Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
609320 | 5ij4 RC | 30030 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H MET 11 H MET 11 1.808 0.000 0.855
2 HA MET 11 HA MET 11 2.568 0.964 -1.339
3 HB2 MET 11 HB2 MET 11 2.762 -1.966 -0.730
4 HB3 MET 11 HB3 MET 11 3.459 -1.328 -2.214
5 HG2 MET 11 HG2 MET 11 4.612 0.374 -0.627
6 HG3 MET 11 HG3 MET 11 4.245 -0.820 0.616
7 HE1 MET 11 HE1 MET 11 7.430 -0.077 0.005
8 HE2 MET 11 HE2 MET 11 7.962 -0.675 -1.566
9 HE3 MET 11 HE3 MET 11 6.692 0.546 -1.471
10 H LEU 12 H LEU 12 0.747 1.729 -2.513
11 HA LEU 12 HA LEU 12 -0.044 -0.084 -4.659
12 HB2 LEU 12 HB2 LEU 12 -2.412 0.882 -4.432
13 HB3 LEU 12 HB3 LEU 12 -1.917 -0.408 -3.339
14 HG LEU 12 HG LEU 12 -1.411 2.227 -2.225
15 HD11 LEU 12 HD11 LEU 12 -3.979 2.446 -1.772
16 HD12 LEU 12 HD12 LEU 12 -4.114 1.597 -3.311
17 HD13 LEU 12 HD13 LEU 12 -3.262 3.139 -3.227
18 HD21 LEU 12 HD21 LEU 12 -1.909 1.161 -0.312
19 HD22 LEU 12 HD22 LEU 12 -1.775 -0.296 -1.297
20 HD23 LEU 12 HD23 LEU 12 -3.359 0.415 -0.984
21 H ASP 13 H ASP 13 0.473 0.913 -6.479
22 HA ASP 13 HA ASP 13 0.933 2.545 -8.002
23 HB2 ASP 13 HB2 ASP 13 -1.602 3.489 -6.703
24 HB3 ASP 13 HB3 ASP 13 -0.822 4.476 -7.936
25 H VAL 14 H VAL 14 2.800 2.795 -6.277
26 HA VAL 14 HA VAL 14 2.806 5.345 -4.916
27 HB VAL 14 HB VAL 14 5.163 4.754 -4.342
28 HG11 VAL 14 HG11 VAL 14 3.500 2.381 -3.653
29 HG12 VAL 14 HG12 VAL 14 4.530 3.376 -2.622
30 HG13 VAL 14 HG13 VAL 14 2.956 3.978 -3.142
31 HG21 VAL 14 HG21 VAL 14 5.050 3.121 -6.520
32 HG22 VAL 14 HG22 VAL 14 6.264 3.018 -5.245
33 HG23 VAL 14 HG23 VAL 14 4.846 1.970 -5.200
34 H GLY 15 H GLY 15 2.327 6.067 -7.387
35 HA2 GLY 15 HA2 GLY 15 3.257 7.869 -8.636
36 HA3 GLY 15 HA3 GLY 15 4.863 7.268 -8.251
37 H LYS 16 H LYS 16 3.792 7.991 -10.846
38 HA LYS 16 HA LYS 16 3.716 5.383 -12.199
39 HB2 LYS 16 HB2 LYS 16 2.292 7.824 -12.592
40 HB3 LYS 16 HB3 LYS 16 3.272 7.527 -14.022
41 HG2 LYS 16 HG2 LYS 16 2.090 5.689 -14.623
42 HG3 LYS 16 HG3 LYS 16 1.722 5.243 -12.956
43 HD2 LYS 16 HD2 LYS 16 0.485 7.754 -13.611
44 HD3 LYS 16 HD3 LYS 16 0.040 6.527 -14.799
45 HE2 LYS 16 HE2 LYS 16 -0.345 5.054 -12.661
46 HE3 LYS 16 HE3 LYS 16 -0.490 6.619 -11.864
47 HZ1 LYS 16 HZ1 LYS 16 -2.278 5.328 -13.754
48 HZ2 LYS 16 HZ2 LYS 16 -2.071 6.993 -13.965
49 HZ3 LYS 16 HZ3 LYS 16 -2.627 6.391 -12.485
50 H HIS 17 H HIS 17 5.224 4.812 -13.699
51 HA HIS 17 HA HIS 17 7.659 6.411 -13.747
52 HB2 HIS 17 HB2 HIS 17 7.250 3.712 -15.029
53 HB3 HIS 17 HB3 HIS 17 8.768 4.467 -14.551
54 HD1 HIS 17 HD1 HIS 17 5.651 2.997 -12.968
55 HD2 HIS 17 HD2 HIS 17 9.623 3.800 -12.052
56 HE1 HIS 17 HE1 HIS 17 6.043 1.962 -10.710
57 H CYS 18 H CYS 18 8.509 7.373 -15.529
58 HA CYS 18 HA CYS 18 6.885 8.275 -17.567
59 HB2 CYS 18 HB2 CYS 18 9.185 9.130 -16.878
60 HB3 CYS 18 HB3 CYS 18 9.855 7.858 -17.895
61 H ALA 19 H ALA 19 6.603 7.728 -19.740
62 HA ALA 19 HA ALA 19 7.011 4.883 -20.311
63 HB1 ALA 19 HB1 ALA 19 5.461 6.049 -22.343
64 HB2 ALA 19 HB2 ALA 19 4.918 4.993 -21.039
65 HB3 ALA 19 HB3 ALA 19 4.894 6.743 -20.824
66 H TYR 20 H TYR 20 8.947 7.277 -20.628
67 HA TYR 20 HA TYR 20 9.789 6.562 -23.353
68 HB2 TYR 20 HB2 TYR 20 8.726 8.936 -22.984
69 HB3 TYR 20 HB3 TYR 20 10.303 9.318 -22.301
70 HD1 TYR 20 HD1 TYR 20 11.545 10.555 -23.797
71 HD2 TYR 20 HD2 TYR 20 9.207 7.318 -25.267
72 HE1 TYR 20 HE1 TYR 20 12.431 10.949 -26.057
73 HE2 TYR 20 HE2 TYR 20 10.088 7.702 -27.531
74 HH TYR 20 HH TYR 20 11.656 8.788 -28.737
75 H CYS 21 H CYS 21 10.720 7.782 -20.173
76 HA CYS 21 HA CYS 21 13.462 6.828 -20.684
77 HB2 CYS 21 HB2 CYS 21 14.328 8.531 -19.319
78 HB3 CYS 21 HB3 CYS 21 13.072 9.335 -20.256
79 H ARG 22 H ARG 22 10.637 6.388 -18.875
80 HA ARG 22 HA ARG 22 10.072 4.984 -17.178
81 HB2 ARG 22 HB2 ARG 22 12.819 3.796 -17.610
82 HB3 ARG 22 HB3 ARG 22 11.476 3.037 -16.765
83 HG2 ARG 22 HG2 ARG 22 11.010 3.882 -19.563
84 HG3 ARG 22 HG3 ARG 22 12.068 2.496 -19.294
85 HD2 ARG 22 HD2 ARG 22 9.504 2.566 -17.807
86 HD3 ARG 22 HD3 ARG 22 9.424 2.264 -19.543
87 HE ARG 22 HE ARG 22 10.371 0.471 -17.522
88 HH11 ARG 22 HH11 ARG 22 10.651 1.366 -20.875
89 HH12 ARG 22 HH12 ARG 22 11.189 -0.201 -21.383
90 HH21 ARG 22 HH21 ARG 22 11.078 -1.596 -18.178
91 HH22 ARG 22 HH22 ARG 22 11.431 -1.885 -19.849
92 H GLN 23 H GLN 23 10.409 7.155 -16.027
93 HA GLN 23 HA GLN 23 12.427 6.806 -13.908
94 HB2 GLN 23 HB2 GLN 23 13.025 8.743 -15.168
95 HB3 GLN 23 HB3 GLN 23 11.367 9.329 -15.176
96 HG2 GLN 23 HG2 GLN 23 11.556 10.278 -13.158
97 HG3 GLN 23 HG3 GLN 23 12.516 8.950 -12.508
98 HE21 GLN 23 HE21 GLN 23 12.721 12.011 -12.619
99 HE22 GLN 23 HE22 GLN 23 14.365 12.282 -13.076
100 H LEU 24 H LEU 24 11.551 6.275 -12.030
101 HA LEU 24 HA LEU 24 8.790 6.378 -11.487
102 HB2 LEU 24 HB2 LEU 24 10.121 4.762 -10.369
103 HB3 LEU 24 HB3 LEU 24 11.191 6.001 -9.716
104 HG LEU 24 HG LEU 24 8.587 6.554 -8.759
105 HD11 LEU 24 HD11 LEU 24 8.430 4.331 -7.412
106 HD12 LEU 24 HD12 LEU 24 9.294 3.654 -8.792
107 HD13 LEU 24 HD13 LEU 24 7.730 4.434 -9.028
108 HD21 LEU 24 HD21 LEU 24 10.637 7.123 -7.614
109 HD22 LEU 24 HD22 LEU 24 11.045 5.417 -7.430
110 HD23 LEU 24 HD23 LEU 24 9.651 6.088 -6.582
111 H ASP 25 H ASP 25 7.706 8.236 -11.346
112 HA ASP 25 HA ASP 25 8.854 10.388 -9.691
113 HB2 ASP 25 HB2 ASP 25 7.815 10.447 -12.369
114 HB3 ASP 25 HB3 ASP 25 6.819 11.463 -11.331
115 H PHE 26 H PHE 26 7.331 11.682 -8.479
116 HA PHE 26 HA PHE 26 5.222 10.041 -7.356
117 HB2 PHE 26 HB2 PHE 26 5.995 12.841 -6.534
118 HB3 PHE 26 HB3 PHE 26 5.126 11.642 -5.582
119 HD1 PHE 26 HD1 PHE 26 8.404 12.585 -6.955
120 HD2 PHE 26 HD2 PHE 26 6.281 9.945 -4.379
121 HE1 PHE 26 HE1 PHE 26 10.534 11.817 -5.993
122 HE2 PHE 26 HE2 PHE 26 8.407 9.174 -3.411
123 HZ PHE 26 HZ PHE 26 10.538 10.110 -4.217
124 H LEU 27 H LEU 27 5.555 13.063 -9.141
125 HA LEU 27 HA LEU 27 2.623 13.205 -9.364
126 HB2 LEU 27 HB2 LEU 27 4.690 15.200 -8.971
127 HB3 LEU 27 HB3 LEU 27 3.662 15.581 -10.351
128 HG LEU 27 HG LEU 27 2.472 14.927 -7.677
129 HD11 LEU 27 HD11 LEU 27 3.420 16.737 -6.799
130 HD12 LEU 27 HD12 LEU 27 2.427 17.682 -7.908
131 HD13 LEU 27 HD13 LEU 27 4.075 17.243 -8.356
132 HD21 LEU 27 HD21 LEU 27 0.542 15.833 -8.519
133 HD22 LEU 27 HD22 LEU 27 1.240 15.143 -9.985
134 HD23 LEU 27 HD23 LEU 27 1.395 16.871 -9.662
135 HA PRO 28 HA PRO 28 4.015 11.844 -13.533
136 HB2 PRO 28 HB2 PRO 28 1.820 10.314 -13.996
137 HB3 PRO 28 HB3 PRO 28 3.233 9.725 -13.111
138 HG2 PRO 28 HG2 PRO 28 0.629 10.756 -12.053
139 HG3 PRO 28 HG3 PRO 28 1.575 9.353 -11.523
140 HD2 PRO 28 HD2 PRO 28 1.620 11.721 -10.210
141 HD3 PRO 28 HD3 PRO 28 3.029 10.643 -10.284
142 H PHE 29 H PHE 29 3.619 13.078 -15.255
143 HA PHE 29 HA PHE 29 1.321 14.836 -15.274
144 HB2 PHE 29 HB2 PHE 29 3.846 14.605 -16.849
145 HB3 PHE 29 HB3 PHE 29 2.487 15.459 -17.573
146 HD1 PHE 29 HD1 PHE 29 1.809 17.603 -16.787
147 HD2 PHE 29 HD2 PHE 29 4.885 15.443 -14.789
148 HE1 PHE 29 HE1 PHE 29 2.411 19.630 -15.529
149 HE2 PHE 29 HE2 PHE 29 5.491 17.466 -13.527
150 HZ PHE 29 HZ PHE 29 4.253 19.563 -13.896
151 H HIS 30 H HIS 30 -0.556 13.994 -15.917
152 HA HIS 30 HA HIS 30 -0.669 11.881 -17.887
153 HB2 HIS 30 HB2 HIS 30 -2.207 11.748 -16.036
154 HB3 HIS 30 HB3 HIS 30 -2.823 13.363 -16.370
155 HD1 HIS 30 HD1 HIS 30 -3.333 9.832 -17.192
156 HD2 HIS 30 HD2 HIS 30 -4.398 13.513 -18.798
