
351 HB3 GLN 45 1HB GLN 45 -10.508 2.718 10.737
352 HG2 GLN 45 2HG GLN 45 -9.053 3.207 12.604
353 HG3 GLN 45 1HG GLN 45 -8.615 4.755 11.885
354 HE21 GLN 45 1HE2 GLN 45 -9.332 5.911 13.621
355 HE22 GLN 45 2HE2 GLN 45 -11.014 6.124 13.956
356 H ASP 46 HN ASP 46 -8.951 0.403 9.522
357 HA ASP 46 HA ASP 46 -7.866 -0.371 12.113
358 HB2 ASP 46 2HB ASP 46 -10.064 -1.221 10.865
359 HB3 ASP 46 1HB ASP 46 -8.927 -2.387 10.196
360 H VAL 47 HN VAL 47 -6.865 -0.167 8.894
361 HA VAL 47 HA VAL 47 -5.141 -2.351 8.629
362 HB VAL 47 HB VAL 47 -4.776 0.427 7.478
363 HG11 VAL 47 1HG1 VAL 47 -2.721 -0.880 7.368
364 HG12 VAL 47 2HG1 VAL 47 -3.424 -0.690 5.763
365 HG13 VAL 47 3HG1 VAL 47 -3.595 -2.218 6.625
366 HG21 VAL 47 3HG2 VAL 47 -6.146 -2.014 6.349
367 HG22 VAL 47 1HG2 VAL 47 -5.851 -0.511 5.473
368 HG23 VAL 47 2HG2 VAL 47 -6.927 -0.521 6.869
369 H ASP 48 HN ASP 48 -3.528 -2.912 9.874
370 HA ASP 48 HA ASP 48 -1.917 -0.827 11.190
371 HB2 ASP 48 2HB ASP 48 -3.232 -1.930 12.869
372 HB3 ASP 48 1HB ASP 48 -2.816 -3.514 12.239
373 H THR 49 HN THR 49 0.235 -1.681 11.888
374 HA THR 49 HA THR 49 1.800 -2.382 9.705
375 HB THR 49 HB THR 49 2.471 -2.792 12.627
376 HG1 THR 49 1HG THR 49 2.996 -0.506 11.013
377 HG21 THR 49 3HG2 THR 49 4.062 -3.836 11.064
378 HG22 THR 49 1HG2 THR 49 4.781 -2.468 11.915
379 HG23 THR 49 2HG2 THR 49 4.252 -2.287 10.242
380 H LYS 50 HN LYS 50 0.536 -4.424 12.336
381 HA LYS 50 HA LYS 50 1.907 -6.770 11.571
382 HB2 LYS 50 2HB LYS 50 0.616 -6.157 13.768
383 HB3 LYS 50 1HB LYS 50 -0.765 -6.845 12.929
384 HG2 LYS 50 2HG LYS 50 1.814 -8.343 13.292
385 HG3 LYS 50 1HG LYS 50 0.509 -8.377 14.476
386 HD2 LYS 50 2HD LYS 50 -0.981 -9.396 12.933
387 HD3 LYS 50 1HD LYS 50 0.118 -9.104 11.583
388 HE2 LYS 50 2HE LYS 50 0.183 -11.439 12.263
389 HE3 LYS 50 1HE LYS 50 1.730 -10.653 12.564
390 HZ1 LYS 50 3HZ LYS 50 -0.360 -11.113 14.622
391 HZ2 LYS 50 1HZ LYS 50 1.189 -10.474 14.888
392 HZ3 LYS 50 2HZ LYS 50 1.008 -12.091 14.399
393 H LEU 51 HN LEU 51 -1.227 -5.432 10.678
394 HA LEU 51 HA LEU 51 -2.153 -7.641 9.195
395 HB2 LEU 51 2HB LEU 51 -2.784 -4.702 8.951
396 HB3 LEU 51 1HB LEU 51 -3.655 -5.971 8.119
397 HG LEU 51 HG LEU 51 -3.518 -5.556 11.099
398 HD11 LEU 51 1HD1 LEU 51 -4.968 -3.963 10.003
399 HD12 LEU 51 2HD1 LEU 51 -5.934 -5.149 10.877
400 HD13 LEU 51 3HD1 LEU 51 -5.775 -5.260 9.124
401 HD21 LEU 51 3HD2 LEU 51 -5.082 -7.417 11.266
402 HD22 LEU 51 1HD2 LEU 51 -3.559 -7.936 10.543
403 HD23 LEU 51 2HD2 LEU 51 -4.976 -7.675 9.526
404 H ILE 52 HN ILE 52 -0.202 -4.828 8.344
405 HA ILE 52 HA ILE 52 -0.050 -5.334 5.565
406 HB ILE 52 HB ILE 52 1.938 -3.908 7.344
407 HG12 ILE 52 2HG1 ILE 52 -0.323 -2.824 5.648
408 HG13 ILE 52 1HG1 ILE 52 -0.340 -2.949 7.402
409 HG21 ILE 52 1HG2 ILE 52 1.604 -3.834 4.344
410 HG22 ILE 52 2HG2 ILE 52 2.942 -4.567 5.228
411 HG23 ILE 52 3HG2 ILE 52 2.704 -2.822 5.281
412 HD11 ILE 52 3HD1 ILE 52 0.133 -0.688 6.747
413 HD12 ILE 52 1HD1 ILE 52 1.484 -1.226 5.749
414 HD13 ILE 52 2HD1 ILE 52 1.564 -1.393 7.502
415 H MET 53 HN MET 53 1.913 -6.365 8.313
416 HA MET 53 HA MET 53 3.945 -7.701 6.926
417 HB2 MET 53 2HB MET 53 2.714 -8.301 9.619
418 HB3 MET 53 1HB MET 53 4.152 -9.103 9.003
419 HG2 MET 53 2HG MET 53 5.318 -6.964 8.915
420 HG3 MET 53 1HG MET 53 3.872 -6.151 9.522
421 HE1 MET 53 3HE MET 53 6.811 -5.944 10.850
422 HE2 MET 53 1HE MET 53 6.380 -6.018 12.558
423 HE3 MET 53 2HE MET 53 5.400 -5.070 11.440
424 H LYS 54 HN LYS 54 0.711 -8.739 7.842
425 HA LYS 54 HA LYS 54 0.957 -11.455 7.172
426 HB2 LYS 54 2HB LYS 54 -1.485 -9.674 7.089
427 HB3 LYS 54 1HB LYS 54 -1.515 -11.430 6.996
428 HG2 LYS 54 2HG LYS 54 -0.600 -11.599 9.227
429 HG3 LYS 54 1HG LYS 54 -0.447 -9.843 9.324
430 HD2 LYS 54 2HD LYS 54 -2.421 -10.533 10.524
431 HD3 LYS 54 1HD LYS 54 -2.906 -9.665 9.068
432 HE2 LYS 54 2HE LYS 54 -3.298 -11.815 7.940
433 HE3 LYS 54 1HE LYS 54 -2.840 -12.660 9.416
434 HZ1 LYS 54 3HZ LYS 54 -4.700 -11.505 10.541
435 HZ2 LYS 54 1HZ LYS 54 -5.205 -12.544 9.297
436 HZ3 LYS 54 2HZ LYS 54 -5.179 -10.871 9.042
437 H VAL 55 HN VAL 55 0.198 -8.621 5.228
438 HA VAL 55 HA VAL 55 -0.522 -10.067 2.876
439 HB VAL 55 HB VAL 55 0.445 -7.210 3.068
440 HG11 VAL 55 1HG1 VAL 55 -1.226 -8.596 0.976
441 HG12 VAL 55 2HG1 VAL 55 0.458 -8.110 0.800
442 HG13 VAL 55 3HG1 VAL 55 -0.796 -6.886 0.988
443 HG21 VAL 55 3HG2 VAL 55 -1.914 -6.575 3.184
444 HG22 VAL 55 1HG2 VAL 55 -1.449 -7.572 4.562
445 HG23 VAL 55 2HG2 VAL 55 -2.370 -8.277 3.233
446 H LEU 56 HN LEU 56 2.433 -8.518 4.036
447 HA LEU 56 HA LEU 56 3.862 -8.965 1.587
448 HB2 LEU 56 2HB LEU 56 4.868 -8.151 4.311
449 HB3 LEU 56 1HB LEU 56 5.797 -8.096 2.825
450 HG LEU 56 HG LEU 56 3.321 -6.466 3.392
451 HD11 LEU 56 1HD1 LEU 56 6.227 -5.667 3.313
452 HD12 LEU 56 2HD1 LEU 56 5.219 -5.775 4.755
453 HD13 LEU 56 3HD1 LEU 56 4.858 -4.574 3.517
454 HD21 LEU 56 3HD2 LEU 56 5.248 -6.383 1.071
455 HD22 LEU 56 1HD2 LEU 56 3.900 -5.276 1.340
456 HD23 LEU 56 2HD2 LEU 56 3.590 -6.983 1.020
457 H ASP 57 HN ASP 57 3.343 -10.724 4.487
458 HA ASP 57 HA ASP 57 5.577 -12.178 4.969
459 HB2 ASP 57 2HB ASP 57 3.355 -12.298 6.171
460 HB3 ASP 57 1HB ASP 57 2.835 -13.423 4.946
461 HA PRO 58 HA PRO 58 4.591 -15.591 1.746
462 HB2 PRO 58 2HB PRO 58 2.694 -15.154 -0.131
463 HB3 PRO 58 1HB PRO 58 2.325 -15.860 1.446
464 HG2 PRO 58 2HG PRO 58 1.990 -13.036 0.505
465 HG3 PRO 58 1HG PRO 58 0.881 -14.036 1.464
466 HD2 PRO 58 2HD PRO 58 2.505 -12.163 2.577
467 HD3 PRO 58 1HD PRO 58 2.023 -13.641 3.426
468 H ILE 59 HN ILE 59 4.475 -12.234 0.839
469 HA ILE 59 HA ILE 59 5.348 -12.604 -1.859
470 HB ILE 59 HB ILE 59 5.450 -10.061 -0.240
471 HG12 ILE 59 2HG1 ILE 59 3.200 -11.067 -0.139
472 HG13 ILE 59 1HG1 ILE 59 3.203 -9.583 -1.079
473 HG21 ILE 59 1HG2 ILE 59 5.201 -8.979 -2.437
474 HG22 ILE 59 2HG2 ILE 59 5.261 -10.562 -3.210
475 HG23 ILE 59 3HG2 ILE 59 6.669 -9.955 -2.339
476 HD11 ILE 59 3HD1 ILE 59 1.821 -11.279 -2.124
477 HD12 ILE 59 1HD1 ILE 59 3.194 -12.384 -2.182
478 HD13 ILE 59 2HD1 ILE 59 3.214 -10.905 -3.140
479 H TRP 60 HN TRP 60 6.923 -12.054 1.230
480 HA TRP 60 HA TRP 60 9.425 -11.195 0.284
481 HB2 TRP 60 2HB TRP 60 8.678 -12.698 2.795
482 HB3 TRP 60 1HB TRP 60 10.306 -12.115 2.470
483 HD1 TRP 60 1HD TRP 60 7.345 -11.121 4.289
484 HE1 TRP 60 1HE TRP 60 7.305 -8.588 4.748
485 HE3 TRP 60 3HE TRP 60 10.975 -9.640 1.002
486 HZ2 TRP 60 2HZ TRP 60 8.631 -6.270 3.834
487 HZ3 TRP 60 3HZ TRP 60 11.528 -7.244 0.860
488 HH2 TRP 60 2HH TRP 60 10.380 -5.598 2.246
489 H GLU 61 HN GLU 61 8.008 -14.379 0.457
490 HA GLU 61 HA GLU 61 10.477 -15.740 -0.039
491 HB2 GLU 61 2HB GLU 61 7.596 -16.641 -0.068
492 HB3 GLU 61 1HB GLU 61 8.970 -17.703 -0.265
493 HG2 GLU 61 2HG GLU 61 8.362 -16.035 2.155
494 HG3 GLU 61 1HG GLU 61 8.133 -17.776 2.008
495 H GLN 62 HN GLN 62 7.721 -14.586 -1.894
496 HA GLN 62 HA GLN 62 8.497 -15.978 -4.293
497 HB2 GLN 62 2HB GLN 62 6.397 -13.862 -3.791
498 HB3 GLN 62 1HB GLN 62 6.623 -14.695 -5.320
499 HG2 GLN 62 2HG GLN 62 6.080 -16.812 -4.288
500 HG3 GLN 62 1HG GLN 62 5.940 -16.029 -2.714
501 HE21 GLN 62 1HE2 GLN 62 4.459 -16.512 -5.822
502 HE22 GLN 62 2HE2 GLN 62 2.909 -15.872 -5.402
503 H LYS 63 HN LYS 63 8.187 -12.532 -3.434
504 HA LYS 63 HA LYS 63 10.435 -11.876 -5.167
505 HB2 LYS 63 2HB LYS 63 7.677 -10.675 -5.501
506 HB3 LYS 63 1HB LYS 63 9.134 -10.030 -6.240
507 HG2 LYS 63 2HG LYS 63 9.413 -12.014 -7.558
508 HG3 LYS 63 1HG LYS 63 8.079 -12.809 -6.721
509 HD2 LYS 63 2HD LYS 63 7.321 -12.028 -8.874
510 HD3 LYS 63 1HD LYS 63 6.548 -11.078 -7.607
511 HE2 LYS 63 2HE LYS 63 7.275 -9.673 -9.468
512 HE3 LYS 63 1HE LYS 63 8.131 -9.267 -7.983
513 HZ1 LYS 63 3HZ LYS 63 10.036 -10.496 -8.751
514 HZ2 LYS 63 1HZ LYS 63 9.597 -9.358 -9.928
515 HZ3 LYS 63 2HZ LYS 63 9.210 -10.996 -10.145
516 HA PRO 64 HA PRO 64 10.571 -9.903 -1.013
517 HB2 PRO 64 2HB PRO 64 13.399 -9.593 -1.854
518 HB3 PRO 64 1HB PRO 64 12.735 -10.239 -0.351
519 HG2 PRO 64 2HG PRO 64 13.793 -11.845 -2.208
520 HG3 PRO 64 1HG PRO 64 12.391 -12.338 -1.244
521 HD2 PRO 64 2HD PRO 64 12.518 -11.424 -4.080
522 HD3 PRO 64 1HD PRO 64 11.463 -12.635 -3.327
523 H GLU 65 HN GLU 65 12.429 -8.656 -3.801
524 HA GLU 65 HA GLU 65 12.619 -6.029 -2.904
525 HB2 GLU 65 2HB GLU 65 12.600 -7.107 -5.715
526 HB3 GLU 65 1HB GLU 65 13.167 -5.526 -5.237
527 HG2 GLU 65 2HG GLU 65 14.355 -8.158 -4.425
528 HG3 GLU 65 1HG GLU 65 15.030 -7.016 -5.586
529 H THR 66 HN THR 66 10.190 -7.688 -4.821
530 HA THR 66 HA THR 66 8.741 -5.363 -5.567
531 HB THR 66 HB THR 66 7.710 -8.200 -5.356
532 HG1 THR 66 1HG THR 66 9.655 -7.839 -6.699
533 HG21 THR 66 3HG2 THR 66 5.937 -6.531 -5.641
534 HG22 THR 66 1HG2 THR 66 6.140 -7.490 -7.107
535 HG23 THR 66 2HG2 THR 66 6.791 -5.855 -7.028
536 H ALA 67 HN ALA 67 8.628 -7.514 -2.797
537 HA ALA 67 HA ALA 67 6.194 -6.652 -1.688
538 HB1 ALA 67 1HB ALA 67 8.655 -7.644 -0.252
539 HB2 ALA 67 2HB ALA 67 7.377 -8.652 -0.932
540 HB3 ALA 67 3HB ALA 67 7.023 -7.567 0.412
541 H SER 68 HN SER 68 9.500 -5.432 -1.287
542 HA SER 68 HA SER 68 8.796 -3.421 0.612
543 HB2 SER 68 2HB SER 68 11.108 -4.331 0.338
544 HB3 SER 68 1HB SER 68 11.209 -3.523 -1.225
545 HG SER 68 HG SER 68 11.935 -1.907 -0.087
546 H ARG 69 HN ARG 69 9.093 -3.488 -2.910
547 HA ARG 69 HA ARG 69 8.734 -0.701 -3.281
548 HB2 ARG 69 2HB ARG 69 8.331 -3.041 -5.147
549 HB3 ARG 69 1HB ARG 69 8.313 -1.362 -5.643
550 HG2 ARG 69 2HG ARG 69 10.625 -1.112 -4.862
551 HG3 ARG 69 1HG ARG 69 10.631 -2.818 -4.415
552 HD2 ARG 69 2HD ARG 69 10.085 -3.340 -6.809
553 HD3 ARG 69 1HD ARG 69 10.374 -1.638 -7.172
554 HE ARG 69 HE ARG 69 12.498 -3.188 -5.864
555 HH11 ARG 69 1HH1 ARG 69 11.322 -1.400 -8.634
556 HH12 ARG 69 2HH1 ARG 69 12.822 -1.503 -9.509
557 HH21 ARG 69 1HH2 ARG 69 14.480 -3.334 -6.999
558 HH22 ARG 69 2HH2 ARG 69 14.624 -2.584 -8.564
559 H LEU 70 HN LEU 70 6.551 -3.433 -3.030
560 HA LEU 70 HA LEU 70 4.176 -2.147 -3.837
561 HB2 LEU 70 2HB LEU 70 4.387 -4.582 -3.584
562 HB3 LEU 70 1HB LEU 70 4.566 -4.389 -1.852
563 HG LEU 70 HG LEU 70 2.256 -3.452 -1.767
564 HD11 LEU 70 1HD1 LEU 70 2.154 -4.328 -4.647
565 HD12 LEU 70 2HD1 LEU 70 2.107 -2.662 -4.070
566 HD13 LEU 70 3HD1 LEU 70 0.786 -3.768 -3.687
567 HD21 LEU 70 3HD2 LEU 70 2.663 -5.786 -1.236
568 HD22 LEU 70 1HD2 LEU 70 2.546 -6.214 -2.942
569 HD23 LEU 70 2HD2 LEU 70 1.128 -5.609 -2.088
570 H ARG 71 HN ARG 71 5.927 -2.244 -0.816
571 HA ARG 71 HA ARG 71 4.038 -1.255 0.957
572 HB2 ARG 71 2HB ARG 71 7.024 -0.836 0.863
573 HB3 ARG 71 1HB ARG 71 6.021 -0.378 2.219
574 HG2 ARG 71 2HG ARG 71 5.321 -2.766 2.411
575 HG3 ARG 71 1HG ARG 71 6.542 -3.144 1.191
576 HD2 ARG 71 2HD ARG 71 7.032 -1.844 3.869
577 HD3 ARG 71 1HD ARG 71 7.412 -3.511 3.437
578 HE ARG 71 HE ARG 71 9.008 -2.560 1.797
579 HH11 ARG 71 1HH1 ARG 71 7.975 -0.569 4.481
580 HH12 ARG 71 2HH1 ARG 71 9.412 0.399 4.476
581 HH21 ARG 71 1HH2 ARG 71 10.913 -1.312 1.804
582 HH22 ARG 71 2HH2 ARG 71 11.100 -0.044 2.983
583 H GLY 72 HN GLY 72 6.059 0.444 -1.373
584 HA2 GLY 72 2HA GLY 72 5.709 3.062 -0.422
585 HA3 GLY 72 1HA GLY 72 6.076 2.625 -2.085
586 H ARG 73 HN ARG 73 3.680 1.092 -2.527
587 HA ARG 73 HA ARG 73 1.933 3.193 -3.314
588 HB2 ARG 73 2HB ARG 73 1.281 0.244 -3.151
589 HB3 ARG 73 1HB ARG 73 0.455 1.454 -4.122
590 HG2 ARG 73 2HG ARG 73 2.588 1.781 -5.378
591 HG3 ARG 73 1HG ARG 73 3.243 0.402 -4.493
592 HD2 ARG 73 2HD ARG 73 1.358 -0.972 -5.377
593 HD3 ARG 73 1HD ARG 73 0.876 0.408 -6.362
594 HE ARG 73 HE ARG 73 3.138 -1.340 -6.788
595 HH11 ARG 73 1HH1 ARG 73 1.598 1.688 -7.591
596 HH12 ARG 73 2HH1 ARG 73 2.503 1.916 -9.057
597 HH21 ARG 73 1HH2 ARG 73 4.313 -1.058 -8.752
598 HH22 ARG 73 2HH2 ARG 73 4.022 0.352 -9.718
599 H ILE 74 HN ILE 74 1.773 0.697 -0.822
600 HA ILE 74 HA ILE 74 -0.743 1.372 0.230
601 HB ILE 74 HB ILE 74 1.602 0.145 1.699
602 HG12 ILE 74 2HG1 ILE 74 -0.641 -1.215 0.183
603 HG13 ILE 74 1HG1 ILE 74 1.017 -1.062 -0.389
604 HG21 ILE 74 1HG2 ILE 74 -0.147 0.909 3.203
605 HG22 ILE 74 2HG2 ILE 74 -0.113 -0.854 3.142
606 HG23 ILE 74 3HG2 ILE 74 -1.360 0.034 2.267
607 HD11 ILE 74 3HD1 ILE 74 0.116 -2.569 2.053
608 HD12 ILE 74 1HD1 ILE 74 1.786 -2.398 1.512
609 HD13 ILE 74 2HD1 ILE 74 0.622 -3.267 0.513
610 H GLU 75 HN GLU 75 2.531 2.414 1.096
611 HA GLU 75 HA GLU 75 1.866 3.933 3.360
612 HB2 GLU 75 2HB GLU 75 4.159 3.156 2.543
613 HB3 GLU 75 1HB GLU 75 4.136 4.538 1.460
614 HG2 GLU 75 2HG GLU 75 3.685 4.976 4.369
615 HG3 GLU 75 1HG GLU 75 5.316 4.650 3.793
616 H SER 76 HN SER 76 2.145 4.849 -0.063
617 HA SER 76 HA SER 76 1.696 7.593 0.241
618 HB2 SER 76 2HB SER 76 1.020 5.808 -2.092
619 HB3 SER 76 1HB SER 76 1.077 7.567 -2.148
620 HG SER 76 HG SER 76 3.222 5.758 -1.692
621 H VAL 77 HN VAL 77 -0.586 4.928 -0.239
622 HA VAL 77 HA VAL 77 -2.885 6.595 -0.484
623 HB VAL 77 HB VAL 77 -2.714 3.659 0.250
624 HG11 VAL 77 1HG1 VAL 77 -4.840 4.636 0.937
625 HG12 VAL 77 2HG1 VAL 77 -5.054 3.539 -0.426
626 HG13 VAL 77 3HG1 VAL 77 -5.077 5.283 -0.687
627 HG21 VAL 77 3HG2 VAL 77 -3.272 3.272 -2.100
628 HG22 VAL 77 1HG2 VAL 77 -1.751 4.146 -1.930
629 HG23 VAL 77 2HG2 VAL 77 -3.215 5.009 -2.401
630 H LEU 78 HN LEU 78 -1.437 4.822 2.231
631 HA LEU 78 HA LEU 78 -3.514 5.317 4.073
632 HB2 LEU 78 2HB LEU 78 -0.589 4.746 4.533
633 HB3 LEU 78 1HB LEU 78 -1.791 4.801 5.808
634 HG LEU 78 HG LEU 78 -1.802 2.865 3.492
635 HD11 LEU 78 1HD1 LEU 78 -1.137 2.438 6.398
636 HD12 LEU 78 2HD1 LEU 78 0.014 2.430 5.060
637 HD13 LEU 78 3HD1 LEU 78 -1.233 1.186 5.161
638 HD21 LEU 78 3HD2 LEU 78 -4.051 3.356 4.246
639 HD22 LEU 78 1HD2 LEU 78 -3.577 3.081 5.921
640 HD23 LEU 78 2HD2 LEU 78 -3.581 1.740 4.774
641 H ASP 79 HN ASP 79 -0.645 7.180 3.208
642 HA ASP 79 HA ASP 79 -0.820 9.064 5.317
643 HB2 ASP 79 2HB ASP 79 1.179 8.748 3.854
644 HB3 ASP 79 1HB ASP 79 0.291 9.500 2.532
645 H TRP 80 HN TRP 80 -2.056 9.058 2.010
646 HA TRP 80 HA TRP 80 -3.377 11.529 2.039
647 HB2 TRP 80 2HB TRP 80 -2.944 10.252 -0.004
648 HB3 TRP 80 1HB TRP 80 -4.023 8.977 0.544
649 HD1 TRP 80 1HD TRP 80 -4.098 12.567 -0.830
650 HE1 TRP 80 1HE TRP 80 -6.445 13.020 -1.794
651 HE3 TRP 80 3HE TRP 80 -6.438 8.273 0.684
652 HZ2 TRP 80 2HZ TRP 80 -8.951 11.721 -1.887
653 HZ3 TRP 80 3HZ TRP 80 -8.808 7.962 0.114
654 HH2 TRP 80 2HH TRP 80 -10.036 9.652 -1.145
655 H ALA 81 HN ALA 81 -4.479 8.274 2.900
656 HA ALA 81 HA ALA 81 -7.158 8.909 3.452
657 HB1 ALA 81 1HB ALA 81 -6.345 6.618 3.145
658 HB2 ALA 81 2HB ALA 81 -7.235 6.802 4.657
659 HB3 ALA 81 3HB ALA 81 -5.472 6.730 4.675
660 H THR 82 HN THR 82 -4.274 9.035 5.465
661 HA THR 82 HA THR 82 -5.575 9.475 7.923
662 HB THR 82 HB THR 82 -2.802 10.331 7.069
663 HG1 THR 82 1HG THR 82 -2.567 8.215 7.074
664 HG21 THR 82 3HG2 THR 82 -3.519 11.511 9.088
665 HG22 THR 82 1HG2 THR 82 -2.291 10.306 9.476
666 HG23 THR 82 2HG2 THR 82 -3.988 9.981 9.831
667 H VAL 83 HN VAL 83 -4.354 11.726 5.472
668 HA VAL 83 HA VAL 83 -4.953 14.076 6.969
669 HB VAL 83 HB VAL 83 -4.607 13.787 3.975
670 HG11 VAL 83 1HG1 VAL 83 -4.412 16.216 5.753
671 HG12 VAL 83 2HG1 VAL 83 -5.682 15.882 4.577
672 HG13 VAL 83 3HG1 VAL 83 -4.030 16.171 4.033
673 HG21 VAL 83 3HG2 VAL 83 -2.287 14.473 4.388
674 HG22 VAL 83 1HG2 VAL 83 -2.673 12.943 5.175
675 HG23 VAL 83 2HG2 VAL 83 -2.590 14.428 6.125
676 H ARG 84 HN ARG 84 -6.727 12.113 4.648
677 HA ARG 84 HA ARG 84 -8.909 13.978 4.469
678 HB2 ARG 84 2HB ARG 84 -8.318 11.285 3.329
679 HB3 ARG 84 1HB ARG 84 -9.988 11.834 3.360
680 HG2 ARG 84 2HG ARG 84 -8.885 12.322 1.229
681 HG3 ARG 84 1HG ARG 84 -9.413 13.782 2.058
682 HD2 ARG 84 2HD ARG 84 -7.118 14.119 2.877
683 HD3 ARG 84 1HD ARG 84 -6.608 12.689 1.984
684 HE ARG 84 HE ARG 84 -7.092 13.865 -0.060
685 HH11 ARG 84 1HH1 ARG 84 -7.094 15.829 2.832
686 HH12 ARG 84 2HH1 ARG 84 -6.765 17.315 1.994
687 HH21 ARG 84 1HH2 ARG 84 -6.640 15.811 -1.187
688 HH22 ARG 84 2HH2 ARG 84 -6.483 17.300 -0.294
689 H GLY 85 HN GLY 85 -7.970 11.818 6.824
690 HA2 GLY 85 2HA GLY 85 -9.032 11.732 8.905
691 HA3 GLY 85 1HA GLY 85 -10.513 12.290 8.151
692 H TYR 86 HN TYR 86 -9.331 9.772 6.322
693 HA TYR 86 HA TYR 86 -11.427 8.024 7.168
694 HB2 TYR 86 2HB TYR 86 -9.085 7.501 5.317
695 HB3 TYR 86 1HB TYR 86 -10.464 6.428 5.529
696 HD1 TYR 86 2HD TYR 86 -12.794 7.987 5.381
697 HD2 TYR 86 1HD TYR 86 -9.143 8.591 3.291
698 HE1 TYR 86 2HE TYR 86 -14.009 9.207 3.627
699 HE2 TYR 86 1HE TYR 86 -10.347 9.815 1.532
700 HH TYR 86 HH TYR 86 -13.452 10.988 1.913
701 H ARG 87 HN ARG 87 -8.142 8.472 7.989
702 HA ARG 87 HA ARG 87 -8.474 6.763 10.290
703 HB2 ARG 87 2HB ARG 87 -6.308 5.594 9.961
704 HB3 ARG 87 1HB ARG 87 -7.497 5.149 8.745
705 HG2 ARG 87 2HG ARG 87 -6.426 6.490 7.094
706 HG3 ARG 87 1HG ARG 87 -5.352 7.209 8.296
707 HD2 ARG 87 2HD ARG 87 -5.406 4.264 7.665
708 HD3 ARG 87 1HD ARG 87 -4.330 5.405 6.862
709 HE ARG 87 HE ARG 87 -3.416 5.888 9.120
710 HH11 ARG 87 1HH1 ARG 87 -5.075 2.855 8.540
711 HH12 ARG 87 2HH1 ARG 87 -4.186 1.987 9.756
712 HH21 ARG 87 1HH2 ARG 87 -2.253 4.755 10.739
713 HH22 ARG 87 2HH2 ARG 87 -2.609 3.075 11.040
714 H GLU 88 HN GLU 88 -7.077 7.450 12.006
715 HA GLU 88 HA GLU 88 -5.322 9.697 11.326
716 HB2 GLU 88 2HB GLU 88 -7.356 9.711 13.559
717 HB3 GLU 88 1HB GLU 88 -6.097 10.921 13.346
718 HG2 GLU 88 2HG GLU 88 -7.102 11.234 10.995
719 HG3 GLU 88 1HG GLU 88 -8.502 10.388 11.650
720 H GLY 89 HN GLY 89 -3.847 10.279 13.124
721 HA2 GLY 89 2HA GLY 89 -2.747 9.434 15.166
722 HA3 GLY 89 1HA GLY 89 -3.028 7.820 14.543
723 H ASP 90 HN ASP 90 -1.597 6.932 13.216
724 HA ASP 90 HA ASP 90 0.440 8.549 11.902
725 HB2 ASP 90 2HB ASP 90 1.219 7.834 14.263
726 HB3 ASP 90 1HB ASP 90 1.283 6.202 13.612
727 H ASN 91 HN ASN 91 1.700 7.180 10.324
728 HA ASN 91 HA ASN 91 -0.048 5.248 9.076
729 HB2 ASN 91 2HB ASN 91 2.461 6.681 8.355
730 HB3 ASN 91 1HB ASN 91 2.163 5.137 7.574
731 HD21 ASN 91 1HD2 ASN 91 2.022 6.279 5.586
732 HD22 ASN 91 2HD2 ASN 91 0.569 7.110 5.158
733 HA PRO 92 HA PRO 92 2.118 1.822 10.900
734 HB2 PRO 92 2HB PRO 92 0.658 -0.144 9.845
735 HB3 PRO 92 1HB PRO 92 -0.054 1.009 10.981
736 HG2 PRO 92 2HG PRO 92 -0.346 0.835 8.024
737 HG3 PRO 92 1HG PRO 92 -1.522 1.350 9.244
738 HD2 PRO 92 2HD PRO 92 0.095 3.021 7.640
739 HD3 PRO 92 1HD PRO 92 -0.891 3.512 9.031
740 H ALA 93 HN ALA 93 2.597 2.831 7.840
741 HA ALA 93 HA ALA 93 3.797 0.357 6.843
742 HB1 ALA 93 1HB ALA 93 3.274 2.953 5.408
743 HB2 ALA 93 2HB ALA 93 2.250 1.517 5.359
744 HB3 ALA 93 3HB ALA 93 3.877 1.466 4.680
745 H ARG 94 HN ARG 94 4.796 2.861 8.678
746 HA ARG 94 HA ARG 94 7.405 3.086 7.399
747 HB2 ARG 94 2HB ARG 94 7.802 4.790 9.274
748 HB3 ARG 94 1HB ARG 94 6.700 5.225 7.982
749 HG2 ARG 94 2HG ARG 94 5.641 5.963 9.912
750 HG3 ARG 94 1HG ARG 94 4.842 4.433 9.555
751 HD2 ARG 94 2HD ARG 94 6.301 3.321 11.194
752 HD3 ARG 94 1HD ARG 94 7.036 4.877 11.573
753 HE ARG 94 HE ARG 94 4.437 5.380 12.016
754 HH11 ARG 94 1HH1 ARG 94 6.509 2.742 13.010
755 HH12 ARG 94 2HH1 ARG 94 5.644 2.445 14.487
756 HH21 ARG 94 1HH2 ARG 94 3.305 5.014 13.940
757 HH22 ARG 94 2HH2 ARG 94 3.811 3.756 15.020
758 H TRP 95 HN TRP 95 9.300 2.510 8.393
759 HA TRP 95 HA TRP 95 9.090 0.807 10.776
760 HB2 TRP 95 2HB TRP 95 9.879 0.011 8.026
761 HB3 TRP 95 1HB TRP 95 10.838 -0.639 9.354
762 HD1 TRP 95 1HD TRP 95 9.270 -1.860 11.349
763 HE1 TRP 95 1HE TRP 95 7.326 -3.501 10.999
764 HE3 TRP 95 3HE TRP 95 8.033 -0.617 6.551
765 HZ2 TRP 95 2HZ TRP 95 5.483 -4.168 8.952
766 HZ3 TRP 95 3HZ TRP 95 6.164 -1.793 5.470
767 HH2 TRP 95 2HH TRP 95 4.914 -3.531 6.646
768 H ARG 96 HN ARG 96 11.097 0.401 11.830
769 HA ARG 96 HA ARG 96 13.107 2.446 11.378
770 HB2 ARG 96 2HB ARG 96 12.590 0.479 13.582
771 HB3 ARG 96 1HB ARG 96 14.135 1.308 13.462
772 HG2 ARG 96 2HG ARG 96 11.440 2.626 13.726
773 HG3 ARG 96 1HG ARG 96 12.643 2.447 15.007
774 HD2 ARG 96 2HD ARG 96 14.233 3.763 13.663
775 HD3 ARG 96 1HD ARG 96 12.989 3.983 12.436
776 HE ARG 96 HE ARG 96 11.987 4.881 14.898
777 HH11 ARG 96 1HH1 ARG 96 14.377 5.721 12.484
778 HH12 ARG 96 2HH1 ARG 96 14.379 7.415 12.869
779 HH21 ARG 96 1HH2 ARG 96 11.946 7.125 15.393
780 HH22 ARG 96 2HH2 ARG 96 12.987 8.214 14.525
781 H GLY 97 HN GLY 97 12.946 -1.072 11.666
782 HA2 GLY 97 2HA GLY 97 14.993 -1.345 9.627
783 HA3 GLY 97 1HA GLY 97 15.478 -1.866 11.236
784 H TYR 98 HN TYR 98 12.459 -2.185 9.370
785 HA TYR 98 HA TYR 98 11.718 -4.711 10.202
786 HB2 TYR 98 2HB TYR 98 10.308 -3.198 8.831
787 HB3 TYR 98 1HB TYR 98 11.318 -3.551 7.434
788 HD1 TYR 98 1HD TYR 98 8.915 -5.012 9.829
789 HD2 TYR 98 2HD TYR 98 10.988 -5.525 6.153
790 HE1 TYR 98 1HE TYR 98 7.476 -6.931 9.294
791 HE2 TYR 98 2HE TYR 98 9.555 -7.446 5.607
792 HH TYR 98 HH TYR 98 8.169 -9.140 6.906
793 H LEU 99 HN LEU 99 13.532 -3.891 7.253
794 HA LEU 99 HA LEU 99 14.414 -6.649 6.987
795 HB2 LEU 99 2HB LEU 99 14.887 -4.222 5.253
796 HB3 LEU 99 1HB LEU 99 15.488 -5.827 4.899
797 HG LEU 99 HG LEU 99 12.573 -5.069 5.082
798 HD11 LEU 99 1HD1 LEU 99 14.321 -5.633 2.689
799 HD12 LEU 99 2HD1 LEU 99 13.612 -4.079 3.130
800 HD13 LEU 99 3HD1 LEU 99 12.571 -5.418 2.649
801 HD21 LEU 99 3HD2 LEU 99 12.189 -7.306 4.134
802 HD22 LEU 99 1HD2 LEU 99 12.944 -7.376 5.726
803 HD23 LEU 99 2HD2 LEU 99 13.914 -7.650 4.279
804 H GLU 100 HN GLU 100 16.181 -3.595 6.561
805 HA GLU 100 HA GLU 100 17.990 -4.177 8.707
806 HB2 GLU 100 2HB GLU 100 18.945 -5.665 7.056
807 HB3 GLU 100 1HB GLU 100 18.933 -4.394 5.842
808 HG2 GLU 100 2HG GLU 100 20.688 -3.243 6.864
809 HG3 GLU 100 1HG GLU 100 20.497 -4.119 8.380
810 H HIS 101 HN HIS 101 18.773 -2.333 9.512
811 HA HIS 101 HA HIS 101 18.708 0.054 7.777
812 HB2 HIS 101 2HB HIS 101 16.991 0.061 9.620
813 HB3 HIS 101 1HB HIS 101 18.314 0.013 10.782
814 HD1 HIS 101 1HD HIS 101 16.048 2.341 9.776
815 HD2 HIS 101 2HD HIS 101 20.204 2.391 9.761
816 HE1 HIS 101 1HE HIS 101 16.700 4.773 9.738
817 HE2 HIS 101 2HE HIS 101 19.215 4.772 9.926
818 H HIS 102 HN HIS 102 20.894 -0.493 7.190
819 HA HIS 102 HA HIS 102 22.787 0.402 9.262
820 HB2 HIS 102 2HB HIS 102 23.196 -1.611 7.050
821 HB3 HIS 102 1HB HIS 102 24.548 -0.810 7.840
822 HD1 HIS 102 1HD HIS 102 24.022 -3.902 7.969
823 HD2 HIS 102 2HD HIS 102 22.961 -1.135 10.890
824 HE1 HIS 102 1HE HIS 102 23.829 -5.211 10.111
825 HE2 HIS 102 2HE HIS 102 23.001 -3.548 11.818
826 H HIS 103 HN HIS 103 23.349 2.396 8.905
827 HA HIS 103 HA HIS 103 22.621 3.829 6.619
828 HB2 HIS 103 2HB HIS 103 23.066 4.687 8.983
829 HB3 HIS 103 1HB HIS 103 24.769 4.694 8.548
830 HD1 HIS 103 1HD HIS 103 25.391 7.068 8.168
831 HD2 HIS 103 2HD HIS 103 21.678 6.146 6.538
832 HE1 HIS 103 1HE HIS 103 24.605 9.173 7.038
833 HE2 HIS 103 2HE HIS 103 22.427 8.544 5.931
834 H HIS 104 HN HIS 104 25.912 2.939 7.705
835 HA HIS 104 HA HIS 104 27.879 2.689 6.572
836 HB2 HIS 104 2HB HIS 104 26.418 1.000 5.370
837 HB3 HIS 104 1HB HIS 104 26.138 2.217 4.135
838 HD1 HIS 104 1HD HIS 104 27.607 1.986 2.171
839 HD2 HIS 104 2HD HIS 104 29.397 0.492 5.626
840 HE1 HIS 104 1HE HIS 104 29.837 1.066 1.445
841 HE2 HIS 104 2HE HIS 104 30.939 0.243 3.554
842 H HIS 105 HN HIS 105 28.815 3.481 4.104
843 HA HIS 105 HA HIS 105 29.242 5.163 2.640
844 HB2 HIS 105 2HB HIS 105 26.711 5.337 2.531
845 HB3 HIS 105 1HB HIS 105 26.823 6.614 3.732
846 HD1 HIS 105 1HD HIS 105 25.943 6.601 0.549
847 HD2 HIS 105 2HD HIS 105 29.245 8.368 2.358
848 HE1 HIS 105 1HE HIS 105 26.629 8.481 -0.975
849 HE2 HIS 105 2HE HIS 105 28.462 9.682 0.269
850 H HIS 106 HN HIS 106 31.019 6.258 3.098
851 HA HIS 106 HA HIS 106 31.498 7.511 5.597
852 HB2 HIS 106 2HB HIS 106 33.327 6.643 4.191
853 HB3 HIS 106 1HB HIS 106 32.970 7.864 2.974
854 HD1 HIS 106 1HD HIS 106 34.504 9.800 3.090
855 HD2 HIS 106 2HD HIS 106 33.945 8.046 6.824
856 HE1 HIS 106 1HE HIS 106 35.940 11.112 4.678
857 HE2 HIS 106 2HE HIS 106 35.705 9.949 6.899
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -15.300 2.254 5.541
2 H2 MET 1 H2 MET 1 -15.446 3.930 5.342
3 H3 MET 1 H3 MET 1 -14.093 3.285 6.135
4 HA MET 1 HA MET 1 -14.784 2.894 3.277
5 HB2 MET 1 2HB MET 1 -13.917 5.179 3.951
6 HB3 MET 1 1HB MET 1 -12.446 4.381 4.489
7 HG2 MET 1 2HG MET 1 -11.980 5.211 2.346
8 HG3 MET 1 1HG MET 1 -12.223 3.477 2.152
9 HE1 MET 1 2HE MET 1 -15.366 6.658 1.018
10 HE2 MET 1 3HE MET 1 -13.750 7.046 1.604
11 HE3 MET 1 1HE MET 1 -14.919 6.283 2.683
12 H THR 2 HN THR 2 -13.848 1.155 2.362
13 HA THR 2 HA THR 2 -12.109 -0.468 4.040
14 HB THR 2 HB THR 2 -12.250 -2.128 2.190
15 HG1 THR 2 1HG THR 2 -14.177 -0.385 1.024
16 HG21 THR 2 3HG2 THR 2 -14.891 -1.042 3.167
17 HG22 THR 2 1HG2 THR 2 -13.870 -2.211 4.001
18 HG23 THR 2 2HG2 THR 2 -14.644 -2.646 2.477
19 H PHE 3 HN PHE 3 -10.115 -1.417 3.075
20 HA PHE 3 HA PHE 3 -8.348 0.619 2.299
21 HB2 PHE 3 2HB PHE 3 -7.660 -1.450 3.469
22 HB3 PHE 3 1HB PHE 3 -7.982 -2.369 2.003
23 HD1 PHE 3 1HD PHE 3 -5.898 0.380 3.363
24 HD2 PHE 3 2HD PHE 3 -6.326 -2.625 0.383
25 HE1 PHE 3 1HE PHE 3 -3.592 0.799 2.613
26 HE2 PHE 3 2HE PHE 3 -4.023 -2.209 -0.375
27 HZ PHE 3 HZ PHE 3 -2.653 -0.497 0.741
28 H SER 4 HN SER 4 -9.990 -1.887 0.406
29 HA SER 4 HA SER 4 -8.750 -1.375 -2.058
30 HB2 SER 4 2HB SER 4 -11.543 -2.404 -1.498
31 HB3 SER 4 1HB SER 4 -10.734 -2.481 -3.065
32 HG SER 4 HG SER 4 -9.037 -3.518 -1.408
33 H GLU 5 HN GLU 5 -11.604 0.061 -0.554
34 HA GLU 5 HA GLU 5 -12.346 1.693 -2.738
35 HB2 GLU 5 2HB GLU 5 -12.882 1.853 0.219
36 HB3 GLU 5 1HB GLU 5 -13.563 2.988 -0.925
37 HG2 GLU 5 2HG GLU 5 -14.685 1.169 -2.081
38 HG3 GLU 5 1HG GLU 5 -13.987 0.018 -0.943
39 H CYS 6 HN CYS 6 -10.446 2.320 0.187
40 HA CYS 6 HA CYS 6 -10.028 5.067 -0.271
41 HB2 CYS 6 2HB CYS 6 -9.671 3.707 1.873
42 HB3 CYS 6 1HB CYS 6 -8.109 3.279 1.206
43 HG CYS 6 HG CYS 6 -7.671 6.233 0.846
44 H ALA 7 HN ALA 7 -8.056 2.229 -1.016
45 HA ALA 7 HA ALA 7 -5.887 3.555 -2.199
46 HB1 ALA 7 1HB ALA 7 -5.826 1.189 -1.601
47 HB2 ALA 7 2HB ALA 7 -5.382 1.426 -3.292
48 HB3 ALA 7 3HB ALA 7 -6.990 0.829 -2.875
49 H ALA 8 HN ALA 8 -8.938 2.402 -3.584
50 HA ALA 8 HA ALA 8 -8.390 3.107 -6.254
51 HB1 ALA 8 1HB ALA 8 -10.218 1.609 -5.626
52 HB2 ALA 8 2HB ALA 8 -10.795 2.952 -6.613
53 HB3 ALA 8 3HB ALA 8 -11.066 2.957 -4.870
54 H LEU 9 HN LEU 9 -9.872 4.910 -3.589
55 HA LEU 9 HA LEU 9 -10.547 7.207 -5.069
56 HB2 LEU 9 2HB LEU 9 -9.874 6.950 -2.136
57 HB3 LEU 9 1HB LEU 9 -10.594 8.363 -2.878
58 HG LEU 9 HG LEU 9 -11.869 5.634 -2.667
59 HD11 LEU 9 1HD1 LEU 9 -13.423 6.743 -1.143
60 HD12 LEU 9 2HD1 LEU 9 -12.516 8.247 -1.303
61 HD13 LEU 9 3HD1 LEU 9 -11.767 6.844 -0.545
62 HD21 LEU 9 3HD2 LEU 9 -13.855 6.719 -3.598
63 HD22 LEU 9 1HD2 LEU 9 -12.505 6.763 -4.732
64 HD23 LEU 9 2HD2 LEU 9 -12.938 8.208 -3.819
65 H TYR 10 HN TYR 10 -7.591 6.267 -3.378
66 HA TYR 10 HA TYR 10 -6.190 8.668 -3.610
67 HB2 TYR 10 2HB TYR 10 -5.405 6.676 -2.332
68 HB3 TYR 10 1HB TYR 10 -5.040 5.879 -3.859
69 HD1 TYR 10 2HD TYR 10 -4.158 8.784 -1.742
70 HD2 TYR 10 1HD TYR 10 -2.989 6.297 -4.989
71 HE1 TYR 10 2HE TYR 10 -1.940 9.843 -1.747
72 HE2 TYR 10 1HE TYR 10 -0.763 7.349 -5.001
73 HH TYR 10 HH TYR 10 0.223 9.588 -4.261
74 H ILE 11 HN ILE 11 -6.500 5.978 -5.866
75 HA ILE 11 HA ILE 11 -4.858 7.105 -7.895
76 HB ILE 11 HB ILE 11 -7.020 5.001 -8.130
77 HG12 ILE 11 2HG1 ILE 11 -4.028 4.681 -7.812
78 HG13 ILE 11 1HG1 ILE 11 -5.194 4.467 -6.513
79 HG21 ILE 11 1HG2 ILE 11 -5.915 4.347 -10.186
80 HG22 ILE 11 2HG2 ILE 11 -4.721 5.628 -9.979
81 HG23 ILE 11 3HG2 ILE 11 -6.414 6.035 -10.277
82 HD11 ILE 11 3HD1 ILE 11 -4.475 2.340 -7.433
83 HD12 ILE 11 1HD1 ILE 11 -5.040 2.826 -9.032
84 HD13 ILE 11 2HD1 ILE 11 -6.195 2.602 -7.716
85 H LYS 12 HN LYS 12 -8.380 6.924 -7.431
86 HA LYS 12 HA LYS 12 -9.179 8.213 -9.768
87 HB2 LYS 12 2HB LYS 12 -10.444 8.108 -7.036
88 HB3 LYS 12 1HB LYS 12 -11.226 8.867 -8.415
89 HG2 LYS 12 2HG LYS 12 -11.284 6.769 -9.592
90 HG3 LYS 12 1HG LYS 12 -10.365 5.983 -8.304
91 HD2 LYS 12 2HD LYS 12 -12.158 6.311 -6.742
92 HD3 LYS 12 1HD LYS 12 -13.048 7.298 -7.902
93 HE2 LYS 12 2HE LYS 12 -13.322 5.363 -9.353
94 HE3 LYS 12 1HE LYS 12 -12.386 4.373 -8.232
95 HZ1 LYS 12 3HZ LYS 12 -14.799 5.786 -7.304
96 HZ2 LYS 12 1HZ LYS 12 -14.073 4.390 -6.671
97 HZ3 LYS 12 2HZ LYS 12 -14.951 4.310 -8.124
98 H ALA 13 HN ALA 13 -8.397 9.610 -6.593
99 HA ALA 13 HA ALA 13 -9.129 12.264 -7.321
100 HB1 ALA 13 1HB ALA 13 -9.115 11.497 -5.001
101 HB2 ALA 13 2HB ALA 13 -8.102 12.926 -5.215
102 HB3 ALA 13 3HB ALA 13 -7.361 11.332 -5.063
103 H HIS 14 HN HIS 14 -6.564 10.444 -8.362
104 HA HIS 14 HA HIS 14 -5.029 12.882 -8.959
105 HB2 HIS 14 2HB HIS 14 -3.902 10.192 -8.152
106 HB3 HIS 14 1HB HIS 14 -2.940 11.500 -8.834
107 HD1 HIS 14 1HD HIS 14 -4.429 10.278 -5.697
108 HD2 HIS 14 2HD HIS 14 -2.674 13.775 -7.106
109 HE1 HIS 14 1HE HIS 14 -3.852 11.622 -3.650
110 HE2 HIS 14 2HE HIS 14 -2.664 13.672 -4.514
111 H ARG 15 HN ARG 15 -6.945 10.711 -10.338
112 HA ARG 15 HA ARG 15 -5.254 9.600 -12.357
113 HB2 ARG 15 2HB ARG 15 -7.259 8.743 -13.367
114 HB3 ARG 15 1HB ARG 15 -7.357 8.527 -11.630
115 HG2 ARG 15 2HG ARG 15 -8.875 10.396 -11.446
116 HG3 ARG 15 1HG ARG 15 -8.718 10.720 -13.175
117 HD2 ARG 15 2HD ARG 15 -9.683 8.548 -13.688
118 HD3 ARG 15 1HD ARG 15 -9.793 8.172 -11.969
119 HE ARG 15 HE ARG 15 -11.351 10.175 -11.885
120 HH11 ARG 15 1HH1 ARG 15 -10.988 8.151 -14.723
121 HH12 ARG 15 2HH1 ARG 15 -12.601 8.437 -15.293
122 HH21 ARG 15 1HH2 ARG 15 -13.468 10.580 -12.645
123 HH22 ARG 15 2HH2 ARG 15 -14.000 9.863 -14.141
124 H SER 16 HN SER 16 -6.789 12.614 -11.980
125 HA SER 16 HA SER 16 -6.533 13.285 -14.800
126 HB2 SER 16 2HB SER 16 -8.442 14.208 -13.521
127 HB3 SER 16 1HB SER 16 -7.315 15.031 -12.444
128 HG SER 16 HG SER 16 -6.521 15.899 -14.650
129 H SER 17 HN SER 17 -4.881 13.741 -11.764
130 HA SER 17 HA SER 17 -2.883 15.521 -12.756
131 HB2 SER 17 2HB SER 17 -2.532 13.611 -10.451
132 HB3 SER 17 1HB SER 17 -1.856 15.223 -10.654
133 HG SER 17 HG SER 17 -4.265 15.823 -10.650
134 H TRP 18 HN TRP 18 -3.589 12.257 -13.058
135 HA TRP 18 HA TRP 18 -0.901 11.565 -13.992
136 HB2 TRP 18 2HB TRP 18 -3.117 9.752 -13.013
137 HB3 TRP 18 1HB TRP 18 -1.614 9.194 -13.718
138 HD1 TRP 18 1HD TRP 18 -0.352 11.772 -11.601
139 HE1 TRP 18 1HE TRP 18 0.249 10.859 -9.255
140 HE3 TRP 18 3HE TRP 18 -2.907 7.381 -11.802
141 HZ2 TRP 18 2HZ TRP 18 -0.310 8.534 -7.706
142 HZ3 TRP 18 3HZ TRP 18 -2.829 5.844 -9.888
143 HH2 TRP 18 2HH TRP 18 -1.559 6.418 -7.869
144 H LYS 19 HN LYS 19 -1.868 12.752 -16.003
145 HA LYS 19 HA LYS 19 -3.392 11.169 -17.758
146 HB2 LYS 19 2HB LYS 19 -1.005 12.917 -18.424
147 HB3 LYS 19 1HB LYS 19 -2.182 12.310 -19.586
148 HG2 LYS 19 2HG LYS 19 -3.945 13.562 -18.472
149 HG3 LYS 19 1HG LYS 19 -2.783 14.159 -17.288
150 HD2 LYS 19 2HD LYS 19 -1.572 15.322 -19.041
151 HD3 LYS 19 1HD LYS 19 -2.672 14.670 -20.259
152 HE2 LYS 19 2HE LYS 19 -3.422 16.498 -17.981
153 HE3 LYS 19 1HE LYS 19 -3.271 16.961 -19.676
154 HZ1 LYS 19 3HZ LYS 19 -5.063 15.406 -20.204
155 HZ2 LYS 19 1HZ LYS 19 -5.576 16.586 -19.101
156 HZ3 LYS 19 2HZ LYS 19 -5.231 15.018 -18.563
157 H ASN 20 HN ASN 20 -1.533 8.570 -16.866
158 HA ASN 20 HA ASN 20 -3.702 7.915 -17.105
159 HB2 ASN 20 2HB ASN 20 -4.639 10.172 -17.283
160 HB3 ASN 20 1HB ASN 20 -4.074 10.296 -18.944
161 HD21 ASN 20 1HD2 ASN 20 -6.110 10.647 -19.755
162 HD22 ASN 20 2HD2 ASN 20 -7.309 9.401 -19.843
163 H THR 21 HN THR 21 -2.831 6.284 -17.829
164 HA THR 21 HA THR 21 -2.996 5.377 -20.511
165 HB THR 21 HB THR 21 -0.492 4.686 -20.443
166 HG1 THR 21 1HG THR 21 0.486 6.826 -19.312
167 HG21 THR 21 3HG2 THR 21 -1.317 6.222 -22.127
168 HG22 THR 21 1HG2 THR 21 0.256 6.768 -21.541
169 HG23 THR 21 2HG2 THR 21 -1.217 7.565 -20.990
170 H LYS 22 HN LYS 22 -1.271 3.138 -20.061
171 HA LYS 22 HA LYS 22 -2.739 1.589 -18.232
172 HB2 LYS 22 2HB LYS 22 -0.898 -0.069 -18.532
173 HB3 LYS 22 1HB LYS 22 -1.619 0.533 -20.015
174 HG2 LYS 22 2HG LYS 22 0.275 2.113 -20.243
175 HG3 LYS 22 1HG LYS 22 1.015 1.344 -18.838
176 HD2 LYS 22 2HD LYS 22 1.200 -0.740 -19.978
177 HD3 LYS 22 1HD LYS 22 0.209 -0.163 -21.318
178 HE2 LYS 22 2HE LYS 22 1.974 1.536 -21.796
179 HE3 LYS 22 1HE LYS 22 2.979 0.763 -20.570
180 HZ1 LYS 22 3HZ LYS 22 1.898 -0.586 -22.985
181 HZ2 LYS 22 1HZ LYS 22 2.940 -1.272 -21.834
182 HZ3 LYS 22 2HZ LYS 22 3.487 -0.009 -22.828
183 H HIS 23 HN HIS 23 -0.565 3.975 -17.527
184 HA HIS 23 HA HIS 23 0.852 3.096 -15.285
185 HB2 HIS 23 2HB HIS 23 -0.056 5.690 -16.324
186 HB3 HIS 23 1HB HIS 23 0.136 5.654 -14.576
187 HD1 HIS 23 1HD HIS 23 2.363 6.445 -13.891
188 HD2 HIS 23 2HD HIS 23 2.486 4.453 -17.546
189 HE1 HIS 23 1HE HIS 23 4.766 6.524 -14.631
190 HE2 HIS 23 2HE HIS 23 4.800 5.422 -16.899
191 H ALA 24 HN ALA 24 -2.487 4.341 -15.424
192 HA ALA 24 HA ALA 24 -2.917 4.218 -12.610
193 HB1 ALA 24 1HB ALA 24 -4.298 5.606 -14.059
194 HB2 ALA 24 2HB ALA 24 -5.297 4.447 -13.182
195 HB3 ALA 24 3HB ALA 24 -4.914 4.172 -14.881
196 H ASP 25 HN ASP 25 -3.377 1.977 -15.275
197 HA ASP 25 HA ASP 25 -4.738 -0.062 -13.887
198 HB2 ASP 25 2HB ASP 25 -4.392 0.179 -16.417
199 HB3 ASP 25 1HB ASP 25 -2.794 -0.509 -16.155
200 H GLN 26 HN GLN 26 -1.297 0.553 -14.458
201 HA GLN 26 HA GLN 26 -0.210 -1.695 -13.237
202 HB2 GLN 26 2HB GLN 26 0.790 1.129 -13.557
203 HB3 GLN 26 1HB GLN 26 1.772 -0.131 -12.839
204 HG2 GLN 26 2HG GLN 26 1.727 -1.412 -14.860
205 HG3 GLN 26 1HG GLN 26 0.577 -0.291 -15.588
206 HE21 GLN 26 1HE2 GLN 26 1.961 0.119 -17.314
207 HE22 GLN 26 2HE2 GLN 26 3.386 1.091 -17.148
208 H TRP 27 HN TRP 27 -1.113 1.428 -11.850
209 HA TRP 27 HA TRP 27 -0.316 0.872 -9.196
210 HB2 TRP 27 2HB TRP 27 -2.054 2.873 -10.544
211 HB3 TRP 27 1HB TRP 27 -2.275 2.659 -8.812
212 HD1 TRP 27 1HD TRP 27 0.445 3.722 -11.355
213 HE1 TRP 27 1HE TRP 27 2.147 5.204 -10.101
214 HE3 TRP 27 3HE TRP 27 -1.376 3.222 -6.601
215 HZ2 TRP 27 2HZ TRP 27 2.649 6.037 -7.438
216 HZ3 TRP 27 3HZ TRP 27 -0.235 4.385 -4.765
217 HH2 TRP 27 2HH TRP 27 1.733 5.763 -5.170
218 H THR 28 HN THR 28 -3.439 0.564 -10.848
219 HA THR 28 HA THR 28 -4.865 -0.236 -8.533
220 HB THR 28 HB THR 28 -5.637 -0.752 -11.415
221 HG1 THR 28 1HG THR 28 -5.239 1.481 -11.087
222 HG21 THR 28 3HG2 THR 28 -6.989 -1.969 -9.777
223 HG22 THR 28 1HG2 THR 28 -7.928 -0.685 -10.536
224 HG23 THR 28 2HG2 THR 28 -7.296 -0.466 -8.905
225 H ASN 29 HN ASN 29 -3.494 -2.048 -11.261
226 HA ASN 29 HA ASN 29 -4.707 -4.504 -10.743
227 HB2 ASN 29 2HB ASN 29 -3.256 -3.606 -12.768
228 HB3 ASN 29 1HB ASN 29 -1.962 -4.437 -11.910
229 HD21 ASN 29 1HD2 ASN 29 -4.733 -4.758 -13.871
230 HD22 ASN 29 2HD2 ASN 29 -4.712 -6.489 -14.018
231 H THR 30 HN THR 30 -1.545 -3.286 -9.695
232 HA THR 30 HA THR 30 -0.669 -5.704 -8.555
233 HB THR 30 HB THR 30 0.931 -4.187 -7.263
234 HG1 THR 30 1HG THR 30 0.164 -2.129 -9.027
235 HG21 THR 30 3HG2 THR 30 2.242 -3.676 -9.257
236 HG22 THR 30 1HG2 THR 30 0.819 -3.910 -10.272
237 HG23 THR 30 2HG2 THR 30 1.510 -5.274 -9.393
238 H ILE 31 HN ILE 31 -2.038 -2.804 -6.995
239 HA ILE 31 HA ILE 31 -2.017 -3.898 -4.388
240 HB ILE 31 HB ILE 31 -3.737 -1.666 -5.480
241 HG12 ILE 31 2HG1 ILE 31 -1.072 -1.544 -4.044
242 HG13 ILE 31 1HG1 ILE 31 -1.300 -1.306 -5.778
243 HG21 ILE 31 1HG2 ILE 31 -2.995 -2.331 -2.633
244 HG22 ILE 31 2HG2 ILE 31 -4.585 -2.546 -3.366
245 HG23 ILE 31 3HG2 ILE 31 -3.921 -0.926 -3.160
246 HD11 ILE 31 3HD1 ILE 31 -1.052 0.806 -4.585
247 HD12 ILE 31 1HD1 ILE 31 -2.460 0.422 -3.596
248 HD13 ILE 31 2HD1 ILE 31 -2.643 0.674 -5.332
249 H LYS 32 HN LYS 32 -4.468 -3.777 -6.906
250 HA LYS 32 HA LYS 32 -6.660 -4.696 -5.425
251 HB2 LYS 32 2HB LYS 32 -6.330 -3.831 -7.945
252 HB3 LYS 32 1HB LYS 32 -6.375 -5.557 -8.263
253 HG2 LYS 32 2HG LYS 32 -8.518 -4.035 -6.798
254 HG3 LYS 32 1HG LYS 32 -8.555 -4.420 -8.517
255 HD2 LYS 32 2HD LYS 32 -8.432 -6.823 -7.928
256 HD3 LYS 32 1HD LYS 32 -8.532 -6.374 -6.222
257 HE2 LYS 32 2HE LYS 32 -10.685 -5.231 -6.720
258 HE3 LYS 32 1HE LYS 32 -10.593 -5.869 -8.361
259 HZ1 LYS 32 3HZ LYS 32 -10.733 -7.469 -5.864
260 HZ2 LYS 32 1HZ LYS 32 -10.581 -8.114 -7.427
261 HZ3 LYS 32 2HZ LYS 32 -11.982 -7.261 -6.991
262 H THR 33 HN THR 33 -4.034 -6.409 -7.017
263 HA THR 33 HA THR 33 -5.317 -8.982 -6.749
264 HB THR 33 HB THR 33 -2.486 -8.371 -7.610
265 HG1 THR 33 1HG THR 33 -3.733 -7.365 -9.103
266 HG21 THR 33 3HG2 THR 33 -2.859 -10.715 -6.999
267 HG22 THR 33 1HG2 THR 33 -2.628 -10.546 -8.740
268 HG23 THR 33 2HG2 THR 33 -4.248 -10.782 -8.085
269 H TYR 34 HN TYR 34 -2.445 -7.406 -5.329
270 HA TYR 34 HA TYR 34 -1.900 -9.720 -3.706
271 HB2 TYR 34 2HB TYR 34 -0.597 -7.004 -3.870
272 HB3 TYR 34 1HB TYR 34 -0.065 -8.264 -2.757
273 HD1 TYR 34 2HD TYR 34 0.901 -10.367 -3.644
274 HD2 TYR 34 1HD TYR 34 -0.082 -7.119 -6.206
275 HE1 TYR 34 2HE TYR 34 2.280 -11.360 -5.421
276 HE2 TYR 34 1HE TYR 34 1.290 -8.104 -7.993
277 HH TYR 34 HH TYR 34 2.516 -11.308 -7.818
278 H CYS 35 HN CYS 35 -3.058 -6.416 -3.040
279 HA CYS 35 HA CYS 35 -3.215 -7.041 -0.205
280 HB2 CYS 35 2HB CYS 35 -3.941 -4.501 -1.672
281 HB3 CYS 35 1HB CYS 35 -3.803 -4.688 0.073
282 HG CYS 35 HG CYS 35 -0.982 -5.538 -0.373
283 H GLY 36 HN GLY 36 -5.317 -6.782 -2.936
284 HA2 GLY 36 2HA GLY 36 -7.744 -6.081 -1.857
285 HA3 GLY 36 1HA GLY 36 -7.554 -7.166 -3.219
286 HA PRO 37 HA PRO 37 -9.097 -10.680 -1.159
287 HB2 PRO 37 2HB PRO 37 -6.465 -12.051 -1.026
288 HB3 PRO 37 1HB PRO 37 -7.980 -12.588 -1.758
289 HG2 PRO 37 2HG PRO 37 -5.967 -11.753 -3.279
290 HG3 PRO 37 1HG PRO 37 -7.643 -11.342 -3.686
291 HD2 PRO 37 2HD PRO 37 -5.527 -9.647 -2.418
292 HD3 PRO 37 1HD PRO 37 -6.747 -9.210 -3.632
293 H VAL 38 HN VAL 38 -6.315 -9.248 0.371
294 HA VAL 38 HA VAL 38 -6.833 -10.774 2.824
295 HB VAL 38 HB VAL 38 -4.490 -8.946 2.292
296 HG11 VAL 38 1HG1 VAL 38 -3.462 -10.178 4.162
297 HG12 VAL 38 2HG1 VAL 38 -4.970 -11.062 4.389
298 HG13 VAL 38 3HG1 VAL 38 -4.923 -9.318 4.651
299 HG21 VAL 38 3HG2 VAL 38 -4.651 -11.942 1.986
300 HG22 VAL 38 1HG2 VAL 38 -3.188 -10.970 1.845
301 HG23 VAL 38 2HG2 VAL 38 -4.495 -10.775 0.673
302 H ILE 39 HN ILE 39 -5.618 -7.452 2.384
303 HA ILE 39 HA ILE 39 -7.278 -6.672 4.668
304 HB ILE 39 HB ILE 39 -5.871 -4.632 4.744
305 HG12 ILE 39 2HG1 ILE 39 -4.288 -6.011 2.561
306 HG13 ILE 39 1HG1 ILE 39 -5.260 -4.553 2.356
307 HG21 ILE 39 1HG2 ILE 39 -5.320 -6.560 6.111