157 HE1 HIS 30 HE1 HIS 30 -5.194 9.346 -18.812
158 H CYS 31 H CYS 31 -0.794 12.194 -20.001
159 HA CYS 31 HA CYS 31 -1.277 14.853 -21.050
160 HB2 CYS 31 HB2 CYS 31 0.417 12.915 -21.837
161 HB3 CYS 31 HB3 CYS 31 -0.945 12.551 -22.892
162 H SER 32 H SER 32 -3.115 15.556 -21.932
163 HA SER 32 HA SER 32 -5.380 13.721 -22.044
164 HB2 SER 32 HB2 SER 32 -5.058 16.478 -21.390
165 HB3 SER 32 HB3 SER 32 -6.129 16.372 -22.787
166 HG SER 32 HG SER 32 -7.329 16.198 -20.887
167 H PHE 33 H PHE 33 -3.115 13.934 -24.068
168 HA PHE 33 HA PHE 33 -4.806 14.352 -26.446
169 HB2 PHE 33 HB2 PHE 33 -1.800 14.532 -26.465
170 HB3 PHE 33 HB3 PHE 33 -2.941 15.140 -27.660
171 HD1 PHE 33 HD1 PHE 33 -4.865 16.567 -25.957
172 HD2 PHE 33 HD2 PHE 33 -0.616 16.402 -25.780
173 HE1 PHE 33 HE1 PHE 33 -4.828 18.774 -24.871
174 HE2 PHE 33 HE2 PHE 33 -0.572 18.608 -24.692
175 HZ PHE 33 HZ PHE 33 -2.680 19.797 -24.235
176 H CYS 34 H CYS 34 -2.076 12.485 -25.149
177 HA CYS 34 HA CYS 34 -2.682 10.356 -27.086
178 HB2 CYS 34 HB2 CYS 34 -0.427 9.508 -26.619
179 HB3 CYS 34 HB3 CYS 34 -0.376 11.186 -27.152
180 H ASN 35 H ASN 35 -2.923 11.206 -23.807
181 HA ASN 35 HA ASN 35 -3.753 10.107 -21.994
182 HB2 ASN 35 HB2 ASN 35 -5.155 9.033 -23.982
183 HB3 ASN 35 HB3 ASN 35 -4.240 7.597 -23.531
184 HD21 ASN 35 HD21 ASN 35 -6.750 9.772 -22.669
185 HD22 ASN 35 HD22 ASN 35 -7.280 8.945 -21.248
186 H GLU 36 H GLU 36 -1.207 10.190 -21.828
187 HA GLU 36 HA GLU 36 -0.422 7.563 -20.842
188 HB2 GLU 36 HB2 GLU 36 1.085 9.103 -22.947
189 HB3 GLU 36 HB3 GLU 36 1.880 7.925 -21.912
190 HG2 GLU 36 HG2 GLU 36 -0.326 6.568 -22.858
191 HG3 GLU 36 HG3 GLU 36 0.202 7.525 -24.240
192 H ASP 37 H ASP 37 1.304 7.628 -19.313
193 HA ASP 37 HA ASP 37 1.506 10.228 -17.981
194 HB2 ASP 37 HB2 ASP 37 1.951 7.396 -17.054
195 HB3 ASP 37 HB3 ASP 37 2.481 8.779 -16.100
196 H PHE 38 H PHE 38 3.437 11.216 -17.527
197 HA PHE 38 HA PHE 38 5.936 9.913 -18.222
198 HB2 PHE 38 HB2 PHE 38 5.115 12.493 -19.571
199 HB3 PHE 38 HB3 PHE 38 6.648 11.652 -19.772
200 HD1 PHE 38 HD1 PHE 38 6.630 9.355 -20.823
201 HD2 PHE 38 HD2 PHE 38 3.265 11.960 -20.893
202 HE1 PHE 38 HE1 PHE 38 5.682 8.074 -22.697
203 HE2 PHE 38 HE2 PHE 38 2.311 10.683 -22.767
204 HZ PHE 38 HZ PHE 38 3.519 8.736 -23.671
205 H CYS 39 H CYS 39 7.636 10.656 -17.053
206 HA CYS 39 HA CYS 39 7.268 12.024 -14.695
207 HB2 CYS 39 HB2 CYS 39 9.623 12.093 -14.475
208 HB3 CYS 39 HB3 CYS 39 9.288 10.657 -15.437
209 H SER 40 H SER 40 8.012 14.135 -13.994
210 HA SER 40 HA SER 40 6.899 16.242 -15.397
211 HB2 SER 40 HB2 SER 40 9.217 16.919 -13.679
212 HB3 SER 40 HB3 SER 40 7.569 17.546 -13.650
213 HG SER 40 HG SER 40 8.624 15.240 -12.446
214 H ASN 41 H ASN 41 10.176 14.976 -15.505
215 HA ASN 41 HA ASN 41 11.395 17.061 -16.925
216 HB2 ASN 41 HB2 ASN 41 12.238 14.679 -15.873
217 HB3 ASN 41 HB3 ASN 41 12.333 14.356 -17.602
218 HD21 ASN 41 HD21 ASN 41 13.819 15.793 -14.944
219 HD22 ASN 41 HD22 ASN 41 15.088 16.614 -15.782
220 H HIS 42 H HIS 42 9.306 14.476 -17.954
221 HA HIS 42 HA HIS 42 9.612 15.376 -20.744
222 HB2 HIS 42 HB2 HIS 42 8.967 12.644 -19.636
223 HB3 HIS 42 HB3 HIS 42 8.696 13.071 -21.323
224 HD2 HIS 42 HD2 HIS 42 11.314 14.159 -22.459
225 HE1 HIS 42 HE1 HIS 42 13.440 11.264 -20.202
226 HE2 HIS 42 HE2 HIS 42 13.545 12.893 -22.121
227 H ARG 43 H ARG 43 7.813 16.273 -18.478
228 HA ARG 43 HA ARG 43 5.185 15.460 -18.857
229 HB2 ARG 43 HB2 ARG 43 4.531 17.568 -17.834
230 HB3 ARG 43 HB3 ARG 43 5.927 16.897 -17.001
231 HG2 ARG 43 HG2 ARG 43 7.355 18.427 -18.403
232 HG3 ARG 43 HG3 ARG 43 5.858 19.205 -18.921
233 HD2 ARG 43 HD2 ARG 43 5.324 19.587 -16.505
234 HD3 ARG 43 HD3 ARG 43 6.939 18.996 -16.117
235 HE ARG 43 HE ARG 43 6.246 21.561 -17.230
236 HH11 ARG 43 HH11 ARG 43 8.757 19.187 -16.805
237 HH12 ARG 43 HH12 ARG 43 10.047 20.325 -17.004
238 HH21 ARG 43 HH21 ARG 43 7.936 23.070 -17.494
239 HH22 ARG 43 HH22 ARG 43 9.580 22.534 -17.395
240 H LEU 44 H LEU 44 7.098 17.827 -20.628
241 HA LEU 44 HA LEU 44 5.125 19.081 -22.107
242 HB2 LEU 44 HB2 LEU 44 7.807 18.286 -23.213
243 HB3 LEU 44 HB3 LEU 44 6.815 19.668 -23.674
244 HG LEU 44 HG LEU 44 8.279 19.313 -21.059
245 HD11 LEU 44 HD11 LEU 44 8.839 20.821 -23.571
246 HD12 LEU 44 HD12 LEU 44 9.931 19.880 -22.556
247 HD13 LEU 44 HD13 LEU 44 9.381 21.468 -22.022
248 HD21 LEU 44 HD21 LEU 44 7.407 21.968 -21.469
249 HD22 LEU 44 HD22 LEU 44 6.917 20.840 -20.204
250 HD23 LEU 44 HD23 LEU 44 6.015 20.915 -21.718
251 H LYS 45 H LYS 45 4.767 18.800 -24.511
252 HA LYS 45 HA LYS 45 3.715 16.177 -24.969
253 HB2 LYS 45 HB2 LYS 45 3.425 18.807 -26.113
254 HB3 LYS 45 HB3 LYS 45 3.671 17.620 -27.388
255 HG2 LYS 45 HG2 LYS 45 1.842 16.321 -25.921
256 HG3 LYS 45 HG3 LYS 45 1.396 17.988 -25.549
257 HD2 LYS 45 HD2 LYS 45 1.761 16.922 -28.346
258 HD3 LYS 45 HD3 LYS 45 0.204 17.009 -27.518
259 HE2 LYS 45 HE2 LYS 45 1.999 19.388 -27.964
260 HE3 LYS 45 HE3 LYS 45 0.703 18.923 -29.065
261 HZ1 LYS 45 HZ1 LYS 45 0.037 20.643 -27.462
262 HZ2 LYS 45 HZ2 LYS 45 0.322 19.565 -26.191
263 HZ3 LYS 45 HZ3 LYS 45 -0.895 19.238 -27.320
264 H GLU 46 H GLU 46 6.036 18.143 -26.842
265 HA GLU 46 HA GLU 46 6.905 16.134 -28.546
266 HB2 GLU 46 HB2 GLU 46 8.864 17.514 -28.958
267 HB3 GLU 46 HB3 GLU 46 7.427 18.522 -28.850
268 HG2 GLU 46 HG2 GLU 46 8.051 18.973 -26.460
269 HG3 GLU 46 HG3 GLU 46 9.584 18.168 -26.789
270 H ASP 47 H ASP 47 7.768 16.789 -25.237
271 HA ASP 47 HA ASP 47 10.178 15.496 -24.955
272 HB2 ASP 47 HB2 ASP 47 7.844 15.935 -23.158
273 HB3 ASP 47 HB3 ASP 47 9.071 14.784 -22.636
274 H HIS 48 H HIS 48 6.950 14.016 -24.658
275 HA HIS 48 HA HIS 48 8.176 11.365 -24.819
276 HB2 HIS 48 HB2 HIS 48 5.948 10.523 -24.188
277 HB3 HIS 48 HB3 HIS 48 6.546 11.710 -23.033
278 HD1 HIS 48 HD1 HIS 48 5.115 13.731 -22.621
279 HD2 HIS 48 HD2 HIS 48 3.871 11.537 -25.923
280 HE1 HIS 48 HE1 HIS 48 2.917 14.741 -23.310
281 H HIS 49 H HIS 49 7.788 13.336 -27.092
282 HA HIS 49 HA HIS 49 7.141 13.348 -29.280
283 HB2 HIS 49 HB2 HIS 49 7.717 10.466 -28.691
284 HB3 HIS 49 HB3 HIS 49 7.098 10.922 -30.276
285 HD1 HIS 49 HD1 HIS 49 9.001 10.970 -31.843
286 HD2 HIS 49 HD2 HIS 49 10.018 12.557 -28.141
287 HE1 HIS 49 HE1 HIS 49 11.376 11.760 -32.080
288 H CYS 50 H CYS 50 4.990 13.890 -27.910
289 HA CYS 50 HA CYS 50 2.825 12.182 -27.859
290 HB2 CYS 50 HB2 CYS 50 3.043 14.607 -26.998
291 HB3 CYS 50 HB3 CYS 50 2.520 15.079 -28.612
292 H ARG 51 H ARG 51 1.633 11.202 -29.353
293 HA ARG 51 HA ARG 51 2.210 11.197 -32.057
294 HB2 ARG 51 HB2 ARG 51 -0.069 10.173 -32.340
295 HB3 ARG 51 HB3 ARG 51 0.945 9.399 -31.129
296 HG2 ARG 51 HG2 ARG 51 -0.272 10.421 -29.351
297 HG3 ARG 51 HG3 ARG 51 -1.168 11.439 -30.480
298 HD2 ARG 51 HD2 ARG 51 -1.723 8.975 -31.459
299 HD3 ARG 51 HD3 ARG 51 -1.564 8.619 -29.739
300 HE ARG 51 HE ARG 51 -3.213 10.887 -30.149
301 HH11 ARG 51 HH11 ARG 51 -3.193 7.414 -30.395
302 HH12 ARG 51 HH12 ARG 51 -4.902 7.257 -30.158
303 HH21 ARG 51 HH21 ARG 51 -5.464 10.693 -29.836
304 HH22 ARG 51 HH22 ARG 51 -6.193 9.123 -29.841
305 H TRP 52 H TRP 52 -0.016 13.233 -30.258
306 HA TRP 52 HA TRP 52 -1.425 14.346 -32.404
307 HB2 TRP 52 HB2 TRP 52 -1.908 14.573 -29.907
308 HB3 TRP 52 HB3 TRP 52 -0.696 15.851 -29.894
309 HD1 TRP 52 HD1 TRP 52 -4.276 15.142 -30.894
310 HE1 TRP 52 HE1 TRP 52 -5.387 17.329 -31.674
311 HE3 TRP 52 HE3 TRP 52 -0.135 18.134 -31.084