308 HG22 ILE 39 2HG2 ILE 39 -3.849 -5.754 5.567
309 HG23 ILE 39 3HG2 ILE 39 -4.374 -7.249 4.793
310 HD11 ILE 39 3HD1 ILE 39 -2.881 -4.053 2.536
311 HD12 ILE 39 1HD1 ILE 39 -2.834 -4.811 4.127
312 HD13 ILE 39 2HD1 ILE 39 -3.791 -3.350 3.872
313 H GLY 40 HN GLY 40 -7.732 -6.770 1.507
314 HA2 GLY 40 2HA GLY 40 -8.390 -4.232 0.597
315 HA3 GLY 40 1HA GLY 40 -9.134 -5.719 0.039
316 HA PRO 41 HA PRO 41 -12.936 -4.654 1.962
317 HB2 PRO 41 2HB PRO 41 -13.280 -7.108 3.482
318 HB3 PRO 41 1HB PRO 41 -14.096 -6.591 2.007
319 HG2 PRO 41 2HG PRO 41 -12.331 -8.649 2.074
320 HG3 PRO 41 1HG PRO 41 -12.570 -7.628 0.646
321 HD2 PRO 41 2HD PRO 41 -10.396 -7.522 2.704
322 HD3 PRO 41 1HD PRO 41 -10.286 -7.350 0.939
323 H LEU 42 HN LEU 42 -10.312 -4.863 3.896
324 HA LEU 42 HA LEU 42 -11.702 -4.571 6.434
325 HB2 LEU 42 2HB LEU 42 -8.767 -4.469 5.739
326 HB3 LEU 42 1HB LEU 42 -9.406 -4.299 7.362
327 HG LEU 42 HG LEU 42 -9.634 -6.754 5.620
328 HD11 LEU 42 1HD1 LEU 42 -7.390 -6.416 6.493
329 HD12 LEU 42 2HD1 LEU 42 -8.177 -7.779 7.290
330 HD13 LEU 42 3HD1 LEU 42 -8.041 -6.230 8.122
331 HD21 LEU 42 3HD2 LEU 42 -11.604 -6.489 7.025
332 HD22 LEU 42 1HD2 LEU 42 -10.575 -6.269 8.443
333 HD23 LEU 42 2HD2 LEU 42 -10.597 -7.817 7.600
334 H SER 43 HN SER 43 -11.209 -2.683 7.810
335 HA SER 43 HA SER 43 -11.806 -0.293 6.379
336 HB2 SER 43 2HB SER 43 -12.672 -0.753 8.652
337 HB3 SER 43 1HB SER 43 -11.033 -0.646 9.284
338 HG SER 43 HG SER 43 -12.728 1.307 8.991
339 H VAL 44 HN VAL 44 -10.529 1.400 5.838
340 HA VAL 44 HA VAL 44 -7.709 1.106 5.753
341 HB VAL 44 HB VAL 44 -8.999 2.491 4.143
342 HG11 VAL 44 1HG1 VAL 44 -9.683 4.762 4.781
343 HG12 VAL 44 2HG1 VAL 44 -9.286 4.398 6.460
344 HG13 VAL 44 3HG1 VAL 44 -10.587 3.524 5.654
345 HG21 VAL 44 3HG2 VAL 44 -6.600 2.809 4.350
346 HG22 VAL 44 1HG2 VAL 44 -6.843 3.966 5.659
347 HG23 VAL 44 2HG2 VAL 44 -7.391 4.352 4.026
348 H GLN 45 HN GLN 45 -9.908 2.266 8.119
349 HA GLN 45 HA GLN 45 -8.038 3.847 9.608
350 HB2 GLN 45 2HB GLN 45 -10.619 3.978 9.617
351 HB3 GLN 45 1HB GLN 45 -10.557 2.599 10.702
352 HG2 GLN 45 2HG GLN 45 -9.108 5.164 11.285
353 HG3 GLN 45 1HG GLN 45 -10.787 4.899 11.744
354 HE21 GLN 45 1HE2 GLN 45 -8.416 5.352 13.389
355 HE22 GLN 45 2HE2 GLN 45 -8.309 3.999 14.462
356 H ASP 46 HN ASP 46 -9.147 0.505 9.612
357 HA ASP 46 HA ASP 46 -7.772 -0.122 12.071
358 HB2 ASP 46 2HB ASP 46 -9.453 -1.669 10.146
359 HB3 ASP 46 1HB ASP 46 -8.421 -2.537 11.275
360 H VAL 47 HN VAL 47 -6.754 0.199 8.895
361 HA VAL 47 HA VAL 47 -5.052 -1.981 8.531
362 HB VAL 47 HB VAL 47 -4.634 0.855 7.565
363 HG11 VAL 47 1HG1 VAL 47 -3.383 -1.731 6.637
364 HG12 VAL 47 2HG1 VAL 47 -2.559 -0.420 7.479
365 HG13 VAL 47 3HG1 VAL 47 -3.195 -0.161 5.854
366 HG21 VAL 47 3HG2 VAL 47 -5.906 -1.541 6.247
367 HG22 VAL 47 1HG2 VAL 47 -5.585 0.006 5.461
368 HG23 VAL 47 2HG2 VAL 47 -6.734 -0.085 6.796
369 H ASP 48 HN ASP 48 -3.714 -2.653 10.034
370 HA ASP 48 HA ASP 48 -1.857 -0.727 11.266
371 HB2 ASP 48 2HB ASP 48 -3.268 -1.654 12.971
372 HB3 ASP 48 1HB ASP 48 -3.037 -3.284 12.360
373 H THR 49 HN THR 49 0.214 -1.823 11.964
374 HA THR 49 HA THR 49 1.599 -2.645 9.683
375 HB THR 49 HB THR 49 2.596 -3.311 12.429
376 HG1 THR 49 1HG THR 49 2.609 -1.267 13.002
377 HG21 THR 49 3HG2 THR 49 4.714 -2.512 11.501
378 HG22 THR 49 1HG2 THR 49 3.902 -2.088 9.993
379 HG23 THR 49 2HG2 THR 49 4.022 -3.778 10.486
380 H LYS 50 HN LYS 50 0.197 -4.528 12.339
381 HA LYS 50 HA LYS 50 1.437 -6.989 11.763
382 HB2 LYS 50 2HB LYS 50 0.181 -6.314 13.856
383 HB3 LYS 50 1HB LYS 50 -1.302 -6.594 12.963
384 HG2 LYS 50 2HG LYS 50 -0.801 -8.503 14.318
385 HG3 LYS 50 1HG LYS 50 -0.632 -8.929 12.615
386 HD2 LYS 50 2HD LYS 50 1.809 -8.623 12.810
387 HD3 LYS 50 1HD LYS 50 1.611 -8.271 14.528
388 HE2 LYS 50 2HE LYS 50 0.666 -10.500 14.879
389 HE3 LYS 50 1HE LYS 50 0.845 -10.852 13.160
390 HZ1 LYS 50 3HZ LYS 50 2.661 -11.817 14.378
391 HZ2 LYS 50 1HZ LYS 50 3.042 -10.328 15.096
392 HZ3 LYS 50 2HZ LYS 50 3.261 -10.550 13.430
393 H LEU 51 HN LEU 51 -1.555 -5.507 10.641
394 HA LEU 51 HA LEU 51 -2.523 -7.707 9.160
395 HB2 LEU 51 2HB LEU 51 -3.003 -4.748 8.812
396 HB3 LEU 51 1HB LEU 51 -3.900 -6.004 7.993
397 HG LEU 51 HG LEU 51 -3.848 -5.515 10.960
398 HD11 LEU 51 1HD1 LEU 51 -6.197 -4.922 10.648
399 HD12 LEU 51 2HD1 LEU 51 -6.013 -5.136 8.907
400 HD13 LEU 51 3HD1 LEU 51 -5.125 -3.859 9.737
401 HD21 LEU 51 3HD2 LEU 51 -5.380 -7.569 9.365
402 HD22 LEU 51 1HD2 LEU 51 -5.562 -7.256 11.093
403 HD23 LEU 51 2HD2 LEU 51 -4.044 -7.900 10.466
404 H ILE 52 HN ILE 52 -0.409 -5.006 8.356
405 HA ILE 52 HA ILE 52 -0.181 -5.538 5.590
406 HB ILE 52 HB ILE 52 1.836 -4.218 7.417
407 HG12 ILE 52 2HG1 ILE 52 -0.352 -2.997 5.723
408 HG13 ILE 52 1HG1 ILE 52 -0.392 -3.151 7.475
409 HG21 ILE 52 1HG2 ILE 52 2.823 -4.893 5.298
410 HG22 ILE 52 2HG2 ILE 52 2.655 -3.138 5.370
411 HG23 ILE 52 3HG2 ILE 52 1.518 -4.093 4.421
412 HD11 ILE 52 3HD1 ILE 52 0.202 -0.901 6.834
413 HD12 ILE 52 1HD1 ILE 52 1.558 -1.505 5.881
414 HD13 ILE 52 2HD1 ILE 52 1.564 -1.685 7.635
415 H MET 53 HN MET 53 1.609 -6.644 8.422
416 HA MET 53 HA MET 53 3.660 -8.044 7.131
417 HB2 MET 53 2HB MET 53 2.301 -8.629 9.766
418 HB3 MET 53 1HB MET 53 3.785 -9.397 9.225
419 HG2 MET 53 2HG MET 53 4.909 -7.239 9.195
420 HG3 MET 53 1HG MET 53 3.417 -6.450 9.702
421 HE1 MET 53 3HE MET 53 4.612 -5.286 11.767
422 HE2 MET 53 1HE MET 53 6.136 -5.999 11.230
423 HE3 MET 53 2HE MET 53 5.631 -6.158 12.911
424 H LYS 54 HN LYS 54 0.361 -8.986 7.907
425 HA LYS 54 HA LYS 54 0.548 -11.715 7.280
426 HB2 LYS 54 2HB LYS 54 -1.824 -9.850 7.044
427 HB3 LYS 54 1HB LYS 54 -1.913 -11.603 6.952
428 HG2 LYS 54 2HG LYS 54 -1.004 -11.723 9.255
429 HG3 LYS 54 1HG LYS 54 -1.072 -9.961 9.330
430 HD2 LYS 54 2HD LYS 54 -3.027 -10.921 10.399
431 HD3 LYS 54 1HD LYS 54 -3.505 -10.060 8.932
432 HE2 LYS 54 2HE LYS 54 -3.610 -12.176 7.719
433 HE3 LYS 54 1HE LYS 54 -3.094 -13.041 9.167
434 HZ1 LYS 54 3HZ LYS 54 -5.616 -11.494 8.860
435 HZ2 LYS 54 1HZ LYS 54 -5.113 -12.283 10.277
436 HZ3 LYS 54 2HZ LYS 54 -5.471 -13.184 8.890
437 H VAL 55 HN VAL 55 -0.035 -8.888 5.281
438 HA VAL 55 HA VAL 55 -0.648 -10.367 2.907
439 HB VAL 55 HB VAL 55 0.242 -7.484 3.107
440 HG11 VAL 55 1HG1 VAL 55 -1.361 -8.920 0.996
441 HG12 VAL 55 2HG1 VAL 55 0.319 -8.405 0.847
442 HG13 VAL 55 3HG1 VAL 55 -0.963 -7.203 1.003
443 HG21 VAL 55 3HG2 VAL 55 -2.123 -6.896 3.178
444 HG22 VAL 55 1HG2 VAL 55 -1.671 -7.880 4.571
445 HG23 VAL 55 2HG2 VAL 55 -2.554 -8.606 3.226
446 H LEU 56 HN LEU 56 2.228 -8.786 4.211
447 HA LEU 56 HA LEU 56 3.712 -9.058 1.777
448 HB2 LEU 56 2HB LEU 56 4.542 -8.248 4.554
449 HB3 LEU 56 1HB LEU 56 5.623 -8.243 3.175
450 HG LEU 56 HG LEU 56 3.145 -6.545 3.496
451 HD11 LEU 56 1HD1 LEU 56 4.723 -4.687 3.588
452 HD12 LEU 56 2HD1 LEU 56 6.073 -5.816 3.482
453 HD13 LEU 56 3HD1 LEU 56 5.018 -5.835 4.895
454 HD21 LEU 56 3HD2 LEU 56 3.507 -7.215 1.164
455 HD22 LEU 56 1HD2 LEU 56 5.163 -6.618 1.252
456 HD23 LEU 56 2HD2 LEU 56 3.812 -5.494 1.404
457 H ASP 57 HN ASP 57 3.256 -11.041 4.570
458 HA ASP 57 HA ASP 57 5.623 -12.376 4.891
459 HB2 ASP 57 2HB ASP 57 3.374 -12.690 6.121
460 HB3 ASP 57 1HB ASP 57 3.036 -13.905 4.905
461 HA PRO 58 HA PRO 58 4.752 -15.514 1.390
462 HB2 PRO 58 2HB PRO 58 2.646 -15.226 -0.255
463 HB3 PRO 58 1HB PRO 58 2.504 -16.033 1.311
464 HG2 PRO 58 2HG PRO 58 1.778 -13.229 0.555
465 HG3 PRO 58 1HG PRO 58 0.869 -14.392 1.538
466 HD2 PRO 58 2HD PRO 58 2.389 -12.395 2.607
467 HD3 PRO 58 1HD PRO 58 2.096 -13.941 3.423
468 H ILE 59 HN ILE 59 4.290 -12.117 0.839
469 HA ILE 59 HA ILE 59 4.864 -12.204 -1.975
470 HB ILE 59 HB ILE 59 4.790 -9.827 -0.111
471 HG12 ILE 59 2HG1 ILE 59 2.708 -10.948 -2.004
472 HG13 ILE 59 1HG1 ILE 59 2.632 -10.987 -0.245
473 HG21 ILE 59 1HG2 ILE 59 4.566 -8.500 -2.172
474 HG22 ILE 59 2HG2 ILE 59 4.797 -9.966 -3.128
475 HG23 ILE 59 3HG2 ILE 59 6.102 -9.364 -2.106
476 HD11 ILE 59 3HD1 ILE 59 1.208 -9.248 -1.149
477 HD12 ILE 59 1HD1 ILE 59 2.589 -8.516 -1.966
478 HD13 ILE 59 2HD1 ILE 59 2.519 -8.547 -0.203
479 H TRP 60 HN TRP 60 6.677 -11.398 0.967
480 HA TRP 60 HA TRP 60 9.042 -10.504 -0.238
481 HB2 TRP 60 2HB TRP 60 8.545 -11.913 2.381
482 HB3 TRP 60 1HB TRP 60 10.154 -11.403 1.888
483 HD1 TRP 60 1HD TRP 60 7.412 -10.242 3.921
484 HE1 TRP 60 1HE TRP 60 7.506 -7.696 4.291
485 HE3 TRP 60 3HE TRP 60 10.753 -9.020 0.254
486 HZ2 TRP 60 2HZ TRP 60 8.821 -5.462 3.169
487 HZ3 TRP 60 3HZ TRP 60 11.375 -6.655 -0.033
488 HH2 TRP 60 2HH TRP 60 10.428 -4.917 1.393
489 H GLU 61 HN GLU 61 7.771 -13.694 0.166
490 HA GLU 61 HA GLU 61 10.222 -15.082 -0.260
491 HB2 GLU 61 2HB GLU 61 7.327 -15.919 -0.230
492 HB3 GLU 61 1HB GLU 61 8.666 -17.030 -0.382
493 HG2 GLU 61 2HG GLU 61 8.285 -15.163 1.934
494 HG3 GLU 61 1HG GLU 61 7.742 -16.839 1.915
495 H GLN 62 HN GLN 62 7.660 -13.828 -2.222
496 HA GLN 62 HA GLN 62 8.468 -15.406 -4.532
497 HB2 GLN 62 2HB GLN 62 6.207 -13.428 -4.203
498 HB3 GLN 62 1HB GLN 62 6.495 -14.430 -5.616
499 HG2 GLN 62 2HG GLN 62 6.183 -16.437 -4.198
500 HG3 GLN 62 1HG GLN 62 5.765 -15.370 -2.856
501 HE21 GLN 62 1HE2 GLN 62 3.678 -16.175 -2.674
502 HE22 GLN 62 2HE2 GLN 62 2.453 -15.847 -3.848
503 H LYS 63 HN LYS 63 7.831 -11.952 -3.837
504 HA LYS 63 HA LYS 63 9.944 -11.235 -5.736
505 HB2 LYS 63 2HB LYS 63 7.091 -10.254 -5.937
506 HB3 LYS 63 1HB LYS 63 8.439 -9.576 -6.835
507 HG2 LYS 63 2HG LYS 63 8.756 -11.652 -8.015
508 HG3 LYS 63 1HG LYS 63 7.510 -12.434 -7.039
509 HD2 LYS 63 2HD LYS 63 5.841 -10.879 -7.943
510 HD3 LYS 63 1HD LYS 63 7.092 -10.112 -8.925
511 HE2 LYS 63 2HE LYS 63 6.323 -13.022 -9.112
512 HE3 LYS 63 1HE LYS 63 5.686 -11.757 -10.162
513 HZ1 LYS 63 3HZ LYS 63 7.883 -11.329 -10.986
514 HZ2 LYS 63 1HZ LYS 63 7.558 -12.985 -11.146
515 HZ3 LYS 63 2HZ LYS 63 8.568 -12.438 -9.898
516 HA PRO 64 HA PRO 64 10.210 -8.648 -1.911
517 HB2 PRO 64 2HB PRO 64 12.991 -8.516 -2.932
518 HB3 PRO 64 1HB PRO 64 12.407 -8.841 -1.296
519 HG2 PRO 64 2HG PRO 64 13.396 -10.799 -2.815
520 HG3 PRO 64 1HG PRO 64 12.016 -11.081 -1.737
521 HD2 PRO 64 2HD PRO 64 12.061 -10.701 -4.701
522 HD3 PRO 64 1HD PRO 64 11.062 -11.792 -3.720
523 H GLU 65 HN GLU 65 11.379 -8.145 -5.206
524 HA GLU 65 HA GLU 65 11.788 -5.365 -5.056
525 HB2 GLU 65 2HB GLU 65 11.530 -7.412 -7.146
526 HB3 GLU 65 1HB GLU 65 11.009 -5.817 -7.644
527 HG2 GLU 65 2HG GLU 65 13.342 -6.219 -8.207
528 HG3 GLU 65 1HG GLU 65 13.171 -4.893 -7.060
529 H THR 66 HN THR 66 8.967 -7.311 -5.938
530 HA THR 66 HA THR 66 7.280 -5.088 -6.522
531 HB THR 66 HB THR 66 6.432 -7.898 -5.779
532 HG1 THR 66 1HG THR 66 6.930 -6.879 -8.398
533 HG21 THR 66 3HG2 THR 66 4.607 -6.273 -5.831
534 HG22 THR 66 1HG2 THR 66 4.483 -7.392 -7.189
535 HG23 THR 66 2HG2 THR 66 5.098 -5.759 -7.444
536 H ALA 67 HN ALA 67 7.896 -7.088 -3.696
537 HA ALA 67 HA ALA 67 5.857 -6.090 -2.038
538 HB1 ALA 67 1HB ALA 67 8.590 -7.084 -1.230
539 HB2 ALA 67 2HB ALA 67 7.168 -8.090 -1.507
540 HB3 ALA 67 3HB ALA 67 7.182 -6.932 -0.178
541 H SER 68 HN SER 68 9.159 -4.970 -2.633
542 HA SER 68 HA SER 68 9.134 -2.847 -0.768
543 HB2 SER 68 2HB SER 68 10.725 -3.104 -3.334
544 HB3 SER 68 1HB SER 68 11.083 -2.002 -2.003
545 HG SER 68 HG SER 68 11.216 -4.831 -2.039
546 H ARG 69 HN ARG 69 8.248 -3.029 -4.198
547 HA ARG 69 HA ARG 69 7.659 -0.279 -4.493
548 HB2 ARG 69 2HB ARG 69 6.860 -2.746 -6.018
549 HB3 ARG 69 1HB ARG 69 6.291 -1.155 -6.472
550 HG2 ARG 69 2HG ARG 69 8.784 -0.508 -6.478
551 HG3 ARG 69 1HG ARG 69 9.058 -2.248 -6.538
552 HD2 ARG 69 2HD ARG 69 7.709 -2.399 -8.569
553 HD3 ARG 69 1HD ARG 69 7.405 -0.663 -8.501
554 HE ARG 69 HE ARG 69 9.753 -1.970 -9.488
555 HH11 ARG 69 1HH1 ARG 69 8.542 0.997 -8.037
556 HH12 ARG 69 2HH1 ARG 69 9.898 1.948 -8.568
557 HH21 ARG 69 1HH2 ARG 69 11.515 -0.694 -10.199
558 HH22 ARG 69 2HH2 ARG 69 11.577 0.991 -9.774
559 H LEU 70 HN LEU 70 5.737 -3.085 -3.569
560 HA LEU 70 HA LEU 70 3.228 -1.808 -3.492
561 HB2 LEU 70 2HB LEU 70 3.645 -4.278 -3.414
562 HB3 LEU 70 1HB LEU 70 4.181 -4.088 -1.757
563 HG LEU 70 HG LEU 70 1.922 -3.255 -1.151
564 HD11 LEU 70 1HD1 LEU 70 1.231 -4.023 -3.984
565 HD12 LEU 70 2HD1 LEU 70 1.273 -2.383 -3.335
566 HD13 LEU 70 3HD1 LEU 70 0.085 -3.540 -2.734
567 HD21 LEU 70 3HD2 LEU 70 2.517 -5.609 -0.858
568 HD22 LEU 70 1HD2 LEU 70 1.968 -5.954 -2.499
569 HD23 LEU 70 2HD2 LEU 70 0.813 -5.422 -1.277
570 H ARG 71 HN ARG 71 5.794 -2.191 -1.105
571 HA ARG 71 HA ARG 71 4.616 -1.093 1.148
572 HB2 ARG 71 2HB ARG 71 7.407 -1.189 0.088
573 HB3 ARG 71 1HB ARG 71 7.071 -0.202 1.499
574 HG2 ARG 71 2HG ARG 71 6.556 -2.028 2.818
575 HG3 ARG 71 1HG ARG 71 6.217 -3.063 1.428
576 HD2 ARG 71 2HD ARG 71 8.444 -3.345 2.778
577 HD3 ARG 71 1HD ARG 71 8.440 -3.480 1.022
578 HE ARG 71 HE ARG 71 8.979 -0.863 1.411
579 HH11 ARG 71 1HH1 ARG 71 10.389 -3.765 2.787
580 HH12 ARG 71 2HH1 ARG 71 11.982 -3.089 2.879
581 HH21 ARG 71 1HH2 ARG 71 11.072 0.011 1.527
582 HH22 ARG 71 2HH2 ARG 71 12.374 -0.947 2.182
583 H GLY 72 HN GLY 72 6.388 0.579 -1.442
584 HA2 GLY 72 2HA GLY 72 6.137 3.170 -0.370
585 HA3 GLY 72 1HA GLY 72 6.466 2.791 -2.055
586 H ARG 73 HN ARG 73 4.119 1.389 -2.659
587 HA ARG 73 HA ARG 73 2.419 3.578 -3.257
588 HB2 ARG 73 2HB ARG 73 1.998 0.597 -3.576
589 HB3 ARG 73 1HB ARG 73 0.914 1.826 -4.218
590 HG2 ARG 73 2HG ARG 73 2.685 2.710 -5.610
591 HG3 ARG 73 1HG ARG 73 3.827 1.555 -4.928
592 HD2 ARG 73 2HD ARG 73 2.494 -0.290 -5.853
593 HD3 ARG 73 1HD ARG 73 1.374 0.881 -6.548
594 HE ARG 73 HE ARG 73 3.527 1.719 -7.719
595 HH11 ARG 73 1HH1 ARG 73 2.725 -1.627 -7.065
596 HH12 ARG 73 2HH1 ARG 73 3.673 -2.245 -8.384
597 HH21 ARG 73 1HH2 ARG 73 4.752 0.916 -9.468
598 HH22 ARG 73 2HH2 ARG 73 4.782 -0.798 -9.781
599 H ILE 74 HN ILE 74 2.146 0.874 -0.966
600 HA ILE 74 HA ILE 74 -0.409 1.554 0.021
601 HB ILE 74 HB ILE 74 1.866 0.073 1.357
602 HG12 ILE 74 2HG1 ILE 74 -0.682 -0.919 0.056
603 HG13 ILE 74 1HG1 ILE 74 0.919 -0.985 -0.674
604 HG21 ILE 74 1HG2 ILE 74 0.204 -0.745 2.961
605 HG22 ILE 74 2HG2 ILE 74 -1.010 0.303 2.232
606 HG23 ILE 74 3HG2 ILE 74 0.381 1.009 3.053
607 HD11 ILE 74 3HD1 ILE 74 1.658 -2.472 1.124
608 HD12 ILE 74 1HD1 ILE 74 0.289 -3.137 0.232
609 HD13 ILE 74 2HD1 ILE 74 0.040 -2.415 1.822
610 H GLU 75 HN GLU 75 2.856 2.530 0.974
611 HA GLU 75 HA GLU 75 2.280 3.946 3.301
612 HB2 GLU 75 2HB GLU 75 4.568 3.506 2.514
613 HB3 GLU 75 1HB GLU 75 4.326 4.614 1.172
614 HG2 GLU 75 2HG GLU 75 3.858 6.386 2.949
615 HG3 GLU 75 1HG GLU 75 4.553 5.241 4.095
616 H SER 76 HN SER 76 2.325 5.071 -0.051
617 HA SER 76 HA SER 76 1.713 7.755 0.450
618 HB2 SER 76 2HB SER 76 1.106 6.117 -2.004
619 HB3 SER 76 1HB SER 76 1.190 7.875 -1.932
620 HG SER 76 HG SER 76 3.429 7.353 -1.020
621 H VAL 77 HN VAL 77 -0.401 5.003 -0.259
622 HA VAL 77 HA VAL 77 -2.798 6.490 -0.402
623 HB VAL 77 HB VAL 77 -2.411 3.577 0.314
624 HG11 VAL 77 1HG1 VAL 77 -4.751 3.301 -0.384
625 HG12 VAL 77 2HG1 VAL 77 -4.892 5.049 -0.572
626 HG13 VAL 77 3HG1 VAL 77 -4.603 4.354 1.023
627 HG21 VAL 77 3HG2 VAL 77 -1.492 4.131 -1.875
628 HG22 VAL 77 1HG2 VAL 77 -3.011 4.904 -2.330
629 HG23 VAL 77 2HG2 VAL 77 -2.960 3.165 -2.047
630 H LEU 78 HN LEU 78 -1.315 4.662 2.273
631 HA LEU 78 HA LEU 78 -3.367 5.201 4.136
632 HB2 LEU 78 2HB LEU 78 -0.466 4.480 4.547
633 HB3 LEU 78 1HB LEU 78 -1.645 4.569 5.843
634 HG LEU 78 HG LEU 78 -1.767 2.673 3.496
635 HD11 LEU 78 1HD1 LEU 78 -1.185 2.149 6.403
636 HD12 LEU 78 2HD1 LEU 78 0.014 2.160 5.111
637 HD13 LEU 78 3HD1 LEU 78 -1.268 0.948 5.117
638 HD21 LEU 78 3HD2 LEU 78 -3.623 1.646 4.728
639 HD22 LEU 78 1HD2 LEU 78 -3.988 3.306 4.262
640 HD23 LEU 78 2HD2 LEU 78 -3.536 2.937 5.926
641 H ASP 79 HN ASP 79 -0.341 6.870 3.382
642 HA ASP 79 HA ASP 79 -0.488 8.758 5.486
643 HB2 ASP 79 2HB ASP 79 1.594 8.377 4.291
644 HB3 ASP 79 1HB ASP 79 0.871 8.948 2.791
645 H TRP 80 HN TRP 80 -1.632 8.785 2.152
646 HA TRP 80 HA TRP 80 -2.615 11.397 2.033
647 HB2 TRP 80 2HB TRP 80 -2.453 10.072 0.038
648 HB3 TRP 80 1HB TRP 80 -3.528 8.846 0.698
649 HD1 TRP 80 1HD TRP 80 -3.686 12.520 -0.535
650 HE1 TRP 80 1HE TRP 80 -6.051 12.940 -1.469
651 HE3 TRP 80 3HE TRP 80 -5.830 8.029 0.636
652 HZ2 TRP 80 2HZ TRP 80 -8.498 11.538 -1.690
653 HZ3 TRP 80 3HZ TRP 80 -8.182 7.650 0.026
654 HH2 TRP 80 2HH TRP 80 -9.487 9.367 -1.110
655 H ALA 81 HN ALA 81 -4.293 8.390 2.959
656 HA ALA 81 HA ALA 81 -6.775 9.574 3.539
657 HB1 ALA 81 1HB ALA 81 -5.577 7.082 4.751
658 HB2 ALA 81 2HB ALA 81 -6.469 7.156 3.232
659 HB3 ALA 81 3HB ALA 81 -7.284 7.524 4.753
660 H THR 82 HN THR 82 -3.954 8.962 5.595
661 HA THR 82 HA THR 82 -5.145 9.747 8.025
662 HB THR 82 HB THR 82 -2.212 9.904 7.284
663 HG1 THR 82 1HG THR 82 -2.806 7.799 6.987
664 HG21 THR 82 3HG2 THR 82 -1.856 9.596 9.711
665 HG22 THR 82 1HG2 THR 82 -3.598 9.695 9.967
666 HG23 THR 82 2HG2 THR 82 -2.715 11.093 9.354
667 H VAL 83 HN VAL 83 -3.265 11.581 5.615
668 HA VAL 83 HA VAL 83 -3.336 14.037 7.042
669 HB VAL 83 HB VAL 83 -2.932 13.519 4.091
670 HG11 VAL 83 1HG1 VAL 83 -1.975 15.782 4.002
671 HG12 VAL 83 2HG1 VAL 83 -2.456 16.040 5.680
672 HG13 VAL 83 3HG1 VAL 83 -3.684 15.805 4.437
673 HG21 VAL 83 3HG2 VAL 83 -1.219 12.502 5.470
674 HG22 VAL 83 1HG2 VAL 83 -0.971 14.026 6.325
675 HG23 VAL 83 2HG2 VAL 83 -0.556 13.894 4.616
676 H ARG 84 HN ARG 84 -5.419 12.607 4.568
677 HA ARG 84 HA ARG 84 -7.070 14.897 4.214
678 HB2 ARG 84 2HB ARG 84 -7.539 11.980 3.608
679 HB3 ARG 84 1HB ARG 84 -8.665 13.251 3.162
680 HG2 ARG 84 2HG ARG 84 -5.815 12.975 2.226
681 HG3 ARG 84 1HG ARG 84 -7.267 12.635 1.284
682 HD2 ARG 84 2HD ARG 84 -6.605 15.336 2.445
683 HD3 ARG 84 1HD ARG 84 -6.192 14.845 0.804
684 HE ARG 84 HE ARG 84 -8.941 14.423 1.195
685 HH11 ARG 84 1HH1 ARG 84 -6.671 17.090 1.034
686 HH12 ARG 84 2HH1 ARG 84 -7.821 18.195 0.337
687 HH21 ARG 84 1HH2 ARG 84 -10.468 15.888 0.307
688 HH22 ARG 84 2HH2 ARG 84 -9.968 17.503 -0.092
689 H GLY 85 HN GLY 85 -6.876 12.573 6.691
690 HA2 GLY 85 2HA GLY 85 -7.925 12.843 8.772
691 HA3 GLY 85 1HA GLY 85 -9.141 13.852 8.006
692 H TYR 86 HN TYR 86 -8.203 10.707 6.776
693 HA TYR 86 HA TYR 86 -10.907 9.738 7.144
694 HB2 TYR 86 2HB TYR 86 -8.484 8.735 5.707
695 HB3 TYR 86 1HB TYR 86 -9.754 7.591 6.129
696 HD1 TYR 86 2HD TYR 86 -11.956 7.746 5.125
697 HD2 TYR 86 1HD TYR 86 -8.861 10.447 4.017
698 HE1 TYR 86 2HE TYR 86 -13.252 8.405 3.146
699 HE2 TYR 86 1HE TYR 86 -10.153 11.119 2.033
700 HH TYR 86 HH TYR 86 -13.423 10.343 1.628
701 H ARG 87 HN ARG 87 -8.004 9.668 8.879
702 HA ARG 87 HA ARG 87 -9.196 8.161 10.982
703 HB2 ARG 87 2HB ARG 87 -7.775 6.266 11.045
704 HB3 ARG 87 1HB ARG 87 -8.357 6.372 9.391
705 HG2 ARG 87 2HG ARG 87 -6.230 7.417 8.731
706 HG3 ARG 87 1HG ARG 87 -5.645 7.229 10.386
707 HD2 ARG 87 2HD ARG 87 -6.398 4.717 9.947
708 HD3 ARG 87 1HD ARG 87 -6.088 5.189 8.277
709 HE ARG 87 HE ARG 87 -3.860 6.013 9.578
710 HH11 ARG 87 1HH1 ARG 87 -5.551 2.957 9.330
711 HH12 ARG 87 2HH1 ARG 87 -4.156 1.999 9.730
712 HH21 ARG 87 1HH2 ARG 87 -2.014 4.745 10.111
713 HH22 ARG 87 2HH2 ARG 87 -2.162 3.017 10.170
714 H GLU 88 HN GLU 88 -7.669 8.003 12.867
715 HA GLU 88 HA GLU 88 -6.030 10.422 12.949
716 HB2 GLU 88 2HB GLU 88 -6.979 8.616 15.179
717 HB3 GLU 88 1HB GLU 88 -6.095 10.120 15.391
718 HG2 GLU 88 2HG GLU 88 -8.841 9.830 14.197
719 HG3 GLU 88 1HG GLU 88 -8.462 10.419 15.816
720 H GLY 89 HN GLY 89 -4.090 10.167 14.543
721 HA2 GLY 89 2HA GLY 89 -2.225 8.995 15.296
722 HA3 GLY 89 1HA GLY 89 -2.808 7.569 14.452
723 H ASP 90 HN ASP 90 -1.445 6.944 12.966
724 HA ASP 90 HA ASP 90 -0.371 8.761 10.996
725 HB2 ASP 90 2HB ASP 90 1.163 8.707 13.143
726 HB3 ASP 90 1HB ASP 90 1.653 7.137 12.517
727 H ASN 91 HN ASN 91 1.102 7.307 9.434
728 HA ASN 91 HA ASN 91 -0.425 4.874 9.044
729 HB2 ASN 91 2HB ASN 91 0.606 4.829 6.833
730 HB3 ASN 91 1HB ASN 91 -0.168 6.367 7.134
731 HD21 ASN 91 1HD2 ASN 91 1.889 5.660 5.218
732 HD22 ASN 91 2HD2 ASN 91 3.230 6.692 5.554
733 HA PRO 92 HA PRO 92 2.784 2.381 10.656
734 HB2 PRO 92 2HB PRO 92 1.803 -0.024 10.037
735 HB3 PRO 92 1HB PRO 92 0.964 1.052 11.159
736 HG2 PRO 92 2HG PRO 92 0.345 0.420 8.319
737 HG3 PRO 92 1HG PRO 92 -0.759 0.768 9.658
738 HD2 PRO 92 2HD PRO 92 0.081 2.566 7.671
739 HD3 PRO 92 1HD PRO 92 -0.761 2.979 9.175
740 H ALA 93 HN ALA 93 2.615 2.987 7.454
741 HA ALA 93 HA ALA 93 4.247 0.829 6.461
742 HB1 ALA 93 1HB ALA 93 3.490 3.447 5.166
743 HB2 ALA 93 2HB ALA 93 2.619 1.920 5.000
744 HB3 ALA 93 3HB ALA 93 4.256 2.078 4.362
745 H ARG 94 HN ARG 94 4.806 3.655 8.192
746 HA ARG 94 HA ARG 94 7.491 4.076 7.192
747 HB2 ARG 94 2HB ARG 94 5.979 5.344 9.472
748 HB3 ARG 94 1HB ARG 94 7.592 5.807 8.971
749 HG2 ARG 94 2HG ARG 94 6.784 6.573 6.848
750 HG3 ARG 94 1HG ARG 94 5.167 5.960 7.197
751 HD2 ARG 94 2HD ARG 94 4.831 7.572 8.907
752 HD3 ARG 94 1HD ARG 94 6.533 8.033 8.899
753 HE ARG 94 HE ARG 94 5.908 8.728 6.449
754 HH11 ARG 94 1HH1 ARG 94 3.850 9.050 9.270
755 HH12 ARG 94 2HH1 ARG 94 3.171 10.559 8.745
756 HH21 ARG 94 1HH2 ARG 94 5.017 10.690 5.766
757 HH22 ARG 94 2HH2 ARG 94 3.797 11.475 6.725
758 H TRP 95 HN TRP 95 9.223 3.136 8.007
759 HA TRP 95 HA TRP 95 8.962 1.691 10.553
760 HB2 TRP 95 2HB TRP 95 10.130 0.861 7.954
761 HB3 TRP 95 1HB TRP 95 10.942 0.313 9.419
762 HD1 TRP 95 1HD TRP 95 9.108 -0.858 11.272
763 HE1 TRP 95 1HE TRP 95 7.307 -2.619 10.743
764 HE3 TRP 95 3HE TRP 95 8.655 -0.045 6.242
765 HZ2 TRP 95 2HZ TRP 95 5.886 -3.538 8.477
766 HZ3 TRP 95 3HZ TRP 95 7.050 -1.409 4.967
767 HH2 TRP 95 2HH TRP 95 5.695 -3.118 6.063
768 H ARG 96 HN ARG 96 10.074 2.581 12.098
769 HA ARG 96 HA ARG 96 12.238 4.377 11.659
770 HB2 ARG 96 2HB ARG 96 12.429 4.299 14.161
771 HB3 ARG 96 1HB ARG 96 10.839 4.741 13.562
772 HG2 ARG 96 2HG ARG 96 10.094 2.407 13.940
773 HG3 ARG 96 1HG ARG 96 11.672 2.052 14.642
774 HD2 ARG 96 2HD ARG 96 11.298 3.678 16.390
775 HD3 ARG 96 1HD ARG 96 9.768 4.157 15.657
776 HE ARG 96 HE ARG 96 9.785 1.368 16.237
777 HH11 ARG 96 1HH1 ARG 96 9.476 4.519 17.742
778 HH12 ARG 96 2HH1 ARG 96 8.525 3.931 19.073
779 HH21 ARG 96 1HH2 ARG 96 8.523 0.586 18.001
780 HH22 ARG 96 2HH2 ARG 96 7.980 1.706 19.221
781 H GLY 97 HN GLY 97 11.986 1.023 12.629
782 HA2 GLY 97 2HA GLY 97 14.919 0.812 12.379
783 HA3 GLY 97 1HA GLY 97 13.995 -0.115 13.556
784 H TYR 98 HN TYR 98 11.849 -0.372 11.412
785 HA TYR 98 HA TYR 98 11.152 -1.888 9.886
786 HB2 TYR 98 2HB TYR 98 12.919 -0.824 8.502
787 HB3 TYR 98 1HB TYR 98 14.068 -2.013 9.091
788 HD1 TYR 98 2HD TYR 98 10.645 -2.059 7.558
789 HD2 TYR 98 1HD TYR 98 14.583 -3.673 7.587
790 HE1 TYR 98 2HE TYR 98 10.038 -3.560 5.705
791 HE2 TYR 98 1HE TYR 98 13.988 -5.173 5.733
792 HH TYR 98 HH TYR 98 12.027 -6.165 4.716
793 H LEU 99 HN LEU 99 11.600 -4.287 9.143
794 HA LEU 99 HA LEU 99 11.643 -5.914 11.438
795 HB2 LEU 99 2HB LEU 99 12.064 -6.721 8.557
796 HB3 LEU 99 1HB LEU 99 11.640 -7.801 9.873
797 HG LEU 99 HG LEU 99 9.897 -5.551 8.855
798 HD11 LEU 99 1HD1 LEU 99 10.108 -7.311 7.196
799 HD12 LEU 99 2HD1 LEU 99 8.504 -7.346 7.928
800 HD13 LEU 99 3HD1 LEU 99 9.720 -8.528 8.412
801 HD21 LEU 99 3HD2 LEU 99 8.169 -6.584 10.237
802 HD22 LEU 99 1HD2 LEU 99 9.539 -6.063 11.217
803 HD23 LEU 99 2HD2 LEU 99 9.335 -7.770 10.823
804 H GLU 100 HN GLU 100 14.103 -4.934 9.192
805 HA GLU 100 HA GLU 100 16.113 -6.715 10.297
806 HB2 GLU 100 2HB GLU 100 15.845 -5.896 7.823
807 HB3 GLU 100 1HB GLU 100 16.645 -4.444 8.403
808 HG2 GLU 100 2HG GLU 100 18.472 -6.000 9.262
809 HG3 GLU 100 1HG GLU 100 17.721 -7.235 8.251
810 H HIS 101 HN HIS 101 18.237 -4.647 10.013
811 HA HIS 101 HA HIS 101 17.488 -2.747 12.108
812 HB2 HIS 101 2HB HIS 101 18.608 -4.585 13.277
813 HB3 HIS 101 1HB HIS 101 19.983 -4.461 12.186
814 HD1 HIS 101 1HD HIS 101 21.878 -3.216 13.127
815 HD2 HIS 101 2HD HIS 101 18.252 -1.933 14.722
816 HE1 HIS 101 1HE HIS 101 22.466 -1.445 14.814
817 HE2 HIS 101 2HE HIS 101 20.270 -0.759 15.845
818 H HIS 102 HN HIS 102 17.384 -1.343 10.271
819 HA HIS 102 HA HIS 102 18.156 0.316 8.935
820 HB2 HIS 102 2HB HIS 102 19.098 0.975 11.189
821 HB3 HIS 102 1HB HIS 102 20.626 0.271 10.678
822 HD1 HIS 102 1HD HIS 102 18.454 3.248 10.242
823 HD2 HIS 102 2HD HIS 102 22.007 1.741 8.689
824 HE1 HIS 102 1HE HIS 102 19.521 5.162 9.004
825 HE2 HIS 102 2HE HIS 102 21.568 4.170 7.911
826 H HIS 103 HN HIS 103 18.339 -1.081 7.104
827 HA HIS 103 HA HIS 103 20.713 -2.568 6.597
828 HB2 HIS 103 2HB HIS 103 18.369 -3.045 5.686
829 HB3 HIS 103 1HB HIS 103 18.688 -1.777 4.507
830 HD1 HIS 103 1HD HIS 103 19.364 -2.761 2.348
831 HD2 HIS 103 2HD HIS 103 20.792 -4.983 5.565
832 HE1 HIS 103 1HE HIS 103 20.629 -4.693 1.340
833 HE2 HIS 103 2HE HIS 103 21.284 -6.135 3.303
834 H HIS 104 HN HIS 104 22.574 -1.625 6.235
835 HA HIS 104 HA HIS 104 22.699 0.784 4.545
836 HB2 HIS 104 2HB HIS 104 23.672 0.901 6.849
837 HB3 HIS 104 1HB HIS 104 24.800 -0.371 6.407
838 HD1 HIS 104 1HD HIS 104 26.933 0.322 5.264
839 HD2 HIS 104 2HD HIS 104 24.126 3.398 5.453
840 HE1 HIS 104 1HE HIS 104 28.132 2.393 4.495
841 HE2 HIS 104 2HE HIS 104 26.456 4.260 4.727
842 H HIS 105 HN HIS 105 22.440 -2.104 3.729
843 HA HIS 105 HA HIS 105 23.362 -3.737 2.447
844 HB2 HIS 105 2HB HIS 105 25.119 -1.444 1.534
845 HB3 HIS 105 1HB HIS 105 25.279 -3.074 0.897
846 HD1 HIS 105 1HD HIS 105 24.738 -1.726 -1.397
847 HD2 HIS 105 2HD HIS 105 21.601 -2.206 1.296
848 HE1 HIS 105 1HE HIS 105 22.636 -1.315 -2.719
849 HE2 HIS 105 2HE HIS 105 20.750 -1.790 -1.113
850 H HIS 106 HN HIS 106 26.450 -2.141 2.710
851 HA HIS 106 HA HIS 106 27.144 -3.342 5.223
852 HB2 HIS 106 2HB HIS 106 28.390 -4.307 2.656
853 HB3 HIS 106 1HB HIS 106 29.314 -4.303 4.153
854 HD1 HIS 106 1HD HIS 106 27.549 -6.585 2.207
855 HD2 HIS 106 2HD HIS 106 27.479 -5.678 6.265
856 HE1 HIS 106 1HE HIS 106 26.550 -8.594 3.333
857 HE2 HIS 106 2HE HIS 106 26.273 -7.906 5.744
Start of MODEL 15
1 H1 MET 1 H1 MET 1 -14.570 2.841 6.261
2 H2 MET 1 H2 MET 1 -15.589 1.677 5.567
3 H3 MET 1 H3 MET 1 -15.927 3.327 5.367
4 HA MET 1 HA MET 1 -15.004 2.527 3.354
5 HB2 MET 1 2HB MET 1 -14.289 4.775 4.134
6 HB3 MET 1 1HB MET 1 -12.903 4.043 4.932
7 HG2 MET 1 2HG MET 1 -12.113 4.923 2.885
8 HG3 MET 1 1HG MET 1 -12.198 3.176 2.688
9 HE1 MET 1 2HE MET 1 -13.947 6.606 1.871
10 HE2 MET 1 3HE MET 1 -15.215 5.697 2.689
11 HE3 MET 1 1HE MET 1 -15.367 6.068 0.972
12 H THR 2 HN THR 2 -13.998 0.848 2.429
13 HA THR 2 HA THR 2 -12.176 -0.728 4.080
14 HB THR 2 HB THR 2 -12.307 -2.419 2.272
15 HG1 THR 2 1HG THR 2 -14.347 -0.783 1.144
16 HG21 THR 2 3HG2 THR 2 -14.970 -1.437 3.302
17 HG22 THR 2 1HG2 THR 2 -13.867 -2.531 4.135
18 HG23 THR 2 2HG2 THR 2 -14.657 -3.043 2.643
19 H PHE 3 HN PHE 3 -10.253 -1.710 2.875
20 HA PHE 3 HA PHE 3 -8.549 0.430 2.165
21 HB2 PHE 3 2HB PHE 3 -7.767 -1.652 3.256
22 HB3 PHE 3 1HB PHE 3 -8.111 -2.543 1.778
23 HD1 PHE 3 1HD PHE 3 -6.061 0.247 3.121
24 HD2 PHE 3 2HD PHE 3 -6.487 -2.748 0.128
25 HE1 PHE 3 1HE PHE 3 -3.792 0.743 2.307
26 HE2 PHE 3 2HE PHE 3 -4.223 -2.256 -0.692
27 HZ PHE 3 HZ PHE 3 -2.870 -0.514 0.396
28 H SER 4 HN SER 4 -10.229 -2.028 0.266
29 HA SER 4 HA SER 4 -9.039 -1.410 -2.216
30 HB2 SER 4 2HB SER 4 -10.337 -3.492 -1.732
31 HB3 SER 4 1HB SER 4 -11.812 -2.530 -1.734
32 HG SER 4 HG SER 4 -10.718 -3.669 -3.789
33 H GLU 5 HN GLU 5 -11.932 -0.180 -0.590
34 HA GLU 5 HA GLU 5 -12.835 1.490 -2.677
35 HB2 GLU 5 2HB GLU 5 -13.211 1.623 0.315
36 HB3 GLU 5 1HB GLU 5 -14.018 2.695 -0.811
37 HG2 GLU 5 2HG GLU 5 -15.137 0.825 -1.847
38 HG3 GLU 5 1HG GLU 5 -14.282 -0.291 -0.780
39 H CYS 6 HN CYS 6 -10.845 2.126 0.185
40 HA CYS 6 HA CYS 6 -10.498 4.883 -0.212
41 HB2 CYS 6 2HB CYS 6 -9.974 3.505 1.864
42 HB3 CYS 6 1HB CYS 6 -8.476 3.050 1.080
43 HG CYS 6 HG CYS 6 -7.823 5.893 0.754
44 H ALA 7 HN ALA 7 -8.495 2.129 -1.156
45 HA ALA 7 HA ALA 7 -6.452 3.539 -2.447
46 HB1 ALA 7 1HB ALA 7 -6.302 1.152 -1.920
47 HB2 ALA 7 2HB ALA 7 -5.961 1.460 -3.625
48 HB3 ALA 7 3HB ALA 7 -7.526 0.807 -3.141
49 H ALA 8 HN ALA 8 -9.489 2.230 -3.755
50 HA ALA 8 HA ALA 8 -9.072 3.021 -6.422
51 HB1 ALA 8 1HB ALA 8 -10.758 1.378 -5.760
52 HB2 ALA 8 2HB ALA 8 -11.465 2.677 -6.719
53 HB3 ALA 8 3HB ALA 8 -11.689 2.649 -4.970
54 H LEU 9 HN LEU 9 -10.306 4.752 -3.629
55 HA LEU 9 HA LEU 9 -11.223 7.029 -5.094
56 HB2 LEU 9 2HB LEU 9 -10.481 6.684 -2.192
57 HB3 LEU 9 1HB LEU 9 -11.165 8.155 -2.854
58 HG LEU 9 HG LEU 9 -12.509 5.455 -2.768
59 HD11 LEU 9 1HD1 LEU 9 -13.074 8.016 -1.284
60 HD12 LEU 9 2HD1 LEU 9 -12.385 6.545 -0.597
61 HD13 LEU 9 3HD1 LEU 9 -14.038 6.541 -1.209
62 HD21 LEU 9 3HD2 LEU 9 -14.467 6.593 -3.649
63 HD22 LEU 9 1HD2 LEU 9 -13.118 6.719 -4.780
64 HD23 LEU 9 2HD2 LEU 9 -13.558 8.099 -3.774
65 H TYR 10 HN TYR 10 -8.257 6.245 -3.327
66 HA TYR 10 HA TYR 10 -6.869 8.635 -3.654
67 HB2 TYR 10 2HB TYR 10 -5.986 6.942 -2.205
68 HB3 TYR 10 1HB TYR 10 -5.897 5.776 -3.516
69 HD1 TYR 10 2HD TYR 10 -4.552 9.161 -2.640
70 HD2 TYR 10 1HD TYR 10 -3.851 5.392 -4.475
71 HE1 TYR 10 2HE TYR 10 -2.229 9.823 -3.099
72 HE2 TYR 10 1HE TYR 10 -1.526 6.039 -4.934
73 HH TYR 10 HH TYR 10 -0.174 8.006 -5.170
74 H ILE 11 HN ILE 11 -6.945 5.776 -5.710
75 HA ILE 11 HA ILE 11 -5.187 6.648 -7.692
76 HB ILE 11 HB ILE 11 -7.538 4.761 -7.934
77 HG12 ILE 11 2HG1 ILE 11 -4.584 4.203 -7.580
78 HG13 ILE 11 1HG1 ILE 11 -5.762 4.181 -6.274
79 HG21 ILE 11 1HG2 ILE 11 -6.888 5.573 -10.136
80 HG22 ILE 11 2HG2 ILE 11 -6.410 3.886 -9.935
81 HG23 ILE 11 3HG2 ILE 11 -5.204 5.166 -9.806
82 HD11 ILE 11 3HD1 ILE 11 -5.757 2.372 -8.672
83 HD12 ILE 11 1HD1 ILE 11 -6.946 2.357 -7.369
84 HD13 ILE 11 2HD1 ILE 11 -5.265 1.941 -7.035
85 H LYS 12 HN LYS 12 -8.687 7.152 -7.384
86 HA LYS 12 HA LYS 12 -8.980 8.437 -9.917
87 HB2 LYS 12 2HB LYS 12 -10.720 8.520 -7.447
88 HB3 LYS 12 1HB LYS 12 -11.164 9.221 -8.995
89 HG2 LYS 12 2HG LYS 12 -11.123 7.029 -10.031
90 HG3 LYS 12 1HG LYS 12 -10.609 6.303 -8.506
91 HD2 LYS 12 2HD LYS 12 -12.689 7.074 -7.455
92 HD3 LYS 12 1HD LYS 12 -13.203 7.760 -8.995
93 HE2 LYS 12 2HE LYS 12 -14.247 5.582 -8.572
94 HE3 LYS 12 1HE LYS 12 -13.215 5.548 -10.002
95 HZ1 LYS 12 3HZ LYS 12 -11.716 4.183 -9.010
96 HZ2 LYS 12 1HZ LYS 12 -13.107 3.682 -8.169
97 HZ3 LYS 12 2HZ LYS 12 -12.023 4.770 -7.449
98 H ALA 13 HN ALA 13 -8.565 9.643 -6.609
99 HA ALA 13 HA ALA 13 -8.896 12.380 -7.299
100 HB1 ALA 13 1HB ALA 13 -9.277 11.553 -5.034
101 HB2 ALA 13 2HB ALA 13 -8.077 12.845 -5.047
102 HB3 ALA 13 3HB ALA 13 -7.563 11.167 -4.883
103 H HIS 14 HN HIS 14 -6.174 10.222 -7.312
104 HA HIS 14 HA HIS 14 -4.337 12.490 -7.707
105 HB2 HIS 14 2HB HIS 14 -4.075 10.507 -5.927
106 HB3 HIS 14 1HB HIS 14 -3.329 9.713 -7.305
107 HD1 HIS 14 1HD HIS 14 -1.128 10.841 -8.257
108 HD2 HIS 14 2HD HIS 14 -2.526 12.376 -4.655
109 HE1 HIS 14 1HE HIS 14 0.785 12.162 -7.294
110 HE2 HIS 14 2HE HIS 14 -0.012 12.881 -5.012
111 H ARG 15 HN ARG 15 -6.173 10.670 -9.596
112 HA ARG 15 HA ARG 15 -4.360 9.358 -11.333
113 HB2 ARG 15 2HB ARG 15 -6.204 8.940 -12.781
114 HB3 ARG 15 1HB ARG 15 -6.825 8.832 -11.141
115 HG2 ARG 15 2HG ARG 15 -7.842 10.993 -11.322
116 HG3 ARG 15 1HG ARG 15 -7.079 11.268 -12.884
117 HD2 ARG 15 2HD ARG 15 -8.394 8.922 -13.320
118 HD3 ARG 15 1HD ARG 15 -9.486 9.743 -12.204
119 HE ARG 15 HE ARG 15 -8.515 11.043 -14.672
120 HH11 ARG 15 1HH1 ARG 15 -11.159 10.037 -12.586
121 HH12 ARG 15 2HH1 ARG 15 -12.368 10.880 -13.507
122 HH21 ARG 15 1HH2 ARG 15 -10.100 12.104 -15.904
123 HH22 ARG 15 2HH2 ARG 15 -11.761 12.082 -15.387
124 H SER 16 HN SER 16 -5.784 12.569 -11.331
125 HA SER 16 HA SER 16 -5.060 13.283 -13.949
126 HB2 SER 16 2HB SER 16 -5.400 15.158 -11.614
127 HB3 SER 16 1HB SER 16 -5.763 15.450 -13.312
128 HG SER 16 HG SER 16 -7.719 14.918 -12.660
129 H SER 17 HN SER 17 -3.369 13.300 -10.911
130 HA SER 17 HA SER 17 -1.222 14.986 -11.685
131 HB2 SER 17 2HB SER 17 -1.815 14.526 -9.320
132 HB3 SER 17 1HB SER 17 -1.305 12.853 -9.530
133 HG SER 17 HG SER 17 0.352 15.147 -9.849
134 H TRP 18 HN TRP 18 -1.851 11.543 -11.984
135 HA TRP 18 HA TRP 18 0.882 11.005 -12.848
136 HB2 TRP 18 2HB TRP 18 -1.490 9.134 -12.796
137 HB3 TRP 18 1HB TRP 18 0.190 8.684 -13.031
138 HD1 TRP 18 1HD TRP 18 1.418 10.316 -10.550
139 HE1 TRP 18 1HE TRP 18 0.984 9.416 -8.164
140 HE3 TRP 18 3HE TRP 18 -2.715 7.475 -11.515
141 HZ2 TRP 18 2HZ TRP 18 -0.882 7.726 -6.883
142 HZ3 TRP 18 3HZ TRP 18 -3.764 6.241 -9.665
143 HH2 TRP 18 2HH TRP 18 -2.864 6.366 -7.395
144 H LYS 19 HN LYS 19 -2.326 11.399 -14.174
145 HA LYS 19 HA LYS 19 -3.344 10.822 -16.104
146 HB2 LYS 19 2HB LYS 19 -1.121 12.043 -17.029
147 HB3 LYS 19 1HB LYS 19 -0.822 10.417 -17.631
148 HG2 LYS 19 2HG LYS 19 -2.802 10.431 -18.928
149 HG3 LYS 19 1HG LYS 19 -3.388 11.895 -18.136
150 HD2 LYS 19 2HD LYS 19 -1.349 13.063 -19.079
151 HD3 LYS 19 1HD LYS 19 -1.095 11.618 -20.063
152 HE2 LYS 19 2HE LYS 19 -2.303 13.298 -21.330
153 HE3 LYS 19 1HE LYS 19 -3.333 11.901 -21.032
154 HZ1 LYS 19 3HZ LYS 19 -4.532 13.063 -19.391
155 HZ2 LYS 19 1HZ LYS 19 -4.386 14.141 -20.691
156 HZ3 LYS 19 2HZ LYS 19 -3.404 14.326 -19.326
157 H ASN 20 HN ASN 20 -3.411 7.565 -15.358
158 HA ASN 20 HA ASN 20 -5.498 8.107 -15.967
159 HB2 ASN 20 2HB ASN 20 -4.739 10.558 -15.414
160 HB3 ASN 20 1HB ASN 20 -4.647 10.738 -17.157
161 HD21 ASN 20 1HD2 ASN 20 -6.913 9.177 -17.863
162 HD22 ASN 20 2HD2 ASN 20 -8.319 10.032 -17.312
163 H THR 21 HN THR 21 -2.921 7.494 -17.648
164 HA THR 21 HA THR 21 -4.457 6.962 -20.094
165 HB THR 21 HB THR 21 -2.147 6.283 -20.988
166 HG1 THR 21 1HG THR 21 -0.391 6.864 -19.864
167 HG21 THR 21 3HG2 THR 21 -1.547 8.599 -21.551
168 HG22 THR 21 1HG2 THR 21 -2.638 9.187 -20.296
169 HG23 THR 21 2HG2 THR 21 -3.283 8.335 -21.699
170 H LYS 22 HN LYS 22 -1.619 5.215 -18.945
171 HA LYS 22 HA LYS 22 -3.290 2.842 -18.454
172 HB2 LYS 22 2HB LYS 22 -0.328 3.073 -19.022
173 HB3 LYS 22 1HB LYS 22 -1.146 1.574 -18.631
174 HG2 LYS 22 2HG LYS 22 -2.564 1.923 -20.665
175 HG3 LYS 22 1HG LYS 22 -1.506 3.275 -21.078
176 HD2 LYS 22 2HD LYS 22 -0.664 0.398 -20.704
177 HD3 LYS 22 1HD LYS 22 -0.811 1.247 -22.244
178 HE2 LYS 22 2HE LYS 22 0.988 2.728 -21.666
179 HE3 LYS 22 1HE LYS 22 1.046 2.089 -20.024
180 HZ1 LYS 22 3HZ LYS 22 1.765 0.637 -22.518
181 HZ2 LYS 22 1HZ LYS 22 1.695 -0.075 -20.980
182 HZ3 LYS 22 2HZ LYS 22 2.822 1.146 -21.300
183 H HIS 23 HN HIS 23 -1.360 5.230 -16.996
184 HA HIS 23 HA HIS 23 -0.034 3.875 -14.967
185 HB2 HIS 23 2HB HIS 23 -1.098 6.690 -15.052
186 HB3 HIS 23 1HB HIS 23 -0.157 6.078 -13.698
187 HD1 HIS 23 1HD HIS 23 2.275 6.455 -13.872
188 HD2 HIS 23 2HD HIS 23 0.428 6.472 -17.598
189 HE1 HIS 23 1HE HIS 23 4.080 7.049 -15.525
190 HE2 HIS 23 2HE HIS 23 2.969 6.908 -17.788
191 H ALA 24 HN ALA 24 -3.371 4.948 -15.060
192 HA ALA 24 HA ALA 24 -3.920 4.677 -12.296
193 HB1 ALA 24 1HB ALA 24 -6.284 4.687 -12.969
194 HB2 ALA 24 2HB ALA 24 -5.802 4.497 -14.656
195 HB3 ALA 24 3HB ALA 24 -5.371 5.965 -13.774
196 H ASP 25 HN ASP 25 -4.133 2.442 -15.033
197 HA ASP 25 HA ASP 25 -5.344 0.339 -13.518
198 HB2 ASP 25 2HB ASP 25 -5.385 0.645 -16.076
199 HB3 ASP 25 1HB ASP 25 -3.776 -0.057 -16.067
200 H GLN 26 HN GLN 26 -2.082 1.254 -14.429
201 HA GLN 26 HA GLN 26 -0.681 -1.001 -13.594
202 HB2 GLN 26 2HB GLN 26 0.089 1.916 -13.619
203 HB3 GLN 26 1HB GLN 26 1.220 0.616 -13.295
204 HG2 GLN 26 2HG GLN 26 -0.390 0.782 -15.820
205 HG3 GLN 26 1HG GLN 26 1.202 1.518 -15.643
206 HE21 GLN 26 1HE2 GLN 26 2.052 0.200 -17.265
207 HE22 GLN 26 2HE2 GLN 26 2.382 -1.477 -17.003
208 H TRP 27 HN TRP 27 -1.688 1.862 -11.763
209 HA TRP 27 HA TRP 27 -0.553 0.982 -9.302
210 HB2 TRP 27 2HB TRP 27 -2.369 3.165 -10.167
211 HB3 TRP 27 1HB TRP 27 -2.434 2.704 -8.469
212 HD1 TRP 27 1HD TRP 27 0.159 3.929 -11.081
213 HE1 TRP 27 1HE TRP 27 2.008 5.216 -9.822
214 HE3 TRP 27 3HE TRP 27 -1.428 3.125 -6.288
215 HZ2 TRP 27 2HZ TRP 27 2.690 5.808 -7.150
216 HZ3 TRP 27 3HZ TRP 27 -0.123 4.086 -4.437
217 HH2 TRP 27 2HH TRP 27 1.892 5.398 -4.857
218 H THR 28 HN THR 28 -3.823 0.873 -10.660
219 HA THR 28 HA THR 28 -5.116 -0.232 -8.435
220 HB THR 28 HB THR 28 -5.837 -0.591 -11.352
221 HG1 THR 28 1HG THR 28 -5.792 1.596 -10.913
222 HG21 THR 28 3HG2 THR 28 -8.126 -0.889 -10.516
223 HG22 THR 28 1HG2 THR 28 -7.530 -0.794 -8.859
224 HG23 THR 28 2HG2 THR 28 -7.043 -2.136 -9.896
225 H ASN 29 HN ASN 29 -3.681 -1.800 -11.278
226 HA ASN 29 HA ASN 29 -4.726 -4.344 -10.926
227 HB2 ASN 29 2HB ASN 29 -3.456 -3.386 -12.920
228 HB3 ASN 29 1HB ASN 29 -1.978 -3.772 -12.050
229 HD21 ASN 29 1HD2 ASN 29 -4.647 -4.973 -13.842
230 HD22 ASN 29 2HD2 ASN 29 -4.105 -6.603 -13.981
231 H THR 30 HN THR 30 -1.570 -3.128 -9.830
232 HA THR 30 HA THR 30 -0.659 -5.516 -8.689
233 HB THR 30 HB THR 30 0.034 -2.756 -7.702
234 HG1 THR 30 1HG THR 30 1.070 -4.157 -9.974
235 HG21 THR 30 3HG2 THR 30 1.647 -5.299 -7.905
236 HG22 THR 30 1HG2 THR 30 0.979 -4.618 -6.422
237 HG23 THR 30 2HG2 THR 30 2.237 -3.750 -7.303
238 H ILE 31 HN ILE 31 -2.216 -2.708 -7.149
239 HA ILE 31 HA ILE 31 -2.129 -3.797 -4.542
240 HB ILE 31 HB ILE 31 -3.903 -1.602 -5.626
241 HG12 ILE 31 2HG1 ILE 31 -1.246 -1.451 -4.184
242 HG13 ILE 31 1HG1 ILE 31 -1.483 -1.174 -5.908
243 HG21 ILE 31 1HG2 ILE 31 -4.776 -2.475 -3.541
244 HG22 ILE 31 2HG2 ILE 31 -4.076 -0.879 -3.281
245 HG23 ILE 31 3HG2 ILE 31 -3.192 -2.319 -2.783
246 HD11 ILE 31 3HD1 ILE 31 -2.632 0.482 -3.668
247 HD12 ILE 31 1HD1 ILE 31 -2.891 0.758 -5.391
248 HD13 ILE 31 2HD1 ILE 31 -1.275 0.919 -4.707
249 H LYS 32 HN LYS 32 -4.638 -3.695 -7.026
250 HA LYS 32 HA LYS 32 -6.715 -4.764 -5.450
251 HB2 LYS 32 2HB LYS 32 -6.801 -3.624 -7.791
252 HB3 LYS 32 1HB LYS 32 -6.475 -5.235 -8.410
253 HG2 LYS 32 2HG LYS 32 -8.480 -6.091 -7.383
254 HG3 LYS 32 1HG LYS 32 -8.803 -4.523 -6.641
255 HD2 LYS 32 2HD LYS 32 -9.018 -3.521 -8.869
256 HD3 LYS 32 1HD LYS 32 -8.709 -5.097 -9.602
257 HE2 LYS 32 2HE LYS 32 -11.016 -4.434 -7.773
258 HE3 LYS 32 1HE LYS 32 -11.107 -4.563 -9.529
259 HZ1 LYS 32 3HZ LYS 32 -10.527 -6.875 -9.396
260 HZ2 LYS 32 1HZ LYS 32 -11.854 -6.582 -8.382
261 HZ3 LYS 32 2HZ LYS 32 -10.305 -6.783 -7.718
262 H THR 33 HN THR 33 -4.096 -6.220 -7.233
263 HA THR 33 HA THR 33 -5.256 -8.860 -7.162
264 HB THR 33 HB THR 33 -2.514 -7.951 -8.062
265 HG1 THR 33 1HG THR 33 -3.879 -7.152 -9.539
266 HG21 THR 33 3HG2 THR 33 -2.398 -10.120 -9.207
267 HG22 THR 33 1HG2 THR 33 -3.940 -10.586 -8.491
268 HG23 THR 33 2HG2 THR 33 -2.532 -10.332 -7.462
269 H TYR 34 HN TYR 34 -2.390 -7.311 -5.661
270 HA TYR 34 HA TYR 34 -1.824 -9.703 -4.162
271 HB2 TYR 34 2HB TYR 34 -0.590 -6.950 -4.098
272 HB3 TYR 34 1HB TYR 34 -0.040 -8.286 -3.093
273 HD1 TYR 34 1HD TYR 34 1.010 -10.275 -4.151
274 HD2 TYR 34 2HD TYR 34 -0.018 -6.825 -6.414
275 HE1 TYR 34 1HE TYR 34 2.479 -11.038 -5.973
276 HE2 TYR 34 2HE TYR 34 1.439 -7.582 -8.239
277 HH TYR 34 HH TYR 34 2.746 -10.727 -8.391
278 H CYS 35 HN CYS 35 -2.987 -6.441 -3.311
279 HA CYS 35 HA CYS 35 -3.202 -7.197 -0.519
280 HB2 CYS 35 2HB CYS 35 -3.994 -4.617 -1.884
281 HB3 CYS 35 1HB CYS 35 -3.860 -4.876 -0.148
282 HG CYS 35 HG CYS 35 -1.462 -4.007 -0.044
283 H GLY 36 HN GLY 36 -5.277 -6.798 -3.269
284 HA2 GLY 36 2HA GLY 36 -7.731 -6.224 -2.180
285 HA3 GLY 36 1HA GLY 36 -7.503 -7.213 -3.610
286 HA PRO 37 HA PRO 37 -8.991 -10.900 -1.788
287 HB2 PRO 37 2HB PRO 37 -6.304 -12.177 -1.724
288 HB3 PRO 37 1HB PRO 37 -7.805 -12.743 -2.464
289 HG2 PRO 37 2HG PRO 37 -5.852 -11.767 -3.972
290 HG3 PRO 37 1HG PRO 37 -7.547 -11.391 -4.336
291 HD2 PRO 37 2HD PRO 37 -5.468 -9.693 -3.019
292 HD3 PRO 37 1HD PRO 37 -6.723 -9.234 -4.188
293 H VAL 38 HN VAL 38 -6.273 -9.458 -0.174
294 HA VAL 38 HA VAL 38 -6.750 -11.101 2.210
295 HB VAL 38 HB VAL 38 -4.480 -9.170 1.732
296 HG11 VAL 38 1HG1 VAL 38 -4.830 -11.353 3.787
297 HG12 VAL 38 2HG1 VAL 38 -4.963 -9.622 4.094
298 HG13 VAL 38 3HG1 VAL 38 -3.416 -10.315 3.604
299 HG21 VAL 38 3HG2 VAL 38 -4.584 -12.162 1.358
300 HG22 VAL 38 1HG2 VAL 38 -3.114 -11.189 1.331
301 HG23 VAL 38 2HG2 VAL 38 -4.350 -10.947 0.099
302 H ILE 39 HN ILE 39 -5.799 -7.681 1.751
303 HA ILE 39 HA ILE 39 -7.471 -7.049 4.089
304 HB ILE 39 HB ILE 39 -6.089 -4.998 4.305
305 HG12 ILE 39 2HG1 ILE 39 -4.418 -6.272 2.130
306 HG13 ILE 39 1HG1 ILE 39 -5.389 -4.816 1.949
307 HG21 ILE 39 1HG2 ILE 39 -4.065 -6.145 5.128
308 HG22 ILE 39 2HG2 ILE 39 -4.598 -7.617 4.318
309 HG23 ILE 39 3HG2 ILE 39 -5.555 -6.940 5.636
310 HD11 ILE 39 3HD1 ILE 39 -3.982 -3.660 3.557
311 HD12 ILE 39 1HD1 ILE 39 -3.025 -4.307 2.225
312 HD13 ILE 39 2HD1 ILE 39 -3.025 -5.125 3.787
313 H GLY 40 HN GLY 40 -7.781 -6.991 0.891
314 HA2 GLY 40 2HA GLY 40 -8.437 -4.414 0.097
315 HA3 GLY 40 1HA GLY 40 -9.159 -5.872 -0.562
316 HA PRO 41 HA PRO 41 -12.996 -4.893 1.391
317 HB2 PRO 41 2HB PRO 41 -13.394 -7.485 2.645
318 HB3 PRO 41 1HB PRO 41 -14.178 -6.814 1.216
319 HG2 PRO 41 2HG PRO 41 -12.436 -8.891 1.101
320 HG3 PRO 41 1HG PRO 41 -12.640 -7.730 -0.222
321 HD2 PRO 41 2HD PRO 41 -10.513 -7.849 1.886
322 HD3 PRO 41 1HD PRO 41 -10.357 -7.518 0.147
323 H LEU 42 HN LEU 42 -10.384 -5.370 3.333
324 HA LEU 42 HA LEU 42 -11.814 -5.229 5.857
325 HB2 LEU 42 2HB LEU 42 -8.870 -5.073 5.205
326 HB3 LEU 42 1HB LEU 42 -9.521 -4.979 6.830
327 HG LEU 42 HG LEU 42 -9.702 -7.356 4.975
328 HD11 LEU 42 1HD1 LEU 42 -8.176 -6.947 7.542
329 HD12 LEU 42 2HD1 LEU 42 -7.478 -7.011 5.922
330 HD13 LEU 42 3HD1 LEU 42 -8.251 -8.440 6.607
331 HD21 LEU 42 3HD2 LEU 42 -10.701 -7.020 7.800
332 HD22 LEU 42 1HD2 LEU 42 -10.710 -8.519 6.873
333 HD23 LEU 42 2HD2 LEU 42 -11.704 -7.155 6.358
334 H SER 43 HN SER 43 -11.621 -3.419 7.288
335 HA SER 43 HA SER 43 -12.132 -0.961 6.025
336 HB2 SER 43 2HB SER 43 -12.974 -1.561 8.281
337 HB3 SER 43 1HB SER 43 -11.334 -1.443 8.905
338 HG SER 43 HG SER 43 -13.121 0.562 8.162
339 H VAL 44 HN VAL 44 -10.901 0.844 5.694
340 HA VAL 44 HA VAL 44 -8.107 0.501 5.368
341 HB VAL 44 HB VAL 44 -9.460 2.079 4.012
342 HG11 VAL 44 1HG1 VAL 44 -10.874 3.003 5.772
343 HG12 VAL 44 2HG1 VAL 44 -10.032 4.283 4.897
344 HG13 VAL 44 3HG1 VAL 44 -9.471 3.792 6.496
345 HG21 VAL 44 3HG2 VAL 44 -7.135 3.321 5.477
346 HG22 VAL 44 1HG2 VAL 44 -7.806 3.897 3.952
347 HG23 VAL 44 2HG2 VAL 44 -7.050 2.306 4.036
348 H GLN 45 HN GLN 45 -10.072 1.476 8.014
349 HA GLN 45 HA GLN 45 -7.964 2.780 9.489
350 HB2 GLN 45 2HB GLN 45 -10.533 3.158 9.662
351 HB3 GLN 45 1HB GLN 45 -10.524 1.722 10.676
352 HG2 GLN 45 2HG GLN 45 -8.780 4.090 11.256
353 HG3 GLN 45 1HG GLN 45 -10.443 3.991 11.820
354 HE21 GLN 45 1HE2 GLN 45 -7.978 4.133 13.338
355 HE22 GLN 45 2HE2 GLN 45 -7.940 2.727 14.348
356 H ASP 46 HN ASP 46 -9.400 -0.410 9.246
357 HA ASP 46 HA ASP 46 -8.128 -1.515 11.532
358 HB2 ASP 46 2HB ASP 46 -9.537 -2.655 9.155
359 HB3 ASP 46 1HB ASP 46 -8.578 -3.721 10.173
360 H VAL 47 HN VAL 47 -7.090 -0.905 8.292
361 HA VAL 47 HA VAL 47 -5.005 -2.722 7.998
362 HB VAL 47 HB VAL 47 -5.062 0.154 7.050
363 HG11 VAL 47 1HG1 VAL 47 -2.809 -0.793 6.984
364 HG12 VAL 47 2HG1 VAL 47 -3.451 -0.584 5.354
365 HG13 VAL 47 3HG1 VAL 47 -3.412 -2.188 6.089
366 HG21 VAL 47 3HG2 VAL 47 -5.877 -0.794 4.933
367 HG22 VAL 47 1HG2 VAL 47 -6.992 -1.112 6.260
368 HG23 VAL 47 2HG2 VAL 47 -5.931 -2.392 5.675
369 H ASP 48 HN ASP 48 -3.439 -3.122 9.361
370 HA ASP 48 HA ASP 48 -2.056 -0.904 10.694
371 HB2 ASP 48 2HB ASP 48 -3.613 -1.849 12.309
372 HB3 ASP 48 1HB ASP 48 -3.026 -3.470 11.982
373 H THR 49 HN THR 49 -0.039 -1.881 11.826
374 HA THR 49 HA THR 49 1.786 -2.443 9.848
375 HB THR 49 HB THR 49 2.286 -3.368 12.652
376 HG1 THR 49 1HG THR 49 1.398 -1.478 13.207
377 HG21 THR 49 3HG2 THR 49 4.465 -2.319 12.260
378 HG22 THR 49 1HG2 THR 49 3.923 -1.776 10.672
379 HG23 THR 49 2HG2 THR 49 4.095 -3.500 11.003
380 H LYS 50 HN LYS 50 0.319 -4.773 12.138
381 HA LYS 50 HA LYS 50 1.916 -6.925 11.224
382 HB2 LYS 50 2HB LYS 50 -0.468 -6.684 13.024
383 HB3 LYS 50 1HB LYS 50 0.190 -8.241 12.582
384 HG2 LYS 50 2HG LYS 50 2.377 -7.548 13.489
385 HG3 LYS 50 1HG LYS 50 1.637 -6.032 14.008
386 HD2 LYS 50 2HD LYS 50 0.730 -8.772 14.886
387 HD3 LYS 50 1HD LYS 50 1.814 -7.732 15.810
388 HE2 LYS 50 2HE LYS 50 0.061 -6.016 15.906
389 HE3 LYS 50 1HE LYS 50 -1.017 -7.080 15.004
390 HZ1 LYS 50 3HZ LYS 50 -1.039 -8.627 16.785
391 HZ2 LYS 50 1HZ LYS 50 -1.344 -7.102 17.457
392 HZ3 LYS 50 2HZ LYS 50 0.188 -7.811 17.616
393 H LEU 51 HN LEU 51 -1.343 -5.778 10.454
394 HA LEU 51 HA LEU 51 -2.164 -7.986 8.925
395 HB2 LEU 51 2HB LEU 51 -2.869 -5.064 8.668
396 HB3 LEU 51 1HB LEU 51 -3.657 -6.341 7.773
397 HG LEU 51 HG LEU 51 -3.747 -5.873 10.741
398 HD11 LEU 51 1HD1 LEU 51 -6.151 -5.693 10.330
399 HD12 LEU 51 2HD1 LEU 51 -5.871 -5.944 8.608
400 HD13 LEU 51 3HD1 LEU 51 -5.243 -4.501 9.402
401 HD21 LEU 51 3HD2 LEU 51 -3.517 -8.277 10.296
402 HD22 LEU 51 1HD2 LEU 51 -4.887 -8.193 9.190
403 HD23 LEU 51 2HD2 LEU 51 -5.123 -7.873 10.906
404 H ILE 52 HN ILE 52 -0.362 -5.066 8.066
405 HA ILE 52 HA ILE 52 -0.116 -5.600 5.310
406 HB ILE 52 HB ILE 52 1.827 -4.115 7.098
407 HG12 ILE 52 2HG1 ILE 52 -0.484 -3.065 5.442
408 HG13 ILE 52 1HG1 ILE 52 -0.478 -3.220 7.196
409 HG21 ILE 52 1HG2 ILE 52 1.448 -4.002 4.104
410 HG22 ILE 52 2HG2 ILE 52 2.813 -4.732 4.952
411 HG23 ILE 52 3HG2 ILE 52 2.547 -2.991 5.045
412 HD11 ILE 52 3HD1 ILE 52 1.378 -1.469 5.601
413 HD12 ILE 52 1HD1 ILE 52 1.296 -1.584 7.359
414 HD13 ILE 52 2HD1 ILE 52 -0.067 -0.926 6.452
415 H MET 53 HN MET 53 1.872 -6.505 8.092
416 HA MET 53 HA MET 53 3.952 -7.763 6.701
417 HB2 MET 53 2HB MET 53 2.848 -8.240 9.466
418 HB3 MET 53 1HB MET 53 4.277 -9.057 8.853
419 HG2 MET 53 2HG MET 53 5.378 -6.895 8.547
420 HG3 MET 53 1HG MET 53 3.944 -6.084 9.172
421 HE1 MET 53 3HE MET 53 5.541 -4.823 10.911
422 HE2 MET 53 1HE MET 53 6.953 -5.711 10.327
423 HE3 MET 53 2HE MET 53 6.595 -5.659 12.052
424 H LYS 54 HN LYS 54 0.831 -9.015 7.825
425 HA LYS 54 HA LYS 54 1.298 -11.722 7.277
426 HB2 LYS 54 2HB LYS 54 -1.301 -10.188 7.204
427 HB3 LYS 54 1HB LYS 54 -1.181 -11.938 7.100
428 HG2 LYS 54 2HG LYS 54 0.089 -11.766 9.332
429 HG3 LYS 54 1HG LYS 54 -0.607 -10.146 9.424
430 HD2 LYS 54 2HD LYS 54 -2.110 -12.755 9.188
431 HD3 LYS 54 1HD LYS 54 -2.029 -11.711 10.607
432 HE2 LYS 54 2HE LYS 54 -3.164 -9.936 9.338
433 HE3 LYS 54 1HE LYS 54 -3.276 -11.011 7.946
434 HZ1 LYS 54 3HZ LYS 54 -4.590 -12.547 9.348
435 HZ2 LYS 54 1HZ LYS 54 -5.341 -11.040 9.133
436 HZ3 LYS 54 2HZ LYS 54 -4.566 -11.402 10.598
437 H VAL 55 HN VAL 55 0.228 -9.101 5.195
438 HA VAL 55 HA VAL 55 -0.370 -10.729 2.937
439 HB VAL 55 HB VAL 55 0.413 -7.807 2.936
440 HG11 VAL 55 1HG1 VAL 55 -0.886 -7.704 0.866
441 HG12 VAL 55 2HG1 VAL 55 -1.171 -9.441 0.962
442 HG13 VAL 55 3HG1 VAL 55 0.467 -8.829 0.733
443 HG21 VAL 55 3HG2 VAL 55 -1.432 -8.156 4.472
444 HG22 VAL 55 1HG2 VAL 55 -2.318 -9.048 3.235
445 HG23 VAL 55 2HG2 VAL 55 -1.993 -7.328 3.020
446 H LEU 56 HN LEU 56 2.454 -8.812 3.901
447 HA LEU 56 HA LEU 56 3.865 -9.340 1.464
448 HB2 LEU 56 2HB LEU 56 4.823 -8.137 4.061
449 HB3 LEU 56 1HB LEU 56 5.718 -8.138 2.552
450 HG LEU 56 HG LEU 56 3.079 -6.747 3.013
451 HD11 LEU 56 1HD1 LEU 56 5.882 -5.664 2.778
452 HD12 LEU 56 2HD1 LEU 56 4.884 -5.683 4.232
453 HD13 LEU 56 3HD1 LEU 56 4.410 -4.693 2.852
454 HD21 LEU 56 3HD2 LEU 56 3.514 -5.721 0.826
455 HD22 LEU 56 1HD2 LEU 56 3.334 -7.472 0.707
456 HD23 LEU 56 2HD2 LEU 56 4.939 -6.743 0.639
457 H ASP 57 HN ASP 57 3.758 -10.830 4.611
458 HA ASP 57 HA ASP 57 6.271 -11.938 4.830
459 HB2 ASP 57 2HB ASP 57 4.071 -12.053 6.342
460 HB3 ASP 57 1HB ASP 57 4.010 -13.666 5.658
461 HA PRO 58 HA PRO 58 4.885 -15.859 2.274
462 HB2 PRO 58 2HB PRO 58 2.650 -14.796 0.681
463 HB3 PRO 58 1HB PRO 58 2.796 -16.344 1.516
464 HG2 PRO 58 2HG PRO 58 1.178 -14.364 2.379
465 HG3 PRO 58 1HG PRO 58 1.961 -15.513 3.477
466 HD2 PRO 58 2HD PRO 58 2.643 -12.668 2.916
467 HD3 PRO 58 1HD PRO 58 2.788 -13.597 4.411
468 H ILE 59 HN ILE 59 4.387 -12.599 1.058
469 HA ILE 59 HA ILE 59 5.119 -13.186 -1.635
470 HB ILE 59 HB ILE 59 4.954 -10.503 -0.251
471 HG12 ILE 59 2HG1 ILE 59 2.923 -12.001 -1.925
472 HG13 ILE 59 1HG1 ILE 59 2.830 -11.735 -0.187
473 HG21 ILE 59 1HG2 ILE 59 6.279 -10.373 -2.281
474 HG22 ILE 59 2HG2 ILE 59 4.716 -9.590 -2.525
475 HG23 ILE 59 3HG2 ILE 59 5.011 -11.198 -3.187
476 HD11 ILE 59 3HD1 ILE 59 1.372 -10.222 -1.409
477 HD12 ILE 59 1HD1 ILE 59 2.756 -9.594 -2.302
478 HD13 ILE 59 2HD1 ILE 59 2.642 -9.339 -0.560
479 H TRP 60 HN TRP 60 6.875 -12.062 1.202
480 HA TRP 60 HA TRP 60 9.186 -11.064 0.040
481 HB2 TRP 60 2HB TRP 60 8.756 -12.548 2.623
482 HB3 TRP 60 1HB TRP 60 10.342 -11.955 2.155
483 HD1 TRP 60 1HD TRP 60 7.772 -10.999 4.378
484 HE1 TRP 60 1HE TRP 60 7.674 -8.457 4.770
485 HE3 TRP 60 3HE TRP 60 10.509 -9.452 0.346
486 HZ2 TRP 60 2HZ TRP 60 8.609 -6.111 3.520
487 HZ3 TRP 60 3HZ TRP 60 10.854 -7.038 0.015
488 HH2 TRP 60 2HH TRP 60 9.923 -5.403 1.572
489 H GLU 61 HN GLU 61 8.133 -14.361 0.212
490 HA GLU 61 HA GLU 61 10.706 -15.539 -0.101
491 HB2 GLU 61 2HB GLU 61 7.959 -16.703 -0.535
492 HB3 GLU 61 1HB GLU 61 9.448 -17.593 -0.327
493 HG2 GLU 61 2HG GLU 61 9.651 -16.698 1.953
494 HG3 GLU 61 1HG GLU 61 8.109 -15.870 1.731
495 H GLN 62 HN GLN 62 8.035 -14.697 -2.265
496 HA GLN 62 HA GLN 62 9.526 -15.846 -4.510
497 HB2 GLN 62 2HB GLN 62 6.607 -15.249 -4.106
498 HB3 GLN 62 1HB GLN 62 7.271 -15.577 -5.694
499 HG2 GLN 62 2HG GLN 62 6.427 -17.619 -4.988
500 HG3 GLN 62 1HG GLN 62 8.154 -17.752 -4.689
501 HE21 GLN 62 1HE2 GLN 62 5.895 -15.939 -2.716
502 HE22 GLN 62 2HE2 GLN 62 6.021 -16.935 -1.311
503 H LYS 63 HN LYS 63 7.888 -12.881 -3.463
504 HA LYS 63 HA LYS 63 9.031 -11.511 -5.819
505 HB2 LYS 63 2HB LYS 63 6.431 -10.687 -4.542
506 HB3 LYS 63 1HB LYS 63 7.058 -10.242 -6.119
507 HG2 LYS 63 2HG LYS 63 6.496 -13.109 -5.679
508 HG3 LYS 63 1HG LYS 63 5.108 -12.025 -5.758
509 HD2 LYS 63 2HD LYS 63 5.468 -12.799 -7.957
510 HD3 LYS 63 1HD LYS 63 6.082 -11.147 -7.918
511 HE2 LYS 63 2HE LYS 63 8.348 -11.960 -7.716
512 HE3 LYS 63 1HE LYS 63 7.772 -13.624 -7.626
513 HZ1 LYS 63 3HZ LYS 63 8.544 -13.151 -9.834
514 HZ2 LYS 63 1HZ LYS 63 7.522 -11.798 -9.953
515 HZ3 LYS 63 2HZ LYS 63 6.860 -13.355 -9.869
516 HA PRO 64 HA PRO 64 10.291 -9.561 -1.729
517 HB2 PRO 64 2HB PRO 64 12.899 -9.323 -3.075
518 HB3 PRO 64 1HB PRO 64 12.514 -9.985 -1.485
519 HG2 PRO 64 2HG PRO 64 13.239 -11.559 -3.534
520 HG3 PRO 64 1HG PRO 64 12.061 -12.084 -2.316
521 HD2 PRO 64 2HD PRO 64 11.591 -11.089 -5.102
522 HD3 PRO 64 1HD PRO 64 10.779 -12.398 -4.219
523 H GLU 65 HN GLU 65 11.565 -8.644 -4.917
524 HA GLU 65 HA GLU 65 11.807 -5.904 -4.431
525 HB2 GLU 65 2HB GLU 65 12.836 -7.050 -6.336
526 HB3 GLU 65 1HB GLU 65 11.246 -7.317 -7.030
527 HG2 GLU 65 2HG GLU 65 10.947 -4.857 -7.154
528 HG3 GLU 65 1HG GLU 65 12.618 -4.677 -6.619
529 H THR 66 HN THR 66 9.100 -7.804 -5.635
530 HA THR 66 HA THR 66 7.481 -5.573 -6.346
531 HB THR 66 HB THR 66 6.518 -8.362 -5.686
532 HG1 THR 66 1HG THR 66 7.905 -7.332 -7.928
533 HG21 THR 66 3HG2 THR 66 5.460 -6.231 -7.555
534 HG22 THR 66 1HG2 THR 66 4.750 -6.706 -6.013
535 HG23 THR 66 2HG2 THR 66 4.783 -7.848 -7.355
536 H ALA 67 HN ALA 67 7.708 -7.646 -3.482
537 HA ALA 67 HA ALA 67 5.577 -6.519 -2.028
538 HB1 ALA 67 1HB ALA 67 6.674 -8.602 -1.353
539 HB2 ALA 67 2HB ALA 67 6.689 -7.426 -0.039
540 HB3 ALA 67 3HB ALA 67 8.149 -7.711 -0.983
541 H SER 68 HN SER 68 8.975 -5.620 -2.339
542 HA SER 68 HA SER 68 8.970 -3.483 -0.502
543 HB2 SER 68 2HB SER 68 10.679 -3.800 -2.988
544 HB3 SER 68 1HB SER 68 11.045 -2.794 -1.586
545 HG SER 68 HG SER 68 10.869 -5.636 -1.670
546 H ARG 69 HN ARG 69 8.334 -3.606 -4.007
547 HA ARG 69 HA ARG 69 7.900 -0.865 -4.401
548 HB2 ARG 69 2HB ARG 69 6.671 -3.239 -5.809
549 HB3 ARG 69 1HB ARG 69 6.579 -1.592 -6.374
550 HG2 ARG 69 2HG ARG 69 9.130 -1.631 -6.399
551 HG3 ARG 69 1HG ARG 69 8.964 -3.379 -6.234
552 HD2 ARG 69 2HD ARG 69 7.379 -3.216 -8.256
553 HD3 ARG 69 1HD ARG 69 8.069 -1.611 -8.487
554 HE ARG 69 HE ARG 69 9.825 -3.959 -8.353
555 HH11 ARG 69 1HH1 ARG 69 8.558 -1.219 -10.166
556 HH12 ARG 69 2HH1 ARG 69 9.628 -1.475 -11.512
557 HH21 ARG 69 1HH2 ARG 69 11.208 -4.271 -10.115
558 HH22 ARG 69 2HH2 ARG 69 11.153 -3.173 -11.468
559 H LEU 70 HN LEU 70 5.734 -3.498 -3.508
560 HA LEU 70 HA LEU 70 3.320 -2.086 -3.548
561 HB2 LEU 70 2HB LEU 70 3.607 -4.561 -3.432
562 HB3 LEU 70 1HB LEU 70 4.060 -4.391 -1.749
563 HG LEU 70 HG LEU 70 1.823 -3.481 -1.244
564 HD11 LEU 70 1HD1 LEU 70 1.318 -2.497 -3.413
565 HD12 LEU 70 2HD1 LEU 70 0.058 -3.641 -2.944
566 HD13 LEU 70 3HD1 LEU 70 1.266 -4.101 -4.144
567 HD21 LEU 70 3HD2 LEU 70 0.601 -5.582 -1.530
568 HD22 LEU 70 1HD2 LEU 70 2.259 -5.871 -1.002
569 HD23 LEU 70 2HD2 LEU 70 1.812 -6.130 -2.689
570 H ARG 71 HN ARG 71 5.735 -2.489 -1.004
571 HA ARG 71 HA ARG 71 4.386 -1.416 1.158
572 HB2 ARG 71 2HB ARG 71 7.304 -1.226 0.413
573 HB3 ARG 71 1HB ARG 71 6.668 -0.724 1.963
574 HG2 ARG 71 2HG ARG 71 5.759 -3.120 2.136
575 HG3 ARG 71 1HG ARG 71 6.891 -3.472 0.829
576 HD2 ARG 71 2HD ARG 71 7.531 -2.385 3.564
577 HD3 ARG 71 1HD ARG 71 7.980 -3.955 2.904
578 HE ARG 71 HE ARG 71 9.248 -2.420 1.199
579 HH11 ARG 71 1HH1 ARG 71 8.925 -1.963 4.649
580 HH12 ARG 71 2HH1 ARG 71 10.436 -1.122 4.820
581 HH21 ARG 71 1HH2 ARG 71 11.254 -1.308 1.407
582 HH22 ARG 71 2HH2 ARG 71 11.748 -0.743 2.977
583 H GLY 72 HN GLY 72 6.227 0.249 -1.369
584 HA2 GLY 72 2HA GLY 72 6.007 2.850 -0.278
585 HA3 GLY 72 1HA GLY 72 6.368 2.464 -1.956
586 H ARG 73 HN ARG 73 3.983 1.041 -2.535
587 HA ARG 73 HA ARG 73 2.309 3.224 -3.214
588 HB2 ARG 73 2HB ARG 73 1.751 0.257 -3.353
589 HB3 ARG 73 1HB ARG 73 0.758 1.509 -4.088
590 HG2 ARG 73 2HG ARG 73 2.767 2.193 -5.414
591 HG3 ARG 73 1HG ARG 73 3.578 0.750 -4.802
592 HD2 ARG 73 2HD ARG 73 1.747 -0.624 -5.752
593 HD3 ARG 73 1HD ARG 73 1.048 0.842 -6.440
594 HE ARG 73 HE ARG 73 3.781 0.446 -7.200
595 HH11 ARG 73 1HH1 ARG 73 0.468 -0.383 -7.939
596 HH12 ARG 73 2HH1 ARG 73 0.801 -0.834 -9.582
597 HH21 ARG 73 1HH2 ARG 73 4.240 -0.120 -9.360
598 HH22 ARG 73 2HH2 ARG 73 2.961 -0.681 -10.390
599 H ILE 74 HN ILE 74 1.990 0.582 -0.857
600 HA ILE 74 HA ILE 74 -0.515 1.342 0.184
601 HB ILE 74 HB ILE 74 1.774 -0.043 1.609
602 HG12 ILE 74 2HG1 ILE 74 -0.648 -1.192 0.198
603 HG13 ILE 74 1HG1 ILE 74 0.993 -1.196 -0.441
604 HG21 ILE 74 1HG2 ILE 74 -1.157 0.126 2.316
605 HG22 ILE 74 2HG2 ILE 74 0.183 0.849 3.206
606 HG23 ILE 74 3HG2 ILE 74 0.027 -0.905 3.119
607 HD11 ILE 74 3HD1 ILE 74 0.425 -3.354 0.487
608 HD12 ILE 74 1HD1 ILE 74 0.050 -2.612 2.041
609 HD13 ILE 74 2HD1 ILE 74 1.707 -2.599 1.434
610 H GLU 75 HN GLU 75 2.778 2.318 0.951
611 HA GLU 75 HA GLU 75 2.303 3.842 3.236
612 HB2 GLU 75 2HB GLU 75 4.524 3.131 2.210
613 HB3 GLU 75 1HB GLU 75 4.346 4.479 1.099
614 HG2 GLU 75 2HG GLU 75 4.355 4.835 4.082
615 HG3 GLU 75 1HG GLU 75 5.828 4.827 3.117
616 H SER 76 HN SER 76 2.287 4.837 -0.192
617 HA SER 76 HA SER 76 1.722 7.549 0.351
618 HB2 SER 76 2HB SER 76 0.980 7.507 -2.132
619 HB3 SER 76 1HB SER 76 2.666 7.172 -1.742
620 HG SER 76 HG SER 76 0.859 5.026 -1.886
621 H VAL 77 HN VAL 77 -0.352 4.752 -0.123
622 HA VAL 77 HA VAL 77 -2.768 6.237 -0.440
623 HB VAL 77 HB VAL 77 -2.371 3.362 0.423
624 HG11 VAL 77 1HG1 VAL 77 -4.718 3.035 -0.184
625 HG12 VAL 77 2HG1 VAL 77 -4.873 4.756 -0.535
626 HG13 VAL 77 3HG1 VAL 77 -4.561 4.217 1.116
627 HG21 VAL 77 3HG2 VAL 77 -2.934 2.824 -1.895
628 HG22 VAL 77 1HG2 VAL 77 -1.490 3.834 -1.804
629 HG23 VAL 77 2HG2 VAL 77 -3.035 4.544 -2.271
630 H LEU 78 HN LEU 78 -1.194 4.657 2.323
631 HA LEU 78 HA LEU 78 -3.252 5.165 4.179
632 HB2 LEU 78 2HB LEU 78 -0.304 4.673 4.600
633 HB3 LEU 78 1HB LEU 78 -1.476 4.762 5.901
634 HG LEU 78 HG LEU 78 -1.482 2.717 3.678
635 HD11 LEU 78 1HD1 LEU 78 -0.910 1.135 5.454
636 HD12 LEU 78 2HD1 LEU 78 -0.800 2.470 6.602
637 HD13 LEU 78 3HD1 LEU 78 0.337 2.369 5.258
638 HD21 LEU 78 3HD2 LEU 78 -3.241 2.985 6.114
639 HD22 LEU 78 1HD2 LEU 78 -3.260 1.643 4.973
640 HD23 LEU 78 2HD2 LEU 78 -3.739 3.254 4.445
641 H ASP 79 HN ASP 79 -0.392 7.038 3.261
642 HA ASP 79 HA ASP 79 -0.648 9.060 5.215
643 HB2 ASP 79 2HB ASP 79 1.378 8.796 3.836
644 HB3 ASP 79 1HB ASP 79 0.466 9.267 2.406
645 H TRP 80 HN TRP 80 -1.926 8.758 1.937
646 HA TRP 80 HA TRP 80 -3.179 11.240 1.722
647 HB2 TRP 80 2HB TRP 80 -2.870 9.795 -0.199
648 HB3 TRP 80 1HB TRP 80 -3.900 8.562 0.512
649 HD1 TRP 80 1HD TRP 80 -4.155 12.111 -1.002
650 HE1 TRP 80 1HE TRP 80 -6.531 12.393 -1.964
651 HE3 TRP 80 3HE TRP 80 -6.210 7.694 0.572
652 HZ2 TRP 80 2HZ TRP 80 -8.941 10.942 -2.038
653 HZ3 TRP 80 3HZ TRP 80 -8.557 7.225 0.010
654 HH2 TRP 80 2HH TRP 80 -9.892 8.817 -1.269
655 H ALA 81 HN ALA 81 -4.549 8.125 2.805
656 HA ALA 81 HA ALA 81 -7.119 9.138 3.373
657 HB1 ALA 81 1HB ALA 81 -6.635 6.747 3.082
658 HB2 ALA 81 2HB ALA 81 -7.478 7.072 4.597
659 HB3 ALA 81 3HB ALA 81 -5.744 6.753 4.605
660 H THR 82 HN THR 82 -4.182 8.970 5.284
661 HA THR 82 HA THR 82 -5.300 9.615 7.790
662 HB THR 82 HB THR 82 -2.529 10.131 6.692
663 HG1 THR 82 1HG THR 82 -2.877 7.952 6.852
664 HG21 THR 82 3HG2 THR 82 -3.003 11.634 8.572
665 HG22 THR 82 1HG2 THR 82 -1.820 10.404 9.017
666 HG23 THR 82 2HG2 THR 82 -3.492 10.252 9.553
667 H VAL 83 HN VAL 83 -3.820 11.652 5.272
668 HA VAL 83 HA VAL 83 -4.201 14.083 6.698
669 HB VAL 83 HB VAL 83 -3.683 13.649 3.753
670 HG11 VAL 83 1HG1 VAL 83 -2.887 15.973 3.750
671 HG12 VAL 83 2HG1 VAL 83 -3.401 16.141 5.428
672 HG13 VAL 83 3HG1 VAL 83 -4.597 15.862 4.165
673 HG21 VAL 83 3HG2 VAL 83 -1.927 12.697 5.148
674 HG22 VAL 83 1HG2 VAL 83 -1.767 14.228 6.014
675 HG23 VAL 83 2HG2 VAL 83 -1.347 14.131 4.304
676 H ARG 84 HN ARG 84 -6.025 12.369 4.218
677 HA ARG 84 HA ARG 84 -7.887 14.470 3.753
678 HB2 ARG 84 2HB ARG 84 -8.053 11.510 3.186
679 HB3 ARG 84 1HB ARG 84 -9.270 12.665 2.677
680 HG2 ARG 84 2HG ARG 84 -6.461 12.334 1.713
681 HG3 ARG 84 1HG ARG 84 -7.961 12.386 0.788
682 HD2 ARG 84 2HD ARG 84 -6.524 14.674 2.115
683 HD3 ARG 84 1HD ARG 84 -6.805 14.430 0.394
684 HE ARG 84 HE ARG 84 -9.312 14.569 1.428
685 HH11 ARG 84 1HH1 ARG 84 -6.491 16.639 1.481
686 HH12 ARG 84 2HH1 ARG 84 -7.394 18.091 1.796
687 HH21 ARG 84 1HH2 ARG 84 -10.519 16.485 1.833
688 HH22 ARG 84 2HH2 ARG 84 -9.686 18.011 1.975
689 H GLY 85 HN GLY 85 -7.669 11.945 6.129
690 HA2 GLY 85 2HA GLY 85 -8.719 12.156 8.233
691 HA3 GLY 85 1HA GLY 85 -9.922 13.206 7.502
692 H TYR 86 HN TYR 86 -8.946 10.025 6.303
693 HA TYR 86 HA TYR 86 -11.711 9.129 6.621
694 HB2 TYR 86 2HB TYR 86 -9.339 7.859 5.247
695 HB3 TYR 86 1HB TYR 86 -10.918 7.096 5.372
696 HD1 TYR 86 2HD TYR 86 -12.917 8.346 4.340
697 HD2 TYR 86 1HD TYR 86 -8.863 9.311 3.494
698 HE1 TYR 86 2HE TYR 86 -13.623 9.488 2.279
699 HE2 TYR 86 1HE TYR 86 -9.555 10.441 1.427
700 HH TYR 86 HH TYR 86 -11.425 10.390 -0.150
701 H ARG 87 HN ARG 87 -8.671 8.856 8.151
702 HA ARG 87 HA ARG 87 -9.727 7.172 10.219
703 HB2 ARG 87 2HB ARG 87 -7.995 5.399 9.990
704 HB3 ARG 87 1HB ARG 87 -9.156 5.405 8.669
705 HG2 ARG 87 2HG ARG 87 -7.616 6.186 7.138
706 HG3 ARG 87 1HG ARG 87 -6.577 6.877 8.383
707 HD2 ARG 87 2HD ARG 87 -7.012 3.916 8.030
708 HD3 ARG 87 1HD ARG 87 -5.689 4.805 7.275
709 HE ARG 87 HE ARG 87 -5.489 5.452 9.912
710 HH11 ARG 87 1HH1 ARG 87 -5.619 2.390 8.187
711 HH12 ARG 87 2HH1 ARG 87 -4.599 1.570 9.333
712 HH21 ARG 87 1HH2 ARG 87 -4.174 4.372 11.396
713 HH22 ARG 87 2HH2 ARG 87 -3.786 2.699 11.156
714 H GLU 88 HN GLU 88 -8.323 7.054 12.066
715 HA GLU 88 HA GLU 88 -6.497 9.149 12.481
716 HB2 GLU 88 2HB GLU 88 -6.462 6.466 13.872
717 HB3 GLU 88 1HB GLU 88 -5.848 7.988 14.493
718 HG2 GLU 88 2HG GLU 88 -8.735 7.310 13.981
719 HG3 GLU 88 1HG GLU 88 -7.946 7.436 15.552
720 H GLY 89 HN GLY 89 -4.143 9.106 12.486
721 HA2 GLY 89 2HA GLY 89 -3.270 7.191 10.417
722 HA3 GLY 89 1HA GLY 89 -3.057 8.915 10.202
723 H ASP 90 HN ASP 90 -1.047 9.467 10.387
724 HA ASP 90 HA ASP 90 1.171 9.176 10.459
725 HB2 ASP 90 2HB ASP 90 0.821 9.716 12.855
726 HB3 ASP 90 1HB ASP 90 0.753 7.994 13.191
727 H ASN 91 HN ASN 91 2.292 7.771 9.388
728 HA ASN 91 HA ASN 91 0.802 5.442 8.656
729 HB2 ASN 91 2HB ASN 91 2.204 7.098 7.208
730 HB3 ASN 91 1HB ASN 91 3.564 6.086 7.662
731 HD21 ASN 91 1HD2 ASN 91 2.332 6.626 5.072
732 HD22 ASN 91 2HD2 ASN 91 1.904 5.088 4.424
733 HA PRO 92 HA PRO 92 3.298 2.509 10.991
734 HB2 PRO 92 2HB PRO 92 1.923 0.301 10.354
735 HB3 PRO 92 1HB PRO 92 1.253 1.520 11.443
736 HG2 PRO 92 2HG PRO 92 0.652 1.017 8.566
737 HG3 PRO 92 1HG PRO 92 -0.443 1.484 9.879
738 HD2 PRO 92 2HD PRO 92 0.642 3.216 7.993
739 HD3 PRO 92 1HD PRO 92 -0.048 3.698 9.553
740 H ALA 93 HN ALA 93 2.903 2.739 7.612
741 HA ALA 93 HA ALA 93 4.627 0.499 6.965
742 HB1 ALA 93 1HB ALA 93 2.782 1.112 5.466
743 HB2 ALA 93 2HB ALA 93 4.342 1.196 4.650
744 HB3 ALA 93 3HB ALA 93 3.543 2.677 5.179
745 H ARG 94 HN ARG 94 5.201 3.390 8.287
746 HA ARG 94 HA ARG 94 7.741 3.810 6.897
747 HB2 ARG 94 2HB ARG 94 6.349 5.533 8.940
748 HB3 ARG 94 1HB ARG 94 7.838 5.929 8.114
749 HG2 ARG 94 2HG ARG 94 6.710 5.998 5.991
750 HG3 ARG 94 1HG ARG 94 5.207 5.478 6.746
751 HD2 ARG 94 2HD ARG 94 5.164 7.545 8.067
752 HD3 ARG 94 1HD ARG 94 6.663 8.064 7.288
753 HE ARG 94 HE ARG 94 5.075 7.595 5.177
754 HH11 ARG 94 1HH1 ARG 94 4.456 9.430 8.120
755 HH12 ARG 94 2HH1 ARG 94 3.353 10.523 7.326
756 HH21 ARG 94 1HH2 ARG 94 3.663 8.969 4.181
757 HH22 ARG 94 2HH2 ARG 94 2.895 10.263 5.068
758 H TRP 95 HN TRP 95 9.410 2.870 7.717
759 HA TRP 95 HA TRP 95 9.360 2.060 10.544
760 HB2 TRP 95 2HB TRP 95 10.374 0.674 8.086
761 HB3 TRP 95 1HB TRP 95 11.040 0.279 9.668
762 HD1 TRP 95 1HD TRP 95 9.092 -0.456 11.546
763 HE1 TRP 95 1HE TRP 95 7.071 -2.004 11.184
764 HE3 TRP 95 3HE TRP 95 8.726 -0.140 6.464
765 HZ2 TRP 95 2HZ TRP 95 5.510 -2.948 9.037
766 HZ3 TRP 95 3HZ TRP 95 6.937 -1.391 5.333
767 HH2 TRP 95 2HH TRP 95 5.363 -2.766 6.594
768 H ARG 96 HN ARG 96 11.154 2.329 11.788
769 HA ARG 96 HA ARG 96 13.210 4.130 10.940
770 HB2 ARG 96 2HB ARG 96 13.119 2.330 13.374
771 HB3 ARG 96 1HB ARG 96 14.171 3.713 13.142
772 HG2 ARG 96 2HG ARG 96 11.171 3.834 13.360
773 HG3 ARG 96 1HG ARG 96 12.309 4.189 14.658
774 HD2 ARG 96 2HD ARG 96 13.290 5.962 13.165
775 HD3 ARG 96 1HD ARG 96 11.928 5.693 12.078
776 HE ARG 96 HE ARG 96 10.640 6.168 14.341
777 HH11 ARG 96 1HH1 ARG 96 13.333 7.871 12.868
778 HH12 ARG 96 2HH1 ARG 96 12.970 9.374 13.666
779 HH21 ARG 96 1HH2 ARG 96 10.172 8.128 15.392
780 HH22 ARG 96 2HH2 ARG 96 11.190 9.517 15.113
781 H GLY 97 HN GLY 97 12.642 0.774 10.855
782 HA2 GLY 97 2HA GLY 97 14.667 0.083 9.127
783 HA3 GLY 97 1HA GLY 97 15.322 -0.174 10.741
784 H TYR 98 HN TYR 98 12.959 -1.204 8.397
785 HA TYR 98 HA TYR 98 11.353 -2.923 9.843
786 HB2 TYR 98 2HB TYR 98 11.073 -2.322 7.438
787 HB3 TYR 98 1HB TYR 98 12.409 -3.394 7.042
788 HD1 TYR 98 1HD TYR 98 9.069 -3.437 8.716
789 HD2 TYR 98 2HD TYR 98 11.944 -5.589 6.438
790 HE1 TYR 98 1HE TYR 98 7.477 -5.291 8.467
791 HE2 TYR 98 2HE TYR 98 10.358 -7.453 6.186
792 HH TYR 98 HH TYR 98 8.355 -8.360 7.386
793 H LEU 99 HN LEU 99 14.344 -3.803 8.104
794 HA LEU 99 HA LEU 99 14.674 -6.021 10.011
795 HB2 LEU 99 2HB LEU 99 15.801 -5.708 7.227
796 HB3 LEU 99 1HB LEU 99 16.078 -7.068 8.288
797 HG LEU 99 HG LEU 99 13.413 -6.286 7.109
798 HD11 LEU 99 1HD1 LEU 99 14.912 -7.185 5.428
799 HD12 LEU 99 2HD1 LEU 99 13.653 -8.359 5.814
800 HD13 LEU 99 3HD1 LEU 99 15.277 -8.564 6.466
801 HD21 LEU 99 3HD2 LEU 99 14.180 -8.677 8.774
802 HD22 LEU 99 1HD2 LEU 99 12.608 -8.395 8.028
803 HD23 LEU 99 2HD2 LEU 99 13.182 -7.326 9.310
804 H GLU 100 HN GLU 100 15.900 -3.081 8.795
805 HA GLU 100 HA GLU 100 18.654 -3.520 9.544
806 HB2 GLU 100 2HB GLU 100 17.483 -0.826 8.930
807 HB3 GLU 100 1HB GLU 100 19.107 -1.418 8.623
808 HG2 GLU 100 2HG GLU 100 18.271 -1.416 6.511
809 HG3 GLU 100 1HG GLU 100 17.847 -3.056 6.999
810 H HIS 101 HN HIS 101 16.494 -3.591 11.658
811 HA HIS 101 HA HIS 101 16.802 -1.219 13.203
812 HB2 HIS 101 2HB HIS 101 15.621 -2.374 14.989
813 HB3 HIS 101 1HB HIS 101 14.803 -2.607 13.454
814 HD1 HIS 101 1HD HIS 101 17.000 -4.497 15.911
815 HD2 HIS 101 2HD HIS 101 14.342 -5.217 12.788
816 HE1 HIS 101 1HE HIS 101 16.600 -6.974 15.919
817 HE2 HIS 101 2HE HIS 101 14.791 -7.339 14.206
818 H HIS 102 HN HIS 102 18.853 -3.825 12.675
819 HA HIS 102 HA HIS 102 20.199 -3.501 15.256
820 HB2 HIS 102 2HB HIS 102 19.835 -5.810 14.368
821 HB3 HIS 102 1HB HIS 102 20.884 -5.413 13.009
822 HD1 HIS 102 1HD HIS 102 23.444 -5.180 13.508
823 HD2 HIS 102 2HD HIS 102 21.136 -6.326 16.778
824 HE1 HIS 102 1HE HIS 102 25.075 -5.991 15.241
825 HE2 HIS 102 2HE HIS 102 23.675 -6.443 17.288
826 H HIS 103 HN HIS 103 21.082 -1.498 15.053
827 HA HIS 103 HA HIS 103 22.624 0.072 14.582
828 HB2 HIS 103 2HB HIS 103 24.073 -1.894 15.283
829 HB3 HIS 103 1HB HIS 103 24.383 -2.155 13.569
830 HD1 HIS 103 1HD HIS 103 26.452 -1.054 12.759
831 HD2 HIS 103 2HD HIS 103 24.791 0.947 16.009
832 HE1 HIS 103 1HE HIS 103 28.009 0.860 13.250
833 HE2 HIS 103 2HE HIS 103 26.917 2.132 15.135
834 H HIS 104 HN HIS 104 21.400 1.040 12.941
835 HA HIS 104 HA HIS 104 22.442 0.560 10.226
836 HB2 HIS 104 2HB HIS 104 20.408 1.672 9.383
837 HB3 HIS 104 1HB HIS 104 20.018 0.252 10.344
838 HD1 HIS 104 1HD HIS 104 19.730 3.991 10.344
839 HD2 HIS 104 2HD HIS 104 18.613 0.755 12.703
840 HE1 HIS 104 1HE HIS 104 18.094 4.907 12.020
841 HE2 HIS 104 2HE HIS 104 17.304 2.895 13.325
842 H HIS 105 HN HIS 105 22.709 2.526 8.881
843 HA HIS 105 HA HIS 105 24.142 4.532 10.339
844 HB2 HIS 105 2HB HIS 105 24.403 3.638 7.841
845 HB3 HIS 105 1HB HIS 105 23.313 4.977 7.502
846 HD1 HIS 105 1HD HIS 105 24.374 7.251 7.274
847 HD2 HIS 105 2HD HIS 105 26.883 4.495 9.131
848 HE1 HIS 105 1HE HIS 105 26.599 8.397 7.499
849 HE2 HIS 105 2HE HIS 105 28.119 6.703 8.582
850 H HIS 106 HN HIS 106 23.539 6.616 10.805
851 HA HIS 106 HA HIS 106 20.754 7.048 11.196
852 HB2 HIS 106 2HB HIS 106 22.377 7.923 12.778
853 HB3 HIS 106 1HB HIS 106 23.111 8.912 11.522
854 HD1 HIS 106 1HD HIS 106 19.885 8.621 13.497
855 HD2 HIS 106 2HD HIS 106 21.989 11.385 11.205
856 HE1 HIS 106 1HE HIS 106 18.645 10.798 13.747
857 HE2 HIS 106 2HE HIS 106 19.866 12.425 12.254
Start of MODEL 16
1 H1 MET 1 H1 MET 1 -16.878 2.749 4.234
2 H2 MET 1 H2 MET 1 -15.928 1.852 5.318
3 H3 MET 1 H3 MET 1 -16.719 1.073 4.036
4 HA MET 1 HA MET 1 -15.369 2.175 2.431
5 HB2 MET 1 2HB MET 1 -15.033 4.285 3.656
6 HB3 MET 1 1HB MET 1 -14.018 3.450 4.826
7 HG2 MET 1 2HG MET 1 -12.580 4.588 3.305
8 HG3 MET 1 1HG MET 1 -12.470 2.866 2.966
9 HE1 MET 1 2HE MET 1 -14.009 6.294 1.820
10 HE2 MET 1 3HE MET 1 -15.430 5.262 1.970
11 HE3 MET 1 1HE MET 1 -14.908 5.818 0.379
12 H THR 2 HN THR 2 -14.067 0.665 1.664
13 HA THR 2 HA THR 2 -12.530 -0.968 3.559
14 HB THR 2 HB THR 2 -12.264 -2.571 1.671
15 HG1 THR 2 1HG THR 2 -14.236 -1.022 0.312
16 HG21 THR 2 3HG2 THR 2 -14.581 -3.388 1.662
17 HG22 THR 2 1HG2 THR 2 -15.125 -1.843 2.319
18 HG23 THR 2 2HG2 THR 2 -14.077 -2.888 3.277
19 H PHE 3 HN PHE 3 -10.366 -1.719 2.661
20 HA PHE 3 HA PHE 3 -8.730 0.525 2.241
21 HB2 PHE 3 2HB PHE 3 -7.933 -1.560 3.284
22 HB3 PHE 3 1HB PHE 3 -8.092 -2.394 1.742
23 HD1 PHE 3 1HD PHE 3 -6.326 0.415 3.401
24 HD2 PHE 3 2HD PHE 3 -6.322 -2.431 0.241
25 HE1 PHE 3 1HE PHE 3 -4.022 1.057 2.838
26 HE2 PHE 3 2HE PHE 3 -4.011 -1.798 -0.327
27 HZ PHE 3 HZ PHE 3 -2.861 -0.051 0.973
28 H SER 4 HN SER 4 -9.979 -1.919 0.008
29 HA SER 4 HA SER 4 -8.602 -1.109 -2.284
30 HB2 SER 4 2HB SER 4 -11.405 -2.241 -2.181
31 HB3 SER 4 1HB SER 4 -10.273 -2.331 -3.531
32 HG SER 4 HG SER 4 -10.067 -4.254 -2.519
33 H GLU 5 HN GLU 5 -11.713 -0.024 -0.968
34 HA GLU 5 HA GLU 5 -12.404 1.663 -3.120
35 HB2 GLU 5 2HB GLU 5 -13.236 1.674 -0.220
36 HB3 GLU 5 1HB GLU 5 -13.963 2.688 -1.451
37 HG2 GLU 5 2HG GLU 5 -14.749 0.763 -2.646
38 HG3 GLU 5 1HG GLU 5 -13.919 -0.311 -1.522
39 H CYS 6 HN CYS 6 -10.817 2.284 -0.021
40 HA CYS 6 HA CYS 6 -10.613 5.091 -0.349
41 HB2 CYS 6 2HB CYS 6 -10.365 3.724 1.796
42 HB3 CYS 6 1HB CYS 6 -8.728 3.388 1.280
43 HG CYS 6 HG CYS 6 -8.395 6.359 1.007
44 H ALA 7 HN ALA 7 -8.413 2.417 -1.016
45 HA ALA 7 HA ALA 7 -6.263 3.897 -2.046
46 HB1 ALA 7 1HB ALA 7 -6.130 1.497 -1.561
47 HB2 ALA 7 2HB ALA 7 -5.617 1.849 -3.211
48 HB3 ALA 7 3HB ALA 7 -7.214 1.165 -2.912
49 H ALA 8 HN ALA 8 -9.174 2.646 -3.627
50 HA ALA 8 HA ALA 8 -8.578 3.466 -6.240
51 HB1 ALA 8 1HB ALA 8 -10.361 1.885 -5.733
52 HB2 ALA 8 2HB ALA 8 -10.978 3.248 -6.667
53 HB3 ALA 8 3HB ALA 8 -11.279 3.159 -4.932
54 H LEU 9 HN LEU 9 -10.017 5.203 -3.524
55 HA LEU 9 HA LEU 9 -10.834 7.504 -4.913
56 HB2 LEU 9 2HB LEU 9 -9.778 7.287 -2.088
57 HB3 LEU 9 1HB LEU 9 -10.639 8.659 -2.741
58 HG LEU 9 HG LEU 9 -11.804 5.897 -2.405
59 HD11 LEU 9 1HD1 LEU 9 -12.204 8.426 -0.811
60 HD12 LEU 9 2HD1 LEU 9 -11.387 6.964 -0.262
61 HD13 LEU 9 3HD1 LEU 9 -13.117 6.930 -0.607
62 HD21 LEU 9 3HD2 LEU 9 -13.929 6.996 -2.919
63 HD22 LEU 9 1HD2 LEU 9 -12.797 7.123 -4.265
64 HD23 LEU 9 2HD2 LEU 9 -13.076 8.511 -3.213
65 H TYR 10 HN TYR 10 -7.787 6.768 -3.259
66 HA TYR 10 HA TYR 10 -6.394 9.116 -3.844
67 HB2 TYR 10 2HB TYR 10 -5.608 7.462 -2.224
68 HB3 TYR 10 1HB TYR 10 -5.374 6.284 -3.504
69 HD1 TYR 10 2HD TYR 10 -4.227 9.684 -2.462
70 HD2 TYR 10 1HD TYR 10 -3.267 6.042 -4.446
71 HE1 TYR 10 2HE TYR 10 -1.908 10.449 -2.737
72 HE2 TYR 10 1HE TYR 10 -0.941 6.799 -4.720
73 HH TYR 10 HH TYR 10 0.292 8.959 -4.808
74 H ILE 11 HN ILE 11 -6.659 6.096 -5.620
75 HA ILE 11 HA ILE 11 -4.835 6.783 -7.678
76 HB ILE 11 HB ILE 11 -7.013 4.696 -7.572
77 HG12 ILE 11 2HG1 ILE 11 -4.013 4.446 -7.274
78 HG13 ILE 11 1HG1 ILE 11 -5.144 4.503 -5.929
79 HG21 ILE 11 1HG2 ILE 11 -4.784 5.003 -9.582
80 HG22 ILE 11 2HG2 ILE 11 -6.504 5.240 -9.892
81 HG23 ILE 11 3HG2 ILE 11 -5.895 3.639 -9.472
82 HD11 ILE 11 3HD1 ILE 11 -4.438 2.230 -6.435
83 HD12 ILE 11 1HD1 ILE 11 -5.081 2.393 -8.068
84 HD13 ILE 11 2HD1 ILE 11 -6.172 2.442 -6.682
85 H LYS 12 HN LYS 12 -8.416 6.776 -7.585
86 HA LYS 12 HA LYS 12 -8.675 7.586 -10.299
87 HB2 LYS 12 2HB LYS 12 -10.620 7.561 -8.001
88 HB3 LYS 12 1HB LYS 12 -11.066 8.109 -9.609
89 HG2 LYS 12 2HG LYS 12 -10.407 5.892 -10.498
90 HG3 LYS 12 1HG LYS 12 -10.114 5.358 -8.841
91 HD2 LYS 12 2HD LYS 12 -12.747 6.428 -9.844
92 HD3 LYS 12 1HD LYS 12 -12.348 4.711 -9.748
93 HE2 LYS 12 2HE LYS 12 -12.080 4.869 -7.355
94 HE3 LYS 12 1HE LYS 12 -12.328 6.615 -7.407
95 HZ1 LYS 12 3HZ LYS 12 -14.372 4.674 -8.325
96 HZ2 LYS 12 1HZ LYS 12 -14.573 6.331 -8.009
97 HZ3 LYS 12 2HZ LYS 12 -14.300 5.246 -6.730
98 H ALA 13 HN ALA 13 -8.513 9.350 -7.257
99 HA ALA 13 HA ALA 13 -9.372 11.843 -8.324
100 HB1 ALA 13 1HB ALA 13 -7.701 11.301 -5.871
101 HB2 ALA 13 2HB ALA 13 -9.463 11.359 -5.931
102 HB3 ALA 13 3HB ALA 13 -8.520 12.814 -6.256
103 H HIS 14 HN HIS 14 -6.582 10.105 -8.898
104 HA HIS 14 HA HIS 14 -5.207 12.543 -9.815
105 HB2 HIS 14 2HB HIS 14 -3.920 10.171 -8.439
106 HB3 HIS 14 1HB HIS 14 -3.033 11.468 -9.231
107 HD1 HIS 14 1HD HIS 14 -4.652 10.538 -6.077
108 HD2 HIS 14 2HD HIS 14 -3.262 14.010 -7.898
109 HE1 HIS 14 1HE HIS 14 -4.477 12.248 -4.237
110 HE2 HIS 14 2HE HIS 14 -3.648 14.350 -5.359
111 H ARG 15 HN ARG 15 -6.810 10.054 -10.944
112 HA ARG 15 HA ARG 15 -4.929 8.507 -12.365
113 HB2 ARG 15 2HB ARG 15 -6.765 7.483 -13.483
114 HB3 ARG 15 1HB ARG 15 -7.248 7.774 -11.822
115 HG2 ARG 15 2HG ARG 15 -8.577 9.678 -12.510
116 HG3 ARG 15 1HG ARG 15 -8.034 9.478 -14.180
117 HD2 ARG 15 2HD ARG 15 -9.014 7.178 -14.134
118 HD3 ARG 15 1HD ARG 15 -9.696 7.558 -12.555
119 HE ARG 15 HE ARG 15 -10.674 9.556 -14.048
120 HH11 ARG 15 1HH1 ARG 15 -10.474 6.123 -14.682
121 HH12 ARG 15 2HH1 ARG 15 -11.940 6.060 -15.599
122 HH21 ARG 15 1HH2 ARG 15 -12.615 9.490 -15.287
123 HH22 ARG 15 2HH2 ARG 15 -13.169 7.976 -15.933
124 H SER 16 HN SER 16 -6.735 11.403 -13.269
125 HA SER 16 HA SER 16 -5.922 11.389 -15.985
126 HB2 SER 16 2HB SER 16 -6.854 13.694 -14.263
127 HB3 SER 16 1HB SER 16 -6.850 13.629 -16.020
128 HG SER 16 HG SER 16 -8.882 13.084 -14.746
129 H SER 17 HN SER 17 -4.509 12.442 -13.015
130 HA SER 17 HA SER 17 -2.520 14.107 -14.277
131 HB2 SER 17 2HB SER 17 -2.771 13.192 -11.405
132 HB3 SER 17 1HB SER 17 -1.757 14.495 -12.007
133 HG SER 17 HG SER 17 -3.699 15.563 -12.685
134 H TRP 18 HN TRP 18 -2.937 10.819 -13.645
135 HA TRP 18 HA TRP 18 -0.106 10.292 -13.249
136 HB2 TRP 18 2HB TRP 18 -2.581 8.635 -12.968
137 HB3 TRP 18 1HB TRP 18 -1.009 7.852 -13.119
138 HD1 TRP 18 1HD TRP 18 -0.146 10.821 -11.342
139 HE1 TRP 18 1HE TRP 18 -0.128 10.476 -8.792
140 HE3 TRP 18 3HE TRP 18 -2.780 6.457 -11.100
141 HZ2 TRP 18 2HZ TRP 18 -1.098 8.597 -6.926
142 HZ3 TRP 18 3HZ TRP 18 -3.187 5.447 -8.897
143 HH2 TRP 18 2HH TRP 18 -2.366 6.495 -6.853
144 H LYS 19 HN LYS 19 -1.163 11.262 -15.821
145 HA LYS 19 HA LYS 19 -0.471 9.224 -17.707
146 HB2 LYS 19 2HB LYS 19 -0.433 12.250 -17.930
147 HB3 LYS 19 1HB LYS 19 -0.215 11.140 -19.276
148 HG2 LYS 19 2HG LYS 19 -2.477 10.322 -19.010
149 HG3 LYS 19 1HG LYS 19 -2.705 11.342 -17.591
150 HD2 LYS 19 2HD LYS 19 -2.101 12.378 -20.363
151 HD3 LYS 19 1HD LYS 19 -3.719 12.269 -19.666
152 HE2 LYS 19 2HE LYS 19 -3.013 13.761 -17.842
153 HE3 LYS 19 1HE LYS 19 -1.421 13.898 -18.585
154 HZ1 LYS 19 3HZ LYS 19 -3.947 14.686 -19.930
155 HZ2 LYS 19 1HZ LYS 19 -2.368 14.973 -20.477
156 HZ3 LYS 19 2HZ LYS 19 -2.948 15.765 -19.090
157 H ASN 20 HN ASN 20 2.867 9.264 -17.615
158 HA ASN 20 HA ASN 20 0.752 9.434 -19.553
159 HB2 ASN 20 2HB ASN 20 2.970 9.918 -20.405
160 HB3 ASN 20 1HB ASN 20 3.588 8.403 -19.756
161 HD21 ASN 20 1HD2 ASN 20 1.675 9.889 -22.246
162 HD22 ASN 20 2HD2 ASN 20 1.599 8.510 -23.290
163 H THR 21 HN THR 21 -0.551 7.880 -19.870
164 HA THR 21 HA THR 21 -1.527 5.893 -20.194
165 HB THR 21 HB THR 21 -0.036 3.797 -20.237
166 HG1 THR 21 1HG THR 21 2.074 5.639 -20.545
167 HG21 THR 21 3HG2 THR 21 0.790 4.386 -22.467
168 HG22 THR 21 1HG2 THR 21 0.410 6.076 -22.142
169 HG23 THR 21 2HG2 THR 21 -0.885 4.880 -22.216
170 H LYS 22 HN LYS 22 -0.883 3.308 -19.012
171 HA LYS 22 HA LYS 22 -2.869 3.659 -17.025
172 HB2 LYS 22 2HB LYS 22 -1.388 1.227 -17.980
173 HB3 LYS 22 1HB LYS 22 -2.676 1.183 -16.791
174 HG2 LYS 22 2HG LYS 22 -4.017 2.448 -18.654
175 HG3 LYS 22 1HG LYS 22 -2.806 1.717 -19.711
176 HD2 LYS 22 2HD LYS 22 -4.618 0.255 -17.789
177 HD3 LYS 22 1HD LYS 22 -4.764 0.282 -19.546
178 HE2 LYS 22 2HE LYS 22 -2.775 -0.955 -19.826
179 HE3 LYS 22 1HE LYS 22 -2.306 -0.731 -18.142
180 HZ1 LYS 22 3HZ LYS 22 -4.737 -2.221 -18.958
181 HZ2 LYS 22 1HZ LYS 22 -4.009 -2.183 -17.424
182 HZ3 LYS 22 2HZ LYS 22 -3.233 -2.964 -18.720
183 H HIS 23 HN HIS 23 -0.351 4.800 -16.158
184 HA HIS 23 HA HIS 23 0.901 3.282 -14.178
185 HB2 HIS 23 2HB HIS 23 0.334 6.233 -14.368
186 HB3 HIS 23 1HB HIS 23 1.189 5.550 -12.990
187 HD1 HIS 23 1HD HIS 23 3.320 6.910 -13.686
188 HD2 HIS 23 2HD HIS 23 2.040 4.111 -16.487
189 HE1 HIS 23 1HE HIS 23 5.239 6.617 -15.287
190 HE2 HIS 23 2HE HIS 23 4.355 5.082 -17.082
191 H ALA 24 HN ALA 24 -2.204 4.952 -14.119
192 HA ALA 24 HA ALA 24 -2.735 4.544 -11.356
193 HB1 ALA 24 1HB ALA 24 -3.916 6.222 -12.696
194 HB2 ALA 24 2HB ALA 24 -5.041 5.115 -11.910
195 HB3 ALA 24 3HB ALA 24 -4.684 4.938 -13.629
196 H ASP 25 HN ASP 25 -3.423 2.658 -14.265
197 HA ASP 25 HA ASP 25 -5.046 0.691 -13.023
198 HB2 ASP 25 2HB ASP 25 -4.985 1.029 -15.465
199 HB3 ASP 25 1HB ASP 25 -3.329 0.450 -15.507
200 H GLN 26 HN GLN 26 -1.609 0.973 -13.649
201 HA GLN 26 HA GLN 26 -0.750 -1.513 -12.736
202 HB2 GLN 26 2HB GLN 26 0.579 1.196 -12.608
203 HB3 GLN 26 1HB GLN 26 1.395 -0.307 -12.238
204 HG2 GLN 26 2HG GLN 26 1.026 -1.091 -14.513
205 HG3 GLN 26 1HG GLN 26 0.162 0.400 -14.887
206 HE21 GLN 26 1HE2 GLN 26 1.598 0.945 -16.508
207 HE22 GLN 26 2HE2 GLN 26 3.206 1.504 -16.181
208 H TRP 27 HN TRP 27 -1.255 1.520 -10.948
209 HA TRP 27 HA TRP 27 -0.526 0.557 -8.406
210 HB2 TRP 27 2HB TRP 27 -2.191 2.829 -9.400
211 HB3 TRP 27 1HB TRP 27 -2.242 2.429 -7.688
212 HD1 TRP 27 1HD TRP 27 0.480 3.255 -10.351
213 HE1 TRP 27 1HE TRP 27 2.331 4.605 -9.175
214 HE3 TRP 27 3HE TRP 27 -1.372 3.193 -5.587
215 HZ2 TRP 27 2HZ TRP 27 2.923 5.523 -6.574
216 HZ3 TRP 27 3HZ TRP 27 -0.106 4.334 -3.817
217 HH2 TRP 27 2HH TRP 27 1.996 5.477 -4.303
218 H THR 28 HN THR 28 -3.717 0.823 -9.938
219 HA THR 28 HA THR 28 -5.235 -0.186 -7.809
220 HB THR 28 HB THR 28 -5.910 -0.474 -10.745
221 HG1 THR 28 1HG THR 28 -5.372 1.700 -10.296