312 HZ2 TRP 52 HZ2 TRP 52 -4.611 19.972 -32.289
313 HZ3 TRP 52 HZ3 TRP 52 -0.405 20.479 -31.778
314 HH2 TRP 52 HH2 TRP 52 -2.597 21.377 -32.369
315 H LEU 53 H LEU 53 1.631 15.296 -30.900
316 HA LEU 53 HA LEU 53 1.996 17.687 -32.349
317 HB2 LEU 53 HB2 LEU 53 3.524 16.028 -30.538
318 HB3 LEU 53 HB3 LEU 53 4.536 16.678 -31.826
319 HG LEU 53 HG LEU 53 2.869 18.273 -29.881
320 HD11 LEU 53 HD11 LEU 53 4.912 18.952 -28.902
321 HD12 LEU 53 HD12 LEU 53 5.860 18.204 -30.187
322 HD13 LEU 53 HD13 LEU 53 4.984 17.194 -29.036
323 HD21 LEU 53 HD21 LEU 53 4.580 20.003 -31.139
324 HD22 LEU 53 HD22 LEU 53 2.864 19.815 -31.498
325 HD23 LEU 53 HD23 LEU 53 4.066 18.948 -32.455
326 H LEU 54 H LEU 54 3.003 14.354 -32.974
327 HA LEU 54 HA LEU 54 4.483 14.964 -35.327
328 HB2 LEU 54 HB2 LEU 54 3.235 12.295 -34.812
329 HB3 LEU 54 HB3 LEU 54 4.775 12.673 -35.580
330 HG LEU 54 HG LEU 54 4.148 12.819 -32.633
331 HD11 LEU 54 HD11 LEU 54 4.515 10.563 -33.797
332 HD12 LEU 54 HD12 LEU 54 5.483 10.928 -32.369
333 HD13 LEU 54 HD13 LEU 54 6.190 11.085 -33.977
334 HD21 LEU 54 HD21 LEU 54 5.786 14.322 -32.522
335 HD22 LEU 54 HD22 LEU 54 6.207 14.098 -34.220
336 HD23 LEU 54 HD23 LEU 54 6.885 13.026 -32.994
337 H GLU 55 H GLU 55 1.150 14.053 -34.679
338 HA GLU 55 HA GLU 55 0.326 13.441 -37.272
339 HB2 GLU 55 HB2 GLU 55 -0.904 13.881 -34.741
340 HB3 GLU 55 HB3 GLU 55 -1.784 14.818 -35.940
341 HG2 GLU 55 HG2 GLU 55 -1.130 11.933 -36.394
342 HG3 GLU 55 HG3 GLU 55 -2.547 12.423 -35.468
343 H HIS 56 H HIS 56 0.706 16.540 -35.657
344 HA HIS 56 HA HIS 56 0.199 17.867 -38.237
345 HB2 HIS 56 HB2 HIS 56 -0.687 18.695 -35.478
346 HB3 HIS 56 HB3 HIS 56 -0.583 19.846 -36.807
347 HD1 HIS 56 HD1 HIS 56 -1.890 18.574 -39.095
348 HD2 HIS 56 HD2 HIS 56 -3.260 17.950 -35.222
349 HE1 HIS 56 HE1 HIS 56 -4.284 17.842 -39.338
350 H GLU 57 H GLU 57 2.475 17.767 -38.612
351 HA GLU 57 HA GLU 57 4.004 19.700 -36.996
352 HB2 GLU 57 HB2 GLU 57 6.040 18.394 -37.723
353 HB3 GLU 57 HB3 GLU 57 4.976 17.572 -36.591
354 HG2 GLU 57 HG2 GLU 57 4.715 15.880 -37.986
355 HG3 GLU 57 HG3 GLU 57 4.174 16.964 -39.267
356 H GLU 58 H GLU 58 3.732 21.499 -38.242
357 HA GLU 58 HA GLU 58 4.878 21.374 -40.948
358 HB2 GLU 58 HB2 GLU 58 3.205 22.868 -41.801
359 HB3 GLU 58 HB3 GLU 58 2.385 21.523 -41.020
360 HG2 GLU 58 HG2 GLU 58 2.647 23.387 -39.002
361 HG3 GLU 58 HG3 GLU 58 2.288 24.356 -40.429
362 H VAL 59 H VAL 59 6.042 23.179 -41.619
363 HA VAL 59 HA VAL 59 7.440 24.960 -41.382
364 HB VAL 59 HB VAL 59 5.390 25.893 -39.368
365 HG11 VAL 59 HG11 VAL 59 7.149 27.297 -38.946
366 HG12 VAL 59 HG12 VAL 59 7.791 27.164 -40.584
367 HG13 VAL 59 HG13 VAL 59 6.371 28.162 -40.271
368 HG21 VAL 59 HG21 VAL 59 5.266 25.612 -42.211
369 HG22 VAL 59 HG22 VAL 59 4.034 26.208 -41.099
370 HG23 VAL 59 HG23 VAL 59 5.214 27.323 -41.788
Start of MODEL 2
1 H MET 11 H MET 11 -2.549 -1.721 -1.867
2 HA MET 11 HA MET 11 -0.024 -0.617 -1.394
3 HB2 MET 11 HB2 MET 11 0.146 -0.358 -3.803
4 HB3 MET 11 HB3 MET 11 -0.614 -1.896 -3.419
5 HG2 MET 11 HG2 MET 11 -2.812 -0.429 -3.693
6 HG3 MET 11 HG3 MET 11 -1.736 0.505 -4.730
7 HE1 MET 11 HE1 MET 11 -4.176 -1.992 -6.852
8 HE2 MET 11 HE2 MET 11 -4.495 -1.689 -5.144
9 HE3 MET 11 HE3 MET 11 -4.064 -0.352 -6.212
10 H LEU 12 H LEU 12 0.821 1.459 -2.137
11 HA LEU 12 HA LEU 12 -1.124 3.635 -2.274
12 HB2 LEU 12 HB2 LEU 12 1.218 3.828 -0.409
13 HB3 LEU 12 HB3 LEU 12 -0.191 4.880 -0.515
14 HG LEU 12 HG LEU 12 -0.356 2.020 0.410
15 HD11 LEU 12 HD11 LEU 12 -0.253 4.423 2.209
16 HD12 LEU 12 HD12 LEU 12 1.181 3.479 1.808
17 HD13 LEU 12 HD13 LEU 12 -0.169 2.716 2.647
18 HD21 LEU 12 HD21 LEU 12 -2.252 4.026 1.377
19 HD22 LEU 12 HD22 LEU 12 -2.536 2.403 0.747
20 HD23 LEU 12 HD23 LEU 12 -2.317 3.755 -0.365
21 H ASP 13 H ASP 13 0.629 5.760 -2.116
22 HA ASP 13 HA ASP 13 2.032 7.015 -3.394
23 HB2 ASP 13 HB2 ASP 13 3.533 4.524 -4.148
24 HB3 ASP 13 HB3 ASP 13 4.155 6.148 -3.867
25 H VAL 14 H VAL 14 0.679 7.664 -5.016
26 HA VAL 14 HA VAL 14 0.136 5.942 -7.277
27 HB VAL 14 HB VAL 14 -1.101 7.922 -8.169
28 HG11 VAL 14 HG11 VAL 14 -2.922 7.288 -7.023
29 HG12 VAL 14 HG12 VAL 14 -1.830 6.146 -6.235
30 HG13 VAL 14 HG13 VAL 14 -2.202 7.689 -5.464
31 HG21 VAL 14 HG21 VAL 14 -1.036 9.961 -7.224
32 HG22 VAL 14 HG22 VAL 14 -1.011 9.314 -5.584
33 HG23 VAL 14 HG23 VAL 14 0.479 9.394 -6.523
34 H GLY 15 H GLY 15 2.755 6.067 -7.301
35 HA2 GLY 15 HA2 GLY 15 3.636 8.295 -8.975
36 HA3 GLY 15 HA3 GLY 15 4.665 7.068 -8.252
37 H LYS 16 H LYS 16 3.664 8.195 -11.111
38 HA LYS 16 HA LYS 16 3.507 5.558 -12.397
39 HB2 LYS 16 HB2 LYS 16 2.158 8.030 -12.844
40 HB3 LYS 16 HB3 LYS 16 3.126 7.674 -14.269
41 HG2 LYS 16 HG2 LYS 16 1.246 6.562 -14.851
42 HG3 LYS 16 HG3 LYS 16 2.031 5.276 -13.931
43 HD2 LYS 16 HD2 LYS 16 0.273 5.206 -12.573
44 HD3 LYS 16 HD3 LYS 16 0.605 6.870 -12.084
45 HE2 LYS 16 HE2 LYS 16 -1.008 7.728 -13.429
46 HE3 LYS 16 HE3 LYS 16 -0.778 6.499 -14.671
47 HZ1 LYS 16 HZ1 LYS 16 -1.984 5.790 -12.076
48 HZ2 LYS 16 HZ2 LYS 16 -2.139 5.012 -13.570
49 HZ3 LYS 16 HZ3 LYS 16 -2.930 6.482 -13.297
50 H HIS 17 H HIS 17 5.039 4.865 -13.794
51 HA HIS 17 HA HIS 17 7.519 6.363 -13.896
52 HB2 HIS 17 HB2 HIS 17 6.982 3.707 -15.217
53 HB3 HIS 17 HB3 HIS 17 8.528 4.372 -14.700
54 HD1 HIS 17 HD1 HIS 17 5.319 3.014 -13.211
55 HD2 HIS 17 HD2 HIS 17 9.296 3.645 -12.186
56 HE1 HIS 17 HE1 HIS 17 5.614 1.927 -10.962
57 H CYS 18 H CYS 18 8.362 7.372 -15.636
58 HA CYS 18 HA CYS 18 6.777 8.314 -17.687
59 HB2 CYS 18 HB2 CYS 18 9.049 9.173 -16.968
60 HB3 CYS 18 HB3 CYS 18 9.756 7.880 -17.932
61 H ALA 19 H ALA 19 6.371 7.733 -19.791
62 HA ALA 19 HA ALA 19 6.831 4.919 -20.423
63 HB1 ALA 19 HB1 ALA 19 4.715 6.785 -20.912
64 HB2 ALA 19 HB2 ALA 19 5.279 6.108 -22.440
65 HB3 ALA 19 HB3 ALA 19 4.738 5.037 -21.148
66 H TYR 20 H TYR 20 8.813 7.243 -20.690
67 HA TYR 20 HA TYR 20 9.613 6.608 -23.449
68 HB2 TYR 20 HB2 TYR 20 8.620 8.966 -23.092
69 HB3 TYR 20 HB3 TYR 20 10.119 9.316 -22.239
70 HD1 TYR 20 HD1 TYR 20 12.198 9.563 -23.430
71 HD2 TYR 20 HD2 TYR 20 8.634 8.513 -25.504
72 HE1 TYR 20 HE1 TYR 20 13.304 10.060 -25.570
73 HE2 TYR 20 HE2 TYR 20 9.731 9.006 -27.650
74 HH TYR 20 HH TYR 20 12.434 9.017 -28.375
75 H CYS 21 H CYS 21 10.613 7.715 -20.244
76 HA CYS 21 HA CYS 21 13.315 6.680 -20.805
77 HB2 CYS 21 HB2 CYS 21 14.242 8.304 -19.366
78 HB3 CYS 21 HB3 CYS 21 13.043 9.177 -20.316
79 H ARG 22 H ARG 22 10.505 6.375 -18.899
80 HA ARG 22 HA ARG 22 9.906 4.903 -17.270
81 HB2 ARG 22 HB2 ARG 22 12.612 3.609 -17.554
82 HB3 ARG 22 HB3 ARG 22 11.107 2.875 -17.015
83 HG2 ARG 22 HG2 ARG 22 10.570 3.816 -19.581
84 HG3 ARG 22 HG3 ARG 22 12.186 3.112 -19.671
85 HD2 ARG 22 HD2 ARG 22 11.151 1.124 -18.400
86 HD3 ARG 22 HD3 ARG 22 9.601 1.811 -18.886
87 HE ARG 22 HE ARG 22 9.967 1.007 -20.987
88 HH11 ARG 22 HH11 ARG 22 13.016 1.178 -19.316
89 HH12 ARG 22 HH12 ARG 22 13.905 0.408 -20.589
90 HH21 ARG 22 HH21 ARG 22 11.126 -0.008 -22.670
91 HH22 ARG 22 HH22 ARG 22 12.829 -0.265 -22.496
92 H GLN 23 H GLN 23 10.361 7.085 -16.120
93 HA GLN 23 HA GLN 23 12.330 6.601 -13.981
94 HB2 GLN 23 HB2 GLN 23 13.069 8.501 -15.215
95 HB3 GLN 23 HB3 GLN 23 11.451 9.187 -15.258
96 HG2 GLN 23 HG2 GLN 23 11.539 9.557 -12.848
97 HG3 GLN 23 HG3 GLN 23 13.159 8.864 -12.801
98 HE21 GLN 23 HE21 GLN 23 12.633 11.398 -11.860
99 HE22 GLN 23 HE22 GLN 23 13.398 12.559 -12.885