222 HG21 THR 28 3HG2 THR 28 -8.222 -0.327 -9.965
223 HG22 THR 28 1HG2 THR 28 -7.660 -0.169 -8.300
224 HG23 THR 28 2HG2 THR 28 -7.389 -1.671 -9.183
225 H ASN 29 HN ASN 29 -3.860 -1.807 -10.633
226 HA ASN 29 HA ASN 29 -5.089 -4.303 -10.227
227 HB2 ASN 29 2HB ASN 29 -3.965 -3.316 -12.328
228 HB3 ASN 29 1HB ASN 29 -2.458 -3.905 -11.640
229 HD21 ASN 29 1HD2 ASN 29 -3.998 -4.599 -14.068
230 HD22 ASN 29 2HD2 ASN 29 -4.180 -6.316 -14.005
231 H THR 30 HN THR 30 -1.823 -3.155 -9.371
232 HA THR 30 HA THR 30 -0.926 -5.645 -8.393
233 HB THR 30 HB THR 30 0.830 -4.257 -7.199
234 HG1 THR 30 1HG THR 30 -0.106 -2.073 -8.727
235 HG21 THR 30 3HG2 THR 30 0.436 -3.795 -10.161
236 HG22 THR 30 1HG2 THR 30 1.201 -5.202 -9.425
237 HG23 THR 30 2HG2 THR 30 1.955 -3.615 -9.285
238 H ILE 31 HN ILE 31 -2.134 -2.771 -6.666
239 HA ILE 31 HA ILE 31 -1.893 -3.841 -4.083
240 HB ILE 31 HB ILE 31 -3.798 -1.722 -5.098
241 HG12 ILE 31 2HG1 ILE 31 -1.123 -1.485 -3.690
242 HG13 ILE 31 1HG1 ILE 31 -1.392 -1.209 -5.406
243 HG21 ILE 31 1HG2 ILE 31 -3.007 -2.388 -2.261
244 HG22 ILE 31 2HG2 ILE 31 -4.589 -2.665 -2.994
245 HG23 ILE 31 3HG2 ILE 31 -4.000 -1.018 -2.762
246 HD11 ILE 31 3HD1 ILE 31 -2.566 0.395 -3.150
247 HD12 ILE 31 1HD1 ILE 31 -2.872 0.665 -4.864
248 HD13 ILE 31 2HD1 ILE 31 -1.248 0.889 -4.210
249 H LYS 32 HN LYS 32 -4.592 -3.873 -6.364
250 HA LYS 32 HA LYS 32 -6.497 -5.000 -4.621
251 HB2 LYS 32 2HB LYS 32 -6.842 -3.876 -6.914
252 HB3 LYS 32 1HB LYS 32 -6.458 -5.445 -7.596
253 HG2 LYS 32 2HG LYS 32 -8.338 -6.445 -6.421
254 HG3 LYS 32 1HG LYS 32 -8.716 -4.886 -5.684
255 HD2 LYS 32 2HD LYS 32 -10.182 -5.202 -7.549
256 HD3 LYS 32 1HD LYS 32 -9.014 -3.952 -7.976
257 HE2 LYS 32 2HE LYS 32 -9.227 -5.367 -9.868
258 HE3 LYS 32 1HE LYS 32 -7.676 -5.746 -9.124
259 HZ1 LYS 32 3HZ LYS 32 -10.188 -7.307 -8.840
260 HZ2 LYS 32 1HZ LYS 32 -8.727 -7.666 -8.048
261 HZ3 LYS 32 2HZ LYS 32 -8.823 -7.759 -9.740
262 H THR 33 HN THR 33 -3.939 -6.396 -6.527
263 HA THR 33 HA THR 33 -4.993 -9.077 -6.385
264 HB THR 33 HB THR 33 -2.289 -8.074 -7.294
265 HG1 THR 33 1HG THR 33 -3.824 -7.364 -8.722
266 HG21 THR 33 3HG2 THR 33 -2.069 -10.274 -8.376
267 HG22 THR 33 1HG2 THR 33 -3.574 -10.790 -7.615
268 HG23 THR 33 2HG2 THR 33 -2.167 -10.416 -6.621
269 H TYR 34 HN TYR 34 -2.197 -7.385 -4.963
270 HA TYR 34 HA TYR 34 -1.505 -9.705 -3.414
271 HB2 TYR 34 2HB TYR 34 -0.347 -6.924 -3.516
272 HB3 TYR 34 1HB TYR 34 0.291 -8.208 -2.493
273 HD1 TYR 34 1HD TYR 34 1.127 -10.330 -3.606
274 HD2 TYR 34 2HD TYR 34 0.256 -6.783 -5.794
275 HE1 TYR 34 1HE TYR 34 2.459 -11.174 -5.493
276 HE2 TYR 34 2HE TYR 34 1.585 -7.619 -7.685
277 HH TYR 34 HH TYR 34 2.593 -10.827 -7.950
278 H CYS 35 HN CYS 35 -2.743 -6.455 -2.635
279 HA CYS 35 HA CYS 35 -2.904 -7.167 0.177
280 HB2 CYS 35 2HB CYS 35 -3.772 -4.612 -1.187
281 HB3 CYS 35 1HB CYS 35 -3.508 -4.851 0.537
282 HG CYS 35 HG CYS 35 -0.696 -5.471 0.005
283 H GLY 36 HN GLY 36 -4.928 -7.093 -2.584
284 HA2 GLY 36 2HA GLY 36 -7.425 -6.429 -1.624
285 HA3 GLY 36 1HA GLY 36 -7.144 -7.569 -2.928
286 HA PRO 37 HA PRO 37 -8.643 -10.998 -0.651
287 HB2 PRO 37 2HB PRO 37 -6.028 -12.390 -0.680
288 HB3 PRO 37 1HB PRO 37 -7.592 -12.911 -1.317
289 HG2 PRO 37 2HG PRO 37 -5.654 -12.121 -2.960
290 HG3 PRO 37 1HG PRO 37 -7.346 -11.698 -3.280
291 HD2 PRO 37 2HD PRO 37 -5.156 -10.011 -2.135
292 HD3 PRO 37 1HD PRO 37 -6.416 -9.577 -3.309
293 H VAL 38 HN VAL 38 -6.124 -9.214 0.723
294 HA VAL 38 HA VAL 38 -6.264 -10.760 3.226
295 HB VAL 38 HB VAL 38 -4.216 -8.654 2.523
296 HG11 VAL 38 1HG1 VAL 38 -2.975 -9.595 4.406
297 HG12 VAL 38 2HG1 VAL 38 -4.295 -10.724 4.715
298 HG13 VAL 38 3HG1 VAL 38 -4.554 -8.990 4.911
299 HG21 VAL 38 3HG2 VAL 38 -2.663 -10.525 2.145
300 HG22 VAL 38 1HG2 VAL 38 -3.990 -10.517 0.984
301 HG23 VAL 38 2HG2 VAL 38 -4.002 -11.657 2.329
302 H ILE 39 HN ILE 39 -5.826 -7.330 2.286
303 HA ILE 39 HA ILE 39 -7.518 -6.624 4.599
304 HB ILE 39 HB ILE 39 -6.260 -4.492 4.729
305 HG12 ILE 39 2HG1 ILE 39 -4.394 -5.821 2.749
306 HG13 ILE 39 1HG1 ILE 39 -5.457 -4.468 2.383
307 HG21 ILE 39 1HG2 ILE 39 -5.696 -6.330 6.202
308 HG22 ILE 39 2HG2 ILE 39 -4.242 -5.440 5.747
309 HG23 ILE 39 3HG2 ILE 39 -4.601 -6.991 4.988
310 HD11 ILE 39 3HD1 ILE 39 -4.233 -3.088 3.994
311 HD12 ILE 39 1HD1 ILE 39 -3.180 -3.719 2.726
312 HD13 ILE 39 2HD1 ILE 39 -3.162 -4.448 4.333
313 H GLY 40 HN GLY 40 -7.612 -6.788 1.382
314 HA2 GLY 40 2HA GLY 40 -8.374 -4.314 0.381
315 HA3 GLY 40 1HA GLY 40 -8.946 -5.855 -0.233
316 HA PRO 41 HA PRO 41 -12.984 -5.063 1.389
317 HB2 PRO 41 2HB PRO 41 -13.244 -7.592 2.809
318 HB3 PRO 41 1HB PRO 41 -14.008 -7.080 1.303
319 HG2 PRO 41 2HG PRO 41 -12.106 -9.009 1.405
320 HG3 PRO 41 1HG PRO 41 -12.326 -7.945 0.003
321 HD2 PRO 41 2HD PRO 41 -10.313 -7.777 2.219
322 HD3 PRO 41 1HD PRO 41 -10.088 -7.533 0.471
323 H LEU 42 HN LEU 42 -10.472 -5.156 3.492
324 HA LEU 42 HA LEU 42 -12.098 -4.921 5.910
325 HB2 LEU 42 2HB LEU 42 -9.108 -4.913 5.492
326 HB3 LEU 42 1HB LEU 42 -9.880 -4.691 7.049
327 HG LEU 42 HG LEU 42 -10.050 -7.168 5.334
328 HD11 LEU 42 1HD1 LEU 42 -8.744 -8.201 7.116
329 HD12 LEU 42 2HD1 LEU 42 -8.641 -6.649 7.947
330 HD13 LEU 42 3HD1 LEU 42 -7.867 -6.862 6.377
331 HD21 LEU 42 3HD2 LEU 42 -11.212 -6.556 8.049
332 HD22 LEU 42 1HD2 LEU 42 -11.183 -8.149 7.292
333 HD23 LEU 42 2HD2 LEU 42 -12.111 -6.840 6.559
334 H SER 43 HN SER 43 -11.482 -3.061 7.386
335 HA SER 43 HA SER 43 -11.974 -0.619 6.030
336 HB2 SER 43 2HB SER 43 -12.773 -1.021 8.316
337 HB3 SER 43 1HB SER 43 -11.111 -1.117 8.889
338 HG SER 43 HG SER 43 -12.629 1.039 8.621
339 H VAL 44 HN VAL 44 -10.636 1.022 5.480
340 HA VAL 44 HA VAL 44 -7.836 0.559 5.268
341 HB VAL 44 HB VAL 44 -9.089 1.947 3.644
342 HG11 VAL 44 1HG1 VAL 44 -9.696 4.262 4.223
343 HG12 VAL 44 2HG1 VAL 44 -9.284 3.929 5.906
344 HG13 VAL 44 3HG1 VAL 44 -10.619 3.071 5.140
345 HG21 VAL 44 3HG2 VAL 44 -6.870 3.416 5.062
346 HG22 VAL 44 1HG2 VAL 44 -7.431 3.741 3.423
347 HG23 VAL 44 2HG2 VAL 44 -6.675 2.194 3.805
348 H GLN 45 HN GLN 45 -9.892 1.844 7.681
349 HA GLN 45 HA GLN 45 -7.904 3.380 9.078
350 HB2 GLN 45 2HB GLN 45 -10.405 3.746 9.194
351 HB3 GLN 45 1HB GLN 45 -10.515 2.262 10.124
352 HG2 GLN 45 2HG GLN 45 -8.805 4.560 11.008
353 HG3 GLN 45 1HG GLN 45 -10.522 4.474 11.384
354 HE21 GLN 45 1HE2 GLN 45 -8.215 4.471 13.151
355 HE22 GLN 45 2HE2 GLN 45 -8.320 3.010 14.081
356 H ASP 46 HN ASP 46 -9.198 0.133 9.148
357 HA ASP 46 HA ASP 46 -8.006 -0.602 11.642
358 HB2 ASP 46 2HB ASP 46 -10.103 -1.592 10.626
359 HB3 ASP 46 1HB ASP 46 -9.059 -2.457 9.504
360 H VAL 47 HN VAL 47 -6.915 -0.451 8.402
361 HA VAL 47 HA VAL 47 -4.975 -2.474 8.365
362 HB VAL 47 HB VAL 47 -4.902 0.209 6.970
363 HG11 VAL 47 1HG1 VAL 47 -3.299 -0.817 5.440
364 HG12 VAL 47 2HG1 VAL 47 -3.312 -2.295 6.402
365 HG13 VAL 47 3HG1 VAL 47 -2.677 -0.800 7.090
366 HG21 VAL 47 3HG2 VAL 47 -6.861 -1.103 6.381
367 HG22 VAL 47 1HG2 VAL 47 -5.843 -2.496 6.021
368 HG23 VAL 47 2HG2 VAL 47 -5.733 -1.044 5.026
369 H ASP 48 HN ASP 48 -3.373 -2.751 9.736
370 HA ASP 48 HA ASP 48 -1.845 -0.415 10.652
371 HB2 ASP 48 2HB ASP 48 -3.562 -1.435 12.348
372 HB3 ASP 48 1HB ASP 48 -2.369 -2.714 12.514
373 H THR 49 HN THR 49 0.037 -1.631 12.149
374 HA THR 49 HA THR 49 1.871 -2.434 10.192
375 HB THR 49 HB THR 49 2.078 -2.975 13.161
376 HG1 THR 49 1HG THR 49 1.841 -0.851 13.233
377 HG21 THR 49 3HG2 THR 49 3.831 -3.999 11.762
378 HG22 THR 49 1HG2 THR 49 4.473 -2.719 12.792
379 HG23 THR 49 2HG2 THR 49 4.195 -2.415 11.078
380 H LYS 50 HN LYS 50 0.033 -4.330 12.539
381 HA LYS 50 HA LYS 50 1.203 -6.830 12.161
382 HB2 LYS 50 2HB LYS 50 -0.358 -6.267 13.979
383 HB3 LYS 50 1HB LYS 50 -1.671 -6.163 12.823
384 HG2 LYS 50 2HG LYS 50 -1.453 -8.532 12.330
385 HG3 LYS 50 1HG LYS 50 -0.100 -8.654 13.458
386 HD2 LYS 50 2HD LYS 50 -1.544 -8.016 15.303
387 HD3 LYS 50 1HD LYS 50 -2.896 -7.792 14.194
388 HE2 LYS 50 2HE LYS 50 -3.049 -9.921 15.380
389 HE3 LYS 50 1HE LYS 50 -2.861 -10.158 13.644
390 HZ1 LYS 50 3HZ LYS 50 -0.531 -10.220 15.462
391 HZ2 LYS 50 1HZ LYS 50 -0.677 -10.867 13.902
392 HZ3 LYS 50 2HZ LYS 50 -1.483 -11.597 15.201
393 H LEU 51 HN LEU 51 -1.538 -5.334 10.533
394 HA LEU 51 HA LEU 51 -2.144 -7.549 8.895
395 HB2 LEU 51 2HB LEU 51 -2.807 -4.625 8.614
396 HB3 LEU 51 1HB LEU 51 -3.444 -5.874 7.569
397 HG LEU 51 HG LEU 51 -3.922 -5.631 10.532
398 HD11 LEU 51 1HD1 LEU 51 -6.255 -5.238 9.839
399 HD12 LEU 51 2HD1 LEU 51 -5.720 -5.197 8.159
400 HD13 LEU 51 3HD1 LEU 51 -5.149 -3.977 9.299
401 HD21 LEU 51 3HD2 LEU 51 -3.826 -7.966 9.872
402 HD22 LEU 51 1HD2 LEU 51 -4.953 -7.658 8.552
403 HD23 LEU 51 2HD2 LEU 51 -5.488 -7.496 10.224
404 H ILE 52 HN ILE 52 -0.246 -4.601 8.314
405 HA ILE 52 HA ILE 52 0.193 -5.021 5.575
406 HB ILE 52 HB ILE 52 1.985 -3.552 7.514
407 HG12 ILE 52 2HG1 ILE 52 -0.247 -2.525 5.746
408 HG13 ILE 52 1HG1 ILE 52 -0.356 -2.740 7.488
409 HG21 ILE 52 1HG2 ILE 52 2.781 -2.348 5.537
410 HG22 ILE 52 2HG2 ILE 52 1.773 -3.364 4.507
411 HG23 ILE 52 3HG2 ILE 52 3.110 -4.076 5.413
412 HD11 ILE 52 3HD1 ILE 52 0.021 -0.417 6.899
413 HD12 ILE 52 1HD1 ILE 52 1.511 -0.860 6.068
414 HD13 ILE 52 2HD1 ILE 52 1.380 -1.070 7.815
415 H MET 53 HN MET 53 2.157 -5.988 8.391
416 HA MET 53 HA MET 53 4.272 -7.094 6.874
417 HB2 MET 53 2HB MET 53 4.988 -8.198 8.916
418 HB3 MET 53 1HB MET 53 4.500 -6.547 9.271
419 HG2 MET 53 2HG MET 53 2.395 -7.332 10.166
420 HG3 MET 53 1HG MET 53 2.803 -8.989 9.731
421 HE1 MET 53 3HE MET 53 4.967 -6.544 12.991
422 HE2 MET 53 1HE MET 53 3.665 -5.923 11.978
423 HE3 MET 53 2HE MET 53 5.247 -6.258 11.274
424 H LYS 54 HN LYS 54 1.214 -8.406 7.996
425 HA LYS 54 HA LYS 54 1.761 -11.094 7.251
426 HB2 LYS 54 2HB LYS 54 -0.685 -9.564 8.004
427 HB3 LYS 54 1HB LYS 54 -0.885 -11.116 7.202
428 HG2 LYS 54 2HG LYS 54 0.899 -10.882 9.589
429 HG3 LYS 54 1HG LYS 54 -0.848 -10.996 9.789
430 HD2 LYS 54 2HD LYS 54 0.003 -13.209 9.956
431 HD3 LYS 54 1HD LYS 54 -0.777 -13.082 8.382
432 HE2 LYS 54 2HE LYS 54 1.265 -14.263 8.076
433 HE3 LYS 54 1HE LYS 54 1.478 -12.656 7.385
434 HZ1 LYS 54 3HZ LYS 54 2.463 -13.560 10.046
435 HZ2 LYS 54 1HZ LYS 54 2.647 -11.998 9.411
436 HZ3 LYS 54 2HZ LYS 54 3.414 -13.309 8.660
437 H VAL 55 HN VAL 55 0.304 -8.344 5.573
438 HA VAL 55 HA VAL 55 -0.510 -9.699 3.249
439 HB VAL 55 HB VAL 55 0.499 -6.856 3.499
440 HG11 VAL 55 1HG1 VAL 55 -1.164 -8.126 1.324
441 HG12 VAL 55 2HG1 VAL 55 0.529 -7.656 1.184
442 HG13 VAL 55 3HG1 VAL 55 -0.708 -6.424 1.426
443 HG21 VAL 55 3HG2 VAL 55 -1.869 -6.249 3.593
444 HG22 VAL 55 1HG2 VAL 55 -1.405 -7.280 4.945
445 HG23 VAL 55 2HG2 VAL 55 -2.305 -7.957 3.588
446 H LEU 56 HN LEU 56 2.566 -8.164 4.088
447 HA LEU 56 HA LEU 56 3.793 -8.677 1.566
448 HB2 LEU 56 2HB LEU 56 5.007 -7.987 4.242
449 HB3 LEU 56 1HB LEU 56 5.878 -8.002 2.724
450 HG LEU 56 HG LEU 56 3.573 -6.170 3.392
451 HD11 LEU 56 1HD1 LEU 56 6.527 -5.601 3.167
452 HD12 LEU 56 2HD1 LEU 56 5.601 -5.663 4.667
453 HD13 LEU 56 3HD1 LEU 56 5.256 -4.415 3.471
454 HD21 LEU 56 3HD2 LEU 56 3.671 -6.680 1.014
455 HD22 LEU 56 1HD2 LEU 56 5.387 -6.273 0.982
456 HD23 LEU 56 2HD2 LEU 56 4.190 -5.021 1.314
457 H ASP 57 HN ASP 57 3.344 -10.531 4.419
458 HA ASP 57 HA ASP 57 5.588 -12.074 4.651
459 HB2 ASP 57 2HB ASP 57 3.377 -12.022 6.029
460 HB3 ASP 57 1HB ASP 57 2.896 -13.347 4.985
461 HA PRO 58 HA PRO 58 4.120 -15.356 1.502
462 HB2 PRO 58 2HB PRO 58 1.927 -14.970 -0.003
463 HB3 PRO 58 1HB PRO 58 1.833 -15.644 1.628
464 HG2 PRO 58 2HG PRO 58 1.316 -12.846 0.699
465 HG3 PRO 58 1HG PRO 58 0.396 -13.828 1.853
466 HD2 PRO 58 2HD PRO 58 2.193 -11.916 2.604
467 HD3 PRO 58 1HD PRO 58 1.812 -13.343 3.586
468 H ILE 59 HN ILE 59 4.054 -11.996 0.801
469 HA ILE 59 HA ILE 59 4.382 -12.235 -2.042
470 HB ILE 59 HB ILE 59 4.912 -9.846 -0.266
471 HG12 ILE 59 2HG1 ILE 59 2.470 -10.582 -1.902
472 HG13 ILE 59 1HG1 ILE 59 2.579 -10.649 -0.147
473 HG21 ILE 59 1HG2 ILE 59 4.687 -8.546 -2.341
474 HG22 ILE 59 2HG2 ILE 59 4.550 -10.047 -3.257
475 HG23 ILE 59 3HG2 ILE 59 6.047 -9.666 -2.408
476 HD11 ILE 59 3HD1 ILE 59 2.765 -8.176 -1.847
477 HD12 ILE 59 1HD1 ILE 59 2.931 -8.225 -0.091
478 HD13 ILE 59 2HD1 ILE 59 1.399 -8.667 -0.845
479 H TRP 60 HN TRP 60 6.510 -11.890 0.745
480 HA TRP 60 HA TRP 60 8.916 -11.444 -0.638
481 HB2 TRP 60 2HB TRP 60 8.348 -12.780 2.009
482 HB3 TRP 60 1HB TRP 60 9.983 -12.577 1.392
483 HD1 TRP 60 1HD TRP 60 7.348 -10.797 3.327
484 HE1 TRP 60 1HE TRP 60 8.093 -8.384 3.818
485 HE3 TRP 60 3HE TRP 60 11.367 -10.537 0.185
486 HZ2 TRP 60 2HZ TRP 60 10.116 -6.603 2.984
487 HZ3 TRP 60 3HZ TRP 60 12.658 -8.445 0.094
488 HH2 TRP 60 2HH TRP 60 12.045 -6.518 1.464
489 H GLU 61 HN GLU 61 7.014 -14.301 -0.207
490 HA GLU 61 HA GLU 61 9.018 -16.168 -0.977
491 HB2 GLU 61 2HB GLU 61 6.009 -16.303 -0.806
492 HB3 GLU 61 1HB GLU 61 7.030 -17.669 -1.187
493 HG2 GLU 61 2HG GLU 61 7.156 -16.086 1.358
494 HG3 GLU 61 1HG GLU 61 6.339 -17.635 1.158
495 H GLN 62 HN GLN 62 6.232 -14.666 -2.564
496 HA GLN 62 HA GLN 62 6.699 -15.907 -5.084
497 HB2 GLN 62 2HB GLN 62 4.617 -14.536 -3.867
498 HB3 GLN 62 1HB GLN 62 5.145 -13.439 -5.134
499 HG2 GLN 62 2HG GLN 62 4.512 -16.323 -5.668
500 HG3 GLN 62 1HG GLN 62 3.287 -15.061 -5.693
501 HE21 GLN 62 1HE2 GLN 62 2.837 -15.335 -7.865
502 HE22 GLN 62 2HE2 GLN 62 3.936 -14.862 -9.118
503 H LYS 63 HN LYS 63 6.845 -12.473 -4.116
504 HA LYS 63 HA LYS 63 8.963 -12.047 -6.110
505 HB2 LYS 63 2HB LYS 63 6.456 -10.395 -5.758
506 HB3 LYS 63 1HB LYS 63 7.841 -9.883 -6.704
507 HG2 LYS 63 2HG LYS 63 6.484 -12.467 -7.339
508 HG3 LYS 63 1HG LYS 63 5.777 -10.938 -7.868
509 HD2 LYS 63 2HD LYS 63 7.087 -11.585 -9.679
510 HD3 LYS 63 1HD LYS 63 8.113 -10.435 -8.826
511 HE2 LYS 63 2HE LYS 63 9.484 -12.278 -9.429
512 HE3 LYS 63 1HE LYS 63 9.197 -12.399 -7.694
513 HZ1 LYS 63 3HZ LYS 63 7.491 -14.053 -8.124
514 HZ2 LYS 63 1HZ LYS 63 8.970 -14.541 -8.792
515 HZ3 LYS 63 2HZ LYS 63 7.751 -13.929 -9.794
516 HA PRO 64 HA PRO 64 10.189 -10.323 -1.990
517 HB2 PRO 64 2HB PRO 64 12.878 -10.534 -2.545
518 HB3 PRO 64 1HB PRO 64 11.915 -11.802 -1.781
519 HG2 PRO 64 2HG PRO 64 12.738 -11.509 -4.641
520 HG3 PRO 64 1HG PRO 64 12.684 -12.967 -3.634
521 HD2 PRO 64 2HD PRO 64 10.773 -12.433 -5.441
522 HD3 PRO 64 1HD PRO 64 10.393 -13.208 -3.889
523 H GLU 65 HN GLU 65 11.193 -9.560 -5.241
524 HA GLU 65 HA GLU 65 12.326 -7.014 -4.684
525 HB2 GLU 65 2HB GLU 65 12.923 -8.155 -6.708
526 HB3 GLU 65 1HB GLU 65 11.246 -8.295 -7.189
527 HG2 GLU 65 2HG GLU 65 12.401 -5.578 -6.846
528 HG3 GLU 65 1HG GLU 65 12.844 -6.519 -8.269
529 H THR 66 HN THR 66 9.159 -8.143 -5.696
530 HA THR 66 HA THR 66 8.045 -5.557 -6.065
531 HB THR 66 HB THR 66 6.614 -8.196 -5.718
532 HG1 THR 66 1HG THR 66 8.266 -7.292 -7.667
533 HG21 THR 66 3HG2 THR 66 5.125 -6.265 -5.538
534 HG22 THR 66 1HG2 THR 66 4.846 -7.121 -7.054
535 HG23 THR 66 2HG2 THR 66 5.764 -5.615 -7.048
536 H ALA 67 HN ALA 67 8.230 -7.798 -3.384
537 HA ALA 67 HA ALA 67 6.248 -6.786 -1.717
538 HB1 ALA 67 1HB ALA 67 7.467 -8.837 -1.233
539 HB2 ALA 67 2HB ALA 67 7.543 -7.729 0.136
540 HB3 ALA 67 3HB ALA 67 8.936 -7.907 -0.930
541 H SER 68 HN SER 68 9.587 -5.696 -2.166
542 HA SER 68 HA SER 68 9.491 -3.664 -0.187
543 HB2 SER 68 2HB SER 68 11.287 -3.858 -2.617
544 HB3 SER 68 1HB SER 68 11.582 -2.891 -1.172
545 HG SER 68 HG SER 68 12.723 -4.725 -0.858
546 H ARG 69 HN ARG 69 8.861 -3.751 -3.660
547 HA ARG 69 HA ARG 69 8.638 -0.964 -4.031
548 HB2 ARG 69 2HB ARG 69 7.501 -3.248 -5.639
549 HB3 ARG 69 1HB ARG 69 7.599 -1.584 -6.171
550 HG2 ARG 69 2HG ARG 69 10.174 -2.359 -5.329
551 HG3 ARG 69 1HG ARG 69 9.535 -3.628 -6.373
552 HD2 ARG 69 2HD ARG 69 10.660 -2.062 -7.754
553 HD3 ARG 69 1HD ARG 69 8.933 -1.856 -8.021
554 HE ARG 69 HE ARG 69 10.403 -0.089 -6.173
555 HH11 ARG 69 1HH1 ARG 69 8.410 -0.544 -9.018
556 HH12 ARG 69 2HH1 ARG 69 8.066 1.151 -9.206
557 HH21 ARG 69 1HH2 ARG 69 9.984 2.144 -6.439
558 HH22 ARG 69 2HH2 ARG 69 8.997 2.678 -7.767
559 H LEU 70 HN LEU 70 6.336 -3.501 -3.245
560 HA LEU 70 HA LEU 70 3.960 -2.058 -3.636
561 HB2 LEU 70 2HB LEU 70 4.075 -4.509 -3.381
562 HB3 LEU 70 1HB LEU 70 4.477 -4.305 -1.687
563 HG LEU 70 HG LEU 70 2.273 -3.209 -1.336
564 HD11 LEU 70 1HD1 LEU 70 1.776 -4.055 -4.188
565 HD12 LEU 70 2HD1 LEU 70 1.895 -2.397 -3.598
566 HD13 LEU 70 3HD1 LEU 70 0.561 -3.425 -3.073
567 HD21 LEU 70 3HD2 LEU 70 2.569 -5.568 -0.852
568 HD22 LEU 70 1HD2 LEU 70 2.205 -5.977 -2.528
569 HD23 LEU 70 2HD2 LEU 70 0.955 -5.272 -1.502
570 H ARG 71 HN ARG 71 6.173 -2.225 -0.925
571 HA ARG 71 HA ARG 71 4.609 -1.161 1.109
572 HB2 ARG 71 2HB ARG 71 6.966 -2.063 1.315
573 HB3 ARG 71 1HB ARG 71 7.537 -0.525 0.679
574 HG2 ARG 71 2HG ARG 71 6.277 0.559 2.606
575 HG3 ARG 71 1HG ARG 71 6.138 -1.065 3.282
576 HD2 ARG 71 2HD ARG 71 8.701 0.385 2.613
577 HD3 ARG 71 1HD ARG 71 8.046 0.124 4.226
578 HE ARG 71 HE ARG 71 8.576 -2.269 2.679
579 HH11 ARG 71 1HH1 ARG 71 9.705 -0.016 5.107
580 HH12 ARG 71 2HH1 ARG 71 10.962 -1.062 5.699
581 HH21 ARG 71 1HH2 ARG 71 10.238 -3.672 3.464
582 HH22 ARG 71 2HH2 ARG 71 11.265 -3.141 4.757
583 H GLY 72 HN GLY 72 6.322 0.444 -1.513
584 HA2 GLY 72 2HA GLY 72 5.998 3.107 -0.599
585 HA3 GLY 72 1HA GLY 72 6.330 2.617 -2.253
586 H ARG 73 HN ARG 73 3.969 1.011 -2.584
587 HA ARG 73 HA ARG 73 2.128 3.075 -3.294
588 HB2 ARG 73 2HB ARG 73 1.915 0.066 -3.367
589 HB3 ARG 73 1HB ARG 73 0.616 1.130 -3.892
590 HG2 ARG 73 2HG ARG 73 2.181 2.136 -5.531
591 HG3 ARG 73 1HG ARG 73 3.380 0.931 -5.062
592 HD2 ARG 73 2HD ARG 73 1.877 -0.856 -5.758
593 HD3 ARG 73 1HD ARG 73 0.645 0.332 -6.179
594 HE ARG 73 HE ARG 73 2.031 1.053 -7.990
595 HH11 ARG 73 1HH1 ARG 73 3.106 -1.854 -6.387
596 HH12 ARG 73 2HH1 ARG 73 4.093 -2.393 -7.712
597 HH21 ARG 73 1HH2 ARG 73 3.308 0.353 -9.764
598 HH22 ARG 73 2HH2 ARG 73 4.222 -1.117 -9.634
599 H ILE 74 HN ILE 74 2.156 0.509 -0.852
600 HA ILE 74 HA ILE 74 -0.324 1.087 0.316
601 HB ILE 74 HB ILE 74 2.149 0.009 1.690
602 HG12 ILE 74 2HG1 ILE 74 -0.134 -1.476 0.359
603 HG13 ILE 74 1HG1 ILE 74 1.483 -1.292 -0.316
604 HG21 ILE 74 1HG2 ILE 74 -0.769 -0.166 2.451
605 HG22 ILE 74 2HG2 ILE 74 0.484 0.750 3.289
606 HG23 ILE 74 3HG2 ILE 74 0.549 -1.012 3.261
607 HD11 ILE 74 3HD1 ILE 74 0.792 -2.715 2.245
608 HD12 ILE 74 1HD1 ILE 74 2.407 -2.546 1.555
609 HD13 ILE 74 2HD1 ILE 74 1.178 -3.475 0.700
610 H GLU 75 HN GLU 75 2.914 2.369 0.939
611 HA GLU 75 HA GLU 75 2.331 3.957 3.153
612 HB2 GLU 75 2HB GLU 75 4.610 3.534 2.451
613 HB3 GLU 75 1HB GLU 75 4.337 4.370 0.933
614 HG2 GLU 75 2HG GLU 75 3.931 6.454 2.220
615 HG3 GLU 75 1HG GLU 75 4.383 5.584 3.684
616 H SER 76 HN SER 76 2.297 4.763 -0.280
617 HA SER 76 HA SER 76 1.670 7.468 0.007
618 HB2 SER 76 2HB SER 76 0.994 5.655 -2.301
619 HB3 SER 76 1HB SER 76 1.097 7.412 -2.359
620 HG SER 76 HG SER 76 3.163 5.509 -2.063
621 H VAL 77 HN VAL 77 -0.415 4.637 -0.265
622 HA VAL 77 HA VAL 77 -2.843 6.114 -0.432
623 HB VAL 77 HB VAL 77 -2.382 3.241 0.393
624 HG11 VAL 77 1HG1 VAL 77 -4.940 4.641 -0.397
625 HG12 VAL 77 2HG1 VAL 77 -4.534 4.055 1.216
626 HG13 VAL 77 3HG1 VAL 77 -4.764 2.911 -0.105
627 HG21 VAL 77 3HG2 VAL 77 -3.093 2.714 -1.896
628 HG22 VAL 77 1HG2 VAL 77 -1.630 3.699 -1.878
629 HG23 VAL 77 2HG2 VAL 77 -3.186 4.437 -2.258
630 H LEU 78 HN LEU 78 -1.149 4.482 2.248
631 HA LEU 78 HA LEU 78 -3.165 5.064 4.159
632 HB2 LEU 78 2HB LEU 78 -0.276 4.275 4.472
633 HB3 LEU 78 1HB LEU 78 -1.362 4.494 5.829
634 HG LEU 78 HG LEU 78 -1.663 2.455 3.622
635 HD11 LEU 78 1HD1 LEU 78 -1.020 2.154 6.551
636 HD12 LEU 78 2HD1 LEU 78 0.099 1.910 5.208
637 HD13 LEU 78 3HD1 LEU 78 -1.283 0.833 5.411
638 HD21 LEU 78 3HD2 LEU 78 -3.567 1.624 4.914
639 HD22 LEU 78 1HD2 LEU 78 -3.835 3.281 4.368
640 HD23 LEU 78 2HD2 LEU 78 -3.387 2.966 6.044
641 H ASP 79 HN ASP 79 -0.178 6.713 3.225
642 HA ASP 79 HA ASP 79 -0.181 8.725 5.172
643 HB2 ASP 79 2HB ASP 79 1.692 8.368 3.631
644 HB3 ASP 79 1HB ASP 79 0.691 8.854 2.269
645 H TRP 80 HN TRP 80 -1.712 8.614 1.988
646 HA TRP 80 HA TRP 80 -2.930 11.138 2.042
647 HB2 TRP 80 2HB TRP 80 -2.629 9.715 0.026
648 HB3 TRP 80 1HB TRP 80 -3.861 8.624 0.641
649 HD1 TRP 80 1HD TRP 80 -3.502 12.227 -0.693
650 HE1 TRP 80 1HE TRP 80 -5.763 12.939 -1.701
651 HE3 TRP 80 3HE TRP 80 -6.292 8.158 0.654
652 HZ2 TRP 80 2HZ TRP 80 -8.386 11.896 -1.896
653 HZ3 TRP 80 3HZ TRP 80 -8.670 8.100 0.022
654 HH2 TRP 80 2HH TRP 80 -9.692 9.934 -1.222
655 H ALA 81 HN ALA 81 -4.188 7.930 2.909
656 HA ALA 81 HA ALA 81 -6.794 8.741 3.573
657 HB1 ALA 81 1HB ALA 81 -7.009 6.591 4.668
658 HB2 ALA 81 2HB ALA 81 -5.258 6.389 4.664
659 HB3 ALA 81 3HB ALA 81 -6.144 6.416 3.139
660 H THR 82 HN THR 82 -3.852 8.567 5.523
661 HA THR 82 HA THR 82 -5.092 8.986 8.028
662 HB THR 82 HB THR 82 -2.263 9.680 7.205
663 HG1 THR 82 1HG THR 82 -2.533 7.508 6.883
664 HG21 THR 82 3HG2 THR 82 -2.925 10.735 9.318
665 HG22 THR 82 1HG2 THR 82 -1.745 9.455 9.591
666 HG23 THR 82 2HG2 THR 82 -3.452 9.171 9.937
667 H VAL 83 HN VAL 83 -3.645 11.232 5.688
668 HA VAL 83 HA VAL 83 -4.097 13.568 7.226
669 HB VAL 83 HB VAL 83 -3.789 13.274 4.227
670 HG11 VAL 83 1HG1 VAL 83 -3.548 15.724 5.978
671 HG12 VAL 83 2HG1 VAL 83 -4.812 15.411 4.790
672 HG13 VAL 83 3HG1 VAL 83 -3.147 15.651 4.261
673 HG21 VAL 83 3HG2 VAL 83 -1.755 13.916 6.366
674 HG22 VAL 83 1HG2 VAL 83 -1.451 13.902 4.628
675 HG23 VAL 83 2HG2 VAL 83 -1.871 12.406 5.463
676 H ARG 84 HN ARG 84 -6.065 11.742 4.973
677 HA ARG 84 HA ARG 84 -8.062 13.781 4.681
678 HB2 ARG 84 2HB ARG 84 -8.000 10.871 3.896
679 HB3 ARG 84 1HB ARG 84 -9.370 11.924 3.576
680 HG2 ARG 84 2HG ARG 84 -6.568 12.355 2.563
681 HG3 ARG 84 1HG ARG 84 -7.912 11.695 1.628
682 HD2 ARG 84 2HD ARG 84 -7.851 14.434 2.892
683 HD3 ARG 84 1HD ARG 84 -7.532 14.092 1.193
684 HE ARG 84 HE ARG 84 -9.934 13.047 1.379
685 HH11 ARG 84 1HH1 ARG 84 -8.788 16.015 2.848
686 HH12 ARG 84 2HH1 ARG 84 -10.332 16.810 2.749
687 HH21 ARG 84 1HH2 ARG 84 -11.959 14.060 1.264
688 HH22 ARG 84 2HH2 ARG 84 -12.152 15.681 1.858
689 H GLY 85 HN GLY 85 -7.333 11.746 7.205
690 HA2 GLY 85 2HA GLY 85 -8.430 11.791 9.263
691 HA3 GLY 85 1HA GLY 85 -9.843 12.469 8.473
692 H TYR 86 HN TYR 86 -8.638 9.709 6.895
693 HA TYR 86 HA TYR 86 -10.938 8.178 7.727
694 HB2 TYR 86 2HB TYR 86 -8.645 7.500 5.870
695 HB3 TYR 86 1HB TYR 86 -9.997 6.421 6.193
696 HD1 TYR 86 1HD TYR 86 -12.377 7.679 5.936
697 HD2 TYR 86 2HD TYR 86 -8.779 8.728 3.925
698 HE1 TYR 86 1HE TYR 86 -13.692 8.786 4.181
699 HE2 TYR 86 2HE TYR 86 -10.083 9.847 2.166
700 HH TYR 86 HH TYR 86 -13.379 10.576 2.506
701 H ARG 87 HN ARG 87 -7.678 8.504 8.651
702 HA ARG 87 HA ARG 87 -8.131 6.850 10.942
703 HB2 ARG 87 2HB ARG 87 -6.196 5.387 10.643
704 HB3 ARG 87 1HB ARG 87 -7.351 5.143 9.342
705 HG2 ARG 87 2HG ARG 87 -5.986 6.499 7.855
706 HG3 ARG 87 1HG ARG 87 -4.832 6.784 9.159
707 HD2 ARG 87 2HD ARG 87 -5.504 4.146 7.859
708 HD3 ARG 87 1HD ARG 87 -3.986 5.036 7.735
709 HE ARG 87 HE ARG 87 -4.867 3.364 9.924
710 HH11 ARG 87 1HH1 ARG 87 -2.696 5.941 8.958
711 HH12 ARG 87 2HH1 ARG 87 -1.525 5.588 10.191
712 HH21 ARG 87 1HH2 ARG 87 -3.332 2.892 11.546
713 HH22 ARG 87 2HH2 ARG 87 -1.871 3.835 11.646
714 H GLU 88 HN GLU 88 -6.553 7.293 12.597
715 HA GLU 88 HA GLU 88 -5.124 9.802 12.033
716 HB2 GLU 88 2HB GLU 88 -6.199 8.796 14.671
717 HB3 GLU 88 1HB GLU 88 -5.316 10.298 14.438
718 HG2 GLU 88 2HG GLU 88 -7.410 11.133 14.380
719 HG3 GLU 88 1HG GLU 88 -7.261 10.708 12.677
720 H GLY 89 HN GLY 89 -3.232 10.204 13.470
721 HA2 GLY 89 2HA GLY 89 -1.389 9.332 14.724
722 HA3 GLY 89 1HA GLY 89 -1.766 7.732 14.096
723 H ASP 90 HN ASP 90 0.215 7.306 13.237
724 HA ASP 90 HA ASP 90 0.955 8.958 10.923
725 HB2 ASP 90 2HB ASP 90 2.653 7.339 12.826
726 HB3 ASP 90 1HB ASP 90 3.246 7.898 11.271
727 H ASN 91 HN ASN 91 2.518 7.250 9.523
728 HA ASN 91 HA ASN 91 0.560 5.200 8.780
729 HB2 ASN 91 2HB ASN 91 1.236 6.606 6.968
730 HB3 ASN 91 1HB ASN 91 2.933 6.453 7.389
731 HD21 ASN 91 1HD2 ASN 91 3.345 5.893 5.237
732 HD22 ASN 91 2HD2 ASN 91 3.043 4.296 4.663
733 HA PRO 92 HA PRO 92 3.191 2.092 10.614
734 HB2 PRO 92 2HB PRO 92 1.605 0.057 9.299
735 HB3 PRO 92 1HB PRO 92 1.641 0.504 11.005
736 HG2 PRO 92 2HG PRO 92 -0.496 0.955 9.375
737 HG3 PRO 92 1HG PRO 92 -0.119 1.940 10.798
738 HD2 PRO 92 2HD PRO 92 0.405 2.504 7.909
739 HD3 PRO 92 1HD PRO 92 -0.140 3.602 9.195
740 H ALA 93 HN ALA 93 2.628 2.338 7.194
741 HA ALA 93 HA ALA 93 4.315 0.111 6.474
742 HB1 ALA 93 1HB ALA 93 2.400 0.769 5.090
743 HB2 ALA 93 2HB ALA 93 3.908 0.799 4.178
744 HB3 ALA 93 3HB ALA 93 3.189 2.308 4.740
745 H ARG 94 HN ARG 94 5.099 2.983 7.741
746 HA ARG 94 HA ARG 94 7.214 3.833 6.005
747 HB2 ARG 94 2HB ARG 94 5.898 5.228 7.717
748 HB3 ARG 94 1HB ARG 94 6.930 4.493 8.933
749 HG2 ARG 94 2HG ARG 94 7.801 6.647 8.366
750 HG3 ARG 94 1HG ARG 94 8.902 5.412 7.754
751 HD2 ARG 94 2HD ARG 94 8.282 5.772 5.545
752 HD3 ARG 94 1HD ARG 94 6.756 6.534 5.995
753 HE ARG 94 HE ARG 94 8.975 8.047 6.928
754 HH11 ARG 94 1HH1 ARG 94 7.249 7.266 3.965
755 HH12 ARG 94 2HH1 ARG 94 7.529 8.834 3.264
756 HH21 ARG 94 1HH2 ARG 94 9.344 10.083 5.980
757 HH22 ARG 94 2HH2 ARG 94 8.704 10.429 4.400
758 H TRP 95 HN TRP 95 7.300 2.621 9.345
759 HA TRP 95 HA TRP 95 8.600 1.160 10.452
760 HB2 TRP 95 2HB TRP 95 8.992 0.254 7.670
761 HB3 TRP 95 1HB TRP 95 10.189 -0.283 8.847
762 HD1 TRP 95 1HD TRP 95 8.798 -1.202 11.264
763 HE1 TRP 95 1HE TRP 95 6.959 -2.999 11.298
764 HE3 TRP 95 3HE TRP 95 7.289 -0.888 6.389
765 HZ2 TRP 95 2HZ TRP 95 5.108 -4.132 9.480
766 HZ3 TRP 95 3HZ TRP 95 5.480 -2.365 5.618
767 HH2 TRP 95 2HH TRP 95 4.414 -3.952 7.133
768 H ARG 96 HN ARG 96 10.200 1.701 11.676
769 HA ARG 96 HA ARG 96 12.354 3.376 10.817
770 HB2 ARG 96 2HB ARG 96 11.879 1.795 13.349
771 HB3 ARG 96 1HB ARG 96 13.263 2.848 13.110
772 HG2 ARG 96 2HG ARG 96 10.401 3.766 12.982
773 HG3 ARG 96 1HG ARG 96 11.415 3.858 14.422
774 HD2 ARG 96 2HD ARG 96 12.993 5.288 13.232
775 HD3 ARG 96 1HD ARG 96 12.006 5.176 11.775
776 HE ARG 96 HE ARG 96 10.209 6.249 13.216
777 HH11 ARG 96 1HH1 ARG 96 13.639 6.841 13.682
778 HH12 ARG 96 2HH1 ARG 96 13.394 8.417 14.374
779 HH21 ARG 96 1HH2 ARG 96 9.897 8.308 14.115
780 HH22 ARG 96 2HH2 ARG 96 11.266 9.263 14.588
781 H GLY 97 HN GLY 97 11.822 -0.032 11.226
782 HA2 GLY 97 2HA GLY 97 13.597 -0.955 9.393
783 HA3 GLY 97 1HA GLY 97 14.580 -0.767 10.838
784 H TYR 98 HN TYR 98 11.640 -2.309 9.602
785 HA TYR 98 HA TYR 98 11.360 -4.067 11.828
786 HB2 TYR 98 2HB TYR 98 9.466 -3.481 10.363
787 HB3 TYR 98 1HB TYR 98 10.242 -4.325 9.028
788 HD1 TYR 98 2HD TYR 98 9.209 -5.005 12.559
789 HD2 TYR 98 1HD TYR 98 9.504 -6.472 8.579
790 HE1 TYR 98 2HE TYR 98 8.122 -7.100 13.258
791 HE2 TYR 98 1HE TYR 98 8.413 -8.563 9.266
792 HH TYR 98 HH TYR 98 8.033 -9.879 11.236
793 H LEU 99 HN LEU 99 12.770 -4.362 8.608
794 HA LEU 99 HA LEU 99 13.997 -6.901 9.427
795 HB2 LEU 99 2HB LEU 99 13.398 -5.840 6.662
796 HB3 LEU 99 1HB LEU 99 14.237 -7.338 7.001
797 HG LEU 99 HG LEU 99 11.389 -6.758 7.808
798 HD11 LEU 99 1HD1 LEU 99 12.468 -8.408 5.530
799 HD12 LEU 99 2HD1 LEU 99 11.579 -6.891 5.393
800 HD13 LEU 99 3HD1 LEU 99 10.777 -8.327 6.029
801 HD21 LEU 99 3HD2 LEU 99 12.497 -8.356 9.275
802 HD22 LEU 99 1HD2 LEU 99 13.005 -9.303 7.877
803 HD23 LEU 99 2HD2 LEU 99 11.290 -9.160 8.270
804 H GLU 100 HN GLU 100 14.653 -4.289 7.098
805 HA GLU 100 HA GLU 100 17.448 -4.286 8.016
806 HB2 GLU 100 2HB GLU 100 16.243 -3.430 5.384
807 HB3 GLU 100 1HB GLU 100 17.920 -3.155 5.828
808 HG2 GLU 100 2HG GLU 100 18.283 -5.561 5.965
809 HG3 GLU 100 1HG GLU 100 16.593 -5.839 5.531
810 H HIS 101 HN HIS 101 18.469 -2.350 8.444
811 HA HIS 101 HA HIS 101 16.834 0.091 8.286
812 HB2 HIS 101 2HB HIS 101 17.216 -0.544 10.650
813 HB3 HIS 101 1HB HIS 101 18.952 -0.559 10.361
814 HD1 HIS 101 1HD HIS 101 16.032 1.806 10.672
815 HD2 HIS 101 2HD HIS 101 20.189 1.927 10.448
816 HE1 HIS 101 1HE HIS 101 16.675 4.172 11.228
817 HE2 HIS 101 2HE HIS 101 19.193 4.201 11.205
818 H HIS 102 HN HIS 102 17.580 0.939 6.419
819 HA HIS 102 HA HIS 102 20.398 0.652 5.750
820 HB2 HIS 102 2HB HIS 102 17.960 1.505 4.242
821 HB3 HIS 102 1HB HIS 102 19.548 1.970 3.643
822 HD1 HIS 102 1HD HIS 102 20.590 0.345 2.109
823 HD2 HIS 102 2HD HIS 102 17.806 -1.452 4.618
824 HE1 HIS 102 1HE HIS 102 20.495 -2.064 1.396
825 HE2 HIS 102 2HE HIS 102 18.953 -3.172 3.058
826 H HIS 103 HN HIS 103 21.852 2.261 5.545
827 HA HIS 103 HA HIS 103 21.291 4.775 6.846
828 HB2 HIS 103 2HB HIS 103 23.538 3.306 6.637
829 HB3 HIS 103 1HB HIS 103 23.784 4.373 5.260
830 HD1 HIS 103 1HD HIS 103 25.670 4.470 7.693
831 HD2 HIS 103 2HD HIS 103 22.339 6.923 7.219
832 HE1 HIS 103 1HE HIS 103 26.108 6.502 9.112
833 HE2 HIS 103 2HE HIS 103 24.161 8.042 8.674
834 H HIS 104 HN HIS 104 21.216 6.808 5.831
835 HA HIS 104 HA HIS 104 19.771 7.003 3.508
836 HB2 HIS 104 2HB HIS 104 20.063 8.834 5.156
837 HB3 HIS 104 1HB HIS 104 21.692 9.098 4.545
838 HD1 HIS 104 1HD HIS 104 21.936 10.474 2.419
839 HD2 HIS 104 2HD HIS 104 17.986 9.594 3.369
840 HE1 HIS 104 1HE HIS 104 20.541 11.871 0.863
841 HE2 HIS 104 2HE HIS 104 18.160 11.452 1.576
842 H HIS 105 HN HIS 105 23.271 7.573 3.825
843 HA HIS 105 HA HIS 105 24.987 7.456 2.347
844 HB2 HIS 105 2HB HIS 105 24.172 5.327 1.534
845 HB3 HIS 105 1HB HIS 105 22.954 6.121 0.545
846 HD1 HIS 105 1HD HIS 105 23.701 7.080 -1.714
847 HD2 HIS 105 2HD HIS 105 26.803 5.413 0.494
848 HE1 HIS 105 1HE HIS 105 25.643 6.913 -3.299
849 HE2 HIS 105 2HE HIS 105 27.532 5.947 -1.935
850 H HIS 106 HN HIS 106 25.892 8.971 1.033
851 HA HIS 106 HA HIS 106 24.102 11.055 0.065
852 HB2 HIS 106 2HB HIS 106 26.147 11.637 1.386
853 HB3 HIS 106 1HB HIS 106 27.129 11.008 0.066
854 HD1 HIS 106 1HD HIS 106 27.736 12.643 -1.725
855 HD2 HIS 106 2HD HIS 106 24.482 13.910 0.538
856 HE1 HIS 106 1HE HIS 106 27.214 14.969 -2.525
857 HE2 HIS 106 2HE HIS 106 25.141 15.647 -1.265
Start of MODEL 17
1 H1 MET 1 H1 MET 1 -15.074 3.559 6.147
2 H2 MET 1 H2 MET 1 -14.920 5.238 5.995
3 H3 MET 1 H3 MET 1 -13.716 4.344 6.782
4 HA MET 1 HA MET 1 -14.430 4.045 3.926
5 HB2 MET 1 2HB MET 1 -13.418 6.261 4.469
6 HB3 MET 1 1HB MET 1 -12.029 5.422 5.147
7 HG2 MET 1 2HG MET 1 -11.518 6.179 2.926
8 HG3 MET 1 1HG MET 1 -11.589 4.419 2.952
9 HE1 MET 1 2HE MET 1 -13.640 7.694 2.062
10 HE2 MET 1 3HE MET 1 -14.730 6.751 3.075
11 HE3 MET 1 1HE MET 1 -15.095 6.981 1.365
12 H THR 2 HN THR 2 -13.629 2.244 3.027
13 HA THR 2 HA THR 2 -11.904 0.556 4.673
14 HB THR 2 HB THR 2 -12.338 -1.204 3.001
15 HG1 THR 2 1HG THR 2 -14.188 0.581 1.785
16 HG21 THR 2 3HG2 THR 2 -14.822 0.203 3.981
17 HG22 THR 2 1HG2 THR 2 -13.871 -0.977 4.880
18 HG23 THR 2 2HG2 THR 2 -14.748 -1.472 3.431
19 H PHE 3 HN PHE 3 -10.154 -0.669 3.440
20 HA PHE 3 HA PHE 3 -8.291 1.266 2.561
21 HB2 PHE 3 2HB PHE 3 -7.649 -0.838 3.702
22 HB3 PHE 3 1HB PHE 3 -8.134 -1.740 2.271
23 HD1 PHE 3 2HD PHE 3 -5.803 0.901 3.433
24 HD2 PHE 3 1HD PHE 3 -6.617 -2.109 0.538
25 HE1 PHE 3 2HE PHE 3 -3.549 1.202 2.491
26 HE2 PHE 3 1HE PHE 3 -4.367 -1.809 -0.412
27 HZ PHE 3 HZ PHE 3 -2.830 -0.153 0.564
28 H SER 4 HN SER 4 -10.240 -1.138 0.847
29 HA SER 4 HA SER 4 -9.119 -0.733 -1.705
30 HB2 SER 4 2HB SER 4 -11.921 -1.619 -0.968
31 HB3 SER 4 1HB SER 4 -11.202 -1.758 -2.572
32 HG SER 4 HG SER 4 -10.498 -3.604 -1.878
33 H GLU 5 HN GLU 5 -11.884 0.780 -0.092
34 HA GLU 5 HA GLU 5 -12.671 2.414 -2.251
35 HB2 GLU 5 2HB GLU 5 -13.083 2.655 0.728
36 HB3 GLU 5 1HB GLU 5 -13.854 3.706 -0.444
37 HG2 GLU 5 2HG GLU 5 -14.994 1.820 -1.430
38 HG3 GLU 5 1HG GLU 5 -14.168 0.723 -0.326
39 H CYS 6 HN CYS 6 -10.616 2.999 0.563
40 HA CYS 6 HA CYS 6 -10.067 5.710 0.101
41 HB2 CYS 6 2HB CYS 6 -9.565 4.330 2.170
42 HB3 CYS 6 1HB CYS 6 -8.157 3.719 1.324
43 HG CYS 6 HG CYS 6 -7.262 6.505 0.923
44 H ALA 7 HN ALA 7 -8.312 2.792 -0.858
45 HA ALA 7 HA ALA 7 -6.224 4.023 -2.267
46 HB1 ALA 7 1HB ALA 7 -5.915 1.882 -3.394
47 HB2 ALA 7 2HB ALA 7 -7.497 1.346 -2.831
48 HB3 ALA 7 3HB ALA 7 -6.207 1.654 -1.671
49 H ALA 8 HN ALA 8 -9.402 2.892 -3.409
50 HA ALA 8 HA ALA 8 -9.071 3.579 -6.107
51 HB1 ALA 8 1HB ALA 8 -11.626 3.540 -4.501
52 HB2 ALA 8 2HB ALA 8 -10.894 2.152 -5.305
53 HB3 ALA 8 3HB ALA 8 -11.502 3.502 -6.262
54 H LEU 9 HN LEU 9 -10.300 5.456 -3.370
55 HA LEU 9 HA LEU 9 -10.963 7.772 -4.832
56 HB2 LEU 9 2HB LEU 9 -10.211 7.403 -1.936
57 HB3 LEU 9 1HB LEU 9 -10.755 8.927 -2.605
58 HG LEU 9 HG LEU 9 -12.359 6.375 -2.474
59 HD11 LEU 9 1HD1 LEU 9 -12.108 7.446 -0.308
60 HD12 LEU 9 2HD1 LEU 9 -13.758 7.639 -0.904
61 HD13 LEU 9 3HD1 LEU 9 -12.623 8.987 -0.992
62 HD21 LEU 9 3HD2 LEU 9 -12.877 7.676 -4.484
63 HD22 LEU 9 1HD2 LEU 9 -13.142 9.107 -3.488
64 HD23 LEU 9 2HD2 LEU 9 -14.211 7.714 -3.329
65 H TYR 10 HN TYR 10 -7.974 6.765 -3.220
66 HA TYR 10 HA TYR 10 -6.447 9.072 -3.624
67 HB2 TYR 10 2HB TYR 10 -5.577 7.302 -2.265
68 HB3 TYR 10 1HB TYR 10 -5.670 6.152 -3.588
69 HD1 TYR 10 1HD TYR 10 -3.835 9.093 -2.302
70 HD2 TYR 10 2HD TYR 10 -3.912 5.964 -5.190
71 HE1 TYR 10 1HE TYR 10 -1.508 9.602 -2.911
72 HE2 TYR 10 2HE TYR 10 -1.584 6.462 -5.802
73 HH TYR 10 HH TYR 10 0.448 8.331 -3.937
74 H ILE 11 HN ILE 11 -6.828 6.229 -5.686
75 HA ILE 11 HA ILE 11 -5.232 7.056 -7.829
76 HB ILE 11 HB ILE 11 -7.641 5.230 -7.787
77 HG12 ILE 11 2HG1 ILE 11 -4.670 4.659 -7.830
78 HG13 ILE 11 1HG1 ILE 11 -5.703 4.547 -6.411
79 HG21 ILE 11 1HG2 ILE 11 -7.308 6.078 -10.047
80 HG22 ILE 11 2HG2 ILE 11 -6.866 4.374 -9.945
81 HG23 ILE 11 3HG2 ILE 11 -5.609 5.610 -9.982
82 HD11 ILE 11 3HD1 ILE 11 -5.231 2.365 -7.378
83 HD12 ILE 11 1HD1 ILE 11 -5.965 2.876 -8.898
84 HD13 ILE 11 2HD1 ILE 11 -6.951 2.742 -7.443
85 H LYS 12 HN LYS 12 -8.746 7.449 -7.309
86 HA LYS 12 HA LYS 12 -9.186 8.787 -9.773
87 HB2 LYS 12 2HB LYS 12 -10.857 8.629 -7.269
88 HB3 LYS 12 1HB LYS 12 -11.399 9.396 -8.757
89 HG2 LYS 12 2HG LYS 12 -11.037 7.231 -9.927
90 HG3 LYS 12 1HG LYS 12 -10.683 6.500 -8.362
91 HD2 LYS 12 2HD LYS 12 -12.916 7.098 -7.570
92 HD3 LYS 12 1HD LYS 12 -13.268 7.862 -9.123
93 HE2 LYS 12 2HE LYS 12 -12.931 5.695 -10.237
94 HE3 LYS 12 1HE LYS 12 -12.645 4.946 -8.669
95 HZ1 LYS 12 3HZ LYS 12 -15.166 6.214 -9.594
96 HZ2 LYS 12 1HZ LYS 12 -14.903 5.626 -8.020
97 HZ3 LYS 12 2HZ LYS 12 -14.890 4.559 -9.341
98 H ALA 13 HN ALA 13 -8.411 9.916 -6.534
99 HA ALA 13 HA ALA 13 -8.944 12.647 -6.938
100 HB1 ALA 13 1HB ALA 13 -8.536 11.670 -4.728
101 HB2 ALA 13 2HB ALA 13 -7.483 13.049 -5.040
102 HB3 ALA 13 3HB ALA 13 -6.846 11.409 -5.161
103 H HIS 14 HN HIS 14 -6.506 10.644 -8.254
104 HA HIS 14 HA HIS 14 -4.939 13.021 -9.015
105 HB2 HIS 14 2HB HIS 14 -4.082 10.156 -8.630
106 HB3 HIS 14 1HB HIS 14 -3.082 11.345 -9.456
107 HD1 HIS 14 1HD HIS 14 -1.660 12.837 -8.017
108 HD2 HIS 14 2HD HIS 14 -4.526 10.756 -5.832
109 HE1 HIS 14 1HE HIS 14 -1.131 13.286 -5.602
110 HE2 HIS 14 2HE HIS 14 -2.751 11.857 -4.309
111 H ARG 15 HN ARG 15 -7.095 10.761 -10.240
112 HA ARG 15 HA ARG 15 -5.877 9.725 -12.499
113 HB2 ARG 15 2HB ARG 15 -8.114 9.307 -13.386
114 HB3 ARG 15 1HB ARG 15 -7.980 8.872 -11.691
115 HG2 ARG 15 2HG ARG 15 -9.227 10.756 -11.011
116 HG3 ARG 15 1HG ARG 15 -9.133 11.479 -12.618
117 HD2 ARG 15 2HD ARG 15 -10.418 8.808 -12.219
118 HD3 ARG 15 1HD ARG 15 -11.312 10.293 -11.888
119 HE ARG 15 HE ARG 15 -10.045 10.281 -14.465
120 HH11 ARG 15 1HH1 ARG 15 -12.859 9.220 -12.692
121 HH12 ARG 15 2HH1 ARG 15 -13.921 9.297 -14.061
122 HH21 ARG 15 1HH2 ARG 15 -11.420 10.393 -16.279
123 HH22 ARG 15 2HH2 ARG 15 -13.103 9.993 -16.115
124 H SER 16 HN SER 16 -7.138 12.928 -12.061
125 HA SER 16 HA SER 16 -7.538 13.614 -14.767
126 HB2 SER 16 2HB SER 16 -8.386 14.900 -12.779
127 HB3 SER 16 1HB SER 16 -6.740 15.460 -12.498
128 HG SER 16 HG SER 16 -8.052 16.945 -13.689
129 H SER 17 HN SER 17 -4.700 13.804 -12.673
130 HA SER 17 HA SER 17 -3.019 14.656 -14.895
131 HB2 SER 17 2HB SER 17 -2.155 13.873 -12.105
132 HB3 SER 17 1HB SER 17 -1.323 14.919 -13.247
133 HG SER 17 HG SER 17 -3.340 16.270 -13.028
134 H TRP 18 HN TRP 18 -4.269 11.929 -13.502
135 HA TRP 18 HA TRP 18 -1.984 10.177 -13.957
136 HB2 TRP 18 2HB TRP 18 -4.202 10.314 -12.129
137 HB3 TRP 18 1HB TRP 18 -4.119 8.734 -12.894
138 HD1 TRP 18 1HD TRP 18 -1.031 10.806 -11.806
139 HE1 TRP 18 1HE TRP 18 0.209 9.437 -9.996
140 HE3 TRP 18 3HE TRP 18 -4.345 6.988 -11.345
141 HZ2 TRP 18 2HZ TRP 18 -0.210 7.024 -8.555
142 HZ3 TRP 18 3HZ TRP 18 -3.869 5.176 -9.744
143 HH2 TRP 18 2HH TRP 18 -1.856 5.206 -8.373
144 H LYS 19 HN LYS 19 -3.600 11.114 -16.291
145 HA LYS 19 HA LYS 19 -4.974 9.075 -17.492
146 HB2 LYS 19 2HB LYS 19 -2.722 10.749 -18.650
147 HB3 LYS 19 1HB LYS 19 -3.770 9.710 -19.615
148 HG2 LYS 19 2HG LYS 19 -5.697 11.002 -19.040
149 HG3 LYS 19 1HG LYS 19 -4.775 11.951 -17.877
150 HD2 LYS 19 2HD LYS 19 -3.457 12.915 -19.674
151 HD3 LYS 19 1HD LYS 19 -4.308 11.914 -20.855
152 HE2 LYS 19 2HE LYS 19 -5.163 14.239 -20.753
153 HE3 LYS 19 1HE LYS 19 -6.389 13.028 -20.378
154 HZ1 LYS 19 3HZ LYS 19 -6.091 13.487 -18.027
155 HZ2 LYS 19 1HZ LYS 19 -6.480 14.915 -18.857
156 HZ3 LYS 19 2HZ LYS 19 -4.880 14.627 -18.371
157 H ASN 20 HN ASN 20 -3.313 6.619 -16.366
158 HA ASN 20 HA ASN 20 -5.238 5.740 -17.210
159 HB2 ASN 20 2HB ASN 20 -6.120 8.055 -17.671
160 HB3 ASN 20 1HB ASN 20 -5.290 8.024 -19.220
161 HD21 ASN 20 1HD2 ASN 20 -6.910 5.236 -17.809
162 HD22 ASN 20 2HD2 ASN 20 -8.184 5.173 -18.975
163 H THR 21 HN THR 21 -2.339 6.058 -18.251
164 HA THR 21 HA THR 21 -2.552 4.051 -20.357
165 HB THR 21 HB THR 21 -0.005 4.033 -20.043
166 HG1 THR 21 1HG THR 21 0.312 6.432 -19.055
167 HG21 THR 21 3HG2 THR 21 0.309 6.094 -21.321
168 HG22 THR 21 1HG2 THR 21 -1.308 6.630 -20.865
169 HG23 THR 21 2HG2 THR 21 -1.105 5.211 -21.892
170 H LYS 22 HN LYS 22 -0.402 2.379 -19.444
171 HA LYS 22 HA LYS 22 -1.837 0.728 -17.638
172 HB2 LYS 22 2HB LYS 22 0.063 -0.754 -17.694
173 HB3 LYS 22 1HB LYS 22 -0.298 -0.170 -19.309
174 HG2 LYS 22 2HG LYS 22 1.536 1.412 -19.169
175 HG3 LYS 22 1HG LYS 22 1.895 0.858 -17.530
176 HD2 LYS 22 2HD LYS 22 2.380 -1.367 -18.364
177 HD3 LYS 22 1HD LYS 22 1.950 -0.872 -20.001
178 HE2 LYS 22 2HE LYS 22 3.793 0.744 -19.986
179 HE3 LYS 22 1HE LYS 22 4.225 0.230 -18.356
180 HZ1 LYS 22 3HZ LYS 22 4.798 -1.916 -19.150
181 HZ2 LYS 22 1HZ LYS 22 5.563 -0.794 -20.164
182 HZ3 LYS 22 2HZ LYS 22 4.166 -1.601 -20.689
183 H HIS 23 HN HIS 23 0.076 3.429 -17.016
184 HA HIS 23 HA HIS 23 1.351 2.806 -14.604
185 HB2 HIS 23 2HB HIS 23 0.108 5.380 -15.573
186 HB3 HIS 23 1HB HIS 23 0.884 5.269 -13.999
187 HD1 HIS 23 1HD HIS 23 3.504 4.435 -14.143
188 HD2 HIS 23 2HD HIS 23 1.793 6.027 -17.583
189 HE1 HIS 23 1HE HIS 23 5.432 5.118 -15.602
190 HE2 HIS 23 2HE HIS 23 4.378 6.179 -17.632
191 H ALA 24 HN ALA 24 -1.969 4.020 -15.069
192 HA ALA 24 HA ALA 24 -2.702 3.970 -12.341
193 HB1 ALA 24 1HB ALA 24 -3.963 5.223 -14.020
194 HB2 ALA 24 2HB ALA 24 -5.007 4.096 -13.152
195 HB3 ALA 24 3HB ALA 24 -4.458 3.713 -14.784
196 H ASP 25 HN ASP 25 -2.767 1.575 -14.894
197 HA ASP 25 HA ASP 25 -4.278 -0.407 -13.547
198 HB2 ASP 25 2HB ASP 25 -3.815 -0.339 -16.019
199 HB3 ASP 25 1HB ASP 25 -2.162 -0.831 -15.669
200 H GLN 26 HN GLN 26 -0.801 0.148 -13.921
201 HA GLN 26 HA GLN 26 0.157 -2.066 -12.559
202 HB2 GLN 26 2HB GLN 26 1.229 0.703 -13.013
203 HB3 GLN 26 1HB GLN 26 2.152 -0.489 -12.125
204 HG2 GLN 26 2HG GLN 26 1.172 -0.771 -14.950
205 HG3 GLN 26 1HG GLN 26 2.819 -0.394 -14.455
206 HE21 GLN 26 1HE2 GLN 26 4.061 -1.998 -13.435
207 HE22 GLN 26 2HE2 GLN 26 3.661 -3.679 -13.585
208 H TRP 27 HN TRP 27 -0.990 1.013 -11.319
209 HA TRP 27 HA TRP 27 -0.215 0.472 -8.611
210 HB2 TRP 27 2HB TRP 27 -1.754 2.588 -10.029
211 HB3 TRP 27 1HB TRP 27 -2.060 2.386 -8.306
212 HD1 TRP 27 1HD TRP 27 0.965 3.030 -10.671
213 HE1 TRP 27 1HE TRP 27 2.689 4.435 -9.359
214 HE3 TRP 27 3HE TRP 27 -1.395 3.181 -6.136
215 HZ2 TRP 27 2HZ TRP 27 2.990 5.473 -6.744
216 HZ3 TRP 27 3HZ TRP 27 -0.327 4.399 -4.285
217 HH2 TRP 27 2HH TRP 27 1.817 5.520 -4.582
218 H THR 28 HN THR 28 -3.290 0.418 -10.388
219 HA THR 28 HA THR 28 -4.908 -0.311 -8.202
220 HB THR 28 HB THR 28 -5.444 -0.921 -11.116
221 HG1 THR 28 1HG THR 28 -4.932 1.320 -10.730
222 HG21 THR 28 3HG2 THR 28 -7.312 -0.449 -8.786
223 HG22 THR 28 1HG2 THR 28 -6.981 -2.006 -9.546
224 HG23 THR 28 2HG2 THR 28 -7.800 -0.738 -10.457
225 H ASN 29 HN ASN 29 -3.378 -2.242 -10.737
226 HA ASN 29 HA ASN 29 -4.559 -4.704 -10.204
227 HB2 ASN 29 2HB ASN 29 -3.174 -4.027 -12.207
228 HB3 ASN 29 1HB ASN 29 -1.743 -4.271 -11.216
229 HD21 ASN 29 1HD2 ASN 29 -2.712 -5.569 -13.674
230 HD22 ASN 29 2HD2 ASN 29 -2.733 -7.261 -13.325
231 H THR 30 HN THR 30 -1.538 -3.332 -8.900
232 HA THR 30 HA THR 30 -0.766 -5.612 -7.452
233 HB THR 30 HB THR 30 0.561 -3.913 -6.039
234 HG1 THR 30 1HG THR 30 -1.014 -2.187 -7.168
235 HG21 THR 30 3HG2 THR 30 1.521 -5.225 -7.867
236 HG22 THR 30 1HG2 THR 30 2.191 -3.593 -7.834
237 HG23 THR 30 2HG2 THR 30 0.965 -4.020 -9.027
238 H ILE 31 HN ILE 31 -2.726 -2.813 -6.484
239 HA ILE 31 HA ILE 31 -2.904 -3.643 -3.752
240 HB ILE 31 HB ILE 31 -4.609 -1.656 -5.270
241 HG12 ILE 31 2HG1 ILE 31 -2.217 -1.184 -3.473
242 HG13 ILE 31 1HG1 ILE 31 -2.193 -1.093 -5.232
243 HG21 ILE 31 1HG2 ILE 31 -4.265 -2.061 -2.301
244 HG22 ILE 31 2HG2 ILE 31 -5.703 -2.452 -3.245
245 HG23 ILE 31 3HG2 ILE 31 -5.196 -0.772 -3.062
246 HD11 ILE 31 3HD1 ILE 31 -3.787 0.762 -5.148
247 HD12 ILE 31 1HD1 ILE 31 -2.313 1.118 -4.247
248 HD13 ILE 31 2HD1 ILE 31 -3.788 0.673 -3.386
249 H LYS 32 HN LYS 32 -5.014 -3.791 -6.561
250 HA LYS 32 HA LYS 32 -7.321 -4.762 -5.321
251 HB2 LYS 32 2HB LYS 32 -7.155 -3.862 -7.643
252 HB3 LYS 32 1HB LYS 32 -6.346 -5.341 -8.126
253 HG2 LYS 32 2HG LYS 32 -8.310 -6.639 -7.689
254 HG3 LYS 32 1HG LYS 32 -9.131 -5.238 -6.995
255 HD2 LYS 32 2HD LYS 32 -9.028 -4.102 -9.160
256 HD3 LYS 32 1HD LYS 32 -8.200 -5.496 -9.852
257 HE2 LYS 32 2HE LYS 32 -10.952 -5.587 -8.631
258 HE3 LYS 32 1HE LYS 32 -10.637 -5.398 -10.354
259 HZ1 LYS 32 3HZ LYS 32 -9.731 -7.706 -8.716
260 HZ2 LYS 32 1HZ LYS 32 -9.564 -7.525 -10.397
261 HZ3 LYS 32 2HZ LYS 32 -11.104 -7.703 -9.710
262 H THR 33 HN THR 33 -4.457 -6.416 -6.499
263 HA THR 33 HA THR 33 -5.717 -9.014 -6.324
264 HB THR 33 HB THR 33 -2.814 -8.367 -6.888
265 HG1 THR 33 1HG THR 33 -3.806 -7.487 -8.592
266 HG21 THR 33 3HG2 THR 33 -4.475 -10.835 -7.438
267 HG22 THR 33 1HG2 THR 33 -3.189 -10.697 -6.242
268 HG23 THR 33 2HG2 THR 33 -2.810 -10.589 -7.961
269 H TYR 34 HN TYR 34 -2.974 -7.407 -4.683
270 HA TYR 34 HA TYR 34 -2.647 -9.659 -2.922
271 HB2 TYR 34 2HB TYR 34 -1.282 -6.967 -2.966
272 HB3 TYR 34 1HB TYR 34 -0.837 -8.297 -1.903
273 HD1 TYR 34 2HD TYR 34 -0.587 -10.624 -3.373
274 HD2 TYR 34 1HD TYR 34 0.134 -6.665 -4.741
275 HE1 TYR 34 2HE TYR 34 0.928 -11.503 -5.099
276 HE2 TYR 34 1HE TYR 34 1.652 -7.530 -6.472
277 HH TYR 34 HH TYR 34 1.790 -10.762 -7.352
278 H CYS 35 HN CYS 35 -3.688 -6.282 -2.511
279 HA CYS 35 HA CYS 35 -3.973 -6.684 0.344
280 HB2 CYS 35 2HB CYS 35 -4.569 -4.241 -1.336
281 HB3 CYS 35 1HB CYS 35 -4.450 -4.290 0.419
282 HG CYS 35 HG CYS 35 -1.668 -5.289 0.075
283 H GLY 36 HN GLY 36 -5.994 -6.456 -2.470
284 HA2 GLY 36 2HA GLY 36 -8.404 -5.582 -1.575
285 HA3 GLY 36 1HA GLY 36 -8.237 -6.833 -2.788
286 HA PRO 37 HA PRO 37 -10.136 -9.832 -0.295
287 HB2 PRO 37 2HB PRO 37 -8.445 -11.951 -0.032
288 HB3 PRO 37 1HB PRO 37 -9.293 -11.557 -1.531
289 HG2 PRO 37 2HG PRO 37 -6.474 -10.950 -0.727
290 HG3 PRO 37 1HG PRO 37 -7.098 -11.520 -2.287
291 HD2 PRO 37 2HD PRO 37 -6.458 -8.932 -1.845
292 HD3 PRO 37 1HD PRO 37 -7.784 -9.410 -2.926
293 H VAL 38 HN VAL 38 -7.089 -8.747 0.978
294 HA VAL 38 HA VAL 38 -7.581 -10.093 3.530
295 HB VAL 38 HB VAL 38 -5.152 -8.492 2.709
296 HG11 VAL 38 1HG1 VAL 38 -5.611 -10.384 5.015
297 HG12 VAL 38 2HG1 VAL 38 -5.453 -8.630 5.122
298 HG13 VAL 38 3HG1 VAL 38 -4.079 -9.611 4.611
299 HG21 VAL 38 3HG2 VAL 38 -5.551 -11.485 2.721
300 HG22 VAL 38 1HG2 VAL 38 -4.050 -10.637 2.356
301 HG23 VAL 38 2HG2 VAL 38 -5.439 -10.467 1.284
302 H ILE 39 HN ILE 39 -6.287 -6.863 2.723
303 HA ILE 39 HA ILE 39 -7.622 -5.856 5.135
304 HB ILE 39 HB ILE 39 -6.069 -3.932 4.972
305 HG12 ILE 39 2HG1 ILE 39 -4.796 -5.528 2.735
306 HG13 ILE 39 1HG1 ILE 39 -5.685 -4.020 2.533
307 HG21 ILE 39 1HG2 ILE 39 -4.773 -6.652 5.045
308 HG22 ILE 39 2HG2 ILE 39 -5.510 -5.799 6.401
309 HG23 ILE 39 3HG2 ILE 39 -4.047 -5.163 5.649
310 HD11 ILE 39 3HD1 ILE 39 -3.114 -4.371 4.062
311 HD12 ILE 39 1HD1 ILE 39 -4.000 -2.858 3.867
312 HD13 ILE 39 2HD1 ILE 39 -3.286 -3.649 2.461
313 H GLY 40 HN GLY 40 -8.155 -5.981 1.907
314 HA2 GLY 40 2HA GLY 40 -8.766 -3.432 1.043
315 HA3 GLY 40 1HA GLY 40 -9.579 -4.888 0.495
316 HA PRO 41 HA PRO 41 -13.297 -3.677 2.477
317 HB2 PRO 41 2HB PRO 41 -13.703 -6.112 4.023
318 HB3 PRO 41 1HB PRO 41 -14.537 -5.567 2.565
319 HG2 PRO 41 2HG PRO 41 -12.852 -7.688 2.581
320 HG3 PRO 41 1HG PRO 41 -13.069 -6.642 1.166
321 HD2 PRO 41 2HD PRO 41 -10.869 -6.638 3.204
322 HD3 PRO 41 1HD PRO 41 -10.768 -6.471 1.437
323 H LEU 42 HN LEU 42 -10.664 -3.964 4.393
324 HA LEU 42 HA LEU 42 -12.054 -3.579 6.930
325 HB2 LEU 42 2HB LEU 42 -9.082 -3.591 6.371
326 HB3 LEU 42 1HB LEU 42 -9.851 -3.644 7.946
327 HG LEU 42 HG LEU 42 -9.890 -5.817 5.850
328 HD11 LEU 42 1HD1 LEU 42 -8.655 -7.092 7.529
329 HD12 LEU 42 2HD1 LEU 42 -8.646 -5.684 8.591
330 HD13 LEU 42 3HD1 LEU 42 -7.786 -5.633 7.053
331 HD21 LEU 42 3HD2 LEU 42 -11.112 -7.150 7.488
332 HD22 LEU 42 1HD2 LEU 42 -12.033 -5.721 7.017
333 HD23 LEU 42 2HD2 LEU 42 -11.196 -5.758 8.568
334 H SER 43 HN SER 43 -11.819 -1.668 8.169
335 HA SER 43 HA SER 43 -11.864 0.748 6.847
336 HB2 SER 43 2HB SER 43 -11.145 0.204 9.735
337 HB3 SER 43 1HB SER 43 -11.767 1.698 9.072
338 HG SER 43 HG SER 43 -13.615 0.867 9.665
339 H VAL 44 HN VAL 44 -10.313 2.099 6.138
340 HA VAL 44 HA VAL 44 -7.633 1.233 5.950
341 HB VAL 44 HB VAL 44 -8.735 2.707 4.290
342 HG11 VAL 44 1HG1 VAL 44 -8.426 4.827 6.405
343 HG12 VAL 44 2HG1 VAL 44 -9.941 4.192 5.765
344 HG13 VAL 44 3HG1 VAL 44 -8.864 5.125 4.724
345 HG21 VAL 44 3HG2 VAL 44 -6.809 4.153 3.852
346 HG22 VAL 44 1HG2 VAL 44 -6.312 2.524 4.315
347 HG23 VAL 44 2HG2 VAL 44 -6.214 3.842 5.482
348 H GLN 45 HN GLN 45 -9.289 3.097 8.324
349 HA GLN 45 HA GLN 45 -6.954 4.278 9.505
350 HB2 GLN 45 2HB GLN 45 -9.270 5.212 9.686
351 HB3 GLN 45 1HB GLN 45 -9.698 3.842 10.699
352 HG2 GLN 45 2HG GLN 45 -7.979 4.556 12.321
353 HG3 GLN 45 1HG GLN 45 -7.672 5.978 11.325
354 HE21 GLN 45 1HE2 GLN 45 -9.317 7.557 11.126
355 HE22 GLN 45 2HE2 GLN 45 -10.563 7.689 12.319
356 H ASP 46 HN ASP 46 -8.503 1.236 9.609
357 HA ASP 46 HA ASP 46 -7.582 0.606 12.316
358 HB2 ASP 46 2HB ASP 46 -9.972 0.245 11.670
359 HB3 ASP 46 1HB ASP 46 -9.437 -0.950 10.500
360 H VAL 47 HN VAL 47 -6.383 0.372 9.286
361 HA VAL 47 HA VAL 47 -5.473 -2.312 9.159
362 HB VAL 47 HB VAL 47 -4.308 0.142 7.824
363 HG11 VAL 47 1HG1 VAL 47 -2.734 -1.699 7.812
364 HG12 VAL 47 2HG1 VAL 47 -3.395 -1.467 6.194
365 HG13 VAL 47 3HG1 VAL 47 -3.977 -2.792 7.202
366 HG21 VAL 47 3HG2 VAL 47 -6.656 -0.158 7.249
367 HG22 VAL 47 1HG2 VAL 47 -6.348 -1.843 6.821
368 HG23 VAL 47 2HG2 VAL 47 -5.626 -0.545 5.870
369 H ASP 48 HN ASP 48 -3.894 -3.267 10.245
370 HA ASP 48 HA ASP 48 -2.169 -1.629 11.944
371 HB2 ASP 48 2HB ASP 48 -2.759 -4.595 11.958
372 HB3 ASP 48 1HB ASP 48 -1.593 -3.824 13.023
373 H THR 49 HN THR 49 0.063 -2.486 12.276
374 HA THR 49 HA THR 49 1.480 -2.552 9.825
375 HB THR 49 HB THR 49 2.606 -3.379 12.500
376 HG1 THR 49 1HG THR 49 2.748 -0.701 11.805
377 HG21 THR 49 3HG2 THR 49 4.623 -2.251 11.633
378 HG22 THR 49 1HG2 THR 49 3.768 -1.913 10.128
379 HG23 THR 49 2HG2 THR 49 4.109 -3.580 10.594
380 H LYS 50 HN LYS 50 0.569 -4.985 12.222
381 HA LYS 50 HA LYS 50 1.992 -7.164 11.175
382 HB2 LYS 50 2HB LYS 50 0.811 -7.073 13.399
383 HB3 LYS 50 1HB LYS 50 -0.699 -7.307 12.533
384 HG2 LYS 50 2HG LYS 50 0.265 -9.413 11.595
385 HG3 LYS 50 1HG LYS 50 1.621 -9.211 12.703
386 HD2 LYS 50 2HD LYS 50 -1.284 -9.553 13.432
387 HD3 LYS 50 1HD LYS 50 0.008 -10.730 13.661
388 HE2 LYS 50 2HE LYS 50 1.132 -9.020 15.140
389 HE3 LYS 50 1HE LYS 50 -0.366 -8.093 15.061
390 HZ1 LYS 50 3HZ LYS 50 0.030 -10.801 16.189
391 HZ2 LYS 50 1HZ LYS 50 -1.506 -10.142 15.897
392 HZ3 LYS 50 2HZ LYS 50 -0.463 -9.401 17.005
393 H LEU 51 HN LEU 51 -1.241 -5.931 10.472
394 HA LEU 51 HA LEU 51 -2.107 -8.000 8.815
395 HB2 LEU 51 2HB LEU 51 -2.786 -5.063 8.705
396 HB3 LEU 51 1HB LEU 51 -3.659 -6.323 7.864
397 HG LEU 51 HG LEU 51 -3.477 -5.924 10.840
398 HD11 LEU 51 1HD1 LEU 51 -5.814 -5.882 8.939
399 HD12 LEU 51 2HD1 LEU 51 -5.054 -4.467 9.662
400 HD13 LEU 51 3HD1 LEU 51 -5.888 -5.637 10.683
401 HD21 LEU 51 3HD2 LEU 51 -4.787 -8.168 9.311
402 HD22 LEU 51 1HD2 LEU 51 -4.925 -7.884 11.045
403 HD23 LEU 51 2HD2 LEU 51 -3.364 -8.308 10.345
404 H ILE 52 HN ILE 52 -0.317 -5.045 8.058
405 HA ILE 52 HA ILE 52 -0.133 -5.494 5.271
406 HB ILE 52 HB ILE 52 1.751 -3.946 7.058
407 HG12 ILE 52 2HG1 ILE 52 -0.619 -3.015 5.426
408 HG13 ILE 52 1HG1 ILE 52 -0.611 -3.204 7.175
409 HG21 ILE 52 1HG2 ILE 52 1.356 -3.843 4.069
410 HG22 ILE 52 2HG2 ILE 52 2.778 -4.454 4.916
411 HG23 ILE 52 3HG2 ILE 52 2.366 -2.742 5.006
412 HD11 ILE 52 3HD1 ILE 52 -0.355 -0.878 6.488
413 HD12 ILE 52 1HD1 ILE 52 1.122 -1.299 5.622
414 HD13 ILE 52 2HD1 ILE 52 1.052 -1.459 7.377
415 H MET 53 HN MET 53 2.006 -6.350 7.976
416 HA MET 53 HA MET 53 4.081 -7.548 6.531
417 HB2 MET 53 2HB MET 53 2.963 -8.250 9.249
418 HB3 MET 53 1HB MET 53 4.441 -8.933 8.594
419 HG2 MET 53 2HG MET 53 5.465 -6.740 8.541
420 HG3 MET 53 1HG MET 53 3.969 -6.010 9.130
421 HE1 MET 53 3HE MET 53 5.404 -4.832 11.061
422 HE2 MET 53 1HE MET 53 6.875 -5.624 10.500
423 HE3 MET 53 2HE MET 53 6.421 -5.714 12.202
424 H LYS 54 HN LYS 54 1.053 -8.875 7.738
425 HA LYS 54 HA LYS 54 1.454 -11.565 7.137
426 HB2 LYS 54 2HB LYS 54 -0.372 -10.622 8.537
427 HB3 LYS 54 1HB LYS 54 -1.155 -10.037 7.077
428 HG2 LYS 54 2HG LYS 54 -1.391 -12.344 6.292
429 HG3 LYS 54 1HG LYS 54 -0.635 -12.919 7.781
430 HD2 LYS 54 2HD LYS 54 -2.435 -11.813 9.069
431 HD3 LYS 54 1HD LYS 54 -3.211 -11.370 7.548
432 HE2 LYS 54 2HE LYS 54 -3.366 -13.764 6.973
433 HE3 LYS 54 1HE LYS 54 -2.670 -14.160 8.545
434 HZ1 LYS 54 3HZ LYS 54 -5.067 -14.328 8.601
435 HZ2 LYS 54 1HZ LYS 54 -5.225 -12.722 8.084
436 HZ3 LYS 54 2HZ LYS 54 -4.552 -13.060 9.604
437 H VAL 55 HN VAL 55 0.125 -8.968 5.135
438 HA VAL 55 HA VAL 55 -0.561 -10.634 2.931
439 HB VAL 55 HB VAL 55 -0.009 -7.657 2.946
440 HG11 VAL 55 1HG1 VAL 55 0.043 -8.590 0.696
441 HG12 VAL 55 2HG1 VAL 55 -1.402 -7.603 0.926
442 HG13 VAL 55 3HG1 VAL 55 -1.519 -9.363 0.967
443 HG21 VAL 55 3HG2 VAL 55 -2.593 -9.165 3.308
444 HG22 VAL 55 1HG2 VAL 55 -2.453 -7.418 3.115
445 HG23 VAL 55 2HG2 VAL 55 -1.754 -8.209 4.529
446 H LEU 56 HN LEU 56 2.274 -8.709 3.764
447 HA LEU 56 HA LEU 56 3.503 -9.083 1.195
448 HB2 LEU 56 2HB LEU 56 4.521 -7.895 3.766
449 HB3 LEU 56 1HB LEU 56 5.454 -7.951 2.284
450 HG LEU 56 HG LEU 56 2.840 -6.482 2.657
451 HD11 LEU 56 1HD1 LEU 56 5.656 -5.450 2.347
452 HD12 LEU 56 2HD1 LEU 56 4.720 -5.451 3.842
453 HD13 LEU 56 3HD1 LEU 56 4.194 -4.471 2.472
454 HD21 LEU 56 3HD2 LEU 56 3.328 -5.554 0.432
455 HD22 LEU 56 1HD2 LEU 56 3.083 -7.299 0.385
456 HD23 LEU 56 2HD2 LEU 56 4.715 -6.638 0.300
457 H ASP 57 HN ASP 57 3.535 -10.785 4.198
458 HA ASP 57 HA ASP 57 6.027 -11.891 4.389
459 HB2 ASP 57 2HB ASP 57 4.062 -12.276 5.930
460 HB3 ASP 57 1HB ASP 57 3.513 -13.494 4.812
461 HA PRO 58 HA PRO 58 5.007 -15.533 1.430
462 HB2 PRO 58 2HB PRO 58 2.816 -15.384 -0.159
463 HB3 PRO 58 1HB PRO 58 2.783 -16.095 1.459
464 HG2 PRO 58 2HG PRO 58 1.937 -13.362 0.572
465 HG3 PRO 58 1HG PRO 58 1.135 -14.475 1.698
466 HD2 PRO 58 2HD PRO 58 2.642 -12.376 2.532
467 HD3 PRO 58 1HD PRO 58 2.506 -13.882 3.454
468 H ILE 59 HN ILE 59 4.708 -12.238 0.646
469 HA ILE 59 HA ILE 59 5.313 -12.622 -2.178
470 HB ILE 59 HB ILE 59 5.052 -9.997 -0.711
471 HG12 ILE 59 2HG1 ILE 59 2.913 -11.541 -2.206
472 HG13 ILE 59 1HG1 ILE 59 2.991 -11.348 -0.457
473 HG21 ILE 59 1HG2 ILE 59 6.176 -9.888 -2.877
474 HG22 ILE 59 2HG2 ILE 59 4.596 -9.110 -2.949
475 HG23 ILE 59 3HG2 ILE 59 4.816 -10.719 -3.635
476 HD11 ILE 59 3HD1 ILE 59 1.373 -9.834 -1.477
477 HD12 ILE 59 1HD1 ILE 59 2.661 -9.116 -2.445
478 HD13 ILE 59 2HD1 ILE 59 2.682 -8.952 -0.690
479 H TRP 60 HN TRP 60 6.813 -11.425 0.794
480 HA TRP 60 HA TRP 60 9.123 -10.272 -0.210
481 HB2 TRP 60 2HB TRP 60 8.671 -11.837 2.329
482 HB3 TRP 60 1HB TRP 60 10.207 -11.066 1.957
483 HD1 TRP 60 1HD TRP 60 7.272 -10.425 3.918
484 HE1 TRP 60 1HE TRP 60 6.937 -7.915 4.363
485 HE3 TRP 60 3HE TRP 60 10.438 -8.520 0.370
486 HZ2 TRP 60 2HZ TRP 60 7.873 -5.466 3.360
487 HZ3 TRP 60 3HZ TRP 60 10.653 -6.075 0.186
488 HH2 TRP 60 2HH TRP 60 9.395 -4.584 1.652
489 H GLU 61 HN GLU 61 8.356 -13.666 0.187
490 HA GLU 61 HA GLU 61 11.034 -14.534 -0.310
491 HB2 GLU 61 2HB GLU 61 8.434 -16.050 -0.144
492 HB3 GLU 61 1HB GLU 61 10.034 -16.756 -0.154
493 HG2 GLU 61 2HG GLU 61 10.554 -15.548 1.933
494 HG3 GLU 61 1HG GLU 61 8.893 -14.956 1.957
495 H GLN 62 HN GLN 62 8.010 -14.332 -2.128
496 HA GLN 62 HA GLN 62 9.095 -15.820 -4.359
497 HB2 GLN 62 2HB GLN 62 6.439 -14.410 -4.055
498 HB3 GLN 62 1HB GLN 62 6.877 -15.510 -5.351
499 HG2 GLN 62 2HG GLN 62 6.759 -16.271 -2.446
500 HG3 GLN 62 1HG GLN 62 5.451 -16.521 -3.598
501 HE21 GLN 62 1HE2 GLN 62 5.493 -18.727 -3.287
502 HE22 GLN 62 2HE2 GLN 62 6.742 -19.732 -3.942
503 H LYS 63 HN LYS 63 7.836 -12.527 -3.855
504 HA LYS 63 HA LYS 63 9.503 -11.617 -6.089
505 HB2 LYS 63 2HB LYS 63 6.553 -11.041 -5.734
506 HB3 LYS 63 1HB LYS 63 7.594 -10.163 -6.845
507 HG2 LYS 63 2HG LYS 63 7.909 -12.053 -8.210
508 HG3 LYS 63 1HG LYS 63 7.272 -13.143 -6.980
509 HD2 LYS 63 2HD LYS 63 5.657 -12.810 -8.770
510 HD3 LYS 63 1HD LYS 63 5.052 -12.162 -7.248
511 HE2 LYS 63 2HE LYS 63 4.549 -10.652 -9.083
512 HE3 LYS 63 1HE LYS 63 5.690 -9.902 -7.968
513 HZ1 LYS 63 3HZ LYS 63 7.479 -10.353 -9.470
514 HZ2 LYS 63 1HZ LYS 63 6.245 -9.575 -10.338
515 HZ3 LYS 63 2HZ LYS 63 6.469 -11.249 -10.501
516 HA PRO 64 HA PRO 64 10.008 -9.075 -2.221
517 HB2 PRO 64 2HB PRO 64 12.718 -8.788 -3.356
518 HB3 PRO 64 1HB PRO 64 12.229 -9.259 -1.727
519 HG2 PRO 64 2HG PRO 64 13.245 -11.033 -3.472
520 HG3 PRO 64 1HG PRO 64 11.998 -11.481 -2.294
521 HD2 PRO 64 2HD PRO 64 11.747 -10.947 -5.220
522 HD3 PRO 64 1HD PRO 64 10.901 -12.139 -4.212
523 H GLU 65 HN GLU 65 11.107 -8.532 -5.508
524 HA GLU 65 HA GLU 65 11.453 -5.761 -5.429
525 HB2 GLU 65 2HB GLU 65 12.253 -7.151 -7.259
526 HB3 GLU 65 1HB GLU 65 10.603 -7.564 -7.690
527 HG2 GLU 65 2HG GLU 65 10.226 -5.122 -8.141
528 HG3 GLU 65 1HG GLU 65 11.967 -4.910 -7.962
529 H THR 66 HN THR 66 8.627 -7.729 -6.215
530 HA THR 66 HA THR 66 6.932 -5.508 -6.775
531 HB THR 66 HB THR 66 6.109 -8.337 -6.104
532 HG1 THR 66 1HG THR 66 7.077 -7.141 -8.499
533 HG21 THR 66 3HG2 THR 66 4.269 -6.717 -6.137
534 HG22 THR 66 1HG2 THR 66 4.163 -7.825 -7.506
535 HG23 THR 66 2HG2 THR 66 4.765 -6.183 -7.743
536 H ALA 67 HN ALA 67 7.657 -7.453 -3.957
537 HA ALA 67 HA ALA 67 5.514 -6.679 -2.317
538 HB1 ALA 67 1HB ALA 67 6.993 -8.563 -1.802
539 HB2 ALA 67 2HB ALA 67 6.880 -7.431 -0.454
540 HB3 ALA 67 3HB ALA 67 8.311 -7.434 -1.486
541 H SER 68 HN SER 68 8.788 -5.304 -2.625
542 HA SER 68 HA SER 68 8.351 -3.260 -0.711
543 HB2 SER 68 2HB SER 68 10.419 -2.236 -1.808
544 HB3 SER 68 1HB SER 68 10.603 -3.857 -1.144
545 HG SER 68 HG SER 68 10.643 -2.995 -3.784
546 H ARG 69 HN ARG 69 7.861 -3.459 -4.182
547 HA ARG 69 HA ARG 69 7.304 -0.698 -4.547
548 HB2 ARG 69 2HB ARG 69 6.773 -3.164 -6.192
549 HB3 ARG 69 1HB ARG 69 6.225 -1.579 -6.695
550 HG2 ARG 69 2HG ARG 69 8.517 -0.760 -6.682
551 HG3 ARG 69 1HG ARG 69 9.073 -2.346 -6.153
552 HD2 ARG 69 2HD ARG 69 8.320 -3.350 -8.207
553 HD3 ARG 69 1HD ARG 69 7.598 -1.827 -8.728
554 HE ARG 69 HE ARG 69 10.161 -1.121 -8.388
555 HH11 ARG 69 1HH1 ARG 69 8.741 -3.869 -10.047
556 HH12 ARG 69 2HH1 ARG 69 10.025 -3.983 -11.208
557 HH21 ARG 69 1HH2 ARG 69 11.832 -1.271 -9.916
558 HH22 ARG 69 2HH2 ARG 69 11.793 -2.520 -11.129
559 H LEU 70 HN LEU 70 5.381 -3.525 -3.746
560 HA LEU 70 HA LEU 70 2.837 -2.316 -3.981
561 HB2 LEU 70 2HB LEU 70 3.122 -4.741 -3.814
562 HB3 LEU 70 1HB LEU 70 3.750 -4.568 -2.185
563 HG LEU 70 HG LEU 70 1.552 -3.673 -1.464
564 HD11 LEU 70 1HD1 LEU 70 0.773 -2.784 -3.580
565 HD12 LEU 70 2HD1 LEU 70 -0.382 -3.957 -2.948
566 HD13 LEU 70 3HD1 LEU 70 0.703 -4.410 -4.261
567 HD21 LEU 70 3HD2 LEU 70 2.072 -6.022 -1.157
568 HD22 LEU 70 1HD2 LEU 70 1.489 -6.383 -2.782
569 HD23 LEU 70 2HD2 LEU 70 0.366 -5.816 -1.548
570 H ARG 71 HN ARG 71 5.224 -2.437 -1.400
571 HA ARG 71 HA ARG 71 3.728 -1.288 0.664
572 HB2 ARG 71 2HB ARG 71 6.116 -2.208 0.775
573 HB3 ARG 71 1HB ARG 71 6.635 -0.650 0.147
574 HG2 ARG 71 2HG ARG 71 5.342 0.352 2.126
575 HG3 ARG 71 1HG ARG 71 5.367 -1.284 2.785
576 HD2 ARG 71 2HD ARG 71 7.278 -0.439 3.724
577 HD3 ARG 71 1HD ARG 71 7.935 -1.112 2.231
578 HE ARG 71 HE ARG 71 7.130 1.692 2.163
579 HH11 ARG 71 1HH1 ARG 71 9.744 -0.636 2.407
580 HH12 ARG 71 2HH1 ARG 71 10.982 0.536 2.067
581 HH21 ARG 71 1HH2 ARG 71 8.745 3.224 1.759
582 HH22 ARG 71 2HH2 ARG 71 10.413 2.729 1.711
583 H GLY 72 HN GLY 72 5.445 0.135 -2.053
584 HA2 GLY 72 2HA GLY 72 5.241 2.840 -1.332
585 HA3 GLY 72 1HA GLY 72 5.414 2.232 -2.972
586 H ARG 73 HN ARG 73 2.947 0.686 -2.893
587 HA ARG 73 HA ARG 73 1.088 2.679 -3.684
588 HB2 ARG 73 2HB ARG 73 0.951 -0.273 -3.219
589 HB3 ARG 73 1HB ARG 73 -0.552 0.623 -3.328
590 HG2 ARG 73 2HG ARG 73 -0.121 -0.259 -5.464
591 HG3 ARG 73 1HG ARG 73 0.219 1.467 -5.552
592 HD2 ARG 73 2HD ARG 73 2.547 1.112 -5.572
593 HD3 ARG 73 1HD ARG 73 2.372 -0.569 -5.061
594 HE ARG 73 HE ARG 73 1.229 -0.880 -7.302
595 HH11 ARG 73 1HH1 ARG 73 3.722 1.534 -6.765
596 HH12 ARG 73 2HH1 ARG 73 4.235 1.543 -8.425
597 HH21 ARG 73 1HH2 ARG 73 1.906 -0.874 -9.468
598 HH22 ARG 73 2HH2 ARG 73 3.201 0.169 -9.963
599 H ILE 74 HN ILE 74 1.267 0.570 -0.838
600 HA ILE 74 HA ILE 74 -1.063 1.606 0.410
601 HB ILE 74 HB ILE 74 1.266 0.199 1.735
602 HG12 ILE 74 2HG1 ILE 74 -1.236 -1.001 0.520
603 HG13 ILE 74 1HG1 ILE 74 0.364 -1.053 -0.218
604 HG21 ILE 74 1HG2 ILE 74 -0.301 1.273 3.287
605 HG22 ILE 74 2HG2 ILE 74 -0.372 -0.485 3.400
606 HG23 ILE 74 3HG2 ILE 74 -1.636 0.392 2.542
607 HD11 ILE 74 3HD1 ILE 74 -0.452 -2.327 2.388
608 HD12 ILE 74 1HD1 ILE 74 1.177 -2.339 1.711
609 HD13 ILE 74 2HD1 ILE 74 -0.136 -3.149 0.859
610 H GLU 75 HN GLU 75 2.361 2.308 0.668
611 HA GLU 75 HA GLU 75 2.382 3.965 2.909
612 HB2 GLU 75 2HB GLU 75 4.331 2.980 1.624
613 HB3 GLU 75 1HB GLU 75 4.117 4.276 0.460
614 HG2 GLU 75 2HG GLU 75 4.567 5.920 2.189
615 HG3 GLU 75 1HG GLU 75 4.754 4.629 3.377
616 H SER 76 HN SER 76 1.947 4.815 -0.526
617 HA SER 76 HA SER 76 1.739 7.610 0.039
618 HB2 SER 76 2HB SER 76 2.595 6.667 -2.123
619 HB3 SER 76 1HB SER 76 0.939 6.204 -2.498
620 HG SER 76 HG SER 76 1.271 8.842 -1.724
621 H VAL 77 HN VAL 77 -0.547 4.973 -0.402
622 HA VAL 77 HA VAL 77 -2.857 6.607 -0.606
623 HB VAL 77 HB VAL 77 -2.558 3.731 0.276
624 HG11 VAL 77 1HG1 VAL 77 -5.085 5.286 -0.293
625 HG12 VAL 77 2HG1 VAL 77 -4.579 4.660 1.276
626 HG13 VAL 77 3HG1 VAL 77 -4.992 3.543 -0.025
627 HG21 VAL 77 3HG2 VAL 77 -3.497 3.254 -1.943
628 HG22 VAL 77 1HG2 VAL 77 -1.982 4.153 -2.050
629 HG23 VAL 77 2HG2 VAL 77 -3.520 4.980 -2.297
630 H LEU 78 HN LEU 78 -1.284 5.007 2.157
631 HA LEU 78 HA LEU 78 -3.085 5.999 4.109
632 HB2 LEU 78 2HB LEU 78 -0.198 5.153 4.380
633 HB3 LEU 78 1HB LEU 78 -1.281 5.455 5.724
634 HG LEU 78 HG LEU 78 -1.640 3.289 3.651
635 HD11 LEU 78 1HD1 LEU 78 -0.820 3.102 6.544
636 HD12 LEU 78 2HD1 LEU 78 0.256 2.893 5.163
637 HD13 LEU 78 3HD1 LEU 78 -1.062 1.753 5.436
638 HD21 LEU 78 3HD2 LEU 78 -3.422 2.488 5.111
639 HD22 LEU 78 1HD2 LEU 78 -3.763 4.119 4.532
640 HD23 LEU 78 2HD2 LEU 78 -3.178 3.871 6.177
641 H ASP 79 HN ASP 79 -0.152 7.265 2.659
642 HA ASP 79 HA ASP 79 0.250 9.516 4.285
643 HB2 ASP 79 2HB ASP 79 1.874 8.737 2.608
644 HB3 ASP 79 1HB ASP 79 0.759 9.160 1.317
645 H TRP 80 HN TRP 80 -1.627 9.094 1.321
646 HA TRP 80 HA TRP 80 -2.723 11.672 1.172
647 HB2 TRP 80 2HB TRP 80 -2.749 10.179 -0.721
648 HB3 TRP 80 1HB TRP 80 -3.714 9.003 0.158
649 HD1 TRP 80 1HD TRP 80 -4.034 12.491 -1.457
650 HE1 TRP 80 1HE TRP 80 -6.513 12.870 -2.070
651 HE3 TRP 80 3HE TRP 80 -6.035 8.283 0.641
652 HZ2 TRP 80 2HZ TRP 80 -8.974 11.545 -1.719
653 HZ3 TRP 80 3HZ TRP 80 -8.458 7.914 0.456
654 HH2 TRP 80 2HH TRP 80 -9.895 9.510 -0.697
655 H ALA 81 HN ALA 81 -3.938 8.689 2.651
656 HA ALA 81 HA ALA 81 -6.444 9.652 3.451
657 HB1 ALA 81 1HB ALA 81 -5.816 7.275 3.369
658 HB2 ALA 81 2HB ALA 81 -6.533 7.734 4.913
659 HB3 ALA 81 3HB ALA 81 -4.788 7.515 4.782
660 H THR 82 HN THR 82 -3.298 9.824 5.005
661 HA THR 82 HA THR 82 -4.145 10.651 7.551
662 HB THR 82 HB THR 82 -1.565 11.294 6.107
663 HG1 THR 82 1HG THR 82 -1.881 9.056 6.361
664 HG21 THR 82 3HG2 THR 82 -1.931 12.790 8.004
665 HG22 THR 82 1HG2 THR 82 -0.632 11.648 8.351
666 HG23 THR 82 2HG2 THR 82 -2.232 11.405 9.053
667 H VAL 83 HN VAL 83 -3.329 12.499 4.637
668 HA VAL 83 HA VAL 83 -3.622 15.052 5.885
669 HB VAL 83 HB VAL 83 -3.695 14.416 2.927
670 HG11 VAL 83 1HG1 VAL 83 -2.939 16.737 2.667
671 HG12 VAL 83 2HG1 VAL 83 -3.062 16.965 4.412
672 HG13 VAL 83 3HG1 VAL 83 -4.512 16.646 3.460
673 HG21 VAL 83 3HG2 VAL 83 -1.664 13.529 3.923
674 HG22 VAL 83 1HG2 VAL 83 -1.349 15.078 4.705
675 HG23 VAL 83 2HG2 VAL 83 -1.296 14.952 2.947
676 H ARG 84 HN ARG 84 -5.702 13.031 3.847
677 HA ARG 84 HA ARG 84 -7.857 14.864 3.778
678 HB2 ARG 84 2HB ARG 84 -7.296 12.135 2.879
679 HB3 ARG 84 1HB ARG 84 -8.978 12.419 3.297
680 HG2 ARG 84 2HG ARG 84 -8.357 12.784 0.887
681 HG3 ARG 84 1HG ARG 84 -9.197 14.102 1.687
682 HD2 ARG 84 2HD ARG 84 -6.209 14.069 1.531
683 HD3 ARG 84 1HD ARG 84 -7.179 14.659 0.183
684 HE ARG 84 HE ARG 84 -8.001 15.893 2.598
685 HH11 ARG 84 1HH1 ARG 84 -5.443 15.982 0.188
686 HH12 ARG 84 2HH1 ARG 84 -4.995 17.627 0.557
687 HH21 ARG 84 1HH2 ARG 84 -7.418 18.044 3.053
688 HH22 ARG 84 2HH2 ARG 84 -6.137 18.802 2.159
689 H GLY 85 HN GLY 85 -6.704 12.849 6.241
690 HA2 GLY 85 2HA GLY 85 -7.427 13.070 8.448
691 HA3 GLY 85 1HA GLY 85 -8.934 13.751 7.864
692 H TYR 86 HN TYR 86 -8.074 10.840 6.299
693 HA TYR 86 HA TYR 86 -10.300 9.455 7.419
694 HB2 TYR 86 2HB TYR 86 -8.030 8.561 5.641
695 HB3 TYR 86 1HB TYR 86 -9.290 7.459 6.187
696 HD1 TYR 86 2HD TYR 86 -11.726 8.167 5.684
697 HD2 TYR 86 1HD TYR 86 -8.343 9.795 3.688
698 HE1 TYR 86 2HE TYR 86 -13.168 8.866 3.827
699 HE2 TYR 86 1HE TYR 86 -9.782 10.506 1.823
700 HH TYR 86 HH TYR 86 -11.895 10.028 0.843
701 H ARG 87 HN ARG 87 -6.861 9.480 8.002
702 HA ARG 87 HA ARG 87 -7.384 8.502 10.670
703 HB2 ARG 87 2HB ARG 87 -5.858 6.718 10.684
704 HB3 ARG 87 1HB ARG 87 -6.726 6.506 9.176
705 HG2 ARG 87 2HG ARG 87 -4.837 7.636 8.008
706 HG3 ARG 87 1HG ARG 87 -3.962 7.630 9.542
707 HD2 ARG 87 2HD ARG 87 -4.793 5.306 7.833
708 HD3 ARG 87 1HD ARG 87 -3.184 5.727 8.415
709 HE ARG 87 HE ARG 87 -5.339 4.529 10.025
710 HH11 ARG 87 1HH1 ARG 87 -1.965 5.370 9.639
711 HH12 ARG 87 2HH1 ARG 87 -1.425 4.331 10.930
712 HH21 ARG 87 1HH2 ARG 87 -4.641 3.140 11.700
713 HH22 ARG 87 2HH2 ARG 87 -2.947 3.055 12.078
714 H GLU 88 HN GLU 88 -5.691 9.126 12.128
715 HA GLU 88 HA GLU 88 -4.474 11.586 11.299
716 HB2 GLU 88 2HB GLU 88 -4.404 10.099 13.923
717 HB3 GLU 88 1HB GLU 88 -3.641 11.664 13.663
718 HG2 GLU 88 2HG GLU 88 -5.854 12.576 13.015
719 HG3 GLU 88 1HG GLU 88 -6.575 11.026 13.443
720 H GLY 89 HN GLY 89 -2.110 11.913 12.300
721 HA2 GLY 89 2HA GLY 89 -0.484 10.879 10.314
722 HA3 GLY 89 1HA GLY 89 0.100 11.652 11.767
723 H ASP 90 HN ASP 90 -0.391 8.734 10.101
724 HA ASP 90 HA ASP 90 1.684 7.431 11.526
725 HB2 ASP 90 2HB ASP 90 -0.063 7.001 13.175
726 HB3 ASP 90 1HB ASP 90 -1.123 6.365 11.923
727 H ASN 91 HN ASN 91 2.563 5.832 10.294
728 HA ASN 91 HA ASN 91 1.038 4.896 7.966
729 HB2 ASN 91 2HB ASN 91 2.489 6.803 7.260
730 HB3 ASN 91 1HB ASN 91 3.893 5.881 7.790
731 HD21 ASN 91 1HD2 ASN 91 1.534 6.311 5.316
732 HD22 ASN 91 2HD2 ASN 91 2.163 5.147 4.218
733 HA PRO 92 HA PRO 92 2.947 1.361 10.194
734 HB2 PRO 92 2HB PRO 92 0.992 -0.407 9.491
735 HB3 PRO 92 1HB PRO 92 0.867 0.681 10.877
736 HG2 PRO 92 2HG PRO 92 -0.273 0.979 8.125
737 HG3 PRO 92 1HG PRO 92 -1.041 1.288 9.694
738 HD2 PRO 92 2HD PRO 92 -0.053 3.280 8.169
739 HD3 PRO 92 1HD PRO 92 0.004 3.339 9.941
740 H ALA 93 HN ALA 93 2.472 2.109 6.957
741 HA ALA 93 HA ALA 93 3.165 -0.486 5.885
742 HB1 ALA 93 1HB ALA 93 1.554 0.952 4.717
743 HB2 ALA 93 2HB ALA 93 2.948 0.563 3.710
744 HB3 ALA 93 3HB ALA 93 2.820 2.153 4.465
745 H ARG 94 HN ARG 94 4.673 2.724 6.130
746 HA ARG 94 HA ARG 94 6.980 1.945 4.660
747 HB2 ARG 94 2HB ARG 94 6.255 4.258 4.698
748 HB3 ARG 94 1HB ARG 94 6.494 4.336 6.436
749 HG2 ARG 94 2HG ARG 94 8.799 4.360 6.247
750 HG3 ARG 94 1HG ARG 94 8.774 3.670 4.623
751 HD2 ARG 94 2HD ARG 94 9.373 6.067 4.651
752 HD3 ARG 94 1HD ARG 94 7.919 5.732 3.715
753 HE ARG 94 HE ARG 94 7.754 6.735 6.489
754 HH11 ARG 94 1HH1 ARG 94 6.923 6.944 3.090
755 HH12 ARG 94 2HH1 ARG 94 5.853 8.302 3.302
756 HH21 ARG 94 1HH2 ARG 94 6.364 8.518 6.773
757 HH22 ARG 94 2HH2 ARG 94 5.556 9.219 5.401
758 H TRP 95 HN TRP 95 8.817 1.132 5.277
759 HA TRP 95 HA TRP 95 9.379 0.767 8.145
760 HB2 TRP 95 2HB TRP 95 9.636 -1.114 5.827
761 HB3 TRP 95 1HB TRP 95 10.770 -1.248 7.167
762 HD1 TRP 95 1HD TRP 95 9.455 -1.439 9.679
763 HE1 TRP 95 1HE TRP 95 7.479 -2.971 10.256
764 HE3 TRP 95 3HE TRP 95 7.674 -2.259 4.965
765 HZ2 TRP 95 2HZ TRP 95 5.418 -4.342 8.894
766 HZ3 TRP 95 3HZ TRP 95 5.696 -3.694 4.685
767 HH2 TRP 95 2HH TRP 95 4.593 -4.714 6.610
768 H ARG 96 HN ARG 96 11.526 1.031 8.799
769 HA ARG 96 HA ARG 96 13.281 2.277 6.820
770 HB2 ARG 96 2HB ARG 96 14.385 3.351 8.585
771 HB3 ARG 96 1HB ARG 96 12.697 3.426 9.046
772 HG2 ARG 96 2HG ARG 96 13.014 1.573 10.578
773 HG3 ARG 96 1HG ARG 96 14.700 1.430 10.079
774 HD2 ARG 96 2HD ARG 96 14.932 3.870 10.815
775 HD3 ARG 96 1HD ARG 96 13.379 3.643 11.622
776 HE ARG 96 HE ARG 96 15.522 1.753 12.228
777 HH11 ARG 96 1HH1 ARG 96 13.492 4.424 13.241
778 HH12 ARG 96 2HH1 ARG 96 14.009 4.344 14.902
779 HH21 ARG 96 1HH2 ARG 96 16.213 1.654 14.398
780 HH22 ARG 96 2HH2 ARG 96 15.541 2.757 15.563
781 H GLY 97 HN GLY 97 12.883 -0.434 8.944
782 HA2 GLY 97 2HA GLY 97 15.110 -1.786 7.678
783 HA3 GLY 97 1HA GLY 97 15.333 -1.452 9.387
784 H TYR 98 HN TYR 98 12.574 -2.589 7.419
785 HA TYR 98 HA TYR 98 11.731 -4.518 9.314
786 HB2 TYR 98 2HB TYR 98 10.266 -3.680 7.502
787 HB3 TYR 98 1HB TYR 98 11.277 -4.496 6.315
788 HD1 TYR 98 1HD TYR 98 9.118 -5.139 9.278
789 HD2 TYR 98 2HD TYR 98 10.832 -6.720 5.719
790 HE1 TYR 98 1HE TYR 98 7.756 -7.171 9.532
791 HE2 TYR 98 2HE TYR 98 9.476 -8.756 5.964
792 HH TYR 98 HH TYR 98 8.337 -10.010 7.797
793 H LEU 99 HN LEU 99 13.806 -4.652 6.470
794 HA LEU 99 HA LEU 99 14.624 -7.380 7.149
795 HB2 LEU 99 2HB LEU 99 15.136 -5.725 4.672
796 HB3 LEU 99 1HB LEU 99 15.672 -7.374 4.913
797 HG LEU 99 HG LEU 99 12.785 -6.497 4.794
798 HD11 LEU 99 1HD1 LEU 99 12.758 -7.630 2.620
799 HD12 LEU 99 2HD1 LEU 99 14.497 -7.898 2.746
800 HD13 LEU 99 3HD1 LEU 99 13.863 -6.256 2.634
801 HD21 LEU 99 3HD2 LEU 99 12.334 -8.916 4.637
802 HD22 LEU 99 1HD2 LEU 99 13.071 -8.466 6.175
803 HD23 LEU 99 2HD2 LEU 99 14.044 -9.235 4.921
804 H GLU 100 HN GLU 100 16.226 -4.485 5.825
805 HA GLU 100 HA GLU 100 18.093 -4.287 7.973
806 HB2 GLU 100 2HB GLU 100 19.068 -6.219 6.820
807 HB3 GLU 100 1HB GLU 100 19.072 -5.330 5.303
808 HG2 GLU 100 2HG GLU 100 20.637 -3.702 6.323
809 HG3 GLU 100 1HG GLU 100 20.704 -4.724 7.759
810 H HIS 101 HN HIS 101 19.199 -2.327 7.912
811 HA HIS 101 HA HIS 101 18.396 -0.437 5.872
812 HB2 HIS 101 2HB HIS 101 19.578 1.252 7.168
813 HB3 HIS 101 1HB HIS 101 18.563 0.297 8.235
814 HD1 HIS 101 1HD HIS 101 21.635 1.880 8.347
815 HD2 HIS 101 2HD HIS 101 20.447 -1.992 9.293
816 HE1 HIS 101 1HE HIS 101 23.405 0.984 9.889
817 HE2 HIS 101 2HE HIS 101 22.536 -1.261 10.629
818 H HIS 102 HN HIS 102 19.306 -0.960 3.954
819 HA HIS 102 HA HIS 102 22.247 -1.109 3.862
820 HB2 HIS 102 2HB HIS 102 20.843 -3.313 3.555
821 HB3 HIS 102 1HB HIS 102 20.551 -2.673 1.943
822 HD1 HIS 102 1HD HIS 102 22.780 -4.794 3.721
823 HD2 HIS 102 2HD HIS 102 23.202 -2.061 0.609
824 HE1 HIS 102 1HE HIS 102 24.953 -5.377 2.590
825 HE2 HIS 102 2HE HIS 102 25.050 -3.878 0.563
826 H HIS 103 HN HIS 103 23.154 0.268 2.469
827 HA HIS 103 HA HIS 103 21.464 1.414 0.346
828 HB2 HIS 103 2HB HIS 103 23.118 2.829 2.394
829 HB3 HIS 103 1HB HIS 103 22.952 3.537 0.791
830 HD1 HIS 103 1HD HIS 103 21.350 3.474 4.017
831 HD2 HIS 103 2HD HIS 103 20.096 3.868 0.068
832 HE1 HIS 103 1HE HIS 103 19.048 4.483 4.130
833 HE2 HIS 103 2HE HIS 103 18.412 4.916 1.724
834 H HIS 104 HN HIS 104 22.250 0.913 -1.540
835 HA HIS 104 HA HIS 104 25.089 1.409 -2.065
836 HB2 HIS 104 2HB HIS 104 23.829 -1.183 -2.108
837 HB3 HIS 104 1HB HIS 104 24.321 -0.743 -3.739
838 HD1 HIS 104 1HD HIS 104 26.625 -1.451 -4.305
839 HD2 HIS 104 2HD HIS 104 26.164 -0.775 -0.219
840 HE1 HIS 104 1HE HIS 104 28.823 -2.077 -3.254
841 HE2 HIS 104 2HE HIS 104 28.481 -1.789 -0.774
842 H HIS 105 HN HIS 105 25.273 2.767 -3.757
843 HA HIS 105 HA HIS 105 22.945 3.247 -5.420
844 HB2 HIS 105 2HB HIS 105 24.290 4.987 -6.528
845 HB3 HIS 105 1HB HIS 105 24.264 5.189 -4.786
846 HD1 HIS 105 1HD HIS 105 26.454 5.662 -3.758
847 HD2 HIS 105 2HD HIS 105 26.852 3.711 -7.415
848 HE1 HIS 105 1HE HIS 105 28.927 5.568 -4.218
849 HE2 HIS 105 2HE HIS 105 29.127 4.586 -6.527
850 H HIS 106 HN HIS 106 25.853 1.463 -5.512
851 HA HIS 106 HA HIS 106 24.997 -0.166 -7.623
852 HB2 HIS 106 2HB HIS 106 25.695 1.844 -8.972
853 HB3 HIS 106 1HB HIS 106 27.330 1.623 -8.361
854 HD1 HIS 106 1HD HIS 106 27.693 1.447 -11.090
855 HD2 HIS 106 2HD HIS 106 25.886 -1.774 -9.169
856 HE1 HIS 106 1HE HIS 106 27.943 -0.516 -12.656
857 HE2 HIS 106 2HE HIS 106 26.735 -2.423 -11.520
Start of MODEL 18
1 H1 MET 1 H1 MET 1 -16.240 1.591 4.425
2 H2 MET 1 H2 MET 1 -16.504 3.263 4.462
3 H3 MET 1 H3 MET 1 -15.381 2.557 5.518
4 HA MET 1 HA MET 1 -15.153 2.605 2.570
5 HB2 MET 1 2HB MET 1 -14.822 4.836 3.573
6 HB3 MET 1 1HB MET 1 -13.615 4.162 4.661
7 HG2 MET 1 2HG MET 1 -12.410 5.197 2.913
8 HG3 MET 1 1HG MET 1 -12.324 3.468 2.616
9 HE1 MET 1 2HE MET 1 -15.492 5.735 1.948
10 HE2 MET 1 3HE MET 1 -15.157 6.288 0.307
11 HE3 MET 1 1HE MET 1 -14.125 6.805 1.640
12 H THR 2 HN THR 2 -13.879 1.067 1.820
13 HA THR 2 HA THR 2 -12.288 -0.490 3.714
14 HB THR 2 HB THR 2 -12.073 -2.116 1.845
15 HG1 THR 2 1HG THR 2 -14.038 -0.606 0.463
16 HG21 THR 2 3HG2 THR 2 -13.921 -2.306 3.461
17 HG22 THR 2 1HG2 THR 2 -14.393 -2.872 1.857
18 HG23 THR 2 2HG2 THR 2 -14.919 -1.287 2.424
19 H PHE 3 HN PHE 3 -10.129 -1.256 2.918
20 HA PHE 3 HA PHE 3 -8.437 0.896 2.330
21 HB2 PHE 3 2HB PHE 3 -7.650 -1.135 3.453
22 HB3 PHE 3 1HB PHE 3 -7.935 -2.072 1.991
23 HD1 PHE 3 1HD PHE 3 -5.954 0.778 3.311
24 HD2 PHE 3 2HD PHE 3 -6.249 -2.325 0.418
25 HE1 PHE 3 1HE PHE 3 -3.657 1.261 2.563
26 HE2 PHE 3 2HE PHE 3 -3.955 -1.851 -0.335
27 HZ PHE 3 HZ PHE 3 -2.656 -0.056 0.739
28 H SER 4 HN SER 4 -9.872 -1.576 0.252
29 HA SER 4 HA SER 4 -8.465 -0.914 -2.096
30 HB2 SER 4 2HB SER 4 -11.221 -2.133 -1.810
31 HB3 SER 4 1HB SER 4 -10.233 -2.160 -3.271
32 HG SER 4 HG SER 4 -8.659 -3.104 -1.484
33 H GLU 5 HN GLU 5 -11.574 0.234 -0.824
34 HA GLU 5 HA GLU 5 -12.247 1.850 -3.035
35 HB2 GLU 5 2HB GLU 5 -13.026 1.981 -0.127
36 HB3 GLU 5 1HB GLU 5 -13.723 3.013 -1.360
37 HG2 GLU 5 2HG GLU 5 -14.637 1.115 -2.509
38 HG3 GLU 5 1HG GLU 5 -13.835 0.015 -1.388
39 H CYS 6 HN CYS 6 -10.666 2.587 0.048
40 HA CYS 6 HA CYS 6 -10.371 5.360 -0.357
41 HB2 CYS 6 2HB CYS 6 -10.100 4.058 1.806
42 HB3 CYS 6 1HB CYS 6 -8.512 3.600 1.244
43 HG CYS 6 HG CYS 6 -8.137 6.617 0.864
44 H ALA 7 HN ALA 7 -8.214 2.642 -0.980
45 HA ALA 7 HA ALA 7 -6.044 4.040 -2.054
46 HB1 ALA 7 1HB ALA 7 -6.004 1.638 -1.496
47 HB2 ALA 7 2HB ALA 7 -5.412 1.957 -3.126
48 HB3 ALA 7 3HB ALA 7 -7.036 1.316 -2.888
49 H ALA 8 HN ALA 8 -8.948 2.769 -3.637
50 HA ALA 8 HA ALA 8 -8.278 3.522 -6.262
51 HB1 ALA 8 1HB ALA 8 -10.655 3.242 -6.759
52 HB2 ALA 8 2HB ALA 8 -11.015 3.205 -5.033
53 HB3 ALA 8 3HB ALA 8 -10.049 1.921 -5.760
54 H LEU 9 HN LEU 9 -9.901 5.272 -3.654
55 HA LEU 9 HA LEU 9 -10.660 7.526 -5.175
56 HB2 LEU 9 2HB LEU 9 -9.982 7.322 -2.241
57 HB3 LEU 9 1HB LEU 9 -10.739 8.709 -2.994
58 HG LEU 9 HG LEU 9 -11.932 5.946 -2.774
59 HD11 LEU 9 1HD1 LEU 9 -13.546 7.039 -1.292
60 HD12 LEU 9 2HD1 LEU 9 -12.638 8.546 -1.425
61 HD13 LEU 9 3HD1 LEU 9 -11.902 7.137 -0.659
62 HD21 LEU 9 3HD2 LEU 9 -13.095 8.475 -3.936
63 HD22 LEU 9 1HD2 LEU 9 -13.947 6.946 -3.721
64 HD23 LEU 9 2HD2 LEU 9 -12.599 7.052 -4.851
65 H TYR 10 HN TYR 10 -7.729 6.770 -3.347
66 HA TYR 10 HA TYR 10 -6.372 9.204 -3.768
67 HB2 TYR 10 2HB TYR 10 -5.671 7.478 -2.130
68 HB3 TYR 10 1HB TYR 10 -5.214 6.418 -3.454
69 HD1 TYR 10 2HD TYR 10 -4.508 9.859 -2.178
70 HD2 TYR 10 1HD TYR 10 -2.998 6.382 -4.110
71 HE1 TYR 10 2HE TYR 10 -2.258 10.850 -2.182
72 HE2 TYR 10 1HE TYR 10 -0.743 7.361 -4.122
73 HH TYR 10 HH TYR 10 0.029 10.253 -2.368
74 H ILE 11 HN ILE 11 -6.546 6.221 -5.604
75 HA ILE 11 HA ILE 11 -4.754 6.890 -7.667
76 HB ILE 11 HB ILE 11 -7.132 5.034 -7.633
77 HG12 ILE 11 2HG1 ILE 11 -4.172 4.429 -7.556
78 HG13 ILE 11 1HG1 ILE 11 -5.182 4.563 -6.123
79 HG21 ILE 11 1HG2 ILE 11 -6.261 4.028 -9.673
80 HG22 ILE 11 2HG2 ILE 11 -4.986 5.242 -9.745
81 HG23 ILE 11 3HG2 ILE 11 -6.671 5.723 -9.937
82 HD11 ILE 11 3HD1 ILE 11 -4.856 2.250 -6.710
83 HD12 ILE 11 1HD1 ILE 11 -5.488 2.546 -8.330
84 HD13 ILE 11 2HD1 ILE 11 -6.550 2.697 -6.930
85 H LYS 12 HN LYS 12 -8.301 7.198 -7.485
86 HA LYS 12 HA LYS 12 -8.651 8.378 -10.006
87 HB2 LYS 12 2HB LYS 12 -10.316 8.507 -7.500
88 HB3 LYS 12 1HB LYS 12 -10.810 9.273 -9.004
89 HG2 LYS 12 2HG LYS 12 -10.601 7.029 -10.104
90 HG3 LYS 12 1HG LYS 12 -10.372 6.346 -8.493
91 HD2 LYS 12 2HD LYS 12 -12.541 7.110 -7.803
92 HD3 LYS 12 1HD LYS 12 -12.762 7.985 -9.319
93 HE2 LYS 12 2HE LYS 12 -12.604 5.801 -10.514
94 HE3 LYS 12 1HE LYS 12 -12.587 5.000 -8.943
95 HZ1 LYS 12 3HZ LYS 12 -14.760 5.865 -8.472
96 HZ2 LYS 12 1HZ LYS 12 -14.806 5.087 -9.981
97 HZ3 LYS 12 2HZ LYS 12 -14.764 6.780 -9.902
98 H ALA 13 HN ALA 13 -7.803 9.778 -6.910
99 HA ALA 13 HA ALA 13 -8.133 12.488 -7.677
100 HB1 ALA 13 1HB ALA 13 -8.011 11.775 -5.336
101 HB2 ALA 13 2HB ALA 13 -6.815 13.020 -5.703
102 HB3 ALA 13 3HB ALA 13 -6.318 11.333 -5.562
103 H HIS 14 HN HIS 14 -5.910 10.189 -8.743
104 HA HIS 14 HA HIS 14 -4.056 12.311 -9.596
105 HB2 HIS 14 2HB HIS 14 -3.353 9.593 -8.492
106 HB3 HIS 14 1HB HIS 14 -2.211 10.589 -9.387
107 HD1 HIS 14 1HD HIS 14 -3.980 10.351 -6.098
108 HD2 HIS 14 2HD HIS 14 -1.210 12.799 -8.006
109 HE1 HIS 14 1HE HIS 14 -3.033 11.839 -4.300
110 HE2 HIS 14 2HE HIS 14 -1.249 13.199 -5.448
111 H ARG 15 HN ARG 15 -6.259 10.216 -10.723
112 HA ARG 15 HA ARG 15 -4.895 8.848 -12.787
113 HB2 ARG 15 2HB ARG 15 -7.153 8.599 -13.821
114 HB3 ARG 15 1HB ARG 15 -7.072 8.091 -12.143
115 HG2 ARG 15 2HG ARG 15 -8.144 10.123 -11.427
116 HG3 ARG 15 1HG ARG 15 -8.121 10.750 -13.075
117 HD2 ARG 15 2HD ARG 15 -9.490 8.168 -12.393
118 HD3 ARG 15 1HD ARG 15 -10.306 9.721 -12.208
119 HE ARG 15 HE ARG 15 -9.608 9.991 -14.682
120 HH11 ARG 15 1HH1 ARG 15 -10.651 6.998 -13.162
121 HH12 ARG 15 2HH1 ARG 15 -11.303 6.348 -14.628
122 HH21 ARG 15 1HH2 ARG 15 -10.458 9.117 -16.603
123 HH22 ARG 15 2HH2 ARG 15 -11.171 7.528 -16.588
124 H SER 16 HN SER 16 -5.929 12.090 -12.447
125 HA SER 16 HA SER 16 -5.920 12.874 -15.158
126 HB2 SER 16 2HB SER 16 -5.142 14.696 -12.902
127 HB3 SER 16 1HB SER 16 -6.152 15.027 -14.306
128 HG SER 16 HG SER 16 -7.829 14.443 -13.192
129 H SER 17 HN SER 17 -3.446 12.578 -12.684
130 HA SER 17 HA SER 17 -1.400 13.806 -14.313
131 HB2 SER 17 2HB SER 17 -1.439 14.033 -11.824
132 HB3 SER 17 1HB SER 17 -1.120 12.303 -11.696
133 HG SER 17 HG SER 17 0.550 14.148 -13.066
134 H TRP 18 HN TRP 18 -2.544 10.620 -13.491
135 HA TRP 18 HA TRP 18 -0.277 9.317 -14.750