100 H LEU 24 H LEU 24 11.366 6.062 -12.147
101 HA LEU 24 HA LEU 24 8.626 6.343 -11.623
102 HB2 LEU 24 HB2 LEU 24 10.341 4.771 -10.554
103 HB3 LEU 24 HB3 LEU 24 10.724 6.120 -9.487
104 HG LEU 24 HG LEU 24 7.925 5.060 -9.727
105 HD11 LEU 24 HD11 LEU 24 8.284 3.358 -8.278
106 HD12 LEU 24 HD12 LEU 24 9.623 4.174 -7.473
107 HD13 LEU 24 HD13 LEU 24 9.880 3.384 -9.028
108 HD21 LEU 24 HD21 LEU 24 7.629 6.871 -8.446
109 HD22 LEU 24 HD22 LEU 24 9.352 7.027 -8.102
110 HD23 LEU 24 HD23 LEU 24 8.363 5.906 -7.166
111 H ASP 25 H ASP 25 7.604 8.224 -11.436
112 HA ASP 25 HA ASP 25 8.862 10.337 -9.811
113 HB2 ASP 25 HB2 ASP 25 7.628 10.421 -12.457
114 HB3 ASP 25 HB3 ASP 25 6.950 11.612 -11.351
115 H PHE 26 H PHE 26 7.399 11.707 -8.601
116 HA PHE 26 HA PHE 26 5.244 10.157 -7.438
117 HB2 PHE 26 HB2 PHE 26 6.122 12.940 -6.663
118 HB3 PHE 26 HB3 PHE 26 5.220 11.786 -5.686
119 HD1 PHE 26 HD1 PHE 26 8.517 12.592 -7.100
120 HD2 PHE 26 HD2 PHE 26 6.323 10.066 -4.468
121 HE1 PHE 26 HE1 PHE 26 10.627 11.761 -6.143
122 HE2 PHE 26 HE2 PHE 26 8.429 9.232 -3.507
123 HZ PHE 26 HZ PHE 26 10.584 10.079 -4.345
124 H LEU 27 H LEU 27 5.663 13.146 -9.262
125 HA LEU 27 HA LEU 27 2.735 13.376 -9.470
126 HB2 LEU 27 HB2 LEU 27 3.361 15.739 -10.297
127 HB3 LEU 27 HB3 LEU 27 3.434 15.382 -8.573
128 HG LEU 27 HG LEU 27 5.960 14.987 -10.022
129 HD11 LEU 27 HD11 LEU 27 6.248 17.599 -9.737
130 HD12 LEU 27 HD12 LEU 27 4.515 17.581 -10.060
131 HD13 LEU 27 HD13 LEU 27 5.638 16.890 -11.232
132 HD21 LEU 27 HD21 LEU 27 6.828 16.157 -8.044
133 HD22 LEU 27 HD22 LEU 27 5.803 14.789 -7.609
134 HD23 LEU 27 HD23 LEU 27 5.175 16.434 -7.494
135 HA PRO 28 HA PRO 28 4.094 11.958 -13.637
136 HB2 PRO 28 HB2 PRO 28 1.882 10.446 -14.075
137 HB3 PRO 28 HB3 PRO 28 3.295 9.849 -13.196
138 HG2 PRO 28 HG2 PRO 28 0.708 10.911 -12.127
139 HG3 PRO 28 HG3 PRO 28 1.645 9.502 -11.595
140 HD2 PRO 28 HD2 PRO 28 1.720 11.877 -10.297
141 HD3 PRO 28 HD3 PRO 28 3.119 10.786 -10.374
142 H PHE 29 H PHE 29 3.698 13.185 -15.363
143 HA PHE 29 HA PHE 29 1.433 14.980 -15.376
144 HB2 PHE 29 HB2 PHE 29 3.920 14.666 -16.997
145 HB3 PHE 29 HB3 PHE 29 2.565 15.536 -17.709
146 HD1 PHE 29 HD1 PHE 29 1.963 17.712 -16.963
147 HD2 PHE 29 HD2 PHE 29 5.004 15.511 -14.958
148 HE1 PHE 29 HE1 PHE 29 2.634 19.747 -15.754
149 HE2 PHE 29 HE2 PHE 29 5.679 17.542 -13.745
150 HZ PHE 29 HZ PHE 29 4.493 19.664 -14.142
151 H HIS 30 H HIS 30 -0.480 14.324 -16.084
152 HA HIS 30 HA HIS 30 -0.688 12.124 -17.970
153 HB2 HIS 30 HB2 HIS 30 -2.209 12.070 -16.105
154 HB3 HIS 30 HB3 HIS 30 -2.767 13.704 -16.448
155 HD1 HIS 30 HD1 HIS 30 -3.320 10.168 -17.347
156 HD2 HIS 30 HD2 HIS 30 -4.471 13.911 -18.736
157 HE1 HIS 30 HE1 HIS 30 -5.247 9.743 -18.907
158 H CYS 31 H CYS 31 -0.791 12.418 -20.087
159 HA CYS 31 HA CYS 31 -1.226 15.071 -21.172
160 HB2 CYS 31 HB2 CYS 31 0.424 13.077 -21.933
161 HB3 CYS 31 HB3 CYS 31 -0.943 12.749 -22.993
162 H SER 32 H SER 32 -3.051 15.795 -22.064
163 HA SER 32 HA SER 32 -5.350 14.001 -22.148
164 HB2 SER 32 HB2 SER 32 -5.187 16.489 -21.179
165 HB3 SER 32 HB3 SER 32 -5.618 16.885 -22.843
166 HG SER 32 HG SER 32 -7.422 16.556 -21.364
167 H PHE 33 H PHE 33 -3.080 14.149 -24.177
168 HA PHE 33 HA PHE 33 -4.766 14.557 -26.560
169 HB2 PHE 33 HB2 PHE 33 -1.757 14.695 -26.576
170 HB3 PHE 33 HB3 PHE 33 -2.886 15.292 -27.788
171 HD1 PHE 33 HD1 PHE 33 -4.801 16.765 -26.094
172 HD2 PHE 33 HD2 PHE 33 -0.552 16.576 -25.951
173 HE1 PHE 33 HE1 PHE 33 -4.741 18.992 -25.052
174 HE2 PHE 33 HE2 PHE 33 -0.484 18.803 -24.908
175 HZ PHE 33 HZ PHE 33 -2.580 20.015 -24.458
176 H CYS 34 H CYS 34 -2.062 12.669 -25.239
177 HA CYS 34 HA CYS 34 -2.702 10.522 -27.144
178 HB2 CYS 34 HB2 CYS 34 -0.460 9.647 -26.668
179 HB3 CYS 34 HB3 CYS 34 -0.382 11.318 -27.217
180 H ASN 35 H ASN 35 -2.921 11.421 -23.875
181 HA ASN 35 HA ASN 35 -3.760 10.361 -22.043
182 HB2 ASN 35 HB2 ASN 35 -5.202 9.301 -24.007
183 HB3 ASN 35 HB3 ASN 35 -4.313 7.849 -23.556
184 HD21 ASN 35 HD21 ASN 35 -5.940 6.717 -22.649
185 HD22 ASN 35 HD22 ASN 35 -6.795 7.213 -21.232
186 H GLU 36 H GLU 36 -1.212 10.388 -21.891
187 HA GLU 36 HA GLU 36 -0.483 7.755 -20.880
188 HB2 GLU 36 HB2 GLU 36 1.047 9.234 -23.011
189 HB3 GLU 36 HB3 GLU 36 1.821 8.051 -21.967
190 HG2 GLU 36 HG2 GLU 36 -0.420 6.732 -22.882
191 HG3 GLU 36 HG3 GLU 36 0.118 7.662 -24.280
192 H ASP 37 H ASP 37 1.262 7.798 -19.368
193 HA ASP 37 HA ASP 37 1.526 10.405 -18.061
194 HB2 ASP 37 HB2 ASP 37 2.335 7.706 -16.972
195 HB3 ASP 37 HB3 ASP 37 2.128 9.206 -16.072
196 H PHE 38 H PHE 38 3.476 11.364 -17.639
197 HA PHE 38 HA PHE 38 5.946 10.008 -18.342
198 HB2 PHE 38 HB2 PHE 38 5.163 12.590 -19.709
199 HB3 PHE 38 HB3 PHE 38 6.675 11.713 -19.919
200 HD1 PHE 38 HD1 PHE 38 6.584 9.395 -20.931
201 HD2 PHE 38 HD2 PHE 38 3.298 12.098 -21.020
202 HE1 PHE 38 HE1 PHE 38 5.587 8.116 -22.782
203 HE2 PHE 38 HE2 PHE 38 2.295 10.824 -22.871
204 HZ PHE 38 HZ PHE 38 3.439 8.830 -23.753
205 H CYS 39 H CYS 39 7.647 10.703 -17.160
206 HA CYS 39 HA CYS 39 7.320 12.127 -14.832
207 HB2 CYS 39 HB2 CYS 39 9.678 12.127 -14.607
208 HB3 CYS 39 HB3 CYS 39 9.295 10.681 -15.536
209 H SER 40 H SER 40 8.190 14.222 -14.173
210 HA SER 40 HA SER 40 7.127 16.346 -15.594
211 HB2 SER 40 HB2 SER 40 7.776 16.389 -13.180
212 HB3 SER 40 HB3 SER 40 9.464 16.507 -13.677
213 HG SER 40 HG SER 40 9.042 18.489 -14.592
214 H ASN 41 H ASN 41 10.337 14.934 -15.754
215 HA ASN 41 HA ASN 41 11.598 16.958 -17.244
216 HB2 ASN 41 HB2 ASN 41 12.274 14.397 -16.250
217 HB3 ASN 41 HB3 ASN 41 12.615 14.373 -17.977
218 HD21 ASN 41 HD21 ASN 41 12.854 16.905 -15.507
219 HD22 ASN 41 HD22 ASN 41 14.522 17.257 -15.786
220 H HIS 42 H HIS 42 9.408 14.419 -18.148
221 HA HIS 42 HA HIS 42 9.695 15.213 -20.972
222 HB2 HIS 42 HB2 HIS 42 9.021 12.527 -19.773
223 HB3 HIS 42 HB3 HIS 42 8.732 12.909 -21.468
224 HD2 HIS 42 HD2 HIS 42 11.327 13.859 -22.718
225 HE1 HIS 42 HE1 HIS 42 13.479 11.092 -20.327
226 HE2 HIS 42 HE2 HIS 42 13.553 12.593 -22.350
227 H ARG 43 H ARG 43 7.954 16.214 -18.708
228 HA ARG 43 HA ARG 43 5.300 15.426 -19.060
229 HB2 ARG 43 HB2 ARG 43 4.699 17.567 -18.034
230 HB3 ARG 43 HB3 ARG 43 6.040 16.813 -17.184
231 HG2 ARG 43 HG2 ARG 43 7.529 18.302 -18.671
232 HG3 ARG 43 HG3 ARG 43 6.048 19.219 -18.957
233 HD2 ARG 43 HD2 ARG 43 5.963 20.008 -16.829
234 HD3 ARG 43 HD3 ARG 43 6.689 18.553 -16.146
235 HE ARG 43 HE ARG 43 8.749 19.531 -16.345
236 HH11 ARG 43 HH11 ARG 43 6.456 21.295 -18.282
237 HH12 ARG 43 HH12 ARG 43 7.558 22.581 -18.649
238 HH21 ARG 43 HH21 ARG 43 10.209 21.218 -16.820
239 HH22 ARG 43 HH22 ARG 43 9.693 22.536 -17.818
240 H LEU 44 H LEU 44 7.234 17.821 -20.783
241 HA LEU 44 HA LEU 44 5.286 19.116 -22.245
242 HB2 LEU 44 HB2 LEU 44 7.961 18.283 -23.344
243 HB3 LEU 44 HB3 LEU 44 6.984 19.665 -23.835
244 HG LEU 44 HG LEU 44 8.386 19.344 -21.182
245 HD11 LEU 44 HD11 LEU 44 9.443 20.051 -23.647
246 HD12 LEU 44 HD12 LEU 44 10.156 20.358 -22.063
247 HD13 LEU 44 HD13 LEU 44 9.155 21.589 -22.833
248 HD21 LEU 44 HD21 LEU 44 7.703 21.630 -20.756
249 HD22 LEU 44 HD22 LEU 44 6.287 20.615 -21.028
250 HD23 LEU 44 HD23 LEU 44 6.859 21.691 -22.304
251 H LYS 45 H LYS 45 4.789 18.876 -24.585
252 HA LYS 45 HA LYS 45 3.718 16.289 -25.093
253 HB2 LYS 45 HB2 LYS 45 3.469 18.933 -26.186
254 HB3 LYS 45 HB3 LYS 45 3.720 17.783 -27.493