136 HB2 TRP 18 2HB TRP 18 -2.785 8.174 -13.505
137 HB3 TRP 18 1HB TRP 18 -1.446 7.216 -14.133
138 HD1 TRP 18 1HD TRP 18 0.832 9.242 -12.864
139 HE1 TRP 18 1HE TRP 18 1.325 9.031 -10.343
140 HE3 TRP 18 3HE TRP 18 -3.458 6.889 -11.405
141 HZ2 TRP 18 2HZ TRP 18 0.059 7.990 -8.049
142 HZ3 TRP 18 3HZ TRP 18 -3.735 6.313 -9.035
143 HH2 TRP 18 2HH TRP 18 -2.014 6.851 -7.391
144 H LYS 19 HN LYS 19 -2.277 11.028 -16.196
145 HA LYS 19 HA LYS 19 -3.115 9.147 -18.277
146 HB2 LYS 19 2HB LYS 19 -4.881 10.708 -17.431
147 HB3 LYS 19 1HB LYS 19 -3.847 12.068 -17.838
148 HG2 LYS 19 2HG LYS 19 -5.352 11.985 -19.593
149 HG3 LYS 19 1HG LYS 19 -3.936 11.157 -20.237
150 HD2 LYS 19 2HD LYS 19 -5.612 9.717 -20.873
151 HD3 LYS 19 1HD LYS 19 -5.145 9.018 -19.324
152 HE2 LYS 19 2HE LYS 19 -7.427 10.952 -19.711
153 HE3 LYS 19 1HE LYS 19 -7.605 9.200 -19.658
154 HZ1 LYS 19 3HZ LYS 19 -8.105 10.196 -17.526
155 HZ2 LYS 19 1HZ LYS 19 -6.571 10.911 -17.456
156 HZ3 LYS 19 2HZ LYS 19 -6.726 9.223 -17.403
157 H ASN 20 HN ASN 20 -0.616 10.117 -20.306
158 HA ASN 20 HA ASN 20 -3.311 9.031 -20.129
159 HB2 ASN 20 2HB ASN 20 -2.566 9.999 -22.284
160 HB3 ASN 20 1HB ASN 20 -1.243 8.847 -22.337
161 HD21 ASN 20 1HD2 ASN 20 -4.634 9.340 -22.787
162 HD22 ASN 20 2HD2 ASN 20 -4.970 7.796 -23.512
163 H THR 21 HN THR 21 -0.410 8.306 -18.887
164 HA THR 21 HA THR 21 0.308 5.765 -19.736
165 HB THR 21 HB THR 21 1.505 5.563 -17.580
166 HG1 THR 21 1HG THR 21 -0.358 7.386 -16.831
167 HG21 THR 21 3HG2 THR 21 1.704 8.255 -18.935
168 HG22 THR 21 1HG2 THR 21 2.554 6.781 -19.398
169 HG23 THR 21 2HG2 THR 21 2.925 7.568 -17.864
170 H LYS 22 HN LYS 22 0.232 3.732 -18.586
171 HA LYS 22 HA LYS 22 -2.409 3.075 -17.629
172 HB2 LYS 22 2HB LYS 22 0.040 1.578 -18.410
173 HB3 LYS 22 1HB LYS 22 -1.095 0.777 -17.335
174 HG2 LYS 22 2HG LYS 22 -1.984 2.023 -19.913
175 HG3 LYS 22 1HG LYS 22 -1.346 0.376 -19.835
176 HD2 LYS 22 2HD LYS 22 -3.064 -0.167 -18.142
177 HD3 LYS 22 1HD LYS 22 -3.725 1.458 -18.324
178 HE2 LYS 22 2HE LYS 22 -4.382 1.032 -20.562
179 HE3 LYS 22 1HE LYS 22 -3.447 -0.462 -20.626
180 HZ1 LYS 22 3HZ LYS 22 -5.804 -0.012 -18.871
181 HZ2 LYS 22 1HZ LYS 22 -4.943 -1.464 -19.055
182 HZ3 LYS 22 2HZ LYS 22 -5.845 -0.841 -20.350
183 H HIS 23 HN HIS 23 -0.185 4.639 -16.026
184 HA HIS 23 HA HIS 23 0.567 3.074 -13.828
185 HB2 HIS 23 2HB HIS 23 0.265 6.043 -14.201
186 HB3 HIS 23 1HB HIS 23 0.694 5.373 -12.631
187 HD1 HIS 23 1HD HIS 23 3.126 5.305 -12.242
188 HD2 HIS 23 2HD HIS 23 2.206 4.962 -16.284
189 HE1 HIS 23 1HE HIS 23 5.337 5.150 -13.433
190 HE2 HIS 23 2HE HIS 23 4.743 4.725 -15.845
191 H ALA 24 HN ALA 24 -2.298 5.099 -14.308
192 HA ALA 24 HA ALA 24 -3.369 4.935 -11.737
193 HB1 ALA 24 1HB ALA 24 -5.532 5.425 -12.788
194 HB2 ALA 24 2HB ALA 24 -4.840 5.073 -14.371
195 HB3 ALA 24 3HB ALA 24 -4.247 6.447 -13.435
196 H ASP 25 HN ASP 25 -3.832 2.785 -14.525
197 HA ASP 25 HA ASP 25 -5.612 1.006 -13.228
198 HB2 ASP 25 2HB ASP 25 -5.410 1.105 -15.676
199 HB3 ASP 25 1HB ASP 25 -3.772 0.480 -15.571
200 H GLN 26 HN GLN 26 -2.123 0.900 -13.810
201 HA GLN 26 HA GLN 26 -1.685 -1.632 -12.693
202 HB2 GLN 26 2HB GLN 26 0.162 0.711 -13.105
203 HB3 GLN 26 1HB GLN 26 0.700 -0.879 -12.602
204 HG2 GLN 26 2HG GLN 26 -0.700 -0.208 -15.176
205 HG3 GLN 26 1HG GLN 26 1.010 -0.583 -14.983
206 HE21 GLN 26 1HE2 GLN 26 -2.223 -1.864 -15.085
207 HE22 GLN 26 2HE2 GLN 26 -1.771 -3.530 -15.195
208 H TRP 27 HN TRP 27 -1.812 1.558 -11.207
209 HA TRP 27 HA TRP 27 -0.858 0.825 -8.668
210 HB2 TRP 27 2HB TRP 27 -2.588 2.999 -9.721
211 HB3 TRP 27 1HB TRP 27 -2.682 2.675 -7.992
212 HD1 TRP 27 1HD TRP 27 0.109 3.370 -10.615
213 HE1 TRP 27 1HE TRP 27 1.934 4.781 -9.469
214 HE3 TRP 27 3HE TRP 27 -1.864 3.554 -5.901
215 HZ2 TRP 27 2HZ TRP 27 2.456 5.831 -6.895
216 HZ3 TRP 27 3HZ TRP 27 -0.643 4.781 -4.159
217 HH2 TRP 27 2HH TRP 27 1.472 5.896 -4.645
218 H THR 28 HN THR 28 -4.143 0.755 -10.015
219 HA THR 28 HA THR 28 -5.381 -0.389 -7.732
220 HB THR 28 HB THR 28 -6.327 -0.750 -10.579
221 HG1 THR 28 1HG THR 28 -6.044 1.581 -9.111
222 HG21 THR 28 3HG2 THR 28 -7.576 -1.921 -8.825
223 HG22 THR 28 1HG2 THR 28 -8.543 -0.636 -9.550
224 HG23 THR 28 2HG2 THR 28 -7.802 -0.396 -7.968
225 H ASN 29 HN ASN 29 -3.912 -1.677 -10.641
226 HA ASN 29 HA ASN 29 -4.831 -4.284 -10.643
227 HB2 ASN 29 2HB ASN 29 -3.475 -3.030 -12.404
228 HB3 ASN 29 1HB ASN 29 -2.046 -3.468 -11.476
229 HD21 ASN 29 1HD2 ASN 29 -4.516 -4.532 -13.603
230 HD22 ASN 29 2HD2 ASN 29 -3.875 -6.109 -13.904
231 H THR 30 HN THR 30 -1.824 -3.049 -9.174
232 HA THR 30 HA THR 30 -0.979 -5.572 -8.202
233 HB THR 30 HB THR 30 -0.163 -2.871 -7.127
234 HG1 THR 30 1HG THR 30 1.022 -4.303 -9.288
235 HG21 THR 30 3HG2 THR 30 1.312 -5.503 -7.302
236 HG22 THR 30 1HG2 THR 30 0.634 -4.800 -5.834
237 HG23 THR 30 2HG2 THR 30 1.964 -3.993 -6.666
238 H ILE 31 HN ILE 31 -2.719 -2.875 -6.682
239 HA ILE 31 HA ILE 31 -2.705 -3.952 -4.059
240 HB ILE 31 HB ILE 31 -4.601 -1.953 -5.312
241 HG12 ILE 31 2HG1 ILE 31 -2.175 -1.546 -3.546
242 HG13 ILE 31 1HG1 ILE 31 -2.228 -1.259 -5.283
243 HG21 ILE 31 1HG2 ILE 31 -5.623 -2.962 -3.361
244 HG22 ILE 31 2HG2 ILE 31 -5.143 -1.303 -3.000
245 HG23 ILE 31 3HG2 ILE 31 -4.170 -2.652 -2.413
246 HD11 ILE 31 3HD1 ILE 31 -3.831 0.204 -3.199
247 HD12 ILE 31 1HD1 ILE 31 -3.895 0.493 -4.937
248 HD13 ILE 31 2HD1 ILE 31 -2.409 0.817 -4.043
249 H LYS 32 HN LYS 32 -5.001 -4.090 -6.727
250 HA LYS 32 HA LYS 32 -7.102 -5.425 -5.466
251 HB2 LYS 32 2HB LYS 32 -7.174 -4.374 -7.727
252 HB3 LYS 32 1HB LYS 32 -6.182 -5.678 -8.342
253 HG2 LYS 32 2HG LYS 32 -8.792 -6.300 -7.032
254 HG3 LYS 32 1HG LYS 32 -8.751 -5.724 -8.698
255 HD2 LYS 32 2HD LYS 32 -7.258 -7.568 -9.296
256 HD3 LYS 32 1HD LYS 32 -7.286 -8.137 -7.627
257 HE2 LYS 32 2HE LYS 32 -9.726 -8.459 -7.814
258 HE3 LYS 32 1HE LYS 32 -9.637 -7.969 -9.505
259 HZ1 LYS 32 3HZ LYS 32 -8.218 -10.299 -8.330
260 HZ2 LYS 32 1HZ LYS 32 -8.229 -9.855 -9.967
261 HZ3 LYS 32 2HZ LYS 32 -9.658 -10.389 -9.219
262 H THR 33 HN THR 33 -4.100 -6.611 -6.839
263 HA THR 33 HA THR 33 -4.967 -9.358 -6.841
264 HB THR 33 HB THR 33 -2.190 -8.221 -7.248
265 HG1 THR 33 1HG THR 33 -3.770 -7.443 -8.777
266 HG21 THR 33 3HG2 THR 33 -1.754 -10.332 -8.427
267 HG22 THR 33 1HG2 THR 33 -3.374 -10.897 -8.018
268 HG23 THR 33 2HG2 THR 33 -2.188 -10.621 -6.743
269 H TYR 34 HN TYR 34 -2.451 -7.548 -5.043
270 HA TYR 34 HA TYR 34 -1.973 -9.841 -3.363
271 HB2 TYR 34 2HB TYR 34 -0.765 -7.078 -3.357
272 HB3 TYR 34 1HB TYR 34 -0.254 -8.390 -2.296
273 HD1 TYR 34 2HD TYR 34 0.605 -10.533 -3.378
274 HD2 TYR 34 1HD TYR 34 0.107 -6.901 -5.535
275 HE1 TYR 34 2HE TYR 34 2.101 -11.377 -5.133
276 HE2 TYR 34 1HE TYR 34 1.604 -7.740 -7.297
277 HH TYR 34 HH TYR 34 2.478 -10.974 -7.570
278 H CYS 35 HN CYS 35 -3.266 -6.574 -2.847
279 HA CYS 35 HA CYS 35 -3.553 -7.091 -0.012
280 HB2 CYS 35 2HB CYS 35 -4.340 -4.651 -1.618
281 HB3 CYS 35 1HB CYS 35 -4.251 -4.757 0.137
282 HG CYS 35 HG CYS 35 -1.403 -5.403 -0.063
283 H GLY 36 HN GLY 36 -5.554 -6.918 -2.843
284 HA2 GLY 36 2HA GLY 36 -8.054 -6.347 -1.963
285 HA3 GLY 36 1HA GLY 36 -7.733 -7.526 -3.216
286 HA PRO 37 HA PRO 37 -9.279 -10.885 -0.917
287 HB2 PRO 37 2HB PRO 37 -6.689 -12.280 -0.643
288 HB3 PRO 37 1HB PRO 37 -8.169 -12.794 -1.459
289 HG2 PRO 37 2HG PRO 37 -6.018 -12.040 -2.849
290 HG3 PRO 37 1HG PRO 37 -7.657 -11.643 -3.399
291 HD2 PRO 37 2HD PRO 37 -5.649 -9.905 -2.014
292 HD3 PRO 37 1HD PRO 37 -6.735 -9.516 -3.365
293 H VAL 38 HN VAL 38 -6.586 -9.286 0.569
294 HA VAL 38 HA VAL 38 -7.170 -10.643 3.118
295 HB VAL 38 HB VAL 38 -4.687 -9.065 2.435
296 HG11 VAL 38 1HG1 VAL 38 -3.771 -10.133 4.454
297 HG12 VAL 38 2HG1 VAL 38 -5.338 -10.881 4.759
298 HG13 VAL 38 3HG1 VAL 38 -5.173 -9.127 4.826
299 HG21 VAL 38 3HG2 VAL 38 -4.834 -11.084 1.062
300 HG22 VAL 38 1HG2 VAL 38 -5.094 -12.052 2.513
301 HG23 VAL 38 2HG2 VAL 38 -3.556 -11.226 2.271
302 H ILE 39 HN ILE 39 -5.721 -7.458 2.389
303 HA ILE 39 HA ILE 39 -7.296 -6.374 4.604
304 HB ILE 39 HB ILE 39 -5.794 -4.397 4.441
305 HG12 ILE 39 2HG1 ILE 39 -4.287 -6.088 2.430
306 HG13 ILE 39 1HG1 ILE 39 -5.223 -4.648 2.037
307 HG21 ILE 39 1HG2 ILE 39 -4.443 -7.068 4.771
308 HG22 ILE 39 2HG2 ILE 39 -5.312 -6.167 6.013
309 HG23 ILE 39 3HG2 ILE 39 -3.810 -5.527 5.345
310 HD11 ILE 39 3HD1 ILE 39 -2.767 -4.757 3.778
311 HD12 ILE 39 1HD1 ILE 39 -3.707 -3.309 3.414
312 HD13 ILE 39 2HD1 ILE 39 -2.856 -4.155 2.123
313 H GLY 40 HN GLY 40 -7.773 -6.725 1.453
314 HA2 GLY 40 2HA GLY 40 -8.417 -4.242 0.387
315 HA3 GLY 40 1HA GLY 40 -9.194 -5.753 -0.057
316 HA PRO 41 HA PRO 41 -12.931 -4.528 1.920
317 HB2 PRO 41 2HB PRO 41 -13.171 -6.897 3.611
318 HB3 PRO 41 1HB PRO 41 -14.113 -6.440 2.191
319 HG2 PRO 41 2HG PRO 41 -12.375 -8.511 2.172
320 HG3 PRO 41 1HG PRO 41 -12.689 -7.519 0.735
321 HD2 PRO 41 2HD PRO 41 -10.395 -7.399 2.660
322 HD3 PRO 41 1HD PRO 41 -10.384 -7.288 0.886
323 H LEU 42 HN LEU 42 -10.219 -4.974 3.874
324 HA LEU 42 HA LEU 42 -11.477 -4.463 6.402
325 HB2 LEU 42 2HB LEU 42 -8.591 -4.373 5.541
326 HB3 LEU 42 1HB LEU 42 -9.121 -4.077 7.185
327 HG LEU 42 HG LEU 42 -9.441 -6.658 5.650
328 HD11 LEU 42 1HD1 LEU 42 -7.149 -6.206 6.396
329 HD12 LEU 42 2HD1 LEU 42 -7.873 -7.560 7.263
330 HD13 LEU 42 3HD1 LEU 42 -7.738 -5.985 8.045
331 HD21 LEU 42 3HD2 LEU 42 -10.239 -5.953 8.471
332 HD22 LEU 42 1HD2 LEU 42 -10.291 -7.565 7.760
333 HD23 LEU 42 2HD2 LEU 42 -11.332 -6.291 7.128
334 H SER 43 HN SER 43 -11.644 -2.555 7.493
335 HA SER 43 HA SER 43 -11.829 -0.174 6.052
336 HB2 SER 43 2HB SER 43 -11.609 -0.573 9.033
337 HB3 SER 43 1HB SER 43 -12.379 0.753 8.189
338 HG SER 43 HG SER 43 -13.688 -1.158 9.027
339 H VAL 44 HN VAL 44 -10.505 1.629 6.000
340 HA VAL 44 HA VAL 44 -7.746 1.098 5.930
341 HB VAL 44 HB VAL 44 -8.843 2.750 4.484
342 HG11 VAL 44 1HG1 VAL 44 -9.038 4.418 6.984
343 HG12 VAL 44 2HG1 VAL 44 -10.378 3.761 6.045
344 HG13 VAL 44 3HG1 VAL 44 -9.337 5.004 5.348
345 HG21 VAL 44 3HG2 VAL 44 -6.434 2.858 4.738
346 HG22 VAL 44 1HG2 VAL 44 -6.607 3.879 6.166
347 HG23 VAL 44 2HG2 VAL 44 -7.096 4.485 4.584
348 H GLN 45 HN GLN 45 -9.747 2.324 8.488
349 HA GLN 45 HA GLN 45 -7.522 3.372 10.018
350 HB2 GLN 45 2HB GLN 45 -9.806 4.355 10.146
351 HB3 GLN 45 1HB GLN 45 -10.370 2.865 10.894
352 HG2 GLN 45 2HG GLN 45 -8.856 3.225 12.770
353 HG3 GLN 45 1HG GLN 45 -8.267 4.706 12.017
354 HE21 GLN 45 1HE2 GLN 45 -8.907 5.987 13.736
355 HE22 GLN 45 2HE2 GLN 45 -10.573 6.334 14.034
356 H ASP 46 HN ASP 46 -9.081 0.381 9.541
357 HA ASP 46 HA ASP 46 -8.365 -0.708 12.128
358 HB2 ASP 46 2HB ASP 46 -9.856 -1.820 9.754
359 HB3 ASP 46 1HB ASP 46 -9.443 -2.793 11.157
360 H VAL 47 HN VAL 47 -7.276 -0.789 8.814
361 HA VAL 47 HA VAL 47 -5.556 -3.025 9.019
362 HB VAL 47 HB VAL 47 -5.267 -0.599 7.230
363 HG11 VAL 47 1HG1 VAL 47 -3.197 -1.898 7.418
364 HG12 VAL 47 2HG1 VAL 47 -3.907 -2.035 5.810
365 HG13 VAL 47 3HG1 VAL 47 -4.075 -3.359 6.963
366 HG21 VAL 47 3HG2 VAL 47 -6.346 -2.026 5.524
367 HG22 VAL 47 1HG2 VAL 47 -7.408 -1.660 6.884
368 HG23 VAL 47 2HG2 VAL 47 -6.640 -3.244 6.765
369 H ASP 48 HN ASP 48 -3.871 -3.235 10.332
370 HA ASP 48 HA ASP 48 -2.367 -0.818 11.090
371 HB2 ASP 48 2HB ASP 48 -2.001 -1.664 13.219
372 HB3 ASP 48 1HB ASP 48 -3.614 -2.274 12.884
373 H THR 49 HN THR 49 -0.127 -1.800 12.084
374 HA THR 49 HA THR 49 1.459 -2.346 9.847
375 HB THR 49 HB THR 49 2.161 -2.865 12.743
376 HG1 THR 49 1HG THR 49 2.658 -0.472 11.297
377 HG21 THR 49 3HG2 THR 49 3.789 -3.745 11.121
378 HG22 THR 49 1HG2 THR 49 4.449 -2.386 12.032
379 HG23 THR 49 2HG2 THR 49 3.895 -2.152 10.374
380 H LYS 50 HN LYS 50 0.141 -4.514 12.341
381 HA LYS 50 HA LYS 50 1.702 -6.768 11.566
382 HB2 LYS 50 2HB LYS 50 0.361 -6.214 13.785
383 HB3 LYS 50 1HB LYS 50 -0.922 -7.083 12.961
384 HG2 LYS 50 2HG LYS 50 1.816 -8.254 13.311
385 HG3 LYS 50 1HG LYS 50 0.564 -8.395 14.543
386 HD2 LYS 50 2HD LYS 50 -0.874 -9.584 13.036
387 HD3 LYS 50 1HD LYS 50 0.227 -9.288 11.687
388 HE2 LYS 50 2HE LYS 50 0.408 -11.580 12.593
389 HE3 LYS 50 1HE LYS 50 1.916 -10.675 12.706
390 HZ1 LYS 50 3HZ LYS 50 1.527 -10.299 15.024
391 HZ2 LYS 50 1HZ LYS 50 1.380 -11.960 14.727
392 HZ3 LYS 50 2HZ LYS 50 -0.004 -11.011 14.949
393 H LEU 51 HN LEU 51 -1.586 -5.675 10.812
394 HA LEU 51 HA LEU 51 -2.367 -7.893 9.287
395 HB2 LEU 51 2HB LEU 51 -3.166 -4.995 9.110
396 HB3 LEU 51 1HB LEU 51 -3.937 -6.268 8.193
397 HG LEU 51 HG LEU 51 -3.886 -6.033 11.193
398 HD11 LEU 51 1HD1 LEU 51 -6.297 -5.670 10.964
399 HD12 LEU 51 2HD1 LEU 51 -6.124 -5.676 9.208
400 HD13 LEU 51 3HD1 LEU 51 -5.359 -4.408 10.169
401 HD21 LEU 51 3HD2 LEU 51 -3.863 -8.364 10.527
402 HD22 LEU 51 1HD2 LEU 51 -5.210 -8.083 9.423
403 HD23 LEU 51 2HD2 LEU 51 -5.448 -7.927 11.164
404 H ILE 52 HN ILE 52 -0.588 -4.972 8.419
405 HA ILE 52 HA ILE 52 -0.449 -5.516 5.635
406 HB ILE 52 HB ILE 52 1.385 -3.831 7.351
407 HG12 ILE 52 2HG1 ILE 52 -0.947 -3.018 5.606
408 HG13 ILE 52 1HG1 ILE 52 -1.012 -3.158 7.358
409 HG21 ILE 52 1HG2 ILE 52 2.454 -4.442 5.250
410 HG22 ILE 52 2HG2 ILE 52 2.027 -2.731 5.258
411 HG23 ILE 52 3HG2 ILE 52 1.042 -3.881 4.354
412 HD11 ILE 52 3HD1 ILE 52 0.723 -1.252 5.808
413 HD12 ILE 52 1HD1 ILE 52 0.658 -1.393 7.565
414 HD13 ILE 52 2HD1 ILE 52 -0.761 -0.846 6.671
415 H MET 53 HN MET 53 1.591 -6.330 8.394
416 HA MET 53 HA MET 53 3.774 -7.428 7.057
417 HB2 MET 53 2HB MET 53 2.498 -8.209 9.675
418 HB3 MET 53 1HB MET 53 3.986 -8.931 9.090
419 HG2 MET 53 2HG MET 53 5.048 -6.727 9.096
420 HG3 MET 53 1HG MET 53 3.550 -6.021 9.707
421 HE1 MET 53 3HE MET 53 6.037 -5.929 12.783
422 HE2 MET 53 1HE MET 53 5.045 -4.955 11.697
423 HE3 MET 53 2HE MET 53 6.483 -5.770 11.084
424 H LYS 54 HN LYS 54 0.709 -8.932 7.995
425 HA LYS 54 HA LYS 54 1.287 -11.538 7.173
426 HB2 LYS 54 2HB LYS 54 -1.362 -10.098 7.289
427 HB3 LYS 54 1HB LYS 54 -1.193 -11.827 7.019
428 HG2 LYS 54 2HG LYS 54 0.117 -11.832 9.229
429 HG3 LYS 54 1HG LYS 54 -0.600 -10.241 9.487
430 HD2 LYS 54 2HD LYS 54 -1.965 -11.944 10.545
431 HD3 LYS 54 1HD LYS 54 -2.841 -11.231 9.187
432 HE2 LYS 54 2HE LYS 54 -2.293 -13.125 7.789
433 HE3 LYS 54 1HE LYS 54 -1.288 -13.816 9.063
434 HZ1 LYS 54 3HZ LYS 54 -3.458 -14.873 8.946
435 HZ2 LYS 54 1HZ LYS 54 -4.224 -13.385 9.225
436 HZ3 LYS 54 2HZ LYS 54 -3.249 -14.076 10.431
437 H VAL 55 HN VAL 55 0.110 -8.777 5.352
438 HA VAL 55 HA VAL 55 -0.462 -10.236 2.967
439 HB VAL 55 HB VAL 55 0.124 -7.285 3.281
440 HG11 VAL 55 1HG1 VAL 55 -1.260 -8.782 1.054
441 HG12 VAL 55 2HG1 VAL 55 0.327 -8.018 0.968
442 HG13 VAL 55 3HG1 VAL 55 -1.118 -7.029 1.181
443 HG21 VAL 55 3HG2 VAL 55 -2.499 -8.772 3.329
444 HG22 VAL 55 1HG2 VAL 55 -2.323 -7.017 3.304
445 HG23 VAL 55 2HG2 VAL 55 -1.735 -7.943 4.685
446 H LEU 56 HN LEU 56 2.322 -8.369 4.115
447 HA LEU 56 HA LEU 56 3.728 -8.590 1.626
448 HB2 LEU 56 2HB LEU 56 4.637 -7.695 4.355
449 HB3 LEU 56 1HB LEU 56 5.626 -7.610 2.910
450 HG LEU 56 HG LEU 56 3.034 -6.127 3.364
451 HD11 LEU 56 1HD1 LEU 56 4.877 -5.245 4.692
452 HD12 LEU 56 2HD1 LEU 56 4.457 -4.136 3.386
453 HD13 LEU 56 3HD1 LEU 56 5.889 -5.158 3.251
454 HD21 LEU 56 3HD2 LEU 56 3.343 -6.731 1.019
455 HD22 LEU 56 1HD2 LEU 56 4.959 -6.028 1.045
456 HD23 LEU 56 2HD2 LEU 56 3.547 -4.996 1.265
457 H ASP 57 HN ASP 57 3.641 -10.432 4.577
458 HA ASP 57 HA ASP 57 6.107 -11.622 4.688
459 HB2 ASP 57 2HB ASP 57 4.049 -11.899 6.235
460 HB3 ASP 57 1HB ASP 57 3.621 -13.237 5.186
461 HA PRO 58 HA PRO 58 4.865 -15.171 1.702
462 HB2 PRO 58 2HB PRO 58 2.618 -14.971 0.218
463 HB3 PRO 58 1HB PRO 58 2.626 -15.655 1.847
464 HG2 PRO 58 2HG PRO 58 1.840 -12.913 0.948
465 HG3 PRO 58 1HG PRO 58 1.042 -13.978 2.121
466 HD2 PRO 58 2HD PRO 58 2.664 -11.918 2.852
467 HD3 PRO 58 1HD PRO 58 2.481 -13.392 3.821
468 H ILE 59 HN ILE 59 4.544 -11.844 0.888
469 HA ILE 59 HA ILE 59 4.959 -12.228 -1.944
470 HB ILE 59 HB ILE 59 5.169 -9.657 -0.368
471 HG12 ILE 59 2HG1 ILE 59 2.824 -10.805 -1.901
472 HG13 ILE 59 1HG1 ILE 59 2.943 -10.713 -0.149
473 HG21 ILE 59 1HG2 ILE 59 4.830 -8.573 -2.531
474 HG22 ILE 59 2HG2 ILE 59 4.781 -10.149 -3.321
475 HG23 ILE 59 3HG2 ILE 59 6.270 -9.592 -2.557
476 HD11 ILE 59 3HD1 ILE 59 3.024 -8.266 -0.305
477 HD12 ILE 59 1HD1 ILE 59 1.543 -8.942 -0.984
478 HD13 ILE 59 2HD1 ILE 59 2.833 -8.390 -2.055
479 H TRP 60 HN TRP 60 6.914 -11.547 0.889
480 HA TRP 60 HA TRP 60 9.330 -10.888 -0.391
481 HB2 TRP 60 2HB TRP 60 8.843 -12.325 2.224
482 HB3 TRP 60 1HB TRP 60 10.424 -11.772 1.688
483 HD1 TRP 60 1HD TRP 60 7.659 -10.712 3.792
484 HE1 TRP 60 1HE TRP 60 7.752 -8.187 4.270
485 HE3 TRP 60 3HE TRP 60 11.046 -9.330 0.217
486 HZ2 TRP 60 2HZ TRP 60 9.079 -5.904 3.260
487 HZ3 TRP 60 3HZ TRP 60 11.672 -6.959 0.040
488 HH2 TRP 60 2HH TRP 60 10.708 -5.280 1.530
489 H GLU 61 HN GLU 61 7.661 -13.873 -0.032
490 HA GLU 61 HA GLU 61 9.783 -15.655 -0.592
491 HB2 GLU 61 2HB GLU 61 6.805 -15.744 -0.556
492 HB3 GLU 61 1HB GLU 61 7.661 -17.031 -1.374
493 HG2 GLU 61 2HG GLU 61 8.398 -16.285 1.415
494 HG3 GLU 61 1HG GLU 61 6.990 -17.301 1.107
495 H GLN 62 HN GLN 62 7.299 -14.088 -2.566
496 HA GLN 62 HA GLN 62 8.193 -15.418 -4.950
497 HB2 GLN 62 2HB GLN 62 5.795 -15.091 -4.349
498 HB3 GLN 62 1HB GLN 62 6.022 -13.358 -4.559
499 HG2 GLN 62 2HG GLN 62 6.629 -13.726 -6.878
500 HG3 GLN 62 1HG GLN 62 6.380 -15.455 -6.662
501 HE21 GLN 62 1HE2 GLN 62 4.854 -12.357 -6.945
502 HE22 GLN 62 2HE2 GLN 62 3.243 -12.943 -7.185
503 H LYS 63 HN LYS 63 7.736 -11.999 -3.946
504 HA LYS 63 HA LYS 63 9.755 -11.213 -5.920
505 HB2 LYS 63 2HB LYS 63 7.125 -9.757 -5.725
506 HB3 LYS 63 1HB LYS 63 8.381 -9.563 -6.935
507 HG2 LYS 63 2HG LYS 63 7.878 -11.866 -7.729
508 HG3 LYS 63 1HG LYS 63 6.520 -11.903 -6.603
509 HD2 LYS 63 2HD LYS 63 5.526 -11.240 -8.598
510 HD3 LYS 63 1HD LYS 63 5.799 -9.708 -7.765
511 HE2 LYS 63 2HE LYS 63 6.481 -9.455 -10.048
512 HE3 LYS 63 1HE LYS 63 7.924 -9.468 -9.035
513 HZ1 LYS 63 3HZ LYS 63 8.362 -11.720 -9.646
514 HZ2 LYS 63 1HZ LYS 63 8.110 -10.838 -11.072
515 HZ3 LYS 63 2HZ LYS 63 6.888 -11.848 -10.473
516 HA PRO 64 HA PRO 64 10.549 -9.257 -1.812
517 HB2 PRO 64 2HB PRO 64 13.108 -8.809 -3.268
518 HB3 PRO 64 1HB PRO 64 12.837 -9.365 -1.613
519 HG2 PRO 64 2HG PRO 64 13.554 -11.080 -3.512
520 HG3 PRO 64 1HG PRO 64 12.364 -11.537 -2.279
521 HD2 PRO 64 2HD PRO 64 11.943 -10.800 -5.141
522 HD3 PRO 64 1HD PRO 64 11.086 -11.990 -4.143
523 H GLU 65 HN GLU 65 11.706 -7.882 -4.915
524 HA GLU 65 HA GLU 65 11.748 -5.227 -3.932
525 HB2 GLU 65 2HB GLU 65 13.037 -5.980 -5.917
526 HB3 GLU 65 1HB GLU 65 11.527 -6.116 -6.803
527 HG2 GLU 65 2HG GLU 65 11.130 -3.726 -6.509
528 HG3 GLU 65 1HG GLU 65 12.643 -3.583 -5.618
529 H THR 66 HN THR 66 9.319 -7.167 -5.540
530 HA THR 66 HA THR 66 7.538 -5.014 -6.078
531 HB THR 66 HB THR 66 6.936 -7.972 -5.867
532 HG1 THR 66 1HG THR 66 8.470 -7.514 -7.485
533 HG21 THR 66 3HG2 THR 66 5.379 -5.743 -7.193
534 HG22 THR 66 1HG2 THR 66 4.903 -6.596 -5.723
535 HG23 THR 66 2HG2 THR 66 4.982 -7.460 -7.259
536 H ALA 67 HN ALA 67 7.978 -7.222 -3.375
537 HA ALA 67 HA ALA 67 5.729 -6.483 -1.860
538 HB1 ALA 67 1HB ALA 67 7.153 -8.379 -1.262
539 HB2 ALA 67 2HB ALA 67 6.997 -7.255 0.088
540 HB3 ALA 67 3HB ALA 67 8.474 -7.275 -0.879
541 H SER 68 HN SER 68 8.936 -5.062 -2.180
542 HA SER 68 HA SER 68 8.566 -3.025 -0.239
543 HB2 SER 68 2HB SER 68 10.448 -3.070 -2.614
544 HB3 SER 68 1HB SER 68 10.586 -2.028 -1.197
545 HG SER 68 HG SER 68 10.522 -4.839 -0.951
546 H ARG 69 HN ARG 69 8.103 -3.167 -3.749
547 HA ARG 69 HA ARG 69 7.470 -0.437 -4.081
548 HB2 ARG 69 2HB ARG 69 6.879 -2.853 -5.791
549 HB3 ARG 69 1HB ARG 69 6.570 -1.202 -6.286
550 HG2 ARG 69 2HG ARG 69 8.980 -0.709 -5.992
551 HG3 ARG 69 1HG ARG 69 9.234 -2.420 -5.654
552 HD2 ARG 69 2HD ARG 69 8.052 -1.325 -8.199
553 HD3 ARG 69 1HD ARG 69 9.740 -1.786 -7.996
554 HE ARG 69 HE ARG 69 8.022 -3.936 -7.308
555 HH11 ARG 69 1HH1 ARG 69 9.314 -2.199 -10.043
556 HH12 ARG 69 2HH1 ARG 69 9.179 -3.538 -11.136
557 HH21 ARG 69 1HH2 ARG 69 7.821 -5.731 -8.758
558 HH22 ARG 69 2HH2 ARG 69 8.301 -5.527 -10.418
559 H LEU 70 HN LEU 70 5.523 -3.301 -3.426
560 HA LEU 70 HA LEU 70 2.997 -2.034 -3.646
561 HB2 LEU 70 2HB LEU 70 3.247 -4.475 -3.592
562 HB3 LEU 70 1HB LEU 70 3.833 -4.388 -1.942
563 HG LEU 70 HG LEU 70 1.622 -3.467 -1.256
564 HD11 LEU 70 1HD1 LEU 70 -0.266 -3.685 -2.788
565 HD12 LEU 70 2HD1 LEU 70 0.832 -4.166 -4.081
566 HD13 LEU 70 3HD1 LEU 70 0.928 -2.541 -3.399
567 HD21 LEU 70 3HD2 LEU 70 2.130 -5.825 -0.983
568 HD22 LEU 70 1HD2 LEU 70 1.587 -6.148 -2.632
569 HD23 LEU 70 2HD2 LEU 70 0.433 -5.605 -1.415
570 H ARG 71 HN ARG 71 5.196 -2.584 -0.933
571 HA ARG 71 HA ARG 71 3.644 -1.408 1.085
572 HB2 ARG 71 2HB ARG 71 5.563 -2.771 1.627
573 HB3 ARG 71 1HB ARG 71 6.643 -1.678 0.782
574 HG2 ARG 71 2HG ARG 71 5.060 -0.552 3.015
575 HG3 ARG 71 1HG ARG 71 6.370 -1.664 3.424
576 HD2 ARG 71 2HD ARG 71 7.993 -0.293 2.430
577 HD3 ARG 71 1HD ARG 71 6.787 0.638 1.542
578 HE ARG 71 HE ARG 71 6.812 0.780 4.472
579 HH11 ARG 71 1HH1 ARG 71 7.423 2.287 1.377
580 HH12 ARG 71 2HH1 ARG 71 7.475 3.900 2.013
581 HH21 ARG 71 1HH2 ARG 71 6.887 2.890 5.333
582 HH22 ARG 71 2HH2 ARG 71 7.133 4.252 4.273
583 H GLY 72 HN GLY 72 5.922 -0.038 -1.205
584 HA2 GLY 72 2HA GLY 72 6.097 2.553 -0.152
585 HA3 GLY 72 1HA GLY 72 6.357 2.123 -1.835
586 H ARG 73 HN ARG 73 3.789 1.233 -2.532
587 HA ARG 73 HA ARG 73 2.507 3.764 -2.865
588 HB2 ARG 73 2HB ARG 73 0.816 2.582 -4.163
589 HB3 ARG 73 1HB ARG 73 2.435 2.122 -4.664
590 HG2 ARG 73 2HG ARG 73 2.232 0.042 -3.405
591 HG3 ARG 73 1HG ARG 73 0.604 0.507 -2.904
592 HD2 ARG 73 2HD ARG 73 0.499 -1.023 -4.782
593 HD3 ARG 73 1HD ARG 73 -0.087 0.570 -5.258
594 HE ARG 73 HE ARG 73 2.671 0.328 -5.846
595 HH11 ARG 73 1HH1 ARG 73 -0.477 -0.710 -6.958
596 HH12 ARG 73 2HH1 ARG 73 0.045 -0.988 -8.592
597 HH21 ARG 73 1HH2 ARG 73 3.365 0.008 -7.992
598 HH22 ARG 73 2HH2 ARG 73 2.232 -0.565 -9.180
599 H ILE 74 HN ILE 74 1.974 0.969 -0.811
600 HA ILE 74 HA ILE 74 -0.564 1.620 0.179
601 HB ILE 74 HB ILE 74 1.728 0.184 1.528
602 HG12 ILE 74 2HG1 ILE 74 -0.797 -0.848 0.219
603 HG13 ILE 74 1HG1 ILE 74 0.813 -0.887 -0.499
604 HG21 ILE 74 1HG2 ILE 74 -1.156 0.307 2.408
605 HG22 ILE 74 2HG2 ILE 74 0.196 1.117 3.202
606 HG23 ILE 74 3HG2 ILE 74 0.129 -0.645 3.151
607 HD11 ILE 74 3HD1 ILE 74 -0.045 -2.333 2.002
608 HD12 ILE 74 1HD1 ILE 74 1.569 -2.366 1.290
609 HD13 ILE 74 2HD1 ILE 74 0.202 -3.050 0.410
610 H GLU 75 HN GLU 75 2.662 2.669 1.183
611 HA GLU 75 HA GLU 75 2.046 4.104 3.475
612 HB2 GLU 75 2HB GLU 75 4.339 3.692 2.670
613 HB3 GLU 75 1HB GLU 75 4.069 4.796 1.332
614 HG2 GLU 75 2HG GLU 75 3.669 6.599 3.027
615 HG3 GLU 75 1HG GLU 75 4.219 5.464 4.257
616 H SER 76 HN SER 76 2.048 5.177 0.104
617 HA SER 76 HA SER 76 1.323 7.838 0.573
618 HB2 SER 76 2HB SER 76 0.875 6.125 -1.861
619 HB3 SER 76 1HB SER 76 0.730 7.880 -1.823
620 HG SER 76 HG SER 76 2.898 6.535 -2.302
621 H VAL 77 HN VAL 77 -0.632 4.951 0.134
622 HA VAL 77 HA VAL 77 -3.116 6.323 -0.145
623 HB VAL 77 HB VAL 77 -2.580 3.460 0.669
624 HG11 VAL 77 1HG1 VAL 77 -4.800 4.187 1.371
625 HG12 VAL 77 2HG1 VAL 77 -4.913 3.045 0.031
626 HG13 VAL 77 3HG1 VAL 77 -5.136 4.770 -0.259
627 HG21 VAL 77 3HG2 VAL 77 -3.283 4.652 -2.014
628 HG22 VAL 77 1HG2 VAL 77 -3.108 2.931 -1.662
629 HG23 VAL 77 2HG2 VAL 77 -1.710 4.001 -1.547
630 H LEU 78 HN LEU 78 -1.538 4.670 2.576
631 HA LEU 78 HA LEU 78 -3.668 5.041 4.385
632 HB2 LEU 78 2HB LEU 78 -0.738 4.546 4.877
633 HB3 LEU 78 1HB LEU 78 -1.958 4.531 6.137
634 HG LEU 78 HG LEU 78 -1.855 2.654 3.773
635 HD11 LEU 78 1HD1 LEU 78 -1.347 0.950 5.472
636 HD12 LEU 78 2HD1 LEU 78 -1.263 2.216 6.698
637 HD13 LEU 78 3HD1 LEU 78 -0.095 2.188 5.377
638 HD21 LEU 78 3HD2 LEU 78 -3.666 1.471 4.931
639 HD22 LEU 78 1HD2 LEU 78 -4.141 3.104 4.462
640 HD23 LEU 78 2HD2 LEU 78 -3.721 2.755 6.139
641 H ASP 79 HN ASP 79 -0.736 6.961 3.790
642 HA ASP 79 HA ASP 79 -1.239 8.787 5.910
643 HB2 ASP 79 2HB ASP 79 0.675 8.621 3.675
644 HB3 ASP 79 1HB ASP 79 0.297 10.255 4.214
645 H TRP 80 HN TRP 80 -2.309 8.612 2.593
646 HA TRP 80 HA TRP 80 -3.343 11.258 2.445
647 HB2 TRP 80 2HB TRP 80 -2.946 9.944 0.423
648 HB3 TRP 80 1HB TRP 80 -4.144 8.762 0.933
649 HD1 TRP 80 1HD TRP 80 -3.955 12.470 -0.153
650 HE1 TRP 80 1HE TRP 80 -6.204 13.112 -1.231
651 HE3 TRP 80 3HE TRP 80 -6.514 8.125 0.688
652 HZ2 TRP 80 2HZ TRP 80 -8.728 11.916 -1.672
653 HZ3 TRP 80 3HZ TRP 80 -8.839 7.957 -0.098
654 HH2 TRP 80 2HH TRP 80 -9.921 9.814 -1.251
655 H ALA 81 HN ALA 81 -4.683 8.139 3.397
656 HA ALA 81 HA ALA 81 -7.331 8.917 3.863
657 HB1 ALA 81 1HB ALA 81 -5.693 6.839 5.317
658 HB2 ALA 81 2HB ALA 81 -6.631 6.581 3.845
659 HB3 ALA 81 3HB ALA 81 -7.451 6.974 5.357
660 H THR 82 HN THR 82 -4.440 9.130 5.867
661 HA THR 82 HA THR 82 -5.645 10.063 8.225
662 HB THR 82 HB THR 82 -2.890 10.747 7.192
663 HG1 THR 82 1HG THR 82 -2.249 8.844 8.250
664 HG21 THR 82 3HG2 THR 82 -3.570 12.092 9.118
665 HG22 THR 82 1HG2 THR 82 -2.320 10.931 9.575
666 HG23 THR 82 2HG2 THR 82 -4.004 10.626 9.998
667 H VAL 83 HN VAL 83 -4.372 11.799 5.400
668 HA VAL 83 HA VAL 83 -4.823 14.412 6.339
669 HB VAL 83 HB VAL 83 -4.875 13.421 3.479
670 HG11 VAL 83 1HG1 VAL 83 -5.899 15.623 3.703
671 HG12 VAL 83 2HG1 VAL 83 -4.348 15.737 2.870
672 HG13 VAL 83 3HG1 VAL 83 -4.476 16.210 4.565
673 HG21 VAL 83 3HG2 VAL 83 -2.604 14.533 5.129
674 HG22 VAL 83 1HG2 VAL 83 -2.531 14.144 3.410
675 HG23 VAL 83 2HG2 VAL 83 -2.788 12.862 4.592
676 H ARG 84 HN ARG 84 -6.885 12.124 4.617
677 HA ARG 84 HA ARG 84 -9.104 13.933 4.407
678 HB2 ARG 84 2HB ARG 84 -8.718 11.007 3.898
679 HB3 ARG 84 1HB ARG 84 -10.333 11.696 3.920
680 HG2 ARG 84 2HG ARG 84 -8.081 12.542 2.113
681 HG3 ARG 84 1HG ARG 84 -9.465 11.546 1.657
682 HD2 ARG 84 2HD ARG 84 -10.844 13.565 2.575
683 HD3 ARG 84 1HD ARG 84 -9.348 14.457 2.306
684 HE ARG 84 HE ARG 84 -10.459 12.887 0.104
685 HH11 ARG 84 1HH1 ARG 84 -9.699 16.013 1.499
686 HH12 ARG 84 2HH1 ARG 84 -10.123 16.890 0.058
687 HH21 ARG 84 1HH2 ARG 84 -10.973 14.024 -1.786
688 HH22 ARG 84 2HH2 ARG 84 -10.793 15.754 -1.835
689 H GLY 85 HN GLY 85 -7.803 12.305 7.007
690 HA2 GLY 85 2HA GLY 85 -8.556 12.238 9.189
691 HA3 GLY 85 1HA GLY 85 -10.069 12.949 8.650
692 H TYR 86 HN TYR 86 -8.807 10.028 7.208
693 HA TYR 86 HA TYR 86 -11.120 8.551 8.143
694 HB2 TYR 86 2HB TYR 86 -8.871 7.922 6.249
695 HB3 TYR 86 1HB TYR 86 -9.928 6.647 6.845
696 HD1 TYR 86 1HD TYR 86 -12.422 6.870 6.423
697 HD2 TYR 86 2HD TYR 86 -9.522 9.267 4.446
698 HE1 TYR 86 1HE TYR 86 -14.057 7.381 4.661
699 HE2 TYR 86 2HE TYR 86 -11.150 9.791 2.678
700 HH TYR 86 HH TYR 86 -14.490 9.064 2.998
701 H ARG 87 HN ARG 87 -7.780 8.893 8.928
702 HA ARG 87 HA ARG 87 -8.128 7.096 11.181
703 HB2 ARG 87 2HB ARG 87 -5.899 6.024 10.718
704 HB3 ARG 87 1HB ARG 87 -7.198 5.552 9.633
705 HG2 ARG 87 2HG ARG 87 -6.248 6.572 7.829
706 HG3 ARG 87 1HG ARG 87 -5.451 7.807 8.804
707 HD2 ARG 87 2HD ARG 87 -3.959 6.062 7.711
708 HD3 ARG 87 1HD ARG 87 -3.721 6.343 9.433
709 HE ARG 87 HE ARG 87 -5.204 4.041 8.328
710 HH11 ARG 87 1HH1 ARG 87 -3.108 5.496 10.718
711 HH12 ARG 87 2HH1 ARG 87 -2.911 4.029 11.634
712 HH21 ARG 87 1HH2 ARG 87 -4.930 2.089 9.515
713 HH22 ARG 87 2HH2 ARG 87 -3.931 2.092 10.933
714 H GLU 88 HN GLU 88 -6.018 7.138 12.516
715 HA GLU 88 HA GLU 88 -5.438 9.886 13.090
716 HB2 GLU 88 2HB GLU 88 -4.612 7.273 14.342
717 HB3 GLU 88 1HB GLU 88 -3.949 8.808 14.884
718 HG2 GLU 88 2HG GLU 88 -5.811 8.018 16.276
719 HG3 GLU 88 1HG GLU 88 -6.133 9.580 15.530
720 H GLY 89 HN GLY 89 -3.097 10.476 13.585
721 HA2 GLY 89 2HA GLY 89 -1.734 10.385 11.082
722 HA3 GLY 89 1HA GLY 89 -1.193 11.211 12.532
723 H ASP 90 HN ASP 90 0.656 10.136 11.035
724 HA ASP 90 HA ASP 90 2.453 8.815 10.930
725 HB2 ASP 90 2HB ASP 90 2.514 9.240 13.370
726 HB3 ASP 90 1HB ASP 90 1.628 7.744 13.616
727 H ASN 91 HN ASN 91 2.847 7.098 9.810
728 HA ASN 91 HA ASN 91 0.514 5.545 9.067
729 HB2 ASN 91 2HB ASN 91 2.135 6.754 7.502
730 HB3 ASN 91 1HB ASN 91 3.285 5.478 7.861
731 HD21 ASN 91 1HD2 ASN 91 1.816 6.411 5.423
732 HD22 ASN 91 2HD2 ASN 91 1.130 4.963 4.758
733 HA PRO 92 HA PRO 92 1.908 1.838 11.184
734 HB2 PRO 92 2HB PRO 92 0.224 0.077 10.000
735 HB3 PRO 92 1HB PRO 92 -0.303 1.208 11.254
736 HG2 PRO 92 2HG PRO 92 -0.584 1.404 8.278
737 HG3 PRO 92 1HG PRO 92 -1.770 1.776 9.545
738 HD2 PRO 92 2HD PRO 92 -0.318 3.692 8.284
739 HD3 PRO 92 1HD PRO 92 -0.852 3.843 9.971
740 H ALA 93 HN ALA 93 1.876 2.281 7.733
741 HA ALA 93 HA ALA 93 3.493 -0.120 7.275
742 HB1 ALA 93 1HB ALA 93 1.644 0.346 5.724
743 HB2 ALA 93 2HB ALA 93 3.205 0.367 4.901
744 HB3 ALA 93 3HB ALA 93 2.395 1.883 5.299
745 H ARG 94 HN ARG 94 4.229 2.604 8.554
746 HA ARG 94 HA ARG 94 6.052 3.917 6.847
747 HB2 ARG 94 2HB ARG 94 4.948 4.887 8.856
748 HB3 ARG 94 1HB ARG 94 5.990 3.894 9.864
749 HG2 ARG 94 2HG ARG 94 7.939 5.049 9.072
750 HG3 ARG 94 1HG ARG 94 6.963 5.970 7.919
751 HD2 ARG 94 2HD ARG 94 5.679 6.877 9.849
752 HD3 ARG 94 1HD ARG 94 6.815 6.070 10.928
753 HE ARG 94 HE ARG 94 8.402 7.574 9.319
754 HH11 ARG 94 1HH1 ARG 94 5.579 8.260 11.284
755 HH12 ARG 94 2HH1 ARG 94 6.088 9.883 11.669
756 HH21 ARG 94 1HH2 ARG 94 9.090 9.684 9.844
757 HH22 ARG 94 2HH2 ARG 94 8.102 10.679 10.875
758 H TRP 95 HN TRP 95 6.947 2.283 9.871
759 HA TRP 95 HA TRP 95 8.601 0.864 10.439
760 HB2 TRP 95 2HB TRP 95 8.589 0.382 7.493
761 HB3 TRP 95 1HB TRP 95 9.921 -0.246 8.458
762 HD1 TRP 95 1HD TRP 95 8.826 -1.603 10.822
763 HE1 TRP 95 1HE TRP 95 7.087 -3.493 10.740
764 HE3 TRP 95 3HE TRP 95 6.831 -0.658 6.212
765 HZ2 TRP 95 2HZ TRP 95 5.120 -4.458 8.948
766 HZ3 TRP 95 3HZ TRP 95 5.026 -2.114 5.387
767 HH2 TRP 95 2HH TRP 95 4.192 -3.975 6.729
768 H ARG 96 HN ARG 96 10.508 1.273 11.233
769 HA ARG 96 HA ARG 96 12.189 3.305 9.967
770 HB2 ARG 96 2HB ARG 96 12.258 2.036 12.709
771 HB3 ARG 96 1HB ARG 96 13.423 3.214 12.136
772 HG2 ARG 96 2HG ARG 96 11.689 4.891 11.950
773 HG3 ARG 96 1HG ARG 96 10.471 3.707 12.436
774 HD2 ARG 96 2HD ARG 96 11.157 5.163 14.299
775 HD3 ARG 96 1HD ARG 96 11.523 3.466 14.605
776 HE ARG 96 HE ARG 96 13.549 5.438 13.731
777 HH11 ARG 96 1HH1 ARG 96 12.580 2.679 15.675
778 HH12 ARG 96 2HH1 ARG 96 14.134 2.511 16.434
779 HH21 ARG 96 1HH2 ARG 96 15.581 5.212 14.706
780 HH22 ARG 96 2HH2 ARG 96 15.856 3.948 15.876
781 H GLY 97 HN GLY 97 12.039 -0.028 10.914
782 HA2 GLY 97 2HA GLY 97 14.235 -0.713 9.185
783 HA3 GLY 97 1HA GLY 97 14.602 -0.915 10.894
784 H TYR 98 HN TYR 98 12.219 -1.804 8.419
785 HA TYR 98 HA TYR 98 11.194 -4.033 9.871
786 HB2 TYR 98 2HB TYR 98 9.936 -2.914 8.064
787 HB3 TYR 98 1HB TYR 98 11.131 -3.459 6.895
788 HD1 TYR 98 2HD TYR 98 8.887 -4.904 9.519
789 HD2 TYR 98 1HD TYR 98 10.618 -5.329 5.658
790 HE1 TYR 98 2HE TYR 98 7.595 -6.967 9.174
791 HE2 TYR 98 1HE TYR 98 9.331 -7.393 5.302
792 HH TYR 98 HH TYR 98 6.772 -8.346 7.355
793 H LEU 99 HN LEU 99 13.200 -3.943 6.924
794 HA LEU 99 HA LEU 99 14.547 -6.381 7.843
795 HB2 LEU 99 2HB LEU 99 14.529 -5.053 5.128
796 HB3 LEU 99 1HB LEU 99 15.412 -6.510 5.524
797 HG LEU 99 HG LEU 99 12.407 -6.215 5.529
798 HD11 LEU 99 1HD1 LEU 99 13.396 -6.241 3.290
799 HD12 LEU 99 2HD1 LEU 99 12.474 -7.709 3.613
800 HD13 LEU 99 3HD1 LEU 99 14.237 -7.741 3.680
801 HD21 LEU 99 3HD2 LEU 99 14.114 -8.652 6.027
802 HD22 LEU 99 1HD2 LEU 99 12.353 -8.610 5.948
803 HD23 LEU 99 2HD2 LEU 99 13.197 -7.774 7.251
804 H GLU 100 HN GLU 100 14.943 -3.051 6.986
805 HA GLU 100 HA GLU 100 17.184 -2.617 8.593
806 HB2 GLU 100 2HB GLU 100 18.117 -3.939 6.516
807 HB3 GLU 100 1HB GLU 100 17.948 -2.392 5.697
808 HG2 GLU 100 2HG GLU 100 19.454 -1.346 7.241
809 HG3 GLU 100 1HG GLU 100 19.529 -2.810 8.222
810 H HIS 101 HN HIS 101 18.168 -0.319 7.837
811 HA HIS 101 HA HIS 101 15.790 1.327 7.524
812 HB2 HIS 101 2HB HIS 101 17.288 3.230 8.179
813 HB3 HIS 101 1HB HIS 101 17.130 1.968 9.390
814 HD1 HIS 101 1HD HIS 101 19.592 4.002 7.774
815 HD2 HIS 101 2HD HIS 101 19.489 0.138 9.305
816 HE1 HIS 101 1HE HIS 101 21.996 3.345 8.131
817 HE2 HIS 101 2HE HIS 101 21.875 1.117 9.310
818 H HIS 102 HN HIS 102 15.933 0.348 5.240
819 HA HIS 102 HA HIS 102 17.698 1.532 3.355
820 HB2 HIS 102 2HB HIS 102 16.217 -0.598 3.130
821 HB3 HIS 102 1HB HIS 102 14.940 0.523 2.678
822 HD1 HIS 102 1HD HIS 102 17.532 -1.485 1.246
823 HD2 HIS 102 2HD HIS 102 15.817 2.197 0.343
824 HE1 HIS 102 1HE HIS 102 18.110 -1.033 -1.160
825 HE2 HIS 102 2HE HIS 102 17.285 1.308 -1.589
826 H HIS 103 HN HIS 103 17.712 3.584 2.717
827 HA HIS 103 HA HIS 103 15.240 5.146 3.095
828 HB2 HIS 103 2HB HIS 103 16.788 7.090 3.641
829 HB3 HIS 103 1HB HIS 103 16.651 5.823 4.852
830 HD1 HIS 103 1HD HIS 103 18.735 4.176 5.048
831 HD2 HIS 103 2HD HIS 103 19.331 7.582 2.737
832 HE1 HIS 103 1HE HIS 103 21.229 4.413 4.820
833 HE2 HIS 103 2HE HIS 103 21.561 6.612 3.631
834 H HIS 104 HN HIS 104 17.020 7.477 2.119
835 HA HIS 104 HA HIS 104 15.978 7.596 -0.481
836 HB2 HIS 104 2HB HIS 104 16.432 9.578 0.828
837 HB3 HIS 104 1HB HIS 104 18.147 9.206 0.869
838 HD1 HIS 104 1HD HIS 104 18.950 11.309 -0.240
839 HD2 HIS 104 2HD HIS 104 16.100 9.294 -2.505
840 HE1 HIS 104 1HE HIS 104 18.931 12.450 -2.482
841 HE2 HIS 104 2HE HIS 104 17.284 11.152 -3.873
842 H HIS 105 HN HIS 105 16.763 5.493 -1.233
843 HA HIS 105 HA HIS 105 18.528 5.801 -3.342
844 HB2 HIS 105 2HB HIS 105 19.973 5.353 -0.959
845 HB3 HIS 105 1HB HIS 105 19.976 3.817 -1.818
846 HD1 HIS 105 1HD HIS 105 20.788 4.052 -4.452
847 HD2 HIS 105 2HD HIS 105 21.863 7.086 -1.813
848 HE1 HIS 105 1HE HIS 105 22.678 5.284 -5.565
849 HE2 HIS 105 2HE HIS 105 23.163 7.234 -4.042
850 H HIS 106 HN HIS 106 16.836 4.742 -4.366
851 HA HIS 106 HA HIS 106 16.027 2.123 -3.404
852 HB2 HIS 106 2HB HIS 106 15.051 3.831 -5.693
853 HB3 HIS 106 1HB HIS 106 14.453 2.203 -5.392
854 HD1 HIS 106 1HD HIS 106 12.809 1.879 -3.444
855 HD2 HIS 106 2HD HIS 106 14.233 5.775 -3.809
856 HE1 HIS 106 1HE HIS 106 11.376 3.273 -1.921
857 HE2 HIS 106 2HE HIS 106 12.172 5.642 -2.243
Start of MODEL 19
1 H1 MET 1 H1 MET 1 -15.486 5.457 5.901
2 H2 MET 1 H2 MET 1 -14.514 4.381 6.785
3 H3 MET 1 H3 MET 1 -15.773 3.789 5.819
4 HA MET 1 HA MET 1 -14.680 4.453 3.829
5 HB2 MET 1 2HB MET 1 -13.641 6.508 4.636
6 HB3 MET 1 1HB MET 1 -12.574 5.585 5.688
7 HG2 MET 1 2HG MET 1 -11.358 6.302 3.741
8 HG3 MET 1 1HG MET 1 -11.550 4.553 3.702
9 HE1 MET 1 2HE MET 1 -13.988 7.490 1.104
10 HE2 MET 1 3HE MET 1 -12.707 7.983 2.213
11 HE3 MET 1 1HE MET 1 -14.220 7.335 2.846
12 H THR 2 HN THR 2 -13.848 2.676 2.892
13 HA THR 2 HA THR 2 -12.285 0.855 4.595
14 HB THR 2 HB THR 2 -12.741 -0.866 2.851
15 HG1 THR 2 1HG THR 2 -14.610 1.016 1.792
16 HG21 THR 2 3HG2 THR 2 -15.110 -1.193 3.412
17 HG22 THR 2 1HG2 THR 2 -15.193 0.465 4.005
18 HG23 THR 2 2HG2 THR 2 -14.171 -0.714 4.826
19 H PHE 3 HN PHE 3 -10.533 -0.360 3.403
20 HA PHE 3 HA PHE 3 -8.652 1.522 2.447
21 HB2 PHE 3 2HB PHE 3 -8.045 -0.569 3.635
22 HB3 PHE 3 1HB PHE 3 -8.566 -1.495 2.234
23 HD1 PHE 3 2HD PHE 3 -6.157 1.124 3.291
24 HD2 PHE 3 1HD PHE 3 -7.068 -1.968 0.514
25 HE1 PHE 3 2HE PHE 3 -3.905 1.333 2.322
26 HE2 PHE 3 1HE PHE 3 -4.818 -1.762 -0.459
27 HZ PHE 3 HZ PHE 3 -3.231 -0.110 0.445
28 H SER 4 HN SER 4 -10.663 -0.888 0.837
29 HA SER 4 HA SER 4 -9.661 -0.625 -1.758
30 HB2 SER 4 2HB SER 4 -11.214 -2.411 -1.053
31 HB3 SER 4 1HB SER 4 -12.505 -1.220 -0.898
32 HG SER 4 HG SER 4 -12.831 -1.935 -2.892
33 H GLU 5 HN GLU 5 -12.313 1.122 -0.155
34 HA GLU 5 HA GLU 5 -13.045 2.752 -2.315
35 HB2 GLU 5 2HB GLU 5 -13.240 3.162 0.663
36 HB3 GLU 5 1HB GLU 5 -13.939 4.266 -0.502
37 HG2 GLU 5 2HG GLU 5 -15.390 2.524 -1.335
38 HG3 GLU 5 1HG GLU 5 -14.641 1.358 -0.246
39 H CYS 6 HN CYS 6 -10.825 3.330 0.378
40 HA CYS 6 HA CYS 6 -10.203 6.001 -0.262
41 HB2 CYS 6 2HB CYS 6 -9.805 4.845 1.926
42 HB3 CYS 6 1HB CYS 6 -8.451 4.016 1.188
43 HG CYS 6 HG CYS 6 -7.611 6.888 0.449
44 H ALA 7 HN ALA 7 -8.498 2.977 -0.926
45 HA ALA 7 HA ALA 7 -6.304 4.013 -2.298
46 HB1 ALA 7 1HB ALA 7 -7.705 1.388 -2.791
47 HB2 ALA 7 2HB ALA 7 -6.452 1.684 -1.586
48 HB3 ALA 7 3HB ALA 7 -6.069 1.800 -3.304
49 H ALA 8 HN ALA 8 -9.467 2.996 -3.551
50 HA ALA 8 HA ALA 8 -8.950 3.544 -6.262
51 HB1 ALA 8 1HB ALA 8 -10.829 2.169 -5.522
52 HB2 ALA 8 2HB ALA 8 -11.370 3.493 -6.553
53 HB3 ALA 8 3HB ALA 8 -11.592 3.589 -4.805
54 H LEU 9 HN LEU 9 -10.360 5.553 -3.690
55 HA LEU 9 HA LEU 9 -10.941 7.786 -5.306
56 HB2 LEU 9 2HB LEU 9 -10.309 7.624 -2.359
57 HB3 LEU 9 1HB LEU 9 -10.888 9.069 -3.159
58 HG LEU 9 HG LEU 9 -12.401 6.468 -2.911
59 HD11 LEU 9 1HD1 LEU 9 -13.888 7.752 -1.457
60 HD12 LEU 9 2HD1 LEU 9 -12.825 9.150 -1.603
61 HD13 LEU 9 3HD1 LEU 9 -12.250 7.685 -0.808
62 HD21 LEU 9 3HD2 LEU 9 -13.221 9.103 -4.131
63 HD22 LEU 9 1HD2 LEU 9 -14.271 7.706 -3.886
64 HD23 LEU 9 2HD2 LEU 9 -12.914 7.602 -5.006
65 H TYR 10 HN TYR 10 -8.048 6.867 -3.510
66 HA TYR 10 HA TYR 10 -6.527 9.183 -3.846
67 HB2 TYR 10 2HB TYR 10 -5.819 7.384 -2.383
68 HB3 TYR 10 1HB TYR 10 -5.673 6.282 -3.744
69 HD1 TYR 10 2HD TYR 10 -4.212 9.312 -2.192
70 HD2 TYR 10 1HD TYR 10 -3.677 6.164 -5.002
71 HE1 TYR 10 2HE TYR 10 -1.846 9.934 -2.431
72 HE2 TYR 10 1HE TYR 10 -1.311 6.777 -5.248
73 HH TYR 10 HH TYR 10 0.268 8.915 -3.122
74 H ILE 11 HN ILE 11 -6.727 6.308 -5.893
75 HA ILE 11 HA ILE 11 -4.933 7.261 -7.870
76 HB ILE 11 HB ILE 11 -7.056 5.116 -8.074
77 HG12 ILE 11 2HG1 ILE 11 -4.088 4.867 -7.520
78 HG13 ILE 11 1HG1 ILE 11 -5.339 4.789 -6.286
79 HG21 ILE 11 1HG2 ILE 11 -4.665 5.665 -9.827
80 HG22 ILE 11 2HG2 ILE 11 -6.356 5.884 -10.273
81 HG23 ILE 11 3HG2 ILE 11 -5.732 4.266 -9.957
82 HD11 ILE 11 3HD1 ILE 11 -5.045 2.887 -8.595
83 HD12 ILE 11 1HD1 ILE 11 -6.256 2.794 -7.318
84 HD13 ILE 11 2HD1 ILE 11 -4.548 2.576 -6.932
85 H LYS 12 HN LYS 12 -8.483 7.160 -7.692
86 HA LYS 12 HA LYS 12 -8.906 8.232 -10.267
87 HB2 LYS 12 2HB LYS 12 -10.666 8.031 -7.834
88 HB3 LYS 12 1HB LYS 12 -11.229 8.752 -9.336
89 HG2 LYS 12 2HG LYS 12 -10.825 6.675 -10.519
90 HG3 LYS 12 1HG LYS 12 -10.177 5.943 -9.052
91 HD2 LYS 12 2HD LYS 12 -12.494 5.252 -9.470
92 HD3 LYS 12 1HD LYS 12 -12.344 6.160 -7.964
93 HE2 LYS 12 2HE LYS 12 -13.204 8.146 -9.024
94 HE3 LYS 12 1HE LYS 12 -13.221 7.345 -10.595
95 HZ1 LYS 12 3HZ LYS 12 -15.017 6.048 -10.014
96 HZ2 LYS 12 1HZ LYS 12 -15.393 7.515 -9.250
97 HZ3 LYS 12 2HZ LYS 12 -14.764 6.222 -8.345
98 H ALA 13 HN ALA 13 -8.435 9.784 -7.136
99 HA ALA 13 HA ALA 13 -9.267 12.366 -8.040
100 HB1 ALA 13 1HB ALA 13 -7.560 11.651 -5.661
101 HB2 ALA 13 2HB ALA 13 -9.319 11.759 -5.672
102 HB3 ALA 13 3HB ALA 13 -8.346 13.201 -5.950
103 H HIS 14 HN HIS 14 -6.215 10.646 -7.968
104 HA HIS 14 HA HIS 14 -4.791 13.073 -8.773
105 HB2 HIS 14 2HB HIS 14 -4.009 11.315 -6.978
106 HB3 HIS 14 1HB HIS 14 -3.451 10.419 -8.383
107 HD1 HIS 14 1HD HIS 14 -2.089 12.476 -5.941
108 HD2 HIS 14 2HD HIS 14 -1.857 12.522 -10.098
109 HE1 HIS 14 1HE HIS 14 -0.009 13.776 -6.497
110 HE2 HIS 14 2HE HIS 14 0.162 13.713 -9.011
111 H ARG 15 HN ARG 15 -6.529 10.787 -10.319
112 HA ARG 15 HA ARG 15 -4.752 9.838 -12.301
113 HB2 ARG 15 2HB ARG 15 -6.638 8.954 -13.419
114 HB3 ARG 15 1HB ARG 15 -6.994 8.832 -11.705
115 HG2 ARG 15 2HG ARG 15 -8.387 10.841 -11.862
116 HG3 ARG 15 1HG ARG 15 -8.047 10.930 -13.589
117 HD2 ARG 15 2HD ARG 15 -9.487 8.719 -12.131
118 HD3 ARG 15 1HD ARG 15 -10.199 9.889 -13.238
119 HE ARG 15 HE ARG 15 -8.169 8.492 -14.582
120 HH11 ARG 15 1HH1 ARG 15 -11.394 8.006 -13.288
121 HH12 ARG 15 2HH1 ARG 15 -11.767 6.694 -14.370
122 HH21 ARG 15 1HH2 ARG 15 -8.650 6.740 -15.989
123 HH22 ARG 15 2HH2 ARG 15 -10.219 5.984 -15.903
124 H SER 16 HN SER 16 -6.505 12.784 -11.934
125 HA SER 16 HA SER 16 -6.602 13.720 -14.550
126 HB2 SER 16 2HB SER 16 -7.697 14.871 -12.682
127 HB3 SER 16 1HB SER 16 -6.124 15.289 -12.000
128 HG SER 16 HG SER 16 -7.289 16.919 -13.357
129 H SER 17 HN SER 17 -3.979 13.846 -12.185
130 HA SER 17 HA SER 17 -2.223 15.213 -14.026
131 HB2 SER 17 2HB SER 17 -1.644 14.067 -11.288
132 HB3 SER 17 1HB SER 17 -0.678 15.237 -12.174
133 HG SER 17 HG SER 17 -2.973 16.362 -12.113
134 H TRP 18 HN TRP 18 -3.192 12.087 -13.509
135 HA TRP 18 HA TRP 18 -0.614 10.893 -14.212
136 HB2 TRP 18 2HB TRP 18 -3.151 9.766 -13.057
137 HB3 TRP 18 1HB TRP 18 -1.924 8.722 -13.757
138 HD1 TRP 18 1HD TRP 18 0.030 11.318 -12.198
139 HE1 TRP 18 1HE TRP 18 0.800 10.655 -9.827
140 HE3 TRP 18 3HE TRP 18 -3.136 7.383 -11.402
141 HZ2 TRP 18 2HZ TRP 18 0.135 8.713 -7.885
142 HZ3 TRP 18 3HZ TRP 18 -3.004 6.176 -9.267
143 HH2 TRP 18 2HH TRP 18 -1.404 6.827 -7.542
144 H LYS 19 HN LYS 19 -2.465 12.356 -16.092
145 HA LYS 19 HA LYS 19 -2.895 12.236 -18.242
146 HB2 LYS 19 2HB LYS 19 -1.404 9.644 -18.138
147 HB3 LYS 19 1HB LYS 19 -2.002 10.383 -19.622
148 HG2 LYS 19 2HG LYS 19 -0.684 12.456 -18.380
149 HG3 LYS 19 1HG LYS 19 0.322 11.057 -18.008
150 HD2 LYS 19 2HD LYS 19 -0.621 11.684 -20.795
151 HD3 LYS 19 1HD LYS 19 0.872 12.341 -20.130
152 HE2 LYS 19 2HE LYS 19 1.636 10.025 -19.695
153 HE3 LYS 19 1HE LYS 19 0.182 9.434 -20.498
154 HZ1 LYS 19 3HZ LYS 19 0.874 10.445 -22.535
155 HZ2 LYS 19 1HZ LYS 19 2.162 9.507 -21.952
156 HZ3 LYS 19 2HZ LYS 19 2.201 11.194 -21.783
157 H ASN 20 HN ASN 20 -5.248 10.314 -19.507
158 HA ASN 20 HA ASN 20 -4.608 7.886 -18.475
159 HB2 ASN 20 2HB ASN 20 -4.936 8.842 -21.272
160 HB3 ASN 20 1HB ASN 20 -4.541 7.160 -20.927
161 HD21 ASN 20 1HD2 ASN 20 -6.950 8.261 -22.104
162 HD22 ASN 20 2HD2 ASN 20 -8.257 7.776 -21.077
163 H THR 21 HN THR 21 -2.658 7.851 -17.480
164 HA THR 21 HA THR 21 -0.936 6.378 -19.368
165 HB THR 21 HB THR 21 0.571 6.634 -17.013
166 HG1 THR 21 1HG THR 21 -0.948 8.675 -16.988
167 HG21 THR 21 3HG2 THR 21 2.166 7.793 -18.472
168 HG22 THR 21 1HG2 THR 21 0.898 7.995 -19.682
169 HG23 THR 21 2HG2 THR 21 1.462 6.379 -19.261
170 H LYS 22 HN LYS 22 -0.552 4.242 -18.818
171 HA LYS 22 HA LYS 22 -2.747 3.191 -17.329
172 HB2 LYS 22 2HB LYS 22 -2.083 1.048 -18.158
173 HB3 LYS 22 1HB LYS 22 -1.999 2.235 -19.444
174 HG2 LYS 22 2HG LYS 22 0.428 2.358 -19.165
175 HG3 LYS 22 1HG LYS 22 0.330 1.137 -17.894
176 HD2 LYS 22 2HD LYS 22 -0.466 0.789 -20.783
177 HD3 LYS 22 1HD LYS 22 0.953 0.097 -19.995
178 HE2 LYS 22 2HE LYS 22 -0.396 -1.295 -18.610
179 HE3 LYS 22 1HE LYS 22 -1.869 -0.464 -19.106
180 HZ1 LYS 22 3HZ LYS 22 -1.624 -2.602 -20.212
181 HZ2 LYS 22 1HZ LYS 22 -0.141 -2.111 -20.879
182 HZ3 LYS 22 2HZ LYS 22 -1.575 -1.332 -21.337
183 H HIS 23 HN HIS 23 0.310 4.057 -16.284
184 HA HIS 23 HA HIS 23 0.878 2.069 -14.407
185 HB2 HIS 23 2HB HIS 23 2.210 3.650 -13.208
186 HB3 HIS 23 1HB HIS 23 2.388 3.985 -14.922
187 HD1 HIS 23 1HD HIS 23 1.978 5.664 -11.820
188 HD2 HIS 23 2HD HIS 23 0.561 6.272 -15.683
189 HE1 HIS 23 1HE HIS 23 1.307 8.078 -11.926
190 HE2 HIS 23 2HE HIS 23 0.743 8.479 -14.346
191 H ALA 24 HN ALA 24 -1.584 4.545 -14.345
192 HA ALA 24 HA ALA 24 -2.314 4.394 -11.628
193 HB1 ALA 24 1HB ALA 24 -4.489 5.269 -12.363
194 HB2 ALA 24 2HB ALA 24 -4.050 4.940 -14.041
195 HB3 ALA 24 3HB ALA 24 -3.150 6.140 -13.113
196 H ASP 25 HN ASP 25 -3.137 2.413 -14.418
197 HA ASP 25 HA ASP 25 -5.110 0.806 -13.165
198 HB2 ASP 25 2HB ASP 25 -4.846 0.931 -15.617
199 HB3 ASP 25 1HB ASP 25 -3.290 0.128 -15.489
200 H GLN 26 HN GLN 26 -1.636 0.489 -13.620
201 HA GLN 26 HA GLN 26 -1.275 -2.064 -12.579
202 HB2 GLN 26 2HB GLN 26 0.556 0.329 -12.611
203 HB3 GLN 26 1HB GLN 26 1.065 -1.274 -12.116
204 HG2 GLN 26 2HG GLN 26 -0.041 -0.561 -14.819
205 HG3 GLN 26 1HG GLN 26 1.666 -0.774 -14.434
206 HE21 GLN 26 1HE2 GLN 26 1.148 -3.019 -12.625
207 HE22 GLN 26 2HE2 GLN 26 0.777 -4.368 -13.638
208 H TRP 27 HN TRP 27 -1.394 1.062 -10.931
209 HA TRP 27 HA TRP 27 -0.786 0.225 -8.326
210 HB2 TRP 27 2HB TRP 27 -2.476 2.434 -9.463
211 HB3 TRP 27 1HB TRP 27 -2.461 2.148 -7.729
212 HD1 TRP 27 1HD TRP 27 0.215 2.750 -10.515
213 HE1 TRP 27 1HE TRP 27 2.045 4.255 -9.491
214 HE3 TRP 27 3HE TRP 27 -1.624 3.156 -5.759
215 HZ2 TRP 27 2HZ TRP 27 2.625 5.442 -7.001
216 HZ3 TRP 27 3HZ TRP 27 -0.373 4.495 -4.118
217 HH2 TRP 27 2HH TRP 27 1.710 5.613 -4.728
218 H THR 28 HN THR 28 -3.944 0.492 -9.932
219 HA THR 28 HA THR 28 -5.460 -0.521 -7.784
220 HB THR 28 HB THR 28 -6.178 -0.677 -10.718
221 HG1 THR 28 1HG THR 28 -5.626 1.464 -10.256
222 HG21 THR 28 3HG2 THR 28 -7.883 -0.456 -8.235
223 HG22 THR 28 1HG2 THR 28 -7.690 -1.895 -9.236
224 HG23 THR 28 2HG2 THR 28 -8.479 -0.462 -9.893
225 H ASN 29 HN ASN 29 -4.092 -2.007 -10.662
226 HA ASN 29 HA ASN 29 -5.277 -4.522 -10.490
227 HB2 ASN 29 2HB ASN 29 -3.967 -3.440 -12.408
228 HB3 ASN 29 1HB ASN 29 -2.516 -3.993 -11.584
229 HD21 ASN 29 1HD2 ASN 29 -3.713 -4.654 -14.198
230 HD22 ASN 29 2HD2 ASN 29 -3.842 -6.376 -14.213
231 H THR 30 HN THR 30 -2.169 -3.384 -9.182
232 HA THR 30 HA THR 30 -1.420 -5.947 -8.193
233 HB THR 30 HB THR 30 0.299 -4.630 -6.865
234 HG1 THR 30 1HG THR 30 -0.611 -2.447 -8.461
235 HG21 THR 30 3HG2 THR 30 0.794 -5.625 -9.050
236 HG22 THR 30 1HG2 THR 30 1.632 -4.086 -8.844
237 HG23 THR 30 2HG2 THR 30 0.185 -4.176 -9.848
238 H ILE 31 HN ILE 31 -2.752 -3.036 -6.637
239 HA ILE 31 HA ILE 31 -2.756 -4.091 -4.023
240 HB ILE 31 HB ILE 31 -4.471 -1.912 -5.221
241 HG12 ILE 31 2HG1 ILE 31 -1.979 -1.774 -3.505
242 HG13 ILE 31 1HG1 ILE 31 -2.027 -1.506 -5.246
243 HG21 ILE 31 1HG2 ILE 31 -5.556 -2.797 -3.239
244 HG22 ILE 31 2HG2 ILE 31 -4.883 -1.204 -2.894
245 HG23 ILE 31 3HG2 ILE 31 -4.057 -2.653 -2.324
246 HD11 ILE 31 3HD1 ILE 31 -1.944 0.590 -4.031
247 HD12 ILE 31 1HD1 ILE 31 -3.419 0.161 -3.162
248 HD13 ILE 31 2HD1 ILE 31 -3.467 0.431 -4.905
249 H LYS 32 HN LYS 32 -5.212 -4.085 -6.561
250 HA LYS 32 HA LYS 32 -7.346 -5.157 -5.104
251 HB2 LYS 32 2HB LYS 32 -7.420 -4.189 -7.434
252 HB3 LYS 32 1HB LYS 32 -6.717 -5.686 -8.017
253 HG2 LYS 32 2HG LYS 32 -9.247 -5.777 -6.440
254 HG3 LYS 32 1HG LYS 32 -9.290 -5.287 -8.132
255 HD2 LYS 32 2HD LYS 32 -8.129 -7.870 -7.091
256 HD3 LYS 32 1HD LYS 32 -9.721 -7.693 -7.830
257 HE2 LYS 32 2HE LYS 32 -8.611 -6.874 -9.895
258 HE3 LYS 32 1HE LYS 32 -7.049 -7.198 -9.146
259 HZ1 LYS 32 3HZ LYS 32 -7.737 -9.016 -10.587
260 HZ2 LYS 32 1HZ LYS 32 -9.160 -9.221 -9.687
261 HZ3 LYS 32 2HZ LYS 32 -7.653 -9.533 -8.974
262 H THR 33 HN THR 33 -4.596 -6.684 -6.645
263 HA THR 33 HA THR 33 -5.668 -9.344 -6.336
264 HB THR 33 HB THR 33 -2.866 -8.532 -7.125
265 HG1 THR 33 1HG THR 33 -4.097 -7.633 -8.687
266 HG21 THR 33 3HG2 THR 33 -2.824 -10.721 -8.238
267 HG22 THR 33 1HG2 THR 33 -4.442 -11.064 -7.622
268 HG23 THR 33 2HG2 THR 33 -3.090 -10.887 -6.503
269 H TYR 34 HN TYR 34 -2.905 -7.544 -4.939
270 HA TYR 34 HA TYR 34 -2.280 -9.742 -3.192
271 HB2 TYR 34 2HB TYR 34 -1.120 -6.964 -3.377
272 HB3 TYR 34 1HB TYR 34 -0.509 -8.227 -2.313
273 HD1 TYR 34 1HD TYR 34 -0.193 -10.582 -3.720
274 HD2 TYR 34 2HD TYR 34 0.141 -6.635 -5.280
275 HE1 TYR 34 1HE TYR 34 1.250 -11.423 -5.527
276 HE2 TYR 34 2HE TYR 34 1.578 -7.469 -7.094
277 HH TYR 34 HH TYR 34 1.863 -10.704 -7.886
278 H CYS 35 HN CYS 35 -3.577 -6.463 -2.697
279 HA CYS 35 HA CYS 35 -3.687 -6.980 0.172
280 HB2 CYS 35 2HB CYS 35 -4.241 -4.438 -1.362
281 HB3 CYS 35 1HB CYS 35 -4.114 -4.584 0.390
282 HG CYS 35 HG CYS 35 -1.363 -5.559 0.084
283 H GLY 36 HN GLY 36 -5.766 -6.788 -2.558
284 HA2 GLY 36 2HA GLY 36 -8.167 -5.893 -1.557
285 HA3 GLY 36 1HA GLY 36 -8.022 -7.107 -2.814
286 HA PRO 37 HA PRO 37 -9.688 -10.279 -0.319
287 HB2 PRO 37 2HB PRO 37 -7.257 -11.951 -0.329
288 HB3 PRO 37 1HB PRO 37 -8.857 -12.285 -0.999
289 HG2 PRO 37 2HG PRO 37 -6.781 -11.748 -2.593
290 HG3 PRO 37 1HG PRO 37 -8.411 -11.164 -2.975
291 HD2 PRO 37 2HD PRO 37 -6.105 -9.678 -1.772
292 HD3 PRO 37 1HD PRO 37 -7.252 -9.153 -3.023
293 H VAL 38 HN VAL 38 -6.990 -8.680 0.910
294 HA VAL 38 HA VAL 38 -7.154 -10.135 3.465
295 HB VAL 38 HB VAL 38 -4.891 -8.366 2.532
296 HG11 VAL 38 1HG1 VAL 38 -5.130 -10.231 4.890
297 HG12 VAL 38 2HG1 VAL 38 -5.087 -8.469 4.949
298 HG13 VAL 38 3HG1 VAL 38 -3.669 -9.369 4.414
299 HG21 VAL 38 3HG2 VAL 38 -5.073 -11.378 2.582
300 HG22 VAL 38 1HG2 VAL 38 -3.624 -10.443 2.207
301 HG23 VAL 38 2HG2 VAL 38 -5.029 -10.363 1.142
302 H ILE 39 HN ILE 39 -6.358 -6.812 2.369
303 HA ILE 39 HA ILE 39 -7.691 -5.847 4.815
304 HB ILE 39 HB ILE 39 -6.195 -3.877 4.709
305 HG12 ILE 39 2HG1 ILE 39 -4.774 -5.463 2.557
306 HG13 ILE 39 1HG1 ILE 39 -5.665 -3.965 2.311
307 HG21 ILE 39 1HG2 ILE 39 -5.674 -5.727 6.181
308 HG22 ILE 39 2HG2 ILE 39 -4.190 -5.034 5.528
309 HG23 ILE 39 3HG2 ILE 39 -4.815 -6.550 4.880
310 HD11 ILE 39 3HD1 ILE 39 -3.249 -3.614 2.368
311 HD12 ILE 39 1HD1 ILE 39 -3.196 -4.262 4.006
312 HD13 ILE 39 2HD1 ILE 39 -4.067 -2.762 3.680
313 H GLY 40 HN GLY 40 -8.246 -6.086 1.647
314 HA2 GLY 40 2HA GLY 40 -8.800 -3.559 0.646
315 HA3 GLY 40 1HA GLY 40 -9.642 -5.024 0.177
316 HA PRO 41 HA PRO 41 -13.305 -3.618 2.146
317 HB2 PRO 41 2HB PRO 41 -14.307 -5.709 3.514
318 HB3 PRO 41 1HB PRO 41 -14.196 -5.706 1.749
319 HG2 PRO 41 2HG PRO 41 -12.385 -6.984 3.762
320 HG3 PRO 41 1HG PRO 41 -12.998 -7.642 2.234
321 HD2 PRO 41 2HD PRO 41 -10.506 -6.578 2.523
322 HD3 PRO 41 1HD PRO 41 -11.402 -6.567 0.991
323 H LEU 42 HN LEU 42 -10.683 -4.097 4.095
324 HA LEU 42 HA LEU 42 -11.993 -3.644 6.638
325 HB2 LEU 42 2HB LEU 42 -9.069 -3.501 5.880
326 HB3 LEU 42 1HB LEU 42 -9.694 -3.400 7.514
327 HG LEU 42 HG LEU 42 -9.858 -5.808 5.698
328 HD11 LEU 42 1HD1 LEU 42 -8.265 -5.318 8.209
329 HD12 LEU 42 2HD1 LEU 42 -7.617 -5.380 6.569
330 HD13 LEU 42 3HD1 LEU 42 -8.325 -6.823 7.291
331 HD21 LEU 42 3HD2 LEU 42 -10.745 -6.970 7.666
332 HD22 LEU 42 1HD2 LEU 42 -11.817 -5.673 7.132
333 HD23 LEU 42 2HD2 LEU 42 -10.787 -5.440 8.543
334 H SER 43 HN SER 43 -11.408 -1.672 7.946
335 HA SER 43 HA SER 43 -11.895 0.687 6.418
336 HB2 SER 43 2HB SER 43 -12.690 0.494 8.740
337 HB3 SER 43 1HB SER 43 -11.030 0.418 9.310
338 HG SER 43 HG SER 43 -12.475 2.599 8.288
339 H VAL 44 HN VAL 44 -10.526 2.482 6.139
340 HA VAL 44 HA VAL 44 -7.879 1.817 5.406
341 HB VAL 44 HB VAL 44 -9.239 3.588 4.315
342 HG11 VAL 44 1HG1 VAL 44 -9.320 5.827 5.332
343 HG12 VAL 44 2HG1 VAL 44 -8.657 5.149 6.820
344 HG13 VAL 44 3HG1 VAL 44 -10.239 4.627 6.242
345 HG21 VAL 44 3HG2 VAL 44 -6.568 4.487 5.380
346 HG22 VAL 44 1HG2 VAL 44 -7.396 5.176 3.983
347 HG23 VAL 44 2HG2 VAL 44 -6.844 3.501 3.944
348 H GLN 45 HN GLN 45 -9.274 2.861 8.391
349 HA GLN 45 HA GLN 45 -6.613 3.426 9.441
350 HB2 GLN 45 2HB GLN 45 -7.909 4.160 11.471
351 HB3 GLN 45 1HB GLN 45 -8.052 5.159 10.046
352 HG2 GLN 45 2HG GLN 45 -10.227 4.207 9.575
353 HG3 GLN 45 1HG GLN 45 -10.067 3.120 10.954
354 HE21 GLN 45 1HE2 GLN 45 -8.820 5.063 12.661
355 HE22 GLN 45 2HE2 GLN 45 -10.033 6.202 13.128
356 H ASP 46 HN ASP 46 -8.851 0.918 9.234
357 HA ASP 46 HA ASP 46 -7.906 -0.360 11.677
358 HB2 ASP 46 2HB ASP 46 -10.037 -1.027 9.683
359 HB3 ASP 46 1HB ASP 46 -9.398 -2.281 10.737
360 H VAL 47 HN VAL 47 -6.671 0.078 8.717
361 HA VAL 47 HA VAL 47 -5.563 -2.505 8.233
362 HB VAL 47 HB VAL 47 -4.510 0.209 7.386
363 HG11 VAL 47 1HG1 VAL 47 -3.314 -1.057 5.640
364 HG12 VAL 47 2HG1 VAL 47 -3.881 -2.562 6.363
365 HG13 VAL 47 3HG1 VAL 47 -2.787 -1.511 7.263
366 HG21 VAL 47 3HG2 VAL 47 -6.245 -1.759 5.897
367 HG22 VAL 47 1HG2 VAL 47 -5.578 -0.265 5.240
368 HG23 VAL 47 2HG2 VAL 47 -6.766 -0.202 6.544
369 H ASP 48 HN ASP 48 -4.420 -3.429 9.822
370 HA ASP 48 HA ASP 48 -2.873 -1.777 11.633
371 HB2 ASP 48 2HB ASP 48 -3.562 -4.709 11.671
372 HB3 ASP 48 1HB ASP 48 -2.451 -3.976 12.819
373 H THR 49 HN THR 49 -0.772 -2.560 12.337
374 HA THR 49 HA THR 49 1.043 -2.610 10.172
375 HB THR 49 HB THR 49 1.591 -3.224 13.087
376 HG1 THR 49 1HG THR 49 2.166 -0.693 12.417
377 HG21 THR 49 3HG2 THR 49 3.808 -2.306 12.607
378 HG22 THR 49 1HG2 THR 49 3.345 -2.069 10.922
379 HG23 THR 49 2HG2 THR 49 3.456 -3.699 11.584
380 H LYS 50 HN LYS 50 -0.115 -5.029 12.481
381 HA LYS 50 HA LYS 50 1.542 -7.143 11.554
382 HB2 LYS 50 2HB LYS 50 -0.076 -6.772 13.718
383 HB3 LYS 50 1HB LYS 50 -1.053 -7.871 12.754
384 HG2 LYS 50 2HG LYS 50 1.786 -8.367 13.636
385 HG3 LYS 50 1HG LYS 50 0.339 -9.048 14.378
386 HD2 LYS 50 2HD LYS 50 -0.199 -10.202 12.306
387 HD3 LYS 50 1HD LYS 50 1.216 -9.491 11.527
388 HE2 LYS 50 2HE LYS 50 1.242 -11.364 13.891
389 HE3 LYS 50 1HE LYS 50 1.650 -11.788 12.231
390 HZ1 LYS 50 3HZ LYS 50 3.512 -10.263 12.323
391 HZ2 LYS 50 1HZ LYS 50 3.622 -11.397 13.577
392 HZ3 LYS 50 2HZ LYS 50 3.112 -9.819 13.911
393 H LEU 51 HN LEU 51 -1.603 -5.917 10.604
394 HA LEU 51 HA LEU 51 -2.407 -8.146 9.072
395 HB2 LEU 51 2HB LEU 51 -3.194 -5.245 8.997
396 HB3 LEU 51 1HB LEU 51 -3.910 -6.442 7.942
397 HG LEU 51 HG LEU 51 -4.059 -6.378 10.949
398 HD11 LEU 51 1HD1 LEU 51 -6.470 -6.113 10.548
399 HD12 LEU 51 2HD1 LEU 51 -6.153 -6.014 8.816
400 HD13 LEU 51 3HD1 LEU 51 -5.528 -4.775 9.899
401 HD21 LEU 51 3HD2 LEU 51 -3.877 -8.679 10.183
402 HD22 LEU 51 1HD2 LEU 51 -5.174 -8.410 9.020
403 HD23 LEU 51 2HD2 LEU 51 -5.512 -8.341 10.749
404 H ILE 52 HN ILE 52 -0.581 -5.224 8.268
405 HA ILE 52 HA ILE 52 -0.373 -5.787 5.495
406 HB ILE 52 HB ILE 52 1.595 -4.189 7.142
407 HG12 ILE 52 2HG1 ILE 52 -0.904 -3.237 5.721
408 HG13 ILE 52 1HG1 ILE 52 -0.750 -3.428 7.465
409 HG21 ILE 52 1HG2 ILE 52 2.023 -3.030 5.019
410 HG22 ILE 52 2HG2 ILE 52 0.882 -4.102 4.208
411 HG23 ILE 52 3HG2 ILE 52 2.370 -4.755 4.893
412 HD11 ILE 52 3HD1 ILE 52 -0.505 -1.108 6.827
413 HD12 ILE 52 1HD1 ILE 52 0.821 -1.526 5.741
414 HD13 ILE 52 2HD1 ILE 52 1.012 -1.726 7.482
415 H MET 53 HN MET 53 1.536 -6.695 8.309
416 HA MET 53 HA MET 53 3.744 -7.878 7.090
417 HB2 MET 53 2HB MET 53 2.248 -8.761 9.566
418 HB3 MET 53 1HB MET 53 3.807 -9.399 9.078
419 HG2 MET 53 2HG MET 53 4.806 -7.203 9.343
420 HG3 MET 53 1HG MET 53 3.237 -6.532 9.788
421 HE1 MET 53 3HE MET 53 4.363 -5.536 12.034
422 HE2 MET 53 1HE MET 53 5.903 -6.235 11.539
423 HE3 MET 53 2HE MET 53 5.284 -6.526 13.168
424 H LYS 54 HN LYS 54 0.525 -9.181 7.690
425 HA LYS 54 HA LYS 54 0.908 -11.837 6.961
426 HB2 LYS 54 2HB LYS 54 -1.499 -10.048 6.625
427 HB3 LYS 54 1HB LYS 54 -1.533 -11.784 6.356
428 HG2 LYS 54 2HG LYS 54 -1.138 -12.245 8.633
429 HG3 LYS 54 1HG LYS 54 -0.690 -10.571 8.970
430 HD2 LYS 54 2HD LYS 54 -2.959 -11.126 9.771
431 HD3 LYS 54 1HD LYS 54 -2.960 -9.841 8.565
432 HE2 LYS 54 2HE LYS 54 -4.760 -11.308 8.044
433 HE3 LYS 54 1HE LYS 54 -3.499 -11.578 6.843
434 HZ1 LYS 54 3HZ LYS 54 -2.828 -13.564 8.007
435 HZ2 LYS 54 1HZ LYS 54 -4.488 -13.643 7.676
436 HZ3 LYS 54 2HZ LYS 54 -3.952 -13.272 9.237
437 H VAL 55 HN VAL 55 0.322 -8.998 4.974
438 HA VAL 55 HA VAL 55 -0.028 -10.497 2.550
439 HB VAL 55 HB VAL 55 0.512 -7.538 2.857
440 HG11 VAL 55 1HG1 VAL 55 -0.577 -7.344 0.671
441 HG12 VAL 55 2HG1 VAL 55 -0.720 -9.100 0.593
442 HG13 VAL 55 3HG1 VAL 55 0.874 -8.344 0.597
443 HG21 VAL 55 3HG2 VAL 55 -1.920 -7.241 2.720
444 HG22 VAL 55 1HG2 VAL 55 -1.443 -8.151 4.154
445 HG23 VAL 55 2HG2 VAL 55 -2.126 -8.992 2.763
446 H LEU 56 HN LEU 56 2.553 -8.518 3.971
447 HA LEU 56 HA LEU 56 4.156 -8.606 1.619
448 HB2 LEU 56 2HB LEU 56 4.779 -7.739 4.431
449 HB3 LEU 56 1HB LEU 56 5.899 -7.580 3.094
450 HG LEU 56 HG LEU 56 3.234 -6.197 3.398
451 HD11 LEU 56 1HD1 LEU 56 4.597 -4.167 3.380
452 HD12 LEU 56 2HD1 LEU 56 6.059 -5.147 3.280
453 HD13 LEU 56 3HD1 LEU 56 5.040 -5.229 4.715
454 HD21 LEU 56 3HD2 LEU 56 3.731 -5.105 1.270
455 HD22 LEU 56 1HD2 LEU 56 3.575 -6.852 1.070
456 HD23 LEU 56 2HD2 LEU 56 5.173 -6.105 1.090
457 H ASP 57 HN ASP 57 4.123 -10.505 4.589
458 HA ASP 57 HA ASP 57 6.716 -11.464 4.607
459 HB2 ASP 57 2HB ASP 57 4.951 -11.866 6.365
460 HB3 ASP 57 1HB ASP 57 4.342 -13.156 5.353
461 HA PRO 58 HA PRO 58 5.497 -15.254 1.889
462 HB2 PRO 58 2HB PRO 58 3.198 -15.066 0.424
463 HB3 PRO 58 1HB PRO 58 3.283 -15.817 2.020
464 HG2 PRO 58 2HG PRO 58 2.337 -13.091 1.251
465 HG3 PRO 58 1HG PRO 58 1.678 -14.212 2.457
466 HD2 PRO 58 2HD PRO 58 3.232 -12.078 3.110
467 HD3 PRO 58 1HD PRO 58 3.194 -13.566 4.068
468 H ILE 59 HN ILE 59 4.826 -11.979 0.886
469 HA ILE 59 HA ILE 59 5.335 -12.426 -1.896
470 HB ILE 59 HB ILE 59 5.355 -9.814 -0.368
471 HG12 ILE 59 2HG1 ILE 59 3.181 -11.151 -1.996
472 HG13 ILE 59 1HG1 ILE 59 3.187 -10.949 -0.248
473 HG21 ILE 59 1HG2 ILE 59 6.570 -9.631 -2.466
474 HG22 ILE 59 2HG2 ILE 59 5.031 -8.777 -2.578
475 HG23 ILE 59 3HG2 ILE 59 5.217 -10.359 -3.335
476 HD11 ILE 59 3HD1 ILE 59 1.734 -9.327 -1.323
477 HD12 ILE 59 1HD1 ILE 59 3.092 -8.726 -2.276
478 HD13 ILE 59 2HD1 ILE 59 3.089 -8.529 -0.524
479 H TRP 60 HN TRP 60 7.305 -11.758 0.900
480 HA TRP 60 HA TRP 60 9.609 -10.772 -0.362
481 HB2 TRP 60 2HB TRP 60 9.307 -12.436 2.139
482 HB3 TRP 60 1HB TRP 60 10.847 -11.780 1.603
483 HD1 TRP 60 1HD TRP 60 8.064 -10.985 3.810
484 HE1 TRP 60 1HE TRP 60 8.077 -8.505 4.484
485 HE3 TRP 60 3HE TRP 60 11.383 -9.232 0.338
486 HZ2 TRP 60 2HZ TRP 60 9.333 -6.113 3.641
487 HZ3 TRP 60 3HZ TRP 60 11.937 -6.836 0.341
488 HH2 TRP 60 2HH TRP 60 10.932 -5.311 1.959
489 H GLU 61 HN GLU 61 8.307 -13.987 -0.226
490 HA GLU 61 HA GLU 61 10.713 -15.275 -1.084
491 HB2 GLU 61 2HB GLU 61 7.847 -16.190 -0.858
492 HB3 GLU 61 1HB GLU 61 9.181 -17.227 -1.301
493 HG2 GLU 61 2HG GLU 61 8.840 -15.792 1.313
494 HG3 GLU 61 1HG GLU 61 8.636 -17.520 1.028
495 H GLN 62 HN GLN 62 7.856 -13.908 -2.533
496 HA GLN 62 HA GLN 62 8.387 -15.142 -5.109
497 HB2 GLN 62 2HB GLN 62 6.184 -13.321 -4.143
498 HB3 GLN 62 1HB GLN 62 6.300 -13.935 -5.784
499 HG2 GLN 62 2HG GLN 62 6.085 -15.664 -3.335
500 HG3 GLN 62 1HG GLN 62 4.723 -15.182 -4.344
501 HE21 GLN 62 1HE2 GLN 62 4.219 -17.277 -4.901
502 HE22 GLN 62 2HE2 GLN 62 5.197 -18.215 -5.988
503 H LYS 63 HN LYS 63 7.909 -11.842 -3.870
504 HA LYS 63 HA LYS 63 9.765 -10.825 -5.890
505 HB2 LYS 63 2HB LYS 63 6.953 -9.800 -5.473
506 HB3 LYS 63 1HB LYS 63 8.179 -8.981 -6.427
507 HG2 LYS 63 2HG LYS 63 8.230 -10.804 -8.004
508 HG3 LYS 63 1HG LYS 63 7.096 -11.726 -7.013
509 HD2 LYS 63 2HD LYS 63 5.370 -10.084 -7.382
510 HD3 LYS 63 1HD LYS 63 6.497 -9.037 -8.243
511 HE2 LYS 63 2HE LYS 63 5.626 -11.787 -9.121
512 HE3 LYS 63 1HE LYS 63 5.025 -10.263 -9.773
513 HZ1 LYS 63 3HZ LYS 63 7.415 -9.770 -10.345
514 HZ2 LYS 63 1HZ LYS 63 6.673 -10.997 -11.251
515 HZ3 LYS 63 2HZ LYS 63 7.755 -11.394 -10.004
516 HA PRO 64 HA PRO 64 10.572 -9.011 -1.704
517 HB2 PRO 64 2HB PRO 64 13.221 -8.677 -2.981
518 HB3 PRO 64 1HB PRO 64 12.817 -9.337 -1.394
519 HG2 PRO 64 2HG PRO 64 13.593 -10.921 -3.408
520 HG3 PRO 64 1HG PRO 64 12.367 -11.443 -2.237
521 HD2 PRO 64 2HD PRO 64 12.029 -10.495 -5.048
522 HD3 PRO 64 1HD PRO 64 11.138 -11.748 -4.162
523 H GLU 65 HN GLU 65 11.584 -7.894 -4.892
524 HA GLU 65 HA GLU 65 11.967 -5.187 -4.247
525 HB2 GLU 65 2HB GLU 65 10.930 -5.417 -6.906
526 HB3 GLU 65 1HB GLU 65 12.564 -5.077 -6.387
527 HG2 GLU 65 2HG GLU 65 12.643 -6.925 -7.854
528 HG3 GLU 65 1HG GLU 65 12.970 -7.516 -6.229
529 H THR 66 HN THR 66 9.183 -6.961 -5.437
530 HA THR 66 HA THR 66 7.507 -4.669 -5.653
531 HB THR 66 HB THR 66 6.721 -7.587 -5.534
532 HG1 THR 66 1HG THR 66 8.196 -7.110 -7.253
533 HG21 THR 66 3HG2 THR 66 4.832 -6.060 -5.170
534 HG22 THR 66 1HG2 THR 66 4.712 -6.867 -6.733
535 HG23 THR 66 2HG2 THR 66 5.253 -5.192 -6.647
536 H ALA 67 HN ALA 67 8.069 -7.076 -3.155
537 HA ALA 67 HA ALA 67 5.933 -6.454 -1.450
538 HB1 ALA 67 1HB ALA 67 7.245 -7.481 0.317
539 HB2 ALA 67 2HB ALA 67 8.699 -7.374 -0.675
540 HB3 ALA 67 3HB ALA 67 7.372 -8.428 -1.166
541 H SER 68 HN SER 68 9.196 -5.081 -1.650
542 HA SER 68 HA SER 68 8.812 -3.298 0.533
543 HB2 SER 68 2HB SER 68 10.901 -2.183 -0.602
544 HB3 SER 68 1HB SER 68 11.053 -3.754 0.183
545 HG SER 68 HG SER 68 11.112 -4.743 -1.767
546 H ARG 69 HN ARG 69 8.375 -3.054 -2.951
547 HA ARG 69 HA ARG 69 7.948 -0.248 -2.984
548 HB2 ARG 69 2HB ARG 69 7.199 -2.414 -4.947
549 HB3 ARG 69 1HB ARG 69 7.001 -0.702 -5.250
550 HG2 ARG 69 2HG ARG 69 9.481 -0.470 -4.831
551 HG3 ARG 69 1HG ARG 69 9.543 -2.231 -4.898
552 HD2 ARG 69 2HD ARG 69 10.070 -1.494 -7.072
553 HD3 ARG 69 1HD ARG 69 8.399 -2.051 -7.150
554 HE ARG 69 HE ARG 69 9.029 0.811 -6.805
555 HH11 ARG 69 1HH1 ARG 69 7.468 -1.777 -8.575
556 HH12 ARG 69 2HH1 ARG 69 6.664 -0.711 -9.683
557 HH21 ARG 69 1HH2 ARG 69 7.962 2.221 -8.259
558 HH22 ARG 69 2HH2 ARG 69 6.943 1.563 -9.506
559 H LEU 70 HN LEU 70 5.858 -3.052 -2.619
560 HA LEU 70 HA LEU 70 3.374 -1.764 -2.887
561 HB2 LEU 70 2HB LEU 70 3.699 -4.220 -2.842
562 HB3 LEU 70 1HB LEU 70 4.078 -4.121 -1.134
563 HG LEU 70 HG LEU 70 1.787 -3.267 -0.703
564 HD11 LEU 70 1HD1 LEU 70 1.372 -3.873 -3.629
565 HD12 LEU 70 2HD1 LEU 70 1.335 -2.279 -2.874
566 HD13 LEU 70 3HD1 LEU 70 0.100 -3.474 -2.472
567 HD21 LEU 70 3HD2 LEU 70 2.292 -5.636 -0.453
568 HD22 LEU 70 1HD2 LEU 70 1.922 -5.904 -2.157
569 HD23 LEU 70 2HD2 LEU 70 0.647 -5.400 -1.047
570 H ARG 71 HN ARG 71 5.507 -2.221 -0.124
571 HA ARG 71 HA ARG 71 3.910 -1.227 1.926
572 HB2 ARG 71 2HB ARG 71 6.124 -2.322 2.230
573 HB3 ARG 71 1HB ARG 71 6.898 -0.876 1.599
574 HG2 ARG 71 2HG ARG 71 5.753 0.372 3.491
575 HG3 ARG 71 1HG ARG 71 5.407 -1.218 4.172
576 HD2 ARG 71 2HD ARG 71 8.131 -0.098 3.527
577 HD3 ARG 71 1HD ARG 71 7.436 -0.282 5.135
578 HE ARG 71 HE ARG 71 7.478 -2.777 3.819
579 HH11 ARG 71 1HH1 ARG 71 9.635 -0.452 5.306
580 HH12 ARG 71 2HH1 ARG 71 10.823 -1.640 5.737
581 HH21 ARG 71 1HH2 ARG 71 9.061 -4.342 4.390
582 HH22 ARG 71 2HH2 ARG 71 10.495 -3.842 5.241
583 H GLY 72 HN GLY 72 6.071 0.490 -0.297
584 HA2 GLY 72 2HA GLY 72 5.796 3.039 0.887
585 HA3 GLY 72 1HA GLY 72 6.387 2.713 -0.732
586 H ARG 73 HN ARG 73 4.030 1.480 -1.781
587 HA ARG 73 HA ARG 73 2.637 3.882 -2.429
588 HB2 ARG 73 2HB ARG 73 1.305 2.572 -3.955
589 HB3 ARG 73 1HB ARG 73 2.995 2.131 -4.112
590 HG2 ARG 73 2HG ARG 73 2.534 0.128 -2.706
591 HG3 ARG 73 1HG ARG 73 0.820 0.552 -2.761
592 HD2 ARG 73 2HD ARG 73 1.305 -1.087 -4.480
593 HD3 ARG 73 1HD ARG 73 0.899 0.459 -5.221
594 HE ARG 73 HE ARG 73 3.606 0.541 -5.039
595 HH11 ARG 73 1HH1 ARG 73 1.360 -1.764 -6.436
596 HH12 ARG 73 2HH1 ARG 73 2.474 -2.284 -7.657
597 HH21 ARG 73 1HH2 ARG 73 5.051 -0.124 -6.641
598 HH22 ARG 73 2HH2 ARG 73 4.571 -1.349 -7.790
599 H ILE 74 HN ILE 74 1.951 1.140 -0.329
600 HA ILE 74 HA ILE 74 -0.713 1.851 0.302
601 HB ILE 74 HB ILE 74 1.340 0.394 1.981
602 HG12 ILE 74 2HG1 ILE 74 -0.976 -0.634 0.322
603 HG13 ILE 74 1HG1 ILE 74 0.720 -0.713 -0.143
604 HG21 ILE 74 1HG2 ILE 74 -1.639 0.652 2.399
605 HG22 ILE 74 2HG2 ILE 74 -0.379 1.365 3.407
606 HG23 ILE 74 3HG2 ILE 74 -0.557 -0.389 3.325
607 HD11 ILE 74 3HD1 ILE 74 1.171 -2.160 1.779
608 HD12 ILE 74 1HD1 ILE 74 -0.047 -2.845 0.702
609 HD13 ILE 74 2HD1 ILE 74 -0.537 -2.091 2.217
610 H GLU 75 HN GLU 75 2.395 2.699 1.790
611 HA GLU 75 HA GLU 75 1.552 4.363 3.852
612 HB2 GLU 75 2HB GLU 75 3.910 3.694 3.384
613 HB3 GLU 75 1HB GLU 75 3.926 4.812 2.028
614 HG2 GLU 75 2HG GLU 75 3.335 6.619 3.696
615 HG3 GLU 75 1HG GLU 75 3.717 5.443 4.951
616 H SER 76 HN SER 76 2.061 5.093 0.438
617 HA SER 76 HA SER 76 1.628 7.849 0.559
618 HB2 SER 76 2HB SER 76 1.076 5.962 -1.723
619 HB3 SER 76 1HB SER 76 1.222 7.712 -1.859
620 HG SER 76 HG SER 76 3.244 5.878 -1.044
621 H VAL 77 HN VAL 77 -0.656 5.185 0.113
622 HA VAL 77 HA VAL 77 -2.923 6.856 -0.329
623 HB VAL 77 HB VAL 77 -2.835 3.977 0.594
624 HG11 VAL 77 1HG1 VAL 77 -4.988 5.040 1.060
625 HG12 VAL 77 2HG1 VAL 77 -5.138 3.854 -0.235
626 HG13 VAL 77 3HG1 VAL 77 -5.094 5.575 -0.618
627 HG21 VAL 77 3HG2 VAL 77 -1.712 4.297 -1.546
628 HG22 VAL 77 1HG2 VAL 77 -3.128 5.138 -2.174
629 HG23 VAL 77 2HG2 VAL 77 -3.233 3.428 -1.758
630 H LEU 78 HN LEU 78 -1.745 5.057 2.511
631 HA LEU 78 HA LEU 78 -3.807 5.796 4.263
632 HB2 LEU 78 2HB LEU 78 -0.923 5.171 4.899
633 HB3 LEU 78 1HB LEU 78 -2.222 5.240 6.074
634 HG LEU 78 HG LEU 78 -1.983 3.258 3.812
635 HD11 LEU 78 1HD1 LEU 78 -1.702 2.933 6.794
636 HD12 LEU 78 2HD1 LEU 78 -0.413 2.809 5.599
637 HD13 LEU 78 3HD1 LEU 78 -1.713 1.618 5.619
638 HD21 LEU 78 3HD2 LEU 78 -3.935 2.178 4.810
639 HD22 LEU 78 1HD2 LEU 78 -4.312 3.808 4.249
640 HD23 LEU 78 2HD2 LEU 78 -4.073 3.499 5.970
641 H ASP 79 HN ASP 79 -0.714 7.342 3.548
642 HA ASP 79 HA ASP 79 -0.886 9.419 5.447
643 HB2 ASP 79 2HB ASP 79 1.224 8.932 4.422
644 HB3 ASP 79 1HB ASP 79 0.570 9.198 2.811
645 H TRP 80 HN TRP 80 -1.891 9.220 2.066
646 HA TRP 80 HA TRP 80 -2.792 11.845 1.730
647 HB2 TRP 80 2HB TRP 80 -2.503 10.393 -0.165
648 HB3 TRP 80 1HB TRP 80 -3.678 9.249 0.466
649 HD1 TRP 80 1HD TRP 80 -3.520 12.776 -1.099
650 HE1 TRP 80 1HE TRP 80 -5.788 13.254 -2.220
651 HE3 TRP 80 3HE TRP 80 -6.071 8.615 0.423
652 HZ2 TRP 80 2HZ TRP 80 -8.325 12.023 -2.428
653 HZ3 TRP 80 3HZ TRP 80 -8.410 8.342 -0.281
654 HH2 TRP 80 2HH TRP 80 -9.514 10.013 -1.677
655 H ALA 81 HN ALA 81 -4.522 8.936 2.793
656 HA ALA 81 HA ALA 81 -7.047 10.136 3.090
657 HB1 ALA 81 1HB ALA 81 -6.723 7.716 2.990
658 HB2 ALA 81 2HB ALA 81 -7.619 8.185 4.434
659 HB3 ALA 81 3HB ALA 81 -5.913 7.758 4.556
660 H THR 82 HN THR 82 -4.314 9.849 5.314
661 HA THR 82 HA THR 82 -5.611 10.826 7.609
662 HB THR 82 HB THR 82 -2.711 10.977 6.782
663 HG1 THR 82 1HG THR 82 -3.808 9.354 8.830
664 HG21 THR 82 3HG2 THR 82 -3.942 11.569 9.481
665 HG22 THR 82 1HG2 THR 82 -3.173 12.740 8.412
666 HG23 THR 82 2HG2 THR 82 -2.216 11.454 9.141
667 H VAL 83 HN VAL 83 -3.753 12.519 5.085
668 HA VAL 83 HA VAL 83 -4.053 15.116 6.114
669 HB VAL 83 HB VAL 83 -3.759 14.263 3.226
670 HG11 VAL 83 1HG1 VAL 83 -2.885 16.525 2.853
671 HG12 VAL 83 2HG1 VAL 83 -3.260 16.940 4.525
672 HG13 VAL 83 3HG1 VAL 83 -4.562 16.558 3.400
673 HG21 VAL 83 3HG2 VAL 83 -1.940 13.439 4.615
674 HG22 VAL 83 1HG2 VAL 83 -1.690 15.055 5.274
675 HG23 VAL 83 2HG2 VAL 83 -1.373 14.740 3.568
676 H ARG 84 HN ARG 84 -6.024 13.277 3.816
677 HA ARG 84 HA ARG 84 -7.907 15.343 3.339
678 HB2 ARG 84 2HB ARG 84 -8.124 12.351 2.993
679 HB3 ARG 84 1HB ARG 84 -9.329 13.499 2.432
680 HG2 ARG 84 2HG ARG 84 -6.458 13.429 1.541
681 HG3 ARG 84 1HG ARG 84 -7.822 12.762 0.646
682 HD2 ARG 84 2HD ARG 84 -7.560 15.657 1.444
683 HD3 ARG 84 1HD ARG 84 -7.092 15.015 -0.128
684 HE ARG 84 HE ARG 84 -9.688 14.235 0.158
685 HH11 ARG 84 1HH1 ARG 84 -8.046 17.324 0.372
686 HH12 ARG 84 2HH1 ARG 84 -9.391 18.220 -0.285
687 HH21 ARG 84 1HH2 ARG 84 -11.450 15.401 -0.686
688 HH22 ARG 84 2HH2 ARG 84 -11.334 17.130 -0.856
689 H GLY 85 HN GLY 85 -7.576 12.974 5.861
690 HA2 GLY 85 2HA GLY 85 -8.567 13.283 7.986
691 HA3 GLY 85 1HA GLY 85 -9.823 14.255 7.235
692 H TYR 86 HN TYR 86 -8.862 11.121 5.988
693 HA TYR 86 HA TYR 86 -11.538 10.107 6.654
694 HB2 TYR 86 2HB TYR 86 -9.490 9.180 4.631
695 HB3 TYR 86 1HB TYR 86 -10.981 8.311 4.972
696 HD1 TYR 86 2HD TYR 86 -13.175 9.767 4.775
697 HD2 TYR 86 1HD TYR 86 -9.478 10.711 2.891
698 HE1 TYR 86 2HE TYR 86 -14.370 11.153 3.135
699 HE2 TYR 86 1HE TYR 86 -10.664 12.106 1.246
700 HH TYR 86 HH TYR 86 -13.887 13.066 1.641
701 H ARG 87 HN ARG 87 -8.608 10.088 8.025
702 HA ARG 87 HA ARG 87 -9.173 7.814 9.645
703 HB2 ARG 87 2HB ARG 87 -7.140 6.535 9.154
704 HB3 ARG 87 1HB ARG 87 -8.174 6.640 7.736
705 HG2 ARG 87 2HG ARG 87 -6.739 8.485 6.901
706 HG3 ARG 87 1HG ARG 87 -5.660 8.205 8.269
707 HD2 ARG 87 2HD ARG 87 -6.351 6.241 6.086
708 HD3 ARG 87 1HD ARG 87 -4.818 7.088 6.289
709 HE ARG 87 HE ARG 87 -5.725 4.749 7.711
710 HH11 ARG 87 1HH1 ARG 87 -3.524 7.479 7.719
711 HH12 ARG 87 2HH1 ARG 87 -2.437 6.744 8.861
712 HH21 ARG 87 1HH2 ARG 87 -4.254 3.779 9.183
713 HH22 ARG 87 2HH2 ARG 87 -2.840 4.661 9.670
714 H GLU 88 HN GLU 88 -7.168 7.450 11.161
715 HA GLU 88 HA GLU 88 -6.618 10.017 12.302
716 HB2 GLU 88 2HB GLU 88 -6.267 7.194 13.129
717 HB3 GLU 88 1HB GLU 88 -5.192 8.375 13.865
718 HG2 GLU 88 2HG GLU 88 -7.148 8.004 15.249
719 HG3 GLU 88 1HG GLU 88 -7.106 9.658 14.652
720 H GLY 89 HN GLY 89 -4.156 9.964 13.367
721 HA2 GLY 89 2HA GLY 89 -2.706 10.688 10.937
722 HA3 GLY 89 1HA GLY 89 -2.407 11.292 12.548
723 H ASP 90 HN ASP 90 -2.657 7.881 12.069
724 HA ASP 90 HA ASP 90 0.283 7.701 12.277
725 HB2 ASP 90 2HB ASP 90 -0.792 6.871 14.307
726 HB3 ASP 90 1HB ASP 90 -1.786 5.773 13.355
727 H ASN 91 HN ASN 91 1.377 6.303 10.930
728 HA ASN 91 HA ASN 91 -0.270 5.044 8.833
729 HB2 ASN 91 2HB ASN 91 1.003 7.090 8.076
730 HB3 ASN 91 1HB ASN 91 2.487 6.191 8.378
731 HD21 ASN 91 1HD2 ASN 91 1.370 7.253 5.872
732 HD22 ASN 91 2HD2 ASN 91 1.255 5.909 4.805
733 HA PRO 92 HA PRO 92 1.868 1.586 10.940
734 HB2 PRO 92 2HB PRO 92 -0.167 0.118 9.359
735 HB3 PRO 92 1HB PRO 92 0.228 0.003 11.077
736 HG2 PRO 92 2HG PRO 92 -1.999 1.216 10.281
737 HG3 PRO 92 1HG PRO 92 -1.046 1.859 11.632
738 HD2 PRO 92 2HD PRO 92 -1.178 2.797 8.791
739 HD3 PRO 92 1HD PRO 92 -1.126 3.747 10.291
740 H ALA 93 HN ALA 93 1.513 2.377 7.625
741 HA ALA 93 HA ALA 93 2.864 0.058 6.585
742 HB1 ALA 93 1HB ALA 93 1.312 1.335 5.185
743 HB2 ALA 93 2HB ALA 93 2.922 1.268 4.469
744 HB3 ALA 93 3HB ALA 93 2.378 2.735 5.280
745 H ARG 94 HN ARG 94 3.844 2.797 8.268
746 HA ARG 94 HA ARG 94 6.584 2.619 7.282
747 HB2 ARG 94 2HB ARG 94 5.276 4.462 9.287
748 HB3 ARG 94 1HB ARG 94 6.992 4.476 8.918
749 HG2 ARG 94 2HG ARG 94 6.489 4.991 6.585
750 HG3 ARG 94 1HG ARG 94 4.767 4.993 6.963
751 HD2 ARG 94 2HD ARG 94 5.038 6.886 8.417
752 HD3 ARG 94 1HD ARG 94 6.792 6.823 8.238
753 HE ARG 94 HE ARG 94 6.142 7.181 5.729
754 HH11 ARG 94 1HH1 ARG 94 4.628 8.682 8.515
755 HH12 ARG 94 2HH1 ARG 94 4.238 10.146 7.655
756 HH21 ARG 94 1HH2 ARG 94 5.614 9.080 4.609
757 HH22 ARG 94 2HH2 ARG 94 4.797 10.373 5.443
758 H TRP 95 HN TRP 95 8.186 1.671 8.427
759 HA TRP 95 HA TRP 95 7.271 0.121 10.754
760 HB2 TRP 95 2HB TRP 95 8.239 -0.762 8.161
761 HB3 TRP 95 1HB TRP 95 9.145 -1.468 9.496
762 HD1 TRP 95 1HD TRP 95 7.263 -2.387 11.556
763 HE1 TRP 95 1HE TRP 95 5.322 -4.010 11.108
764 HE3 TRP 95 3HE TRP 95 6.706 -1.626 6.534
765 HZ2 TRP 95 2HZ TRP 95 3.750 -4.846 8.926
766 HZ3 TRP 95 3HZ TRP 95 4.955 -2.875 5.343
767 HH2 TRP 95 2HH TRP 95 3.510 -4.450 6.517
768 H ARG 96 HN ARG 96 8.458 0.308 12.489
769 HA ARG 96 HA ARG 96 11.360 0.664 12.202
770 HB2 ARG 96 2HB ARG 96 9.534 1.310 14.521
771 HB3 ARG 96 1HB ARG 96 11.282 1.410 14.577
772 HG2 ARG 96 2HG ARG 96 11.170 3.074 12.717
773 HG3 ARG 96 1HG ARG 96 9.415 3.061 12.907
774 HD2 ARG 96 2HD ARG 96 9.719 3.703 15.280
775 HD3 ARG 96 1HD ARG 96 11.454 3.831 14.986
776 HE ARG 96 HE ARG 96 9.363 5.626 13.993
777 HH11 ARG 96 1HH1 ARG 96 12.759 4.745 14.131
778 HH12 ARG 96 2HH1 ARG 96 13.319 6.316 13.630
779 HH21 ARG 96 1HH2 ARG 96 10.092 7.685 13.295
780 HH22 ARG 96 2HH2 ARG 96 11.802 7.992 13.159
781 H GLY 97 HN GLY 97 8.852 -1.457 13.035
782 HA2 GLY 97 2HA GLY 97 10.757 -3.216 14.443
783 HA3 GLY 97 1HA GLY 97 9.082 -3.060 14.949
784 H TYR 98 HN TYR 98 10.434 -3.364 11.675
785 HA TYR 98 HA TYR 98 8.847 -5.836 11.374
786 HB2 TYR 98 2HB TYR 98 8.308 -3.890 9.865
787 HB3 TYR 98 1HB TYR 98 9.916 -4.059 9.175
788 HD1 TYR 98 1HD TYR 98 7.253 -6.534 10.072
789 HD2 TYR 98 2HD TYR 98 9.759 -4.905 7.045
790 HE1 TYR 98 1HE TYR 98 6.360 -8.163 8.462
791 HE2 TYR 98 2HE TYR 98 8.874 -6.534 5.428
792 HH TYR 98 HH TYR 98 6.123 -8.492 6.122
793 H LEU 99 HN LEU 99 9.869 -7.692 10.873
794 HA LEU 99 HA LEU 99 11.559 -9.179 10.817
795 HB2 LEU 99 2HB LEU 99 12.681 -7.201 8.852
796 HB3 LEU 99 1HB LEU 99 13.088 -8.887 9.001
797 HG LEU 99 HG LEU 99 10.388 -7.847 8.175
798 HD11 LEU 99 1HD1 LEU 99 12.067 -7.420 6.475
799 HD12 LEU 99 2HD1 LEU 99 10.979 -8.707 5.960
800 HD13 LEU 99 3HD1 LEU 99 12.594 -9.101 6.547
801 HD21 LEU 99 3HD2 LEU 99 10.242 -9.984 9.327
802 HD22 LEU 99 1HD2 LEU 99 11.494 -10.653 8.279
803 HD23 LEU 99 2HD2 LEU 99 9.932 -10.191 7.602
804 H GLU 100 HN GLU 100 11.828 -7.764 12.999
805 HA GLU 100 HA GLU 100 14.262 -6.373 13.320
806 HB2 GLU 100 2HB GLU 100 12.594 -7.813 15.397
807 HB3 GLU 100 1HB GLU 100 13.889 -6.676 15.743
808 HG2 GLU 100 2HG GLU 100 12.638 -4.913 14.582
809 HG3 GLU 100 1HG GLU 100 11.329 -6.053 14.289
810 H HIS 101 HN HIS 101 15.965 -7.424 12.527
811 HA HIS 101 HA HIS 101 16.883 -9.853 13.848
812 HB2 HIS 101 2HB HIS 101 15.449 -10.491 11.843
813 HB3 HIS 101 1HB HIS 101 16.646 -9.697 10.829
814 HD1 HIS 101 1HD HIS 101 16.103 -12.724 12.956
815 HD2 HIS 101 2HD HIS 101 18.999 -11.158 10.411
816 HE1 HIS 101 1HE HIS 101 17.704 -14.613 12.503
817 HE2 HIS 101 2HE HIS 101 19.336 -13.698 10.812
818 H HIS 102 HN HIS 102 18.546 -8.590 14.659
819 HA HIS 102 HA HIS 102 20.012 -6.775 13.009
820 HB2 HIS 102 2HB HIS 102 20.429 -7.802 15.813
821 HB3 HIS 102 1HB HIS 102 21.579 -6.717 15.037
822 HD1 HIS 102 1HD HIS 102 21.181 -4.330 15.523
823 HD2 HIS 102 2HD HIS 102 17.672 -6.557 15.748
824 HE1 HIS 102 1HE HIS 102 19.386 -2.707 16.205
825 HE2 HIS 102 2HE HIS 102 17.248 -4.033 16.158
826 H HIS 103 HN HIS 103 20.963 -7.721 11.330
827 HA HIS 103 HA HIS 103 23.036 -9.730 11.908
828 HB2 HIS 103 2HB HIS 103 20.984 -10.482 10.550
829 HB3 HIS 103 1HB HIS 103 21.585 -9.434 9.272
830 HD1 HIS 103 1HD HIS 103 22.314 -12.644 11.055
831 HD2 HIS 103 2HD HIS 103 23.786 -10.410 7.869
832 HE1 HIS 103 1HE HIS 103 23.913 -14.163 9.842
833 HE2 HIS 103 2HE HIS 103 24.794 -12.799 7.912
834 H HIS 104 HN HIS 104 25.015 -8.935 11.593
835 HA HIS 104 HA HIS 104 25.402 -6.265 10.756
836 HB2 HIS 104 2HB HIS 104 26.830 -7.341 12.421
837 HB3 HIS 104 1HB HIS 104 27.421 -8.474 11.213
838 HD1 HIS 104 1HD HIS 104 28.094 -5.199 12.685
839 HD2 HIS 104 2HD HIS 104 29.081 -7.200 9.172
840 HE1 HIS 104 1HE HIS 104 30.054 -3.952 11.718
841 HE2 HIS 104 2HE HIS 104 30.706 -5.246 9.651
842 H HIS 105 HN HIS 105 26.591 -9.292 9.256
843 HA HIS 105 HA HIS 105 27.516 -7.752 6.975
844 HB2 HIS 105 2HB HIS 105 28.946 -9.522 7.939
845 HB3 HIS 105 1HB HIS 105 27.726 -10.721 7.523
846 HD1 HIS 105 1HD HIS 105 29.031 -12.046 5.823
847 HD2 HIS 105 2HD HIS 105 29.017 -7.958 5.032
848 HE1 HIS 105 1HE HIS 105 30.067 -11.787 3.543
849 HE2 HIS 105 2HE HIS 105 30.185 -9.297 3.150
850 H HIS 106 HN HIS 106 26.258 -7.335 5.323
851 HA HIS 106 HA HIS 106 23.952 -9.062 4.794
852 HB2 HIS 106 2HB HIS 106 24.664 -6.341 3.679
853 HB3 HIS 106 1HB HIS 106 23.203 -7.237 3.289
854 HD1 HIS 106 1HD HIS 106 24.503 -4.767 5.578
855 HD2 HIS 106 2HD HIS 106 21.517 -7.661 5.672
856 HE1 HIS 106 1HE HIS 106 22.996 -4.125 7.490
857 HE2 HIS 106 2HE HIS 106 21.084 -5.773 7.384
Start of MODEL 20
1 H1 MET 1 H1 MET 1 -15.625 2.969 5.937
2 H2 MET 1 H2 MET 1 -15.641 4.659 5.929
3 H3 MET 1 H3 MET 1 -14.482 3.830 6.851
4 HA MET 1 HA MET 1 -14.700 3.798 3.895
5 HB2 MET 1 2HB MET 1 -13.874 5.943 4.824
6 HB3 MET 1 1HB MET 1 -12.617 5.066 5.685
7 HG2 MET 1 2HG MET 1 -11.585 5.930 3.763
8 HG3 MET 1 1HG MET 1 -11.836 4.219 3.447
9 HE1 MET 1 2HE MET 1 -14.478 7.128 3.379
10 HE2 MET 1 3HE MET 1 -14.470 7.556 1.669
11 HE3 MET 1 1HE MET 1 -13.050 7.878 2.663
12 H THR 2 HN THR 2 -13.819 2.056 3.010
13 HA THR 2 HA THR 2 -12.123 0.341 4.676
14 HB THR 2 HB THR 2 -12.391 -1.325 2.828
15 HG1 THR 2 1HG THR 2 -14.268 0.575 1.802
16 HG21 THR 2 3HG2 THR 2 -14.965 -0.224 3.968
17 HG22 THR 2 1HG2 THR 2 -13.887 -1.371 4.762
18 HG23 THR 2 2HG2 THR 2 -14.747 -1.839 3.295
19 H PHE 3 HN PHE 3 -10.206 -0.663 3.590
20 HA PHE 3 HA PHE 3 -8.436 1.337 2.721
21 HB2 PHE 3 2HB PHE 3 -7.698 -0.746 3.821
22 HB3 PHE 3 1HB PHE 3 -8.182 -1.663 2.397
23 HD1 PHE 3 1HD PHE 3 -5.890 1.035 3.522
24 HD2 PHE 3 2HD PHE 3 -6.697 -1.994 0.645
25 HE1 PHE 3 1HE PHE 3 -3.658 1.380 2.543
26 HE2 PHE 3 2HE PHE 3 -4.469 -1.654 -0.344
27 HZ PHE 3 HZ PHE 3 -2.948 0.032 0.605
28 H SER 4 HN SER 4 -10.293 -1.089 0.944
29 HA SER 4 HA SER 4 -9.252 -0.649 -1.611
30 HB2 SER 4 2HB SER 4 -12.097 -1.387 -0.872
31 HB3 SER 4 1HB SER 4 -11.349 -1.610 -2.453
32 HG SER 4 HG SER 4 -10.582 -2.850 -0.016
33 H GLU 5 HN GLU 5 -11.982 0.915 0.037
34 HA GLU 5 HA GLU 5 -12.741 2.599 -2.072
35 HB2 GLU 5 2HB GLU 5 -13.051 2.836 0.913
36 HB3 GLU 5 1HB GLU 5 -13.757 3.979 -0.210
37 HG2 GLU 5 2HG GLU 5 -15.105 2.272 -1.195
38 HG3 GLU 5 1HG GLU 5 -14.303 1.033 -0.234
39 H CYS 6 HN CYS 6 -10.605 3.155 0.697
40 HA CYS 6 HA CYS 6 -10.062 5.868 0.149
41 HB2 CYS 6 2HB CYS 6 -9.638 4.608 2.309
42 HB3 CYS 6 1HB CYS 6 -8.212 3.941 1.550
43 HG CYS 6 HG CYS 6 -7.614 6.916 0.988
44 H ALA 7 HN ALA 7 -8.270 2.905 -0.593
45 HA ALA 7 HA ALA 7 -6.150 4.093 -2.004
46 HB1 ALA 7 1HB ALA 7 -5.749 1.905 -2.970
47 HB2 ALA 7 2HB ALA 7 -7.349 1.365 -2.466