255 HG2 LYS 45 HG2 LYS 45 1.862 16.476 -26.028
256 HG3 LYS 45 HG3 LYS 45 1.414 18.155 -25.716
257 HD2 LYS 45 HD2 LYS 45 1.850 17.007 -28.470
258 HD3 LYS 45 HD3 LYS 45 0.272 17.125 -27.689
259 HE2 LYS 45 HE2 LYS 45 2.087 19.487 -28.134
260 HE3 LYS 45 HE3 LYS 45 0.844 18.991 -29.282
261 HZ1 LYS 45 HZ1 LYS 45 0.023 20.723 -27.836
262 HZ2 LYS 45 HZ2 LYS 45 0.388 19.805 -26.462
263 HZ3 LYS 45 HZ3 LYS 45 -0.814 19.285 -27.533
264 H GLU 46 H GLU 46 6.062 18.206 -26.986
265 HA GLU 46 HA GLU 46 6.871 16.152 -28.680
266 HB2 GLU 46 HB2 GLU 46 8.864 17.514 -29.122
267 HB3 GLU 46 HB3 GLU 46 7.404 18.493 -29.108
268 HG2 GLU 46 HG2 GLU 46 8.058 18.876 -26.601
269 HG3 GLU 46 HG3 GLU 46 9.663 18.427 -27.174
270 H ASP 47 H ASP 47 7.811 16.885 -25.409
271 HA ASP 47 HA ASP 47 10.225 15.594 -25.151
272 HB2 ASP 47 HB2 ASP 47 8.012 16.287 -23.356
273 HB3 ASP 47 HB3 ASP 47 8.954 14.901 -22.813
274 H HIS 48 H HIS 48 7.001 14.130 -24.739
275 HA HIS 48 HA HIS 48 8.213 11.473 -24.845
276 HB2 HIS 48 HB2 HIS 48 5.994 10.656 -24.167
277 HB3 HIS 48 HB3 HIS 48 6.591 11.889 -23.061
278 HD1 HIS 48 HD1 HIS 48 5.134 13.895 -22.699
279 HD2 HIS 48 HD2 HIS 48 3.927 11.618 -25.958
280 HE1 HIS 48 HE1 HIS 48 2.935 14.875 -23.426
281 H HIS 49 H HIS 49 7.822 13.375 -27.174
282 HA HIS 49 HA HIS 49 7.164 13.324 -29.357
283 HB2 HIS 49 HB2 HIS 49 7.717 10.456 -28.684
284 HB3 HIS 49 HB3 HIS 49 7.095 10.871 -30.279
285 HD1 HIS 49 HD1 HIS 49 8.968 10.919 -31.877
286 HD2 HIS 49 HD2 HIS 49 10.063 12.474 -28.184
287 HE1 HIS 49 HE1 HIS 49 11.356 11.662 -32.142
288 H CYS 50 H CYS 50 5.026 13.936 -28.009
289 HA CYS 50 HA CYS 50 2.845 12.252 -27.880
290 HB2 CYS 50 HB2 CYS 50 3.089 14.707 -27.117
291 HB3 CYS 50 HB3 CYS 50 2.567 15.121 -28.747
292 H ARG 51 H ARG 51 1.667 11.203 -29.336
293 HA ARG 51 HA ARG 51 2.225 11.112 -32.042
294 HB2 ARG 51 HB2 ARG 51 0.158 9.889 -32.307
295 HB3 ARG 51 HB3 ARG 51 0.920 9.410 -30.797
296 HG2 ARG 51 HG2 ARG 51 -0.622 11.195 -29.733
297 HG3 ARG 51 HG3 ARG 51 -1.538 11.048 -31.234
298 HD2 ARG 51 HD2 ARG 51 -0.887 8.847 -29.280
299 HD3 ARG 51 HD3 ARG 51 -2.470 9.564 -29.579
300 HE ARG 51 HE ARG 51 -1.291 8.422 -31.929
301 HH11 ARG 51 HH11 ARG 51 -3.144 7.742 -29.061
302 HH12 ARG 51 HH12 ARG 51 -3.896 6.329 -29.725
303 HH21 ARG 51 HH21 ARG 51 -2.275 6.564 -32.814
304 HH22 ARG 51 HH22 ARG 51 -3.400 5.659 -31.859
305 H TRP 52 H TRP 52 -0.009 13.186 -30.296
306 HA TRP 52 HA TRP 52 -1.437 14.214 -32.475
307 HB2 TRP 52 HB2 TRP 52 -1.924 14.508 -29.986
308 HB3 TRP 52 HB3 TRP 52 -0.727 15.800 -30.009
309 HD1 TRP 52 HD1 TRP 52 -4.298 15.021 -30.990
310 HE1 TRP 52 HE1 TRP 52 -5.434 17.171 -31.833
311 HE3 TRP 52 HE3 TRP 52 -0.192 18.054 -31.264
312 HZ2 TRP 52 HZ2 TRP 52 -4.688 19.804 -32.523
313 HZ3 TRP 52 HZ3 TRP 52 -0.488 20.374 -32.026
314 HH2 TRP 52 HH2 TRP 52 -2.691 21.229 -32.642
315 H LEU 53 H LEU 53 1.627 15.207 -31.027
316 HA LEU 53 HA LEU 53 1.960 17.576 -32.527
317 HB2 LEU 53 HB2 LEU 53 3.517 15.964 -30.694
318 HB3 LEU 53 HB3 LEU 53 4.512 16.604 -32.001
319 HG LEU 53 HG LEU 53 2.832 18.219 -30.082
320 HD11 LEU 53 HD11 LEU 53 4.877 17.229 -29.113
321 HD12 LEU 53 HD12 LEU 53 4.934 18.990 -29.192
322 HD13 LEU 53 HD13 LEU 53 5.827 18.026 -30.368
323 HD21 LEU 53 HD21 LEU 53 2.799 19.629 -31.850
324 HD22 LEU 53 HD22 LEU 53 4.199 18.879 -32.618
325 HD23 LEU 53 HD23 LEU 53 4.425 20.009 -31.282
326 H LEU 54 H LEU 54 2.815 14.218 -33.137
327 HA LEU 54 HA LEU 54 4.378 14.737 -35.461
328 HB2 LEU 54 HB2 LEU 54 2.955 12.152 -34.980
329 HB3 LEU 54 HB3 LEU 54 4.533 12.435 -35.713
330 HG LEU 54 HG LEU 54 3.851 12.610 -32.780
331 HD11 LEU 54 HD11 LEU 54 5.781 10.797 -32.910
332 HD12 LEU 54 HD12 LEU 54 5.103 10.562 -34.521
333 HD13 LEU 54 HD13 LEU 54 4.079 10.371 -33.098
334 HD21 LEU 54 HD21 LEU 54 6.250 13.005 -32.453
335 HD22 LEU 54 HD22 LEU 54 5.488 14.307 -33.367
336 HD23 LEU 54 HD23 LEU 54 6.466 13.099 -34.201
337 H GLU 55 H GLU 55 1.091 13.417 -35.040
338 HA GLU 55 HA GLU 55 0.429 13.334 -37.758
339 HB2 GLU 55 HB2 GLU 55 -1.874 13.135 -37.040
340 HB3 GLU 55 HB3 GLU 55 -0.846 12.191 -35.971
341 HG2 GLU 55 HG2 GLU 55 -0.882 14.176 -34.405
342 HG3 GLU 55 HG3 GLU 55 -2.169 14.827 -35.419
343 H HIS 56 H HIS 56 0.206 15.925 -35.394
344 HA HIS 56 HA HIS 56 -0.617 17.744 -37.561
345 HB2 HIS 56 HB2 HIS 56 -1.692 17.374 -34.858
346 HB3 HIS 56 HB3 HIS 56 -1.336 19.053 -35.252
347 HD1 HIS 56 HD1 HIS 56 -2.534 19.957 -37.502
348 HD2 HIS 56 HD2 HIS 56 -4.038 16.440 -35.880
349 HE1 HIS 56 HE1 HIS 56 -4.809 19.661 -38.531
350 H GLU 57 H GLU 57 1.600 18.142 -38.034
351 HA GLU 57 HA GLU 57 2.991 19.748 -35.993
352 HB2 GLU 57 HB2 GLU 57 5.067 19.173 -37.365
353 HB3 GLU 57 HB3 GLU 57 4.357 17.878 -36.411
354 HG2 GLU 57 HG2 GLU 57 3.206 17.070 -38.446
355 HG3 GLU 57 HG3 GLU 57 4.052 18.308 -39.373
356 H GLU 58 H GLU 58 2.466 21.809 -36.451
357 HA GLU 58 HA GLU 58 2.960 22.744 -39.202
358 HB2 GLU 58 HB2 GLU 58 1.248 24.532 -38.703
359 HB3 GLU 58 HB3 GLU 58 0.613 22.902 -38.876
360 HG2 GLU 58 HG2 GLU 58 0.596 22.699 -36.407
361 HG3 GLU 58 HG3 GLU 58 1.093 24.387 -36.305
362 H VAL 59 H VAL 59 4.266 24.472 -39.453
363 HA VAL 59 HA VAL 59 5.815 26.066 -38.957
364 HB VAL 59 HB VAL 59 4.081 26.561 -36.532
365 HG11 VAL 59 HG11 VAL 59 6.399 27.980 -37.734
366 HG12 VAL 59 HG12 VAL 59 5.091 28.950 -37.054
367 HG13 VAL 59 HG13 VAL 59 5.945 27.785 -36.042
368 HG21 VAL 59 HG21 VAL 59 3.685 27.089 -39.365
369 HG22 VAL 59 HG22 VAL 59 2.536 27.166 -38.029
370 HG23 VAL 59 HG23 VAL 59 3.578 28.546 -38.378
Start of MODEL 3
1 H MET 11 H MET 11 2.665 -3.001 1.519
2 HA MET 11 HA MET 11 4.080 -1.058 0.682
3 HB2 MET 11 HB2 MET 11 2.920 -3.252 -0.858
4 HB3 MET 11 HB3 MET 11 3.400 -1.892 -1.864
5 HG2 MET 11 HG2 MET 11 5.343 -2.798 0.169
6 HG3 MET 11 HG3 MET 11 5.052 -3.872 -1.198
7 HE1 MET 11 HE1 MET 11 6.154 -3.190 -3.838
8 HE2 MET 11 HE2 MET 11 7.777 -2.795 -3.270
9 HE3 MET 11 HE3 MET 11 6.831 -4.036 -2.446
10 H LEU 12 H LEU 12 3.976 0.974 -0.040
11 HA LEU 12 HA LEU 12 1.473 1.875 -1.305
12 HB2 LEU 12 HB2 LEU 12 3.157 3.726 0.321
13 HB3 LEU 12 HB3 LEU 12 1.441 3.827 -0.070
14 HG LEU 12 HG LEU 12 1.612 1.550 1.484
15 HD11 LEU 12 HD11 LEU 12 3.088 1.797 3.185
16 HD12 LEU 12 HD12 LEU 12 3.072 3.557 3.096
17 HD13 LEU 12 HD13 LEU 12 4.008 2.624 1.929
18 HD21 LEU 12 HD21 LEU 12 0.594 3.030 3.235
19 HD22 LEU 12 HD22 LEU 12 -0.179 3.109 1.651
20 HD23 LEU 12 HD23 LEU 12 0.909 4.398 2.168
21 H ASP 13 H ASP 13 1.952 2.169 -3.387
22 HA ASP 13 HA ASP 13 4.103 4.015 -4.063
23 HB2 ASP 13 HB2 ASP 13 3.959 1.157 -4.959
24 HB3 ASP 13 HB3 ASP 13 4.656 2.374 -6.024
25 H VAL 14 H VAL 14 1.868 5.095 -4.237
26 HA VAL 14 HA VAL 14 0.356 4.445 -6.612
27 HB VAL 14 HB VAL 14 -0.965 6.484 -6.027
28 HG11 VAL 14 HG11 VAL 14 -1.832 5.531 -3.841
29 HG12 VAL 14 HG12 VAL 14 -1.799 4.430 -5.220
30 HG13 VAL 14 HG13 VAL 14 -0.554 4.324 -3.975
31 HG21 VAL 14 HG21 VAL 14 -0.243 7.993 -4.559
32 HG22 VAL 14 HG22 VAL 14 0.067 6.754 -3.343
33 HG23 VAL 14 HG23 VAL 14 1.300 7.140 -4.543
34 H GLY 15 H GLY 15 2.744 4.820 -7.610
35 HA2 GLY 15 HA2 GLY 15 2.638 7.529 -8.784
36 HA3 GLY 15 HA3 GLY 15 4.161 6.785 -8.323
37 H LYS 16 H LYS 16 3.158 7.739 -10.947
38 HA LYS 16 HA LYS 16 3.123 5.221 -12.457
39 HB2 LYS 16 HB2 LYS 16 1.763 7.709 -12.762
40 HB3 LYS 16 HB3 LYS 16 2.803 7.482 -14.162