48 HB3 ALA 7 3HB ALA 7 -6.125 1.746 -1.253
49 H ALA 8 HN ALA 8 -9.280 2.855 -3.132
50 HA ALA 8 HA ALA 8 -8.906 3.371 -5.866
51 HB1 ALA 8 1HB ALA 8 -10.723 1.965 -4.999
52 HB2 ALA 8 2HB ALA 8 -11.321 3.231 -6.071
53 HB3 ALA 8 3HB ALA 8 -11.499 3.400 -4.324
54 H LEU 9 HN LEU 9 -10.163 5.409 -3.257
55 HA LEU 9 HA LEU 9 -10.889 7.607 -4.870
56 HB2 LEU 9 2HB LEU 9 -10.056 7.469 -1.975
57 HB3 LEU 9 1HB LEU 9 -10.639 8.933 -2.743
58 HG LEU 9 HG LEU 9 -12.204 6.380 -2.368
59 HD11 LEU 9 1HD1 LEU 9 -13.578 7.736 -0.860
60 HD12 LEU 9 2HD1 LEU 9 -12.475 9.095 -1.083
61 HD13 LEU 9 3HD1 LEU 9 -11.910 7.619 -0.301
62 HD21 LEU 9 3HD2 LEU 9 -12.820 7.470 -4.450
63 HD22 LEU 9 1HD2 LEU 9 -13.028 9.004 -3.607
64 HD23 LEU 9 2HD2 LEU 9 -14.105 7.652 -3.256
65 H TYR 10 HN TYR 10 -7.867 6.785 -3.217
66 HA TYR 10 HA TYR 10 -6.407 9.089 -3.823
67 HB2 TYR 10 2HB TYR 10 -5.564 7.380 -2.295
68 HB3 TYR 10 1HB TYR 10 -5.464 6.220 -3.611
69 HD1 TYR 10 2HD TYR 10 -4.123 9.536 -2.553
70 HD2 TYR 10 1HD TYR 10 -3.457 5.967 -4.774
71 HE1 TYR 10 2HE TYR 10 -1.817 10.255 -3.006
72 HE2 TYR 10 1HE TYR 10 -1.147 6.680 -5.234
73 HH TYR 10 HH TYR 10 0.168 8.724 -5.325
74 H ILE 11 HN ILE 11 -6.831 6.099 -5.634
75 HA ILE 11 HA ILE 11 -5.217 6.852 -7.848
76 HB ILE 11 HB ILE 11 -7.389 4.764 -7.606
77 HG12 ILE 11 2HG1 ILE 11 -4.376 4.477 -7.581
78 HG13 ILE 11 1HG1 ILE 11 -5.383 4.519 -6.138
79 HG21 ILE 11 1HG2 ILE 11 -7.133 5.323 -9.938
80 HG22 ILE 11 2HG2 ILE 11 -6.382 3.757 -9.631
81 HG23 ILE 11 3HG2 ILE 11 -5.380 5.193 -9.816
82 HD11 ILE 11 3HD1 ILE 11 -6.503 2.492 -6.837
83 HD12 ILE 11 1HD1 ILE 11 -4.757 2.252 -6.764
84 HD13 ILE 11 2HD1 ILE 11 -5.555 2.463 -8.323
85 H LYS 12 HN LYS 12 -8.732 6.821 -7.348
86 HA LYS 12 HA LYS 12 -9.417 7.665 -9.954
87 HB2 LYS 12 2HB LYS 12 -10.958 6.469 -8.491
88 HB3 LYS 12 1HB LYS 12 -10.960 7.809 -7.358
89 HG2 LYS 12 2HG LYS 12 -12.156 9.193 -8.865
90 HG3 LYS 12 1HG LYS 12 -11.934 8.046 -10.191
91 HD2 LYS 12 2HD LYS 12 -13.339 6.428 -9.105
92 HD3 LYS 12 1HD LYS 12 -13.440 7.423 -7.652
93 HE2 LYS 12 2HE LYS 12 -14.438 8.305 -10.352
94 HE3 LYS 12 1HE LYS 12 -15.451 7.494 -9.159
95 HZ1 LYS 12 3HZ LYS 12 -14.037 10.082 -8.759
96 HZ2 LYS 12 1HZ LYS 12 -15.013 9.301 -7.612
97 HZ3 LYS 12 2HZ LYS 12 -15.699 9.890 -9.044
98 H ALA 13 HN ALA 13 -8.747 9.466 -6.987
99 HA ALA 13 HA ALA 13 -9.597 11.970 -8.130
100 HB1 ALA 13 1HB ALA 13 -8.754 12.981 -6.094
101 HB2 ALA 13 2HB ALA 13 -7.957 11.472 -5.647
102 HB3 ALA 13 3HB ALA 13 -9.718 11.554 -5.713
103 H HIS 14 HN HIS 14 -7.041 10.093 -8.885
104 HA HIS 14 HA HIS 14 -5.496 12.436 -9.749
105 HB2 HIS 14 2HB HIS 14 -4.343 9.968 -8.436
106 HB3 HIS 14 1HB HIS 14 -3.379 11.149 -9.313
107 HD1 HIS 14 1HD HIS 14 -4.770 10.419 -6.034
108 HD2 HIS 14 2HD HIS 14 -3.435 13.795 -8.055
109 HE1 HIS 14 1HE HIS 14 -4.395 12.163 -4.261
110 HE2 HIS 14 2HE HIS 14 -3.857 14.263 -5.545
111 H ARG 15 HN ARG 15 -7.265 9.975 -10.791
112 HA ARG 15 HA ARG 15 -5.563 8.555 -12.537
113 HB2 ARG 15 2HB ARG 15 -7.683 7.896 -13.710
114 HB3 ARG 15 1HB ARG 15 -7.670 7.574 -11.987
115 HG2 ARG 15 2HG ARG 15 -9.070 9.478 -11.566
116 HG3 ARG 15 1HG ARG 15 -8.973 9.969 -13.258
117 HD2 ARG 15 2HD ARG 15 -10.095 7.318 -12.388
118 HD3 ARG 15 1HD ARG 15 -11.087 8.767 -12.549
119 HE ARG 15 HE ARG 15 -9.904 8.675 -14.942
120 HH11 ARG 15 1HH1 ARG 15 -11.497 6.159 -13.080
121 HH12 ARG 15 2HH1 ARG 15 -12.050 5.294 -14.484
122 HH21 ARG 15 1HH2 ARG 15 -10.648 7.552 -16.775
123 HH22 ARG 15 2HH2 ARG 15 -11.601 6.113 -16.588
124 H SER 16 HN SER 16 -7.532 11.464 -12.997
125 HA SER 16 HA SER 16 -6.910 11.772 -15.739
126 HB2 SER 16 2HB SER 16 -7.805 13.806 -13.690
127 HB3 SER 16 1HB SER 16 -7.840 14.017 -15.432
128 HG SER 16 HG SER 16 -9.512 12.558 -13.787
129 H SER 17 HN SER 17 -5.222 12.451 -12.828
130 HA SER 17 HA SER 17 -3.395 14.345 -13.977
131 HB2 SER 17 2HB SER 17 -3.064 12.743 -11.438
132 HB3 SER 17 1HB SER 17 -2.319 14.286 -11.847
133 HG SER 17 HG SER 17 -4.894 14.688 -12.063
134 H TRP 18 HN TRP 18 -3.451 10.896 -13.223
135 HA TRP 18 HA TRP 18 -0.713 10.461 -13.944
136 HB2 TRP 18 2HB TRP 18 -2.974 8.510 -13.481
137 HB3 TRP 18 1HB TRP 18 -1.294 8.051 -13.725
138 HD1 TRP 18 1HD TRP 18 -0.586 10.811 -11.737
139 HE1 TRP 18 1HE TRP 18 -0.594 10.307 -9.206
140 HE3 TRP 18 3HE TRP 18 -3.199 6.432 -11.808
141 HZ2 TRP 18 2HZ TRP 18 -1.571 8.291 -7.478
142 HZ3 TRP 18 3HZ TRP 18 -3.615 5.267 -9.687
143 HH2 TRP 18 2HH TRP 18 -2.825 6.180 -7.564
144 H LYS 19 HN LYS 19 -3.809 10.206 -15.597
145 HA LYS 19 HA LYS 19 -4.321 10.076 -17.753
146 HB2 LYS 19 2HB LYS 19 -1.362 10.427 -18.078
147 HB3 LYS 19 1HB LYS 19 -2.468 10.254 -19.440
148 HG2 LYS 19 2HG LYS 19 -2.670 12.379 -17.333
149 HG3 LYS 19 1HG LYS 19 -1.978 12.593 -18.945
150 HD2 LYS 19 2HD LYS 19 -4.109 12.035 -19.965
151 HD3 LYS 19 1HD LYS 19 -4.813 11.718 -18.380
152 HE2 LYS 19 2HE LYS 19 -4.455 14.060 -17.762
153 HE3 LYS 19 1HE LYS 19 -3.768 14.372 -19.357
154 HZ1 LYS 19 3HZ LYS 19 -5.867 13.862 -20.366
155 HZ2 LYS 19 1HZ LYS 19 -6.121 15.021 -19.153
156 HZ3 LYS 19 2HZ LYS 19 -6.537 13.402 -18.877
157 H ASN 20 HN ASN 20 -4.048 7.062 -19.206
158 HA ASN 20 HA ASN 20 -2.527 6.996 -20.802
159 HB2 ASN 20 2HB ASN 20 -2.184 9.368 -20.945
160 HB3 ASN 20 1HB ASN 20 -1.167 9.345 -19.508
161 HD21 ASN 20 1HD2 ASN 20 0.933 8.965 -19.687
162 HD22 ASN 20 2HD2 ASN 20 1.741 8.607 -21.179
163 H THR 21 HN THR 21 -1.069 5.586 -21.096
164 HA THR 21 HA THR 21 0.309 3.852 -20.719
165 HB THR 21 HB THR 21 2.171 3.936 -19.231
166 HG1 THR 21 1HG THR 21 0.792 6.073 -17.955
167 HG21 THR 21 3HG2 THR 21 3.232 6.063 -19.833
168 HG22 THR 21 1HG2 THR 21 1.665 6.690 -20.349
169 HG23 THR 21 2HG2 THR 21 2.394 5.326 -21.200
170 H LYS 22 HN LYS 22 0.963 2.183 -19.012
171 HA LYS 22 HA LYS 22 -1.487 1.399 -17.682
172 HB2 LYS 22 2HB LYS 22 1.175 0.049 -18.107
173 HB3 LYS 22 1HB LYS 22 -0.117 -0.673 -17.160
174 HG2 LYS 22 2HG LYS 22 -0.618 0.239 -19.963
175 HG3 LYS 22 1HG LYS 22 0.149 -1.317 -19.646
176 HD2 LYS 22 2HD LYS 22 -2.463 -0.503 -18.391
177 HD3 LYS 22 1HD LYS 22 -2.370 -1.339 -19.942
178 HE2 LYS 22 2HE LYS 22 -1.144 -3.174 -18.854
179 HE3 LYS 22 1HE LYS 22 -1.287 -2.340 -17.310
180 HZ1 LYS 22 3HZ LYS 22 -2.951 -4.121 -17.674
181 HZ2 LYS 22 1HZ LYS 22 -3.612 -3.210 -18.940
182 HZ3 LYS 22 2HZ LYS 22 -3.644 -2.606 -17.355
183 H HIS 23 HN HIS 23 0.590 3.533 -16.720
184 HA HIS 23 HA HIS 23 1.643 2.681 -14.251
185 HB2 HIS 23 2HB HIS 23 1.737 4.996 -15.756
186 HB3 HIS 23 1HB HIS 23 0.825 5.503 -14.339
187 HD1 HIS 23 1HD HIS 23 2.296 6.482 -12.617
188 HD2 HIS 23 2HD HIS 23 4.233 3.515 -14.808
189 HE1 HIS 23 1HE HIS 23 4.619 6.333 -11.656
190 HE2 HIS 23 2HE HIS 23 5.746 4.464 -12.919
191 H ALA 24 HN ALA 24 -1.425 4.314 -15.019
192 HA ALA 24 HA ALA 24 -2.367 4.411 -12.346
193 HB1 ALA 24 1HB ALA 24 -3.272 5.846 -14.119
194 HB2 ALA 24 2HB ALA 24 -4.546 4.913 -13.336
195 HB3 ALA 24 3HB ALA 24 -3.950 4.430 -14.923
196 H ASP 25 HN ASP 25 -2.612 2.057 -14.930
197 HA ASP 25 HA ASP 25 -4.472 0.298 -13.750
198 HB2 ASP 25 2HB ASP 25 -3.795 0.178 -16.124
199 HB3 ASP 25 1HB ASP 25 -2.184 -0.330 -15.635
200 H GLN 26 HN GLN 26 -0.943 0.405 -13.703
201 HA GLN 26 HA GLN 26 -0.438 -1.862 -12.191
202 HB2 GLN 26 2HB GLN 26 1.036 0.722 -12.591
203 HB3 GLN 26 1HB GLN 26 1.677 -0.519 -11.533
204 HG2 GLN 26 2HG GLN 26 1.656 -2.109 -13.395
205 HG3 GLN 26 1HG GLN 26 1.037 -0.841 -14.452
206 HE21 GLN 26 1HE2 GLN 26 2.820 -0.978 -15.804
207 HE22 GLN 26 2HE2 GLN 26 4.376 -0.365 -15.354
208 H TRP 27 HN TRP 27 -1.123 1.446 -11.116
209 HA TRP 27 HA TRP 27 -0.704 1.043 -8.374
210 HB2 TRP 27 2HB TRP 27 -2.316 2.975 -9.982
211 HB3 TRP 27 1HB TRP 27 -2.580 2.901 -8.244
212 HD1 TRP 27 1HD TRP 27 0.062 3.920 -10.831
213 HE1 TRP 27 1HE TRP 27 1.837 5.370 -9.641
214 HE3 TRP 27 3HE TRP 27 -1.489 3.308 -5.997
215 HZ2 TRP 27 2HZ TRP 27 2.490 6.134 -7.007
216 HZ3 TRP 27 3HZ TRP 27 -0.233 4.428 -4.203
217 HH2 TRP 27 2HH TRP 27 1.715 5.811 -4.698
218 H THR 28 HN THR 28 -3.698 0.764 -10.276
219 HA THR 28 HA THR 28 -5.300 -0.028 -8.064
220 HB THR 28 HB THR 28 -5.881 -0.534 -10.982
221 HG1 THR 28 1HG THR 28 -5.657 1.811 -9.583
222 HG21 THR 28 3HG2 THR 28 -7.679 -0.112 -8.592
223 HG22 THR 28 1HG2 THR 28 -7.414 -1.636 -9.439
224 HG23 THR 28 2HG2 THR 28 -8.223 -0.300 -10.258
225 H ASN 29 HN ASN 29 -3.710 -1.798 -10.678
226 HA ASN 29 HA ASN 29 -4.961 -4.270 -10.328
227 HB2 ASN 29 2HB ASN 29 -3.569 -3.436 -12.285
228 HB3 ASN 29 1HB ASN 29 -2.144 -3.847 -11.343
229 HD21 ASN 29 1HD2 ASN 29 -3.092 -4.854 -13.902
230 HD22 ASN 29 2HD2 ASN 29 -3.234 -6.571 -13.717
231 H THR 30 HN THR 30 -1.823 -3.149 -9.033
232 HA THR 30 HA THR 30 -1.175 -5.629 -7.845
233 HB THR 30 HB THR 30 -0.181 -2.931 -6.953
234 HG1 THR 30 1HG THR 30 0.582 -4.554 -9.175
235 HG21 THR 30 3HG2 THR 30 1.143 -5.642 -6.949
236 HG22 THR 30 1HG2 THR 30 0.437 -4.853 -5.540
237 HG23 THR 30 2HG2 THR 30 1.833 -4.136 -6.342
238 H ILE 31 HN ILE 31 -2.628 -2.666 -6.492
239 HA ILE 31 HA ILE 31 -2.732 -3.594 -3.827
240 HB ILE 31 HB ILE 31 -4.446 -1.511 -5.193
241 HG12 ILE 31 2HG1 ILE 31 -1.988 -1.207 -3.455
242 HG13 ILE 31 1HG1 ILE 31 -2.020 -1.023 -5.208
243 HG21 ILE 31 1HG2 ILE 31 -5.535 -2.324 -3.177
244 HG22 ILE 31 2HG2 ILE 31 -4.934 -0.684 -2.935
245 HG23 ILE 31 3HG2 ILE 31 -4.058 -2.053 -2.252
246 HD11 ILE 31 3HD1 ILE 31 -2.025 1.132 -4.083
247 HD12 ILE 31 1HD1 ILE 31 -3.499 0.694 -3.219
248 HD13 ILE 31 2HD1 ILE 31 -3.526 0.883 -4.971
249 H LYS 32 HN LYS 32 -5.107 -3.619 -6.444
250 HA LYS 32 HA LYS 32 -7.276 -4.661 -5.027
251 HB2 LYS 32 2HB LYS 32 -7.269 -3.723 -7.382
252 HB3 LYS 32 1HB LYS 32 -6.590 -5.254 -7.911
253 HG2 LYS 32 2HG LYS 32 -8.853 -5.919 -6.405
254 HG3 LYS 32 1HG LYS 32 -9.324 -4.550 -7.414
255 HD2 LYS 32 2HD LYS 32 -9.774 -6.538 -8.654
256 HD3 LYS 32 1HD LYS 32 -8.351 -5.785 -9.375
257 HE2 LYS 32 2HE LYS 32 -6.923 -7.315 -8.065
258 HE3 LYS 32 1HE LYS 32 -8.372 -8.104 -7.448
259 HZ1 LYS 32 3HZ LYS 32 -7.350 -8.073 -10.221
260 HZ2 LYS 32 1HZ LYS 32 -8.945 -8.524 -9.853
261 HZ3 LYS 32 2HZ LYS 32 -7.649 -9.409 -9.222
262 H THR 33 HN THR 33 -4.502 -6.219 -6.503
263 HA THR 33 HA THR 33 -5.671 -8.854 -6.335
264 HB THR 33 HB THR 33 -2.865 -8.033 -7.125
265 HG1 THR 33 1HG THR 33 -4.129 -7.179 -8.675
266 HG21 THR 33 3HG2 THR 33 -2.817 -10.229 -8.258
267 HG22 THR 33 1HG2 THR 33 -4.387 -10.611 -7.552
268 HG23 THR 33 2HG2 THR 33 -2.983 -10.387 -6.508
269 H TYR 34 HN TYR 34 -2.842 -7.240 -4.862
270 HA TYR 34 HA TYR 34 -2.350 -9.541 -3.203
271 HB2 TYR 34 2HB TYR 34 -0.966 -6.877 -3.450
272 HB3 TYR 34 1HB TYR 34 -0.470 -8.118 -2.298
273 HD1 TYR 34 2HD TYR 34 0.196 -10.391 -3.191
274 HD2 TYR 34 1HD TYR 34 -0.265 -6.990 -5.703
275 HE1 TYR 34 2HE TYR 34 1.519 -11.510 -4.937
276 HE2 TYR 34 1HE TYR 34 1.052 -8.098 -7.461
277 HH TYR 34 HH TYR 34 1.750 -11.393 -7.422
278 H CYS 35 HN CYS 35 -3.371 -6.181 -2.601
279 HA CYS 35 HA CYS 35 -3.510 -6.667 0.242
280 HB2 CYS 35 2HB CYS 35 -4.390 -4.258 -1.363
281 HB3 CYS 35 1HB CYS 35 -4.228 -4.329 0.390
282 HG CYS 35 HG CYS 35 -1.388 -5.018 0.047
283 H GLY 36 HN GLY 36 -5.670 -6.686 -2.448
284 HA2 GLY 36 2HA GLY 36 -8.132 -6.089 -1.449
285 HA3 GLY 36 1HA GLY 36 -7.857 -7.329 -2.658
286 HA PRO 37 HA PRO 37 -9.189 -10.596 -0.116
287 HB2 PRO 37 2HB PRO 37 -7.110 -12.336 0.235
288 HB3 PRO 37 1HB PRO 37 -8.037 -12.185 -1.262
289 HG2 PRO 37 2HG PRO 37 -5.394 -10.972 -0.541
290 HG3 PRO 37 1HG PRO 37 -5.888 -11.760 -2.052
291 HD2 PRO 37 2HD PRO 37 -5.800 -9.090 -1.839
292 HD3 PRO 37 1HD PRO 37 -7.076 -9.899 -2.776
293 H VAL 38 HN VAL 38 -6.669 -8.712 1.195
294 HA VAL 38 HA VAL 38 -7.050 -9.993 3.821
295 HB VAL 38 HB VAL 38 -4.640 -8.389 2.957
296 HG11 VAL 38 1HG1 VAL 38 -3.633 -9.234 5.029
297 HG12 VAL 38 2HG1 VAL 38 -5.145 -10.051 5.431
298 HG13 VAL 38 3HG1 VAL 38 -5.086 -8.290 5.362
299 HG21 VAL 38 3HG2 VAL 38 -4.947 -11.379 3.263
300 HG22 VAL 38 1HG2 VAL 38 -3.443 -10.528 2.917
301 HG23 VAL 38 2HG2 VAL 38 -4.757 -10.509 1.740
302 H ILE 39 HN ILE 39 -5.718 -6.822 2.861
303 HA ILE 39 HA ILE 39 -7.224 -5.657 5.074
304 HB ILE 39 HB ILE 39 -5.787 -3.665 4.745
305 HG12 ILE 39 2HG1 ILE 39 -4.396 -5.388 2.681
306 HG13 ILE 39 1HG1 ILE 39 -5.360 -3.955 2.335
307 HG21 ILE 39 1HG2 ILE 39 -3.711 -4.700 5.556
308 HG22 ILE 39 2HG2 ILE 39 -4.327 -6.281 5.072
309 HG23 ILE 39 3HG2 ILE 39 -5.140 -5.367 6.344
310 HD11 ILE 39 3HD1 ILE 39 -2.973 -3.479 2.253
311 HD12 ILE 39 1HD1 ILE 39 -2.803 -4.011 3.924
312 HD13 ILE 39 2HD1 ILE 39 -3.758 -2.576 3.549
313 H GLY 40 HN GLY 40 -7.642 -6.073 1.838
314 HA2 GLY 40 2HA GLY 40 -8.414 -3.666 0.757
315 HA3 GLY 40 1HA GLY 40 -9.132 -5.208 0.332
316 HA PRO 41 HA PRO 41 -12.886 -3.957 2.246
317 HB2 PRO 41 2HB PRO 41 -13.429 -6.367 3.718
318 HB3 PRO 41 1HB PRO 41 -14.046 -5.887 2.137
319 HG2 PRO 41 2HG PRO 41 -12.316 -7.981 2.542
320 HG3 PRO 41 1HG PRO 41 -12.474 -7.097 1.015
321 HD2 PRO 41 2HD PRO 41 -10.416 -6.808 3.171
322 HD3 PRO 41 1HD PRO 41 -10.216 -6.764 1.405
323 H LEU 42 HN LEU 42 -10.294 -4.267 4.211
324 HA LEU 42 HA LEU 42 -11.700 -4.014 6.741
325 HB2 LEU 42 2HB LEU 42 -8.750 -3.864 6.099
326 HB3 LEU 42 1HB LEU 42 -9.432 -3.790 7.712
327 HG LEU 42 HG LEU 42 -9.533 -6.151 5.835
328 HD11 LEU 42 1HD1 LEU 42 -8.109 -5.796 8.468
329 HD12 LEU 42 2HD1 LEU 42 -7.345 -5.732 6.880
330 HD13 LEU 42 3HD1 LEU 42 -8.086 -7.230 7.444
331 HD21 LEU 42 3HD2 LEU 42 -10.586 -7.355 7.678
332 HD22 LEU 42 1HD2 LEU 42 -11.584 -5.999 7.158
333 HD23 LEU 42 2HD2 LEU 42 -10.628 -5.874 8.635
334 H SER 43 HN SER 43 -11.412 -2.157 8.129
335 HA SER 43 HA SER 43 -11.839 0.300 6.925
336 HB2 SER 43 2HB SER 43 -10.813 -0.204 9.721
337 HB3 SER 43 1HB SER 43 -11.837 1.104 9.161
338 HG SER 43 HG SER 43 -13.002 -0.572 10.255
339 H VAL 44 HN VAL 44 -10.509 1.977 6.410
340 HA VAL 44 HA VAL 44 -7.832 1.396 5.761
341 HB VAL 44 HB VAL 44 -9.192 3.022 4.513
342 HG11 VAL 44 1HG1 VAL 44 -9.520 5.291 5.380
343 HG12 VAL 44 2HG1 VAL 44 -8.856 4.785 6.933
344 HG13 VAL 44 3HG1 VAL 44 -10.366 4.084 6.349
345 HG21 VAL 44 3HG2 VAL 44 -7.451 4.761 4.236
346 HG22 VAL 44 1HG2 VAL 44 -6.790 3.126 4.260
347 HG23 VAL 44 2HG2 VAL 44 -6.653 4.151 5.686
348 H GLN 45 HN GLN 45 -9.243 2.737 8.636
349 HA GLN 45 HA GLN 45 -6.786 3.884 9.604
350 HB2 GLN 45 2HB GLN 45 -9.149 4.669 10.159
351 HB3 GLN 45 1HB GLN 45 -9.264 3.271 11.214
352 HG2 GLN 45 2HG GLN 45 -6.926 5.036 11.592
353 HG3 GLN 45 1HG GLN 45 -8.498 5.687 12.043
354 HE21 GLN 45 1HE2 GLN 45 -6.061 3.321 12.757
355 HE22 GLN 45 2HE2 GLN 45 -6.699 2.840 14.289
356 H ASP 46 HN ASP 46 -8.540 0.891 9.907
357 HA ASP 46 HA ASP 46 -7.189 -0.095 12.203
358 HB2 ASP 46 2HB ASP 46 -8.960 -1.352 10.127
359 HB3 ASP 46 1HB ASP 46 -8.175 -2.324 11.366
360 H VAL 47 HN VAL 47 -6.360 0.041 8.887
361 HA VAL 47 HA VAL 47 -4.716 -2.225 8.659
362 HB VAL 47 HB VAL 47 -4.377 0.442 7.274
363 HG11 VAL 47 1HG1 VAL 47 -3.363 -2.298 6.526
364 HG12 VAL 47 2HG1 VAL 47 -2.385 -0.942 7.088
365 HG13 VAL 47 3HG1 VAL 47 -3.220 -0.845 5.537
366 HG21 VAL 47 3HG2 VAL 47 -5.656 -0.572 5.447
367 HG22 VAL 47 1HG2 VAL 47 -6.604 -0.471 6.930
368 HG23 VAL 47 2HG2 VAL 47 -5.909 -2.014 6.431
369 H ASP 48 HN ASP 48 -3.146 -2.695 10.053
370 HA ASP 48 HA ASP 48 -1.232 -0.567 10.757
371 HB2 ASP 48 2HB ASP 48 -0.977 -1.444 12.941
372 HB3 ASP 48 1HB ASP 48 -2.711 -1.409 12.659
373 H THR 49 HN THR 49 0.736 -1.982 11.909
374 HA THR 49 HA THR 49 2.213 -2.899 9.726
375 HB THR 49 HB THR 49 2.779 -3.649 12.591
376 HG1 THR 49 1HG THR 49 3.961 -1.559 12.521
377 HG21 THR 49 3HG2 THR 49 4.560 -3.048 10.225
378 HG22 THR 49 1HG2 THR 49 4.262 -4.636 10.932
379 HG23 THR 49 2HG2 THR 49 5.120 -3.406 11.859
380 H LYS 50 HN LYS 50 0.428 -4.690 12.208
381 HA LYS 50 HA LYS 50 1.430 -7.253 11.640
382 HB2 LYS 50 2HB LYS 50 0.184 -6.560 13.681
383 HB3 LYS 50 1HB LYS 50 -1.280 -6.472 12.726
384 HG2 LYS 50 2HG LYS 50 0.235 -9.031 12.818
385 HG3 LYS 50 1HG LYS 50 -0.761 -8.558 14.192
386 HD2 LYS 50 2HD LYS 50 -2.664 -8.252 12.578
387 HD3 LYS 50 1HD LYS 50 -1.643 -8.989 11.342
388 HE2 LYS 50 2HE LYS 50 -3.124 -10.645 12.311
389 HE3 LYS 50 1HE LYS 50 -1.448 -11.009 12.724
390 HZ1 LYS 50 3HZ LYS 50 -3.335 -9.581 14.524
391 HZ2 LYS 50 1HZ LYS 50 -1.784 -10.140 14.913
392 HZ3 LYS 50 2HZ LYS 50 -3.031 -11.243 14.598
393 H LEU 51 HN LEU 51 -1.429 -5.543 10.472
394 HA LEU 51 HA LEU 51 -2.430 -7.638 8.878
395 HB2 LEU 51 2HB LEU 51 -2.825 -4.657 8.677
396 HB3 LEU 51 1HB LEU 51 -3.757 -5.842 7.792
397 HG LEU 51 HG LEU 51 -3.700 -5.503 10.783
398 HD11 LEU 51 1HD1 LEU 51 -5.849 -4.959 8.744
399 HD12 LEU 51 2HD1 LEU 51 -4.941 -3.751 9.656
400 HD13 LEU 51 3HD1 LEU 51 -6.044 -4.846 10.494
401 HD21 LEU 51 3HD2 LEU 51 -5.288 -7.424 9.089
402 HD22 LEU 51 1HD2 LEU 51 -5.442 -7.208 10.833
403 HD23 LEU 51 2HD2 LEU 51 -3.946 -7.852 10.152
404 H ILE 52 HN ILE 52 -0.235 -4.961 8.199
405 HA ILE 52 HA ILE 52 -0.104 -5.402 5.398
406 HB ILE 52 HB ILE 52 1.831 -3.968 7.224
407 HG12 ILE 52 2HG1 ILE 52 -0.353 -2.910 5.414
408 HG13 ILE 52 1HG1 ILE 52 -0.458 -3.032 7.164
409 HG21 ILE 52 1HG2 ILE 52 2.692 -2.900 5.201
410 HG22 ILE 52 2HG2 ILE 52 1.625 -3.900 4.216
411 HG23 ILE 52 3HG2 ILE 52 2.922 -4.649 5.148
412 HD11 ILE 52 3HD1 ILE 52 0.030 -0.762 6.456
413 HD12 ILE 52 1HD1 ILE 52 1.490 -1.320 5.641
414 HD13 ILE 52 2HD1 ILE 52 1.364 -1.432 7.397
415 H MET 53 HN MET 53 1.885 -6.479 8.128
416 HA MET 53 HA MET 53 3.957 -7.665 6.664
417 HB2 MET 53 2HB MET 53 2.847 -8.202 9.402
418 HB3 MET 53 1HB MET 53 4.133 -9.204 8.743
419 HG2 MET 53 2HG MET 53 5.505 -7.172 8.440
420 HG3 MET 53 1HG MET 53 4.230 -6.233 9.213
421 HE1 MET 53 3HE MET 53 7.157 -6.445 11.881
422 HE2 MET 53 1HE MET 53 6.232 -5.366 10.838
423 HE3 MET 53 2HE MET 53 7.401 -6.485 10.135
424 H LYS 54 HN LYS 54 0.851 -9.006 7.718
425 HA LYS 54 HA LYS 54 1.270 -11.653 6.986
426 HB2 LYS 54 2HB LYS 54 -1.251 -10.003 7.017
427 HB3 LYS 54 1HB LYS 54 -1.246 -11.724 6.653
428 HG2 LYS 54 2HG LYS 54 -0.064 -12.020 8.893
429 HG3 LYS 54 1HG LYS 54 -0.544 -10.355 9.227
430 HD2 LYS 54 2HD LYS 54 -2.150 -11.980 10.140
431 HD3 LYS 54 1HD LYS 54 -2.885 -10.946 8.912
432 HE2 LYS 54 2HE LYS 54 -2.617 -12.698 7.250
433 HE3 LYS 54 1HE LYS 54 -1.822 -13.726 8.438
434 HZ1 LYS 54 3HZ LYS 54 -4.576 -12.718 8.831
435 HZ2 LYS 54 1HZ LYS 54 -3.802 -14.008 9.616
436 HZ3 LYS 54 2HZ LYS 54 -4.251 -14.154 7.986
437 H VAL 55 HN VAL 55 0.318 -8.900 5.016
438 HA VAL 55 HA VAL 55 -0.274 -10.425 2.678
439 HB VAL 55 HB VAL 55 0.425 -7.491 2.870
440 HG11 VAL 55 1HG1 VAL 55 -0.878 -7.308 0.783
441 HG12 VAL 55 2HG1 VAL 55 -1.037 -9.065 0.753
442 HG13 VAL 55 3HG1 VAL 55 0.555 -8.318 0.601
443 HG21 VAL 55 3HG2 VAL 55 -2.269 -8.836 3.025
444 HG22 VAL 55 1HG2 VAL 55 -1.992 -7.095 2.948
445 HG23 VAL 55 2HG2 VAL 55 -1.434 -8.016 4.345
446 H LEU 56 HN LEU 56 2.510 -8.502 3.744
447 HA LEU 56 HA LEU 56 3.909 -8.791 1.264
448 HB2 LEU 56 2HB LEU 56 4.828 -7.799 3.958
449 HB3 LEU 56 1HB LEU 56 5.787 -7.719 2.495
450 HG LEU 56 HG LEU 56 3.145 -6.329 2.928
451 HD11 LEU 56 1HD1 LEU 56 4.884 -5.353 4.283
452 HD12 LEU 56 2HD1 LEU 56 4.516 -4.287 2.925
453 HD13 LEU 56 3HD1 LEU 56 5.969 -5.287 2.895
454 HD21 LEU 56 3HD2 LEU 56 5.105 -6.134 0.643
455 HD22 LEU 56 1HD2 LEU 56 3.623 -5.198 0.831
456 HD23 LEU 56 2HD2 LEU 56 3.538 -6.942 0.584
457 H ASP 57 HN ASP 57 3.945 -10.495 4.304
458 HA ASP 57 HA ASP 57 6.487 -11.500 4.433
459 HB2 ASP 57 2HB ASP 57 4.520 -11.778 6.068
460 HB3 ASP 57 1HB ASP 57 4.133 -13.218 5.148
461 HA PRO 58 HA PRO 58 5.445 -15.411 1.871
462 HB2 PRO 58 2HB PRO 58 3.167 -15.508 0.415
463 HB3 PRO 58 1HB PRO 58 3.247 -16.033 2.100
464 HG2 PRO 58 2HG PRO 58 2.251 -13.451 0.965
465 HG3 PRO 58 1HG PRO 58 1.557 -14.447 2.258
466 HD2 PRO 58 2HD PRO 58 3.036 -12.215 2.732
467 HD3 PRO 58 1HD PRO 58 2.980 -13.592 3.847
468 H ILE 59 HN ILE 59 4.868 -12.220 0.698
469 HA ILE 59 HA ILE 59 5.123 -12.884 -2.098
470 HB ILE 59 HB ILE 59 5.312 -10.148 -0.815
471 HG12 ILE 59 2HG1 ILE 59 2.907 -11.561 -1.998
472 HG13 ILE 59 1HG1 ILE 59 3.173 -11.259 -0.284
473 HG21 ILE 59 1HG2 ILE 59 6.215 -10.255 -3.087
474 HG22 ILE 59 2HG2 ILE 59 4.723 -9.316 -3.031
475 HG23 ILE 59 3HG2 ILE 59 4.702 -10.964 -3.658
476 HD11 ILE 59 3HD1 ILE 59 3.107 -8.842 -0.724
477 HD12 ILE 59 1HD1 ILE 59 1.614 -9.657 -1.186
478 HD13 ILE 59 2HD1 ILE 59 2.778 -9.180 -2.424
479 H TRP 60 HN TRP 60 7.260 -11.934 0.494
480 HA TRP 60 HA TRP 60 9.408 -10.914 -0.965
481 HB2 TRP 60 2HB TRP 60 9.436 -12.500 1.606
482 HB3 TRP 60 1HB TRP 60 10.828 -11.644 0.957
483 HD1 TRP 60 1HD TRP 60 8.241 -11.200 3.433
484 HE1 TRP 60 1HE TRP 60 7.891 -8.720 4.022
485 HE3 TRP 60 3HE TRP 60 10.707 -9.069 -0.507
486 HZ2 TRP 60 2HZ TRP 60 8.561 -6.192 2.956
487 HZ3 TRP 60 3HZ TRP 60 10.807 -6.612 -0.648
488 HH2 TRP 60 2HH TRP 60 9.755 -5.206 1.049
489 H GLU 61 HN GLU 61 8.440 -14.236 -0.422
490 HA GLU 61 HA GLU 61 10.885 -15.373 -1.351
491 HB2 GLU 61 2HB GLU 61 8.164 -16.426 -0.653
492 HB3 GLU 61 1HB GLU 61 9.375 -17.457 -1.378
493 HG2 GLU 61 2HG GLU 61 9.639 -15.971 1.218
494 HG3 GLU 61 1HG GLU 61 9.374 -17.703 1.026
495 H GLN 62 HN GLN 62 7.828 -14.475 -2.767
496 HA GLN 62 HA GLN 62 8.360 -15.974 -5.202
497 HB2 GLN 62 2HB GLN 62 6.002 -14.361 -4.237
498 HB3 GLN 62 1HB GLN 62 6.092 -15.042 -5.854
499 HG2 GLN 62 2HG GLN 62 6.135 -17.260 -5.008
500 HG3 GLN 62 1HG GLN 62 6.351 -16.689 -3.355
501 HE21 GLN 62 1HE2 GLN 62 4.544 -17.858 -2.690
502 HE22 GLN 62 2HE2 GLN 62 2.937 -17.311 -3.038
503 H LYS 63 HN LYS 63 7.600 -12.607 -4.333
504 HA LYS 63 HA LYS 63 9.203 -11.679 -6.595
505 HB2 LYS 63 2HB LYS 63 6.320 -10.879 -6.123
506 HB3 LYS 63 1HB LYS 63 7.392 -10.132 -7.299
507 HG2 LYS 63 2HG LYS 63 7.410 -12.026 -8.663
508 HG3 LYS 63 1HG LYS 63 6.816 -13.072 -7.373
509 HD2 LYS 63 2HD LYS 63 5.056 -12.671 -8.976
510 HD3 LYS 63 1HD LYS 63 4.658 -11.883 -7.448
511 HE2 LYS 63 2HE LYS 63 5.425 -9.745 -8.362
512 HE3 LYS 63 1HE LYS 63 5.828 -10.543 -9.884
513 HZ1 LYS 63 3HZ LYS 63 3.487 -11.135 -10.134
514 HZ2 LYS 63 1HZ LYS 63 3.692 -9.454 -10.038
515 HZ3 LYS 63 2HZ LYS 63 3.111 -10.316 -8.695
516 HA PRO 64 HA PRO 64 9.965 -9.517 -2.568
517 HB2 PRO 64 2HB PRO 64 12.562 -8.864 -3.230
518 HB3 PRO 64 1HB PRO 64 12.075 -10.341 -2.393
519 HG2 PRO 64 2HG PRO 64 12.688 -9.911 -5.287
520 HG3 PRO 64 1HG PRO 64 13.103 -11.283 -4.243
521 HD2 PRO 64 2HD PRO 64 11.076 -11.409 -6.003
522 HD3 PRO 64 1HD PRO 64 10.992 -12.221 -4.426
523 H GLU 65 HN GLU 65 11.095 -8.376 -5.750
524 HA GLU 65 HA GLU 65 11.249 -5.669 -5.096
525 HB2 GLU 65 2HB GLU 65 11.157 -5.361 -7.563
526 HB3 GLU 65 1HB GLU 65 12.349 -6.527 -7.043
527 HG2 GLU 65 2HG GLU 65 10.877 -8.344 -7.670
528 HG3 GLU 65 1HG GLU 65 9.627 -7.191 -8.136
529 H THR 66 HN THR 66 8.632 -7.651 -6.357
530 HA THR 66 HA THR 66 6.802 -5.559 -6.849
531 HB THR 66 HB THR 66 6.154 -8.430 -6.158
532 HG1 THR 66 1HG THR 66 7.170 -7.217 -8.496
533 HG21 THR 66 3HG2 THR 66 4.152 -8.054 -7.511
534 HG22 THR 66 1HG2 THR 66 4.651 -6.387 -7.802
535 HG23 THR 66 2HG2 THR 66 4.220 -6.908 -6.173
536 H ALA 67 HN ALA 67 7.527 -7.532 -4.030
537 HA ALA 67 HA ALA 67 5.388 -6.703 -2.403
538 HB1 ALA 67 1HB ALA 67 6.708 -7.523 -0.537
539 HB2 ALA 67 2HB ALA 67 8.147 -7.571 -1.555
540 HB3 ALA 67 3HB ALA 67 6.791 -8.648 -1.892
541 H SER 68 HN SER 68 8.656 -5.384 -2.839
542 HA SER 68 HA SER 68 8.324 -3.323 -0.908
543 HB2 SER 68 2HB SER 68 10.540 -4.165 -1.776
544 HB3 SER 68 1HB SER 68 10.219 -3.281 -3.269
545 HG SER 68 HG SER 68 10.509 -1.407 -2.255
546 H ARG 69 HN ARG 69 7.860 -3.482 -4.424
547 HA ARG 69 HA ARG 69 7.149 -0.803 -4.822
548 HB2 ARG 69 2HB ARG 69 6.392 -3.341 -6.258
549 HB3 ARG 69 1HB ARG 69 5.865 -1.761 -6.796
550 HG2 ARG 69 2HG ARG 69 8.207 -1.071 -7.040
551 HG3 ARG 69 1HG ARG 69 8.707 -2.687 -6.545
552 HD2 ARG 69 2HD ARG 69 7.543 -3.643 -8.472
553 HD3 ARG 69 1HD ARG 69 7.031 -2.029 -8.964
554 HE ARG 69 HE ARG 69 9.852 -2.125 -8.714
555 HH11 ARG 69 1HH1 ARG 69 7.237 -3.139 -10.821
556 HH12 ARG 69 2HH1 ARG 69 8.238 -3.195 -12.244
557 HH21 ARG 69 1HH2 ARG 69 11.162 -2.211 -10.574
558 HH22 ARG 69 2HH2 ARG 69 10.477 -2.683 -12.099
559 H LEU 70 HN LEU 70 5.293 -3.605 -3.750
560 HA LEU 70 HA LEU 70 2.744 -2.414 -3.798
561 HB2 LEU 70 2HB LEU 70 3.054 -4.820 -3.543
562 HB3 LEU 70 1HB LEU 70 3.823 -4.578 -1.987
563 HG LEU 70 HG LEU 70 1.697 -3.690 -1.091
564 HD11 LEU 70 1HD1 LEU 70 0.766 -2.840 -3.186
565 HD12 LEU 70 2HD1 LEU 70 -0.356 -3.934 -2.375
566 HD13 LEU 70 3HD1 LEU 70 0.570 -4.492 -3.768
567 HD21 LEU 70 3HD2 LEU 70 1.504 -6.412 -2.370
568 HD22 LEU 70 1HD2 LEU 70 0.511 -5.830 -1.034
569 HD23 LEU 70 2HD2 LEU 70 2.248 -6.041 -0.815
570 H ARG 71 HN ARG 71 5.292 -2.463 -1.346
571 HA ARG 71 HA ARG 71 3.916 -1.186 0.722
572 HB2 ARG 71 2HB ARG 71 6.834 -0.996 -0.026
573 HB3 ARG 71 1HB ARG 71 6.151 -0.448 1.489
574 HG2 ARG 71 2HG ARG 71 5.440 -2.784 1.946
575 HG3 ARG 71 1HG ARG 71 6.319 -3.276 0.493
576 HD2 ARG 71 2HD ARG 71 7.446 -1.973 2.968
577 HD3 ARG 71 1HD ARG 71 7.749 -3.614 2.393
578 HE ARG 71 HE ARG 71 8.997 -2.661 0.559
579 HH11 ARG 71 1HH1 ARG 71 8.180 -0.445 3.154
580 HH12 ARG 71 2HH1 ARG 71 9.433 0.689 2.751
581 HH21 ARG 71 1HH2 ARG 71 10.625 -1.171 0.009
582 HH22 ARG 71 2HH2 ARG 71 10.828 0.276 0.959
583 H GLY 72 HN GLY 72 5.716 0.108 -2.036
584 HA2 GLY 72 2HA GLY 72 5.568 2.826 -1.376
585 HA3 GLY 72 1HA GLY 72 5.721 2.186 -3.006
586 H ARG 73 HN ARG 73 3.284 0.745 -3.090
587 HA ARG 73 HA ARG 73 1.427 2.746 -3.775
588 HB2 ARG 73 2HB ARG 73 1.512 -0.176 -3.698
589 HB3 ARG 73 1HB ARG 73 -0.083 0.470 -3.340
590 HG2 ARG 73 2HG ARG 73 0.071 0.013 -5.676
591 HG3 ARG 73 1HG ARG 73 0.012 1.758 -5.444
592 HD2 ARG 73 2HD ARG 73 1.640 1.271 -7.125
593 HD3 ARG 73 1HD ARG 73 2.489 1.802 -5.673
594 HE ARG 73 HE ARG 73 3.345 -0.337 -5.396
595 HH11 ARG 73 1HH1 ARG 73 1.080 -0.261 -8.070
596 HH12 ARG 73 2HH1 ARG 73 1.575 -1.796 -8.706
597 HH21 ARG 73 1HH2 ARG 73 4.011 -2.353 -6.253
598 HH22 ARG 73 2HH2 ARG 73 3.277 -2.969 -7.705
599 H ILE 74 HN ILE 74 1.601 0.557 -0.974
600 HA ILE 74 HA ILE 74 -0.747 1.527 0.280
601 HB ILE 74 HB ILE 74 1.603 0.151 1.593
602 HG12 ILE 74 2HG1 ILE 74 -0.901 -1.048 0.387
603 HG13 ILE 74 1HG1 ILE 74 0.705 -1.118 -0.333
604 HG21 ILE 74 1HG2 ILE 74 -1.286 0.355 2.428
605 HG22 ILE 74 2HG2 ILE 74 0.069 1.197 3.180
606 HG23 ILE 74 3HG2 ILE 74 -0.032 -0.563 3.263
607 HD11 ILE 74 3HD1 ILE 74 0.041 -3.197 0.822
608 HD12 ILE 74 1HD1 ILE 74 -0.030 -2.298 2.340
609 HD13 ILE 74 2HD1 ILE 74 1.505 -2.473 1.485
610 H GLU 75 HN GLU 75 2.688 2.273 0.726
611 HA GLU 75 HA GLU 75 2.541 3.996 2.907
612 HB2 GLU 75 2HB GLU 75 4.626 3.135 1.866
613 HB3 GLU 75 1HB GLU 75 4.370 4.215 0.507
614 HG2 GLU 75 2HG GLU 75 4.532 6.136 2.037
615 HG3 GLU 75 1HG GLU 75 4.877 5.023 3.359
616 H SER 76 HN SER 76 2.281 4.758 -0.549
617 HA SER 76 HA SER 76 1.967 7.536 -0.198
618 HB2 SER 76 2HB SER 76 1.045 5.825 -2.497
619 HB3 SER 76 1HB SER 76 1.305 7.568 -2.536
620 HG SER 76 HG SER 76 3.163 5.474 -2.477
621 H VAL 77 HN VAL 77 -0.352 4.884 -0.358
622 HA VAL 77 HA VAL 77 -2.660 6.548 -0.452
623 HB VAL 77 HB VAL 77 -2.385 3.651 0.378
624 HG11 VAL 77 1HG1 VAL 77 -4.387 4.645 1.377
625 HG12 VAL 77 2HG1 VAL 77 -4.818 3.511 0.095
626 HG13 VAL 77 3HG1 VAL 77 -4.882 5.248 -0.205
627 HG21 VAL 77 3HG2 VAL 77 -3.303 4.934 -2.193
628 HG22 VAL 77 1HG2 VAL 77 -3.334 3.204 -1.851
629 HG23 VAL 77 2HG2 VAL 77 -1.792 4.058 -1.945
630 H LEU 78 HN LEU 78 -0.947 4.880 2.186
631 HA LEU 78 HA LEU 78 -2.732 5.651 4.230
632 HB2 LEU 78 2HB LEU 78 0.206 4.980 4.402
633 HB3 LEU 78 1HB LEU 78 -0.859 5.152 5.782
634 HG LEU 78 HG LEU 78 -1.019 3.037 3.635
635 HD11 LEU 78 1HD1 LEU 78 -0.553 1.505 5.471
636 HD12 LEU 78 2HD1 LEU 78 -0.422 2.870 6.583
637 HD13 LEU 78 3HD1 LEU 78 0.744 2.684 5.274
638 HD21 LEU 78 3HD2 LEU 78 -2.836 3.519 5.994
639 HD22 LEU 78 1HD2 LEU 78 -2.871 2.100 4.948
640 HD23 LEU 78 2HD2 LEU 78 -3.263 3.689 4.292
641 H ASP 79 HN ASP 79 0.168 7.188 2.918
642 HA ASP 79 HA ASP 79 0.297 9.362 4.698
643 HB2 ASP 79 2HB ASP 79 2.153 8.980 3.245
644 HB3 ASP 79 1HB ASP 79 1.136 9.070 1.811
645 H TRP 80 HN TRP 80 -1.361 8.995 1.586
646 HA TRP 80 HA TRP 80 -2.521 11.545 1.481
647 HB2 TRP 80 2HB TRP 80 -2.418 10.002 -0.441
648 HB3 TRP 80 1HB TRP 80 -3.561 8.933 0.360
649 HD1 TRP 80 1HD TRP 80 -3.439 12.514 -1.118
650 HE1 TRP 80 1HE TRP 80 -5.799 13.102 -1.974
651 HE3 TRP 80 3HE TRP 80 -5.931 8.329 0.454
652 HZ2 TRP 80 2HZ TRP 80 -8.362 11.940 -1.982
653 HZ3 TRP 80 3HZ TRP 80 -8.339 8.148 -0.028
654 HH2 TRP 80 2HH TRP 80 -9.525 9.918 -1.220
655 H ALA 81 HN ALA 81 -3.767 8.478 2.763
656 HA ALA 81 HA ALA 81 -6.275 9.405 3.597
657 HB1 ALA 81 1HB ALA 81 -6.363 7.420 4.992
658 HB2 ALA 81 2HB ALA 81 -4.623 7.195 4.816
659 HB3 ALA 81 3HB ALA 81 -5.681 7.028 3.414
660 H THR 82 HN THR 82 -3.128 9.593 5.116
661 HA THR 82 HA THR 82 -3.981 10.382 7.690
662 HB THR 82 HB THR 82 -1.401 11.006 6.236
663 HG1 THR 82 1HG THR 82 -1.671 8.785 6.531
664 HG21 THR 82 3HG2 THR 82 -0.461 11.410 8.463
665 HG22 THR 82 1HG2 THR 82 -2.052 11.170 9.182
666 HG23 THR 82 2HG2 THR 82 -1.766 12.542 8.110
667 H VAL 83 HN VAL 83 -2.961 12.257 4.848
668 HA VAL 83 HA VAL 83 -3.370 14.805 6.022
669 HB VAL 83 HB VAL 83 -3.372 14.076 3.083
670 HG11 VAL 83 1HG1 VAL 83 -2.874 16.719 4.449
671 HG12 VAL 83 2HG1 VAL 83 -4.292 16.294 3.491
672 HG13 VAL 83 3HG1 VAL 83 -2.708 16.405 2.723
673 HG21 VAL 83 3HG2 VAL 83 -1.103 14.903 4.890
674 HG22 VAL 83 1HG2 VAL 83 -0.994 14.703 3.141
675 HG23 VAL 83 2HG2 VAL 83 -1.341 13.311 4.168
676 H ARG 84 HN ARG 84 -5.452 12.594 4.279
677 HA ARG 84 HA ARG 84 -7.597 14.502 4.005
678 HB2 ARG 84 2HB ARG 84 -7.563 11.506 3.603
679 HB3 ARG 84 1HB ARG 84 -8.888 12.573 3.160
680 HG2 ARG 84 2HG ARG 84 -6.103 12.673 2.021
681 HG3 ARG 84 1HG ARG 84 -7.517 11.969 1.235
682 HD2 ARG 84 2HD ARG 84 -7.231 14.861 2.045
683 HD3 ARG 84 1HD ARG 84 -7.003 14.233 0.412
684 HE ARG 84 HE ARG 84 -9.450 13.416 0.792
685 HH11 ARG 84 1HH1 ARG 84 -8.043 16.477 1.737
686 HH12 ARG 84 2HH1 ARG 84 -9.561 17.327 1.730
687 HH21 ARG 84 1HH2 ARG 84 -11.425 14.502 0.762
688 HH22 ARG 84 2HH2 ARG 84 -11.507 16.188 1.190
689 H GLY 85 HN GLY 85 -6.437 12.567 6.510
690 HA2 GLY 85 2HA GLY 85 -7.172 12.523 8.700
691 HA3 GLY 85 1HA GLY 85 -8.594 13.423 8.204
692 H TYR 86 HN TYR 86 -7.572 10.357 6.816
693 HA TYR 86 HA TYR 86 -10.090 9.183 7.738
694 HB2 TYR 86 2HB TYR 86 -8.079 8.203 5.704
695 HB3 TYR 86 1HB TYR 86 -9.555 7.349 6.138
696 HD1 TYR 86 2HD TYR 86 -11.489 9.587 6.273
697 HD2 TYR 86 1HD TYR 86 -8.382 8.794 3.479
698 HE1 TYR 86 2HE TYR 86 -12.712 10.858 4.561
699 HE2 TYR 86 1HE TYR 86 -9.598 10.064 1.758
700 HH TYR 86 HH TYR 86 -12.223 12.086 2.476
701 H ARG 87 HN ARG 87 -6.750 9.157 8.403
702 HA ARG 87 HA ARG 87 -7.138 7.216 10.503
703 HB2 ARG 87 2HB ARG 87 -5.196 5.824 9.835
704 HB3 ARG 87 1HB ARG 87 -6.540 5.707 8.707
705 HG2 ARG 87 2HG ARG 87 -5.430 7.101 7.125
706 HG3 ARG 87 1HG ARG 87 -4.157 7.493 8.283
707 HD2 ARG 87 2HD ARG 87 -4.718 4.699 7.306
708 HD3 ARG 87 1HD ARG 87 -3.545 5.777 6.548
709 HE ARG 87 HE ARG 87 -2.400 5.814 8.756
710 HH11 ARG 87 1HH1 ARG 87 -4.524 3.128 7.968
711 HH12 ARG 87 2HH1 ARG 87 -3.664 1.996 8.969
712 HH21 ARG 87 1HH2 ARG 87 -1.262 4.325 10.053
713 HH22 ARG 87 2HH2 ARG 87 -1.820 2.682 10.163
714 H GLU 88 HN GLU 88 -4.901 6.892 11.656
715 HA GLU 88 HA GLU 88 -3.986 9.488 12.398
716 HB2 GLU 88 2HB GLU 88 -3.355 6.696 13.254
717 HB3 GLU 88 1HB GLU 88 -2.277 8.002 13.729
718 HG2 GLU 88 2HG GLU 88 -3.995 7.441 15.424
719 HG3 GLU 88 1HG GLU 88 -4.026 9.123 14.899
720 H GLY 89 HN GLY 89 -1.502 9.787 12.692
721 HA2 GLY 89 2HA GLY 89 -0.619 9.977 9.933
722 HA3 GLY 89 1HA GLY 89 0.052 10.822 11.308
723 H ASP 90 HN ASP 90 -0.280 7.477 11.757
724 HA ASP 90 HA ASP 90 2.602 7.153 11.368
725 HB2 ASP 90 2HB ASP 90 1.621 6.483 13.558
726 HB3 ASP 90 1HB ASP 90 0.696 5.235 12.725
727 H ASN 91 HN ASN 91 3.447 5.822 9.904
728 HA ASN 91 HA ASN 91 1.558 4.513 8.059
729 HB2 ASN 91 2HB ASN 91 2.740 6.570 7.176
730 HB3 ASN 91 1HB ASN 91 4.247 5.669 7.296
731 HD21 ASN 91 1HD2 ASN 91 2.858 6.783 4.965
732 HD22 ASN 91 2HD2 ASN 91 2.617 5.465 3.886
733 HA PRO 92 HA PRO 92 4.082 1.148 9.856
734 HB2 PRO 92 2HB PRO 92 1.785 -0.486 9.040
735 HB3 PRO 92 1HB PRO 92 2.496 -0.268 10.642
736 HG2 PRO 92 2HG PRO 92 0.097 0.762 9.995
737 HG3 PRO 92 1HG PRO 92 1.208 1.587 11.103
738 HD2 PRO 92 2HD PRO 92 0.676 2.125 8.205
739 HD3 PRO 92 1HD PRO 92 0.881 3.275 9.545
740 H ALA 93 HN ALA 93 3.084 1.818 6.704
741 HA ALA 93 HA ALA 93 3.954 -0.685 5.538
742 HB1 ALA 93 1HB ALA 93 3.510 0.383 3.390
743 HB2 ALA 93 2HB ALA 93 3.264 1.931 4.199
744 HB3 ALA 93 3HB ALA 93 2.148 0.598 4.490
745 H ARG 94 HN ARG 94 5.400 2.149 6.647
746 HA ARG 94 HA ARG 94 7.795 1.690 5.014
747 HB2 ARG 94 2HB ARG 94 6.951 3.986 4.942
748 HB3 ARG 94 1HB ARG 94 7.034 4.086 6.694
749 HG2 ARG 94 2HG ARG 94 9.455 3.844 6.599
750 HG3 ARG 94 1HG ARG 94 9.380 3.723 4.841
751 HD2 ARG 94 2HD ARG 94 8.398 6.092 6.425
752 HD3 ARG 94 1HD ARG 94 10.003 5.983 5.704
753 HE ARG 94 HE ARG 94 8.040 5.498 3.728
754 HH11 ARG 94 1HH1 ARG 94 9.300 8.114 5.714
755 HH12 ARG 94 2HH1 ARG 94 8.977 9.342 4.520
756 HH21 ARG 94 1HH2 ARG 94 7.614 7.117 2.165
757 HH22 ARG 94 2HH2 ARG 94 7.988 8.781 2.519
758 H TRP 95 HN TRP 95 9.585 0.979 5.908
759 HA TRP 95 HA TRP 95 9.616 0.541 8.827
760 HB2 TRP 95 2HB TRP 95 10.359 -1.226 6.542
761 HB3 TRP 95 1HB TRP 95 11.260 -1.376 8.048
762 HD1 TRP 95 1HD TRP 95 9.639 -1.767 10.294
763 HE1 TRP 95 1HE TRP 95 7.605 -3.330 10.504
764 HE3 TRP 95 3HE TRP 95 8.463 -2.228 5.345
765 HZ2 TRP 95 2HZ TRP 95 5.730 -4.572 8.792
766 HZ3 TRP 95 3HZ TRP 95 6.531 -3.613 4.717
767 HH2 TRP 95 2HH TRP 95 5.196 -4.759 6.404
768 H ARG 96 HN ARG 96 11.536 0.849 9.925
769 HA ARG 96 HA ARG 96 13.648 2.232 8.436
770 HB2 ARG 96 2HB ARG 96 12.523 3.325 10.445
771 HB3 ARG 96 1HB ARG 96 13.310 2.100 11.432
772 HG2 ARG 96 2HG ARG 96 15.486 2.874 10.676
773 HG3 ARG 96 1HG ARG 96 14.704 4.088 9.665
774 HD2 ARG 96 2HD ARG 96 13.711 5.093 11.688
775 HD3 ARG 96 1HD ARG 96 14.575 3.911 12.673
776 HE ARG 96 HE ARG 96 16.011 5.809 10.930
777 HH11 ARG 96 1HH1 ARG 96 15.421 4.396 14.091
778 HH12 ARG 96 2HH1 ARG 96 16.789 5.182 14.823
779 HH21 ARG 96 1HH2 ARG 96 17.794 6.836 11.886
780 HH22 ARG 96 2HH2 ARG 96 18.154 6.556 13.570
781 H GLY 97 HN GLY 97 12.815 -0.613 10.142
782 HA2 GLY 97 2HA GLY 97 15.574 -1.598 9.772
783 HA3 GLY 97 1HA GLY 97 14.625 -2.014 11.193
784 H TYR 98 HN TYR 98 12.840 -3.386 10.984
785 HA TYR 98 HA TYR 98 11.764 -5.247 10.317
786 HB2 TYR 98 2HB TYR 98 10.852 -3.777 8.588
787 HB3 TYR 98 1HB TYR 98 12.215 -4.154 7.537
788 HD1 TYR 98 2HD TYR 98 9.891 -6.221 9.619
789 HD2 TYR 98 1HD TYR 98 11.557 -5.494 5.771
790 HE1 TYR 98 2HE TYR 98 8.673 -8.164 8.733
791 HE2 TYR 98 1HE TYR 98 10.344 -7.438 4.874
792 HH TYR 98 HH TYR 98 7.928 -9.130 6.727
793 H LEU 99 HN LEU 99 14.098 -4.969 7.623
794 HA LEU 99 HA LEU 99 14.548 -7.771 7.547
795 HB2 LEU 99 2HB LEU 99 16.100 -5.496 6.311
796 HB3 LEU 99 1HB LEU 99 16.394 -7.190 5.972
797 HG LEU 99 HG LEU 99 13.827 -5.717 5.378
798 HD11 LEU 99 1HD1 LEU 99 15.686 -5.003 3.960
799 HD12 LEU 99 2HD1 LEU 99 14.494 -5.927 3.046
800 HD13 LEU 99 3HD1 LEU 99 16.010 -6.683 3.536
801 HD21 LEU 99 3HD2 LEU 99 13.200 -7.737 4.170
802 HD22 LEU 99 1HD2 LEU 99 13.481 -8.089 5.876
803 HD23 LEU 99 2HD2 LEU 99 14.699 -8.518 4.674
804 H GLU 100 HN GLU 100 16.256 -5.081 8.995
805 HA GLU 100 HA GLU 100 17.750 -4.967 10.691
806 HB2 GLU 100 2HB GLU 100 16.475 -6.766 11.758
807 HB3 GLU 100 1HB GLU 100 17.415 -7.963 10.877
808 HG2 GLU 100 2HG GLU 100 19.453 -7.063 12.010
809 HG3 GLU 100 1HG GLU 100 18.385 -6.070 12.999
810 H HIS 101 HN HIS 101 18.574 -8.034 9.026
811 HA HIS 101 HA HIS 101 21.370 -7.576 9.302
812 HB2 HIS 101 2HB HIS 101 20.299 -9.829 9.090
813 HB3 HIS 101 1HB HIS 101 19.984 -9.476 7.396
814 HD1 HIS 101 1HD HIS 101 21.522 -11.089 6.243
815 HD2 HIS 101 2HD HIS 101 23.439 -8.926 9.240
816 HE1 HIS 101 1HE HIS 101 23.954 -11.703 6.083
817 HE2 HIS 101 2HE HIS 101 25.116 -10.222 7.751
818 H HIS 102 HN HIS 102 22.410 -6.016 8.291
819 HA HIS 102 HA HIS 102 21.417 -5.034 5.733
820 HB2 HIS 102 2HB HIS 102 22.861 -3.092 6.109
821 HB3 HIS 102 1HB HIS 102 21.815 -3.376 7.492
822 HD1 HIS 102 1HD HIS 102 25.209 -2.584 6.701
823 HD2 HIS 102 2HD HIS 102 23.341 -4.895 9.615
824 HE1 HIS 102 1HE HIS 102 26.906 -2.872 8.536
825 HE2 HIS 102 2HE HIS 102 25.795 -4.370 10.231
826 H HIS 103 HN HIS 103 22.484 -5.124 3.858
827 HA HIS 103 HA HIS 103 25.247 -6.152 3.867
828 HB2 HIS 103 2HB HIS 103 22.939 -6.751 2.056
829 HB3 HIS 103 1HB HIS 103 24.571 -6.792 1.402
830 HD1 HIS 103 1HD HIS 103 22.164 -9.018 2.612
831 HD2 HIS 103 2HD HIS 103 26.236 -8.536 3.339
832 HE1 HIS 103 1HE HIS 103 22.978 -11.245 3.442
833 HE2 HIS 103 2HE HIS 103 25.482 -10.992 3.642
834 H HIS 104 HN HIS 104 26.580 -4.487 3.463
835 HA HIS 104 HA HIS 104 25.663 -2.329 1.724
836 HB2 HIS 104 2HB HIS 104 26.955 -1.873 3.860
837 HB3 HIS 104 1HB HIS 104 28.363 -2.569 3.066
838 HD1 HIS 104 1HD HIS 104 29.789 -0.968 1.793
839 HD2 HIS 104 2HD HIS 104 25.927 0.478 2.375
840 HE1 HIS 104 1HE HIS 104 29.792 1.378 0.882
841 HE2 HIS 104 2HE HIS 104 27.486 2.281 1.363
842 H HIS 105 HN HIS 105 25.517 -3.578 -0.161
843 HA HIS 105 HA HIS 105 28.110 -4.297 -1.351
844 HB2 HIS 105 2HB HIS 105 26.508 -6.211 -0.705
845 HB3 HIS 105 1HB HIS 105 25.490 -5.638 -2.018
846 HD1 HIS 105 1HD HIS 105 25.751 -7.276 -3.850
847 HD2 HIS 105 2HD HIS 105 29.379 -6.367 -2.041
848 HE1 HIS 105 1HE HIS 105 27.497 -8.514 -5.174
849 HE2 HIS 105 2HE HIS 105 29.643 -8.144 -3.905
850 H HIS 106 HN HIS 106 28.439 -3.700 -3.452
851 HA HIS 106 HA HIS 106 28.519 -2.034 -4.962
852 HB2 HIS 106 2HB HIS 106 26.686 -1.991 -6.603
853 HB3 HIS 106 1HB HIS 106 27.201 -3.622 -6.217
854 HD1 HIS 106 1HD HIS 106 24.398 -1.226 -5.305
855 HD2 HIS 106 2HD HIS 106 25.147 -5.296 -5.633
856 HE1 HIS 106 1HE HIS 106 22.166 -2.350 -4.993
857 HE2 HIS 106 2HE HIS 106 22.625 -4.813 -5.303