41 HG2 LYS 16 HG2 LYS 16 1.339 6.078 -15.036
42 HG3 LYS 16 HG3 LYS 16 1.489 5.022 -13.629
43 HD2 LYS 16 HD2 LYS 16 -0.162 6.560 -12.474
44 HD3 LYS 16 HD3 LYS 16 -0.445 7.290 -14.055
45 HE2 LYS 16 HE2 LYS 16 -0.651 4.326 -13.689
46 HE3 LYS 16 HE3 LYS 16 -1.993 5.376 -13.238
47 HZ1 LYS 16 HZ1 LYS 16 -1.879 6.292 -15.538
48 HZ2 LYS 16 HZ2 LYS 16 -2.347 4.669 -15.457
49 HZ3 LYS 16 HZ3 LYS 16 -0.772 5.072 -15.923
50 H HIS 17 H HIS 17 4.689 4.707 -13.919
51 HA HIS 17 HA HIS 17 7.149 6.262 -13.767
52 HB2 HIS 17 HB2 HIS 17 6.759 3.641 -15.208
53 HB3 HIS 17 HB3 HIS 17 8.264 4.343 -14.621
54 HD1 HIS 17 HD1 HIS 17 5.059 2.837 -13.268
55 HD2 HIS 17 HD2 HIS 17 8.989 3.541 -12.120
56 HE1 HIS 17 HE1 HIS 17 5.329 1.681 -11.051
57 H CYS 18 H CYS 18 8.079 7.319 -15.447
58 HA CYS 18 HA CYS 18 6.563 8.340 -17.512
59 HB2 CYS 18 HB2 CYS 18 8.834 9.136 -16.668
60 HB3 CYS 18 HB3 CYS 18 9.543 7.914 -17.719
61 H ALA 19 H ALA 19 6.393 7.916 -19.725
62 HA ALA 19 HA ALA 19 6.801 5.100 -20.426
63 HB1 ALA 19 HB1 ALA 19 4.726 6.998 -20.931
64 HB2 ALA 19 HB2 ALA 19 5.370 6.414 -22.466
65 HB3 ALA 19 HB3 ALA 19 4.758 5.268 -21.273
66 H TYR 20 H TYR 20 8.773 7.486 -20.515
67 HA TYR 20 HA TYR 20 9.749 6.903 -23.228
68 HB2 TYR 20 HB2 TYR 20 8.764 9.165 -23.183
69 HB3 TYR 20 HB3 TYR 20 9.845 9.603 -21.864
70 HD1 TYR 20 HD1 TYR 20 12.200 10.017 -22.269
71 HD2 TYR 20 HD2 TYR 20 9.603 8.918 -25.455
72 HE1 TYR 20 HE1 TYR 20 13.907 10.719 -23.895
73 HE2 TYR 20 HE2 TYR 20 11.303 9.616 -27.090
74 HH TYR 20 HH TYR 20 13.454 10.227 -27.362
75 H CYS 21 H CYS 21 10.524 7.935 -19.941
76 HA CYS 21 HA CYS 21 13.282 6.985 -20.363
77 HB2 CYS 21 HB2 CYS 21 14.081 8.591 -18.842
78 HB3 CYS 21 HB3 CYS 21 12.890 9.463 -19.803
79 H ARG 22 H ARG 22 10.363 6.476 -18.721
80 HA ARG 22 HA ARG 22 9.701 4.971 -17.149
81 HB2 ARG 22 HB2 ARG 22 12.455 3.777 -17.507
82 HB3 ARG 22 HB3 ARG 22 11.056 2.983 -16.796
83 HG2 ARG 22 HG2 ARG 22 10.653 4.010 -19.517
84 HG3 ARG 22 HG3 ARG 22 11.831 2.705 -19.367
85 HD2 ARG 22 HD2 ARG 22 9.054 2.592 -18.204
86 HD3 ARG 22 HD3 ARG 22 9.467 1.975 -19.804
87 HE ARG 22 HE ARG 22 10.039 0.747 -17.276
88 HH11 ARG 22 HH11 ARG 22 11.047 1.029 -20.596
89 HH12 ARG 22 HH12 ARG 22 11.844 -0.510 -20.621
90 HH21 ARG 22 HH21 ARG 22 11.084 -1.280 -17.296
91 HH22 ARG 22 HH22 ARG 22 11.863 -1.822 -18.744
92 H GLN 23 H GLN 23 10.008 7.070 -15.856
93 HA GLN 23 HA GLN 23 11.906 6.560 -13.660
94 HB2 GLN 23 HB2 GLN 23 12.600 8.557 -14.766
95 HB3 GLN 23 HB3 GLN 23 10.953 9.172 -14.829
96 HG2 GLN 23 HG2 GLN 23 10.942 9.758 -12.599
97 HG3 GLN 23 HG3 GLN 23 12.241 8.638 -12.192
98 HE21 GLN 23 HE21 GLN 23 13.043 10.587 -11.078
99 HE22 GLN 23 HE22 GLN 23 14.019 11.695 -11.975
100 H LEU 24 H LEU 24 10.927 5.940 -11.862
101 HA LEU 24 HA LEU 24 8.140 6.068 -11.460
102 HB2 LEU 24 HB2 LEU 24 9.787 4.445 -10.434
103 HB3 LEU 24 HB3 LEU 24 10.212 5.731 -9.306
104 HG LEU 24 HG LEU 24 7.373 4.809 -9.557
105 HD11 LEU 24 HD11 LEU 24 9.239 3.607 -7.555
106 HD12 LEU 24 HD12 LEU 24 9.062 2.890 -9.156
107 HD13 LEU 24 HD13 LEU 24 7.660 3.039 -8.097
108 HD21 LEU 24 HD21 LEU 24 7.135 6.395 -8.021
109 HD22 LEU 24 HD22 LEU 24 8.880 6.625 -7.905
110 HD23 LEU 24 HD23 LEU 24 8.085 5.393 -6.923
111 H ASP 25 H ASP 25 7.093 7.942 -11.255
112 HA ASP 25 HA ASP 25 8.206 9.957 -9.413
113 HB2 ASP 25 HB2 ASP 25 7.517 10.261 -12.104
114 HB3 ASP 25 HB3 ASP 25 6.182 10.991 -11.217
115 H PHE 26 H PHE 26 6.629 11.238 -8.223
116 HA PHE 26 HA PHE 26 4.462 9.559 -7.266
117 HB2 PHE 26 HB2 PHE 26 5.224 12.299 -6.255
118 HB3 PHE 26 HB3 PHE 26 4.324 11.047 -5.405
119 HD1 PHE 26 HD1 PHE 26 7.645 12.064 -6.609
120 HD2 PHE 26 HD2 PHE 26 5.437 9.279 -4.268
121 HE1 PHE 26 HE1 PHE 26 9.742 11.236 -5.623
122 HE2 PHE 26 HE2 PHE 26 7.530 8.446 -3.278
123 HZ PHE 26 HZ PHE 26 9.686 9.425 -3.954
124 H LEU 27 H LEU 27 4.908 12.682 -8.847
125 HA LEU 27 HA LEU 27 1.991 12.874 -9.192
126 HB2 LEU 27 HB2 LEU 27 4.058 14.815 -8.585
127 HB3 LEU 27 HB3 LEU 27 3.093 15.293 -9.980
128 HG LEU 27 HG LEU 27 1.945 14.591 -7.280
129 HD11 LEU 27 HD11 LEU 27 3.212 16.560 -6.951
130 HD12 LEU 27 HD12 LEU 27 1.539 17.076 -7.161
131 HD13 LEU 27 HD13 LEU 27 2.686 17.243 -8.490
132 HD21 LEU 27 HD21 LEU 27 0.276 16.263 -8.829
133 HD22 LEU 27 HD22 LEU 27 -0.008 14.595 -8.331
134 HD23 LEU 27 HD23 LEU 27 0.794 14.934 -9.866
135 HA PRO 28 HA PRO 28 3.558 11.759 -13.372
136 HB2 PRO 28 HB2 PRO 28 1.373 10.287 -14.028
137 HB3 PRO 28 HB3 PRO 28 2.739 9.627 -13.120
138 HG2 PRO 28 HG2 PRO 28 0.099 10.620 -12.116
139 HG3 PRO 28 HG3 PRO 28 1.008 9.176 -11.634
140 HD2 PRO 28 HD2 PRO 28 1.014 11.456 -10.173
141 HD3 PRO 28 HD3 PRO 28 2.416 10.369 -10.253
142 H PHE 29 H PHE 29 3.252 13.102 -15.029
143 HA PHE 29 HA PHE 29 0.968 14.881 -15.041
144 HB2 PHE 29 HB2 PHE 29 3.572 14.737 -16.489
145 HB3 PHE 29 HB3 PHE 29 2.256 15.632 -17.241
146 HD1 PHE 29 HD1 PHE 29 1.569 17.746 -16.413
147 HD2 PHE 29 HD2 PHE 29 4.448 15.439 -14.291
148 HE1 PHE 29 HE1 PHE 29 2.093 19.697 -15.010
149 HE2 PHE 29 HE2 PHE 29 4.976 17.387 -12.883
150 HZ PHE 29 HZ PHE 29 3.799 19.520 -13.243
151 H HIS 30 H HIS 30 -0.876 14.054 -15.802
152 HA HIS 30 HA HIS 30 -0.906 12.088 -17.913
153 HB2 HIS 30 HB2 HIS 30 -2.526 11.922 -16.098
154 HB3 HIS 30 HB3 HIS 30 -3.163 13.516 -16.492
155 HD1 HIS 30 HD1 HIS 30 -3.250 9.953 -17.579
156 HD2 HIS 30 HD2 HIS 30 -4.833 13.609 -18.756
157 HE1 HIS 30 HE1 HIS 30 -5.045 9.401 -19.251
158 H CYS 31 H CYS 31 -0.943 12.518 -20.011
159 HA CYS 31 HA CYS 31 -1.332 15.242 -20.923
160 HB2 CYS 31 HB2 CYS 31 0.363 13.324 -21.747
161 HB3 CYS 31 HB3 CYS 31 -0.956 13.040 -22.877
162 H SER 32 H SER 32 -3.116 16.031 -21.844
163 HA SER 32 HA SER 32 -5.405 14.250 -22.163
164 HB2 SER 32 HB2 SER 32 -5.226 16.730 -21.065
165 HB3 SER 32 HB3 SER 32 -5.746 17.135 -22.700
166 HG SER 32 HG SER 32 -7.439 16.674 -21.076
167 H PHE 33 H PHE 33 -3.050 14.535 -24.070
168 HA PHE 33 HA PHE 33 -4.624 15.130 -26.489
169 HB2 PHE 33 HB2 PHE 33 -1.617 15.252 -26.355
170 HB3 PHE 33 HB3 PHE 33 -2.685 15.939 -27.574
171 HD1 PHE 33 HD1 PHE 33 -4.676 17.305 -25.889
172 HD2 PHE 33 HD2 PHE 33 -0.442 17.070 -25.526
173 HE1 PHE 33 HE1 PHE 33 -4.663 19.453 -24.690
174 HE2 PHE 33 HE2 PHE 33 -0.422 19.217 -24.324
175 HZ PHE 33 HZ PHE 33 -2.535 20.411 -23.904
176 H CYS 34 H CYS 34 -1.989 13.132 -25.191
177 HA CYS 34 HA CYS 34 -2.544 11.138 -27.279
178 HB2 CYS 34 HB2 CYS 34 -0.332 10.212 -26.758
179 HB3 CYS 34 HB3 CYS 34 -0.221 11.918 -27.181
180 H ASN 35 H ASN 35 -2.911 11.789 -23.963
181 HA ASN 35 HA ASN 35 -3.851 10.601 -22.263
182 HB2 ASN 35 HB2 ASN 35 -5.190 9.695 -24.373
183 HB3 ASN 35 HB3 ASN 35 -4.330 8.209 -23.980
184 HD21 ASN 35 HD21 ASN 35 -4.442 7.586 -21.628
185 HD22 ASN 35 HD22 ASN 35 -5.975 7.766 -20.852
186 H GLU 36 H GLU 36 -1.315 10.603 -21.978
187 HA GLU 36 HA GLU 36 -0.640 7.896 -21.138
188 HB2 GLU 36 HB2 GLU 36 0.999 9.537 -23.059
189 HB3 GLU 36 HB3 GLU 36 1.721 8.277 -22.069
190 HG2 GLU 36 HG2 GLU 36 -0.468 7.040 -23.210
191 HG3 GLU 36 HG3 GLU 36 0.160 8.066 -24.498
192 H ASP 37 H ASP 37 1.069 7.820 -19.564
193 HA ASP 37 HA ASP 37 1.220 10.298 -18.012
194 HB2 ASP 37 HB2 ASP 37 2.126 8.713 -16.221
195 HB3 ASP 37 HB3 ASP 37 0.435 8.517 -16.676
196 H PHE 38 H PHE 38 3.130 11.251 -17.422
197 HA PHE 38 HA PHE 38 5.657 10.015 -18.129
198 HB2 PHE 38 HB2 PHE 38 4.850 12.672 -19.331
199 HB3 PHE 38 HB3 PHE 38 6.409 11.875 -19.522
200 HD1 PHE 38 HD1 PHE 38 6.453 9.614 -20.684
201 HD2 PHE 38 HD2 PHE 38 3.100 12.234 -20.801
202 HE1 PHE 38 HE1 PHE 38 5.611 8.443 -22.678
203 HE2 PHE 38 HE2 PHE 38 2.253 11.067 -22.794
204 HZ PHE 38 HZ PHE 38 3.508 9.168 -23.735
205 H CYS 39 H CYS 39 7.293 10.656 -16.828
206 HA CYS 39 HA CYS 39 6.830 11.882 -14.410
207 HB2 CYS 39 HB2 CYS 39 9.168 11.896 -14.073
208 HB3 CYS 39 HB3 CYS 39 8.870 10.536 -15.152
209 H SER 40 H SER 40 7.547 13.937 -13.546
210 HA SER 40 HA SER 40 6.530 16.138 -14.875
211 HB2 SER 40 HB2 SER 40 8.764 16.393 -12.871
212 HB3 SER 40 HB3 SER 40 7.382 17.459 -13.118
213 HG SER 40 HG SER 40 6.736 16.319 -11.422
214 H ASN 41 H ASN 41 9.801 14.849 -14.874
215 HA ASN 41 HA ASN 41 11.111 17.000 -16.099
216 HB2 ASN 41 HB2 ASN 41 11.772 14.378 -15.290
217 HB3 ASN 41 HB3 ASN 41 12.212 14.494 -16.991
218 HD21 ASN 41 HD21 ASN 41 12.485 16.286 -13.949
219 HD22 ASN 41 HD22 ASN 41 14.079 16.885 -14.245
220 H HIS 42 H HIS 42 9.046 14.523 -17.393
221 HA HIS 42 HA HIS 42 9.512 15.586 -20.102
222 HB2 HIS 42 HB2 HIS 42 8.797 12.792 -19.212
223 HB3 HIS 42 HB3 HIS 42 8.633 13.331 -20.881
224 HD2 HIS 42 HD2 HIS 42 11.340 14.516 -21.730
225 HE1 HIS 42 HE1 HIS 42 13.278 11.383 -19.625
226 HE2 HIS 42 HE2 HIS 42 13.531 13.189 -21.364
227 H ARG 43 H ARG 43 7.597 16.345 -17.881
228 HA ARG 43 HA ARG 43 4.992 15.570 -18.446
229 HB2 ARG 43 HB2 ARG 43 4.293 17.638 -17.349
230 HB3 ARG 43 HB3 ARG 43 5.613 16.881 -16.469
231 HG2 ARG 43 HG2 ARG 43 7.154 18.465 -17.723
232 HG3 ARG 43 HG3 ARG 43 5.691 19.329 -18.199
233 HD2 ARG 43 HD2 ARG 43 5.148 19.828 -15.945
234 HD3 ARG 43 HD3 ARG 43 6.362 18.706 -15.334
235 HE ARG 43 HE ARG 43 7.915 20.363 -15.534
236 HH11 ARG 43 HH11 ARG 43 5.185 21.147 -17.546
237 HH12 ARG 43 HH12 ARG 43 5.787 22.714 -17.977
238 HH21 ARG 43 HH21 ARG 43 8.719 22.423 -16.094
239 HH22 ARG 43 HH22 ARG 43 7.797 23.438 -17.152
240 H LEU 44 H LEU 44 6.982 18.063 -19.949
241 HA LEU 44 HA LEU 44 5.100 19.405 -21.454
242 HB2 LEU 44 HB2 LEU 44 7.828 18.653 -22.473
243 HB3 LEU 44 HB3 LEU 44 6.868 20.067 -22.901
244 HG LEU 44 HG LEU 44 8.200 19.549 -20.244
245 HD11 LEU 44 HD11 LEU 44 9.182 20.632 -22.666
246 HD12 LEU 44 HD12 LEU 44 9.979 20.556 -21.095
247 HD13 LEU 44 HD13 LEU 44 9.000 21.960 -21.519
248 HD21 LEU 44 HD21 LEU 44 6.061 20.744 -20.020
249 HD22 LEU 44 HD22 LEU 44 6.629 21.950 -21.175
250 HD23 LEU 44 HD23 LEU 44 7.444 21.764 -19.621
251 H LYS 45 H LYS 45 4.863 19.273 -23.887
252 HA LYS 45 HA LYS 45 3.815 16.693 -24.553
253 HB2 LYS 45 HB2 LYS 45 3.599 19.388 -25.548
254 HB3 LYS 45 HB3 LYS 45 3.902 18.280 -26.879
255 HG2 LYS 45 HG2 LYS 45 1.994 16.909 -25.594
256 HG3 LYS 45 HG3 LYS 45 1.540 18.552 -25.134
257 HD2 LYS 45 HD2 LYS 45 2.022 17.649 -27.972
258 HD3 LYS 45 HD3 LYS 45 0.432 17.737 -27.212
259 HE2 LYS 45 HE2 LYS 45 2.307 20.084 -27.431
260 HE3 LYS 45 HE3 LYS 45 1.065 19.717 -28.627
261 HZ1 LYS 45 HZ1 LYS 45 0.545 20.218 -25.746
262 HZ2 LYS 45 HZ2 LYS 45 -0.619 19.969 -26.947
263 HZ3 LYS 45 HZ3 LYS 45 0.342 21.361 -26.977
264 H GLU 46 H GLU 46 6.235 18.744 -26.194
265 HA GLU 46 HA GLU 46 7.174 16.830 -27.968
266 HB2 GLU 46 HB2 GLU 46 9.069 18.236 -28.311
267 HB3 GLU 46 HB3 GLU 46 7.700 19.289 -27.985
268 HG2 GLU 46 HG2 GLU 46 8.473 19.418 -25.611
269 HG3 GLU 46 HG3 GLU 46 9.927 18.553 -26.106
270 H ASP 47 H ASP 47 7.878 17.282 -24.590
271 HA ASP 47 HA ASP 47 10.266 15.957 -24.268
272 HB2 ASP 47 HB2 ASP 47 7.850 16.312 -22.564
273 HB3 ASP 47 HB3 ASP 47 9.038 15.117 -22.052
274 H HIS 48 H HIS 48 7.019 14.487 -24.214
275 HA HIS 48 HA HIS 48 8.239 11.842 -24.475
276 HB2 HIS 48 HB2 HIS 48 5.980 10.980 -23.998
277 HB3 HIS 48 HB3 HIS 48 6.533 12.088 -22.746
278 HD1 HIS 48 HD1 HIS 48 5.116 14.117 -22.294
279 HD2 HIS 48 HD2 HIS 48 3.969 12.092 -25.736
280 HE1 HIS 48 HE1 HIS 48 2.952 15.180 -23.010
281 H HIS 49 H HIS 49 7.964 13.947 -26.642
282 HA HIS 49 HA HIS 49 7.418 14.092 -28.852
283 HB2 HIS 49 HB2 HIS 49 7.861 11.142 -28.455
284 HB3 HIS 49 HB3 HIS 49 7.461 11.799 -30.039
285 HD1 HIS 49 HD1 HIS 49 9.331 12.836 -31.357
286 HD2 HIS 49 HD2 HIS 49 10.379 12.090 -27.407
287 HE1 HIS 49 HE1 HIS 49 11.804 13.272 -31.223
288 H CYS 50 H CYS 50 5.211 14.574 -27.550
289 HA CYS 50 HA CYS 50 3.034 12.886 -27.697
290 HB2 CYS 50 HB2 CYS 50 3.232 15.257 -26.688
291 HB3 CYS 50 HB3 CYS 50 2.781 15.825 -28.293
292 H ARG 51 H ARG 51 1.888 12.019 -29.295
293 HA ARG 51 HA ARG 51 2.590 12.153 -31.966
294 HB2 ARG 51 HB2 ARG 51 0.511 11.019 -32.448
295 HB3 ARG 51 HB3 ARG 51 1.178 10.386 -30.949
296 HG2 ARG 51 HG2 ARG 51 -0.374 12.084 -29.794
297 HG3 ARG 51 HG3 ARG 51 -1.198 12.156 -31.353
298 HD2 ARG 51 HD2 ARG 51 -0.639 9.443 -30.388
299 HD3 ARG 51 HD3 ARG 51 -1.749 10.366 -29.375
300 HE ARG 51 HE ARG 51 -2.734 10.750 -31.859
301 HH11 ARG 51 HH11 ARG 51 -1.836 7.903 -30.069
302 HH12 ARG 51 HH12 ARG 51 -3.003 6.886 -30.847
303 HH21 ARG 51 HH21 ARG 51 -4.275 9.421 -32.891
304 HH22 ARG 51 HH22 ARG 51 -4.389 7.751 -32.453
305 H TRP 52 H TRP 52 0.320 14.131 -30.158
306 HA TRP 52 HA TRP 52 -0.971 15.388 -32.299
307 HB2 TRP 52 HB2 TRP 52 -1.562 15.488 -29.817
308 HB3 TRP 52 HB3 TRP 52 -0.328 16.738 -29.679
309 HD1 TRP 52 HD1 TRP 52 -3.872 16.160 -30.873
310 HE1 TRP 52 HE1 TRP 52 -4.906 18.409 -31.579
311 HE3 TRP 52 HE3 TRP 52 0.329 19.069 -30.717
312 HZ2 TRP 52 HZ2 TRP 52 -4.053 21.065 -32.014
313 HZ3 TRP 52 HZ3 TRP 52 0.135 21.454 -31.293
314 HH2 TRP 52 HH2 TRP 52 -2.012 22.429 -31.928
315 H LEU 53 H LEU 53 2.031 16.194 -30.611
316 HA LEU 53 HA LEU 53 2.503 18.652 -31.908
317 HB2 LEU 53 HB2 LEU 53 3.919 16.865 -30.127
318 HB3 LEU 53 HB3 LEU 53 4.999 17.567 -31.330
319 HG LEU 53 HG LEU 53 3.262 19.094 -29.391
320 HD11 LEU 53 HD11 LEU 53 6.263 18.979 -29.506
321 HD12 LEU 53 HD12 LEU 53 5.305 17.894 -28.497
322 HD13 LEU 53 HD13 LEU 53 5.238 19.636 -28.230
323 HD21 LEU 53 HD21 LEU 53 3.380 20.481 -31.247
324 HD22 LEU 53 HD22 LEU 53 5.004 19.941 -31.675
325 HD23 LEU 53 HD23 LEU 53 4.764 20.998 -30.283
326 H LEU 54 H LEU 54 3.465 15.336 -32.676
327 HA LEU 54 HA LEU 54 5.065 16.044 -34.923
328 HB2 LEU 54 HB2 LEU 54 3.747 13.377 -34.616
329 HB3 LEU 54 HB3 LEU 54 5.329 13.765 -35.288
330 HG LEU 54 HG LEU 54 4.563 13.760 -32.370
331 HD11 LEU 54 HD11 LEU 54 6.773 12.100 -33.009
332 HD12 LEU 54 HD12 LEU 54 5.457 11.716 -34.118
333 HD13 LEU 54 HD13 LEU 54 5.193 11.638 -32.376
334 HD21 LEU 54 HD21 LEU 54 7.229 14.369 -33.644
335 HD22 LEU 54 HD22 LEU 54 6.881 14.298 -31.917
336 HD23 LEU 54 HD23 LEU 54 6.154 15.560 -32.913
337 H GLU 55 H GLU 55 1.690 15.171 -34.473
338 HA GLU 55 HA GLU 55 0.972 14.718 -37.130
339 HB2 GLU 55 HB2 GLU 55 -0.362 15.046 -34.634
340 HB3 GLU 55 HB3 GLU 55 -1.169 16.066 -35.816
341 HG2 GLU 55 HG2 GLU 55 -1.085 13.925 -37.300
342 HG3 GLU 55 HG3 GLU 55 -0.879 13.102 -35.755
343 H HIS 56 H HIS 56 1.343 17.716 -35.331
344 HA HIS 56 HA HIS 56 0.695 19.225 -37.775
345 HB2 HIS 56 HB2 HIS 56 0.476 19.908 -34.858
346 HB3 HIS 56 HB3 HIS 56 0.574 21.181 -36.071
347 HD1 HIS 56 HD1 HIS 56 -1.766 22.062 -36.032
348 HD2 HIS 56 HD2 HIS 56 -1.634 17.926 -36.398
349 HE1 HIS 56 HE1 HIS 56 -4.139 21.350 -36.465
350 H GLU 57 H GLU 57 3.034 18.329 -38.182
351 HA GLU 57 HA GLU 57 5.162 19.755 -36.894
352 HB2 GLU 57 HB2 GLU 57 4.909 17.689 -38.979
353 HB3 GLU 57 HB3 GLU 57 6.284 18.766 -39.172
354 HG2 GLU 57 HG2 GLU 57 5.708 17.376 -36.579
355 HG3 GLU 57 HG3 GLU 57 6.648 16.619 -37.864
356 H GLU 58 H GLU 58 4.382 21.933 -37.234
357 HA GLU 58 HA GLU 58 4.305 23.947 -38.296
358 HB2 GLU 58 HB2 GLU 58 6.761 22.689 -38.953
359 HB3 GLU 58 HB3 GLU 58 6.190 23.502 -40.404
360 HG2 GLU 58 HG2 GLU 58 5.825 25.274 -38.229
361 HG3 GLU 58 HG3 GLU 58 7.455 24.612 -38.120
362 H VAL 59 H VAL 59 4.516 24.844 -40.819
363 HA VAL 59 HA VAL 59 2.110 23.869 -42.027
364 HB VAL 59 HB VAL 59 2.532 25.568 -43.765
365 HG11 VAL 59 HG11 VAL 59 3.123 27.090 -41.316
366 HG12 VAL 59 HG12 VAL 59 1.775 27.231 -42.446
367 HG13 VAL 59 HG13 VAL 59 1.762 25.974 -41.208
368 HG21 VAL 59 HG21 VAL 59 4.522 26.521 -44.127
369 HG22 VAL 59 HG22 VAL 59 4.796 26.808 -42.409
370 HG23 VAL 59 HG23 VAL 59 5.182 25.238 -43.113
Start of MODEL 4
1 H MET 11 H MET 11 4.165 -2.153 -1.540
2 HA MET 11 HA MET 11 5.334 -1.211 -3.997
3 HB2 MET 11 HB2 MET 11 4.599 -4.130 -3.717
4 HB3 MET 11 HB3 MET 11 5.002 -3.328 -5.229
5 HG2 MET 11 HG2 MET 11 7.207 -2.715 -3.967
6 HG3 MET 11 HG3 MET 11 6.764 -4.088 -2.955
7 HE1 MET 11 HE1 MET 11 9.586 -5.526 -5.284
8 HE2 MET 11 HE2 MET 11 9.486 -3.862 -4.709
9 HE3 MET 11 HE3 MET 11 9.095 -5.196 -3.623
10 H LEU 12 H LEU 12 3.695 0.128 -4.475
11 HA LEU 12 HA LEU 12 1.082 -1.065 -5.000
12 HB2 LEU 12 HB2 LEU 12 1.268 1.542 -3.527
13 HB3 LEU 12 HB3 LEU 12 -0.145 0.519 -3.773
14 HG LEU 12 HG LEU 12 2.193 -0.320 -2.073
15 HD11 LEU 12 HD11 LEU 12 1.170 1.806 -1.256
16 HD12 LEU 12 HD12 LEU 12 1.026 0.449 -0.140
17 HD13 LEU 12 HD13 LEU 12 -0.363 0.947 -1.106
18 HD21 LEU 12 HD21 LEU 12 -0.141 -1.618 -3.018
19 HD22 LEU 12 HD22 LEU 12 -0.330 -1.368 -1.282
20 HD23 LEU 12 HD23 LEU 12 1.080 -2.230 -1.901
21 H ASP 13 H ASP 13 -0.301 1.235 -5.638
22 HA ASP 13 HA ASP 13 1.108 2.060 -8.067
23 HB2 ASP 13 HB2 ASP 13 -1.800 2.216 -7.261
24 HB3 ASP 13 HB3 ASP 13 -1.165 2.912 -8.749
25 H VAL 14 H VAL 14 2.029 3.217 -5.700
26 HA VAL 14 HA VAL 14 0.827 5.810 -5.348
27 HB VAL 14 HB VAL 14 2.823 6.259 -3.905
28 HG11 VAL 14 HG11 VAL 14 0.816 4.151 -3.510
29 HG12 VAL 14 HG12 VAL 14 2.194 4.086 -2.409
30 HG13 VAL 14 HG13 VAL 14 1.211 5.547 -2.508
31 HG21 VAL 14 HG21 VAL 14 4.123 4.423 -5.323
32 HG22 VAL 14 HG22 VAL 14 4.552 4.799 -3.654
33 HG23 VAL 14 HG23 VAL 14 3.558 3.387 -4.012
34 H GLY 15 H GLY 15 1.178 5.884 -7.909
35 HA2 GLY 15 HA2 GLY 15 2.225 7.957 -8.915
36 HA3 GLY 15 HA3 GLY 15 3.749 7.251 -8.398
37 H LYS 16 H LYS 16 2.768 7.978 -11.089
38 HA LYS 16 HA LYS 16 2.711 5.338 -12.376
39 HB2 LYS 16 HB2 LYS 16 1.348 7.787 -12.888
40 HB3 LYS 16 HB3 LYS 16 2.389 7.451 -14.265
41 HG2 LYS 16 HG2 LYS 16 0.559 6.309 -14.939
42 HG3 LYS 16 HG3 LYS 16 1.319 5.034 -13.984
43 HD2 LYS 16 HD2 LYS 16 -0.207 5.207 -12.287
44 HD3 LYS 16 HD3 LYS 16 -0.523 6.915 -12.599
45 HE2 LYS 16 HE2 LYS 16 -1.469 5.864 -14.877
46 HE3 LYS 16 HE3 LYS 16 -1.743 4.500 -13.795
47 HZ1 LYS 16 HZ1 LYS 16 -3.522 6.378 -14.081
48 HZ2 LYS 16 HZ2 LYS 16 -2.585 7.164 -12.913
49 HZ3 LYS 16 HZ3 LYS 16 -3.264 5.652 -12.574
50 H HIS 17 H HIS 17 4.370 4.628 -13.576
51 HA HIS 17 HA HIS 17 6.800 6.197 -13.626
52 HB2 HIS 17 HB2 HIS 17 6.391 3.478 -14.865
53 HB3 HIS 17 HB3 HIS 17 7.900 4.207 -14.324
54 HD1 HIS 17 HD1 HIS 17 4.671 2.841 -12.881
55 HD2 HIS 17 HD2 HIS 17 8.601 3.593 -11.763
56 HE1 HIS 17 HE1 HIS 17 4.916 1.856 -10.581
57 H CYS 18 H CYS 18 7.760 7.105 -15.377
58 HA CYS 18 HA CYS 18 6.271 7.988 -17.522
59 HB2 CYS 18 HB2 CYS 18 8.550 8.811 -16.725
60 HB3 CYS 18 HB3 CYS 18 9.244 7.505 -17.680
61 H ALA 19 H ALA 19 6.123 7.404 -19.706
62 HA ALA 19 HA ALA 19 6.485 4.536 -20.184
63 HB1 ALA 19 HB1 ALA 19 4.446 6.425 -20.854
64 HB2 ALA 19 HB2 ALA 19 5.092 5.709 -22.332
65 HB3 ALA 19 HB3 ALA 19 4.451 4.672 -21.057
66 H TYR 20 H TYR 20 8.492 6.883 -20.440
67 HA TYR 20 HA TYR 20 9.485 6.074 -23.088
68 HB2 TYR 20 HB2 TYR 20 8.529 8.343 -23.235
69 HB3 TYR 20 HB3 TYR 20 9.601 8.873 -21.943
70 HD1 TYR 20 HD1 TYR 20 11.276 10.235 -22.738
71 HD2 TYR 20 HD2 TYR 20 10.078 6.895 -25.085
72 HE1 TYR 20 HE1 TYR 20 13.006 10.788 -24.397
73 HE2 TYR 20 HE2 TYR 20 11.805 7.438 -26.750
74 HH TYR 20 HH TYR 20 14.189 9.934 -26.177
75 H CYS 21 H CYS 21 10.245 7.361 -19.889
76 HA CYS 21 HA CYS 21 12.993 6.343 -20.204
77 HB2 CYS 21 HB2 CYS 21 13.803 8.059 -18.818
78 HB3 CYS 21 HB3 CYS 21 12.630 8.864 -19.855
79 H ARG 22 H ARG 22 10.053 5.991 -18.569
80 HA ARG 22 HA ARG 22 9.357 4.635 -16.882
81 HB2 ARG 22 HB2 ARG 22 12.101 3.388 -17.117
82 HB3 ARG 22 HB3 ARG 22 10.694 2.673 -16.342
83 HG2 ARG 22 HG2 ARG 22 10.385 3.466 -19.171
84 HG3 ARG 22 HG3 ARG 22 11.444 2.094 -18.836
85 HD2 ARG 22 HD2 ARG 22 9.285 1.547 -17.255
86 HD3 ARG 22 HD3 ARG 22 8.530 2.321 -18.648
87 HE ARG 22 HE ARG 22 10.427 0.290 -19.362
88 HH11 ARG 22 HH11 ARG 22 7.129 0.916 -18.440
89 HH12 ARG 22 HH12 ARG 22 6.510 -0.519 -19.189
90 HH21 ARG 22 HH21 ARG 22 9.624 -1.602 -20.352
91 HH22 ARG 22 HH22 ARG 22 7.931 -1.951 -20.275
92 H GLN 23 H GLN 23 9.665 6.825 -15.758
93 HA GLN 23 HA GLN 23 11.539 6.484 -13.509
94 HB2 GLN 23 HB2 GLN 23 12.255 8.380 -14.769
95 HB3 GLN 23 HB3 GLN 23 10.614 8.999 -14.894
96 HG2 GLN 23 HG2 GLN 23 10.646 9.907 -12.824
97 HG3 GLN 23 HG3 GLN 23 11.698 8.653 -12.169
98 HE21 GLN 23 HE21 GLN 23 13.825 9.029 -12.016
99 HE22 GLN 23 HE22 GLN 23 14.616 10.459 -12.576
100 H LEU 24 H LEU 24 10.555 6.051 -11.660
101 HA LEU 24 HA LEU 24 7.760 6.210 -11.301
102 HB2 LEU 24 HB2 LEU 24 9.038 4.594 -10.083
103 HB3 LEU 24 HB3 LEU 24 10.016 5.857 -9.338
104 HG LEU 24 HG LEU 24 8.038 6.620 -8.085
105 HD11 LEU 24 HD11 LEU 24 5.975 5.964 -8.573
106 HD12 LEU 24 HD12 LEU 24 6.426 4.264 -8.450
107 HD13 LEU 24 HD13 LEU 24 6.633 5.122 -9.976
108 HD21 LEU 24 HD21 LEU 24 8.092 3.745 -7.446
109 HD22 LEU 24 HD22 LEU 24 8.413 5.145 -6.422
110 HD23 LEU 24 HD23 LEU 24 9.662 4.545 -7.515
111 H ASP 25 H ASP 25 6.716 8.096 -11.270
112 HA ASP 25 HA ASP 25 7.815 10.262 -9.598
113 HB2 ASP 25 HB2 ASP 25 7.314 10.397 -12.283
114 HB3 ASP 25 HB3 ASP 25 5.805 11.011 -11.613
115 H PHE 26 H PHE 26 6.244 11.629 -8.520
116 HA PHE 26 HA PHE 26 4.044 10.052 -7.473
117 HB2 PHE 26 HB2 PHE 26 4.827 12.849 -6.654
118 HB3 PHE 26 HB3 PHE 26 3.902 11.672 -5.727
119 HD1 PHE 26 HD1 PHE 26 7.250 12.564 -6.958
120 HD2 PHE 26 HD2 PHE 26 4.981 9.977 -4.452
121 HE1 PHE 26 HE1 PHE 26 9.324 11.786 -5.889
122 HE2 PHE 26 HE2 PHE 26 7.052 9.196 -3.378
123 HZ PHE 26 HZ PHE 26 9.227 10.101 -4.095
124 H LEU 27 H LEU 27 4.556 13.011 -9.313
125 HA LEU 27 HA LEU 27 1.644 13.234 -9.686
126 HB2 LEU 27 HB2 LEU 27 2.147 15.579 -10.394
127 HB3 LEU 27 HB3 LEU 27 2.474 15.220 -8.700
128 HG LEU 27 HG LEU 27 4.878 14.799 -10.144
129 HD11 LEU 27 HD11 LEU 27 5.023 17.363 -10.770
130 HD12 LEU 27 HD12 LEU 27 3.294 17.146 -11.039
131 HD13 LEU 27 HD13 LEU 27 4.455 16.156 -11.924
132 HD21 LEU 27 HD21 LEU 27 4.003 16.969 -8.240
133 HD22 LEU 27 HD22 LEU 27 5.672 16.629 -8.700
134 HD23 LEU 27 HD23 LEU 27 4.739 15.425 -7.809
135 HA PRO 28 HA PRO 28 3.236 11.747 -13.745
136 HB2 PRO 28 HB2 PRO 28 1.052 10.227 -14.282
137 HB3 PRO 28 HB3 PRO 28 2.412 9.646 -13.314
138 HG2 PRO 28 HG2 PRO 28 -0.230 10.724 -12.412
139 HG3 PRO 28 HG3 PRO 28 0.674 9.325 -11.803
140 HD2 PRO 28 HD2 PRO 28 0.677 11.722 -10.543
141 HD3 PRO 28 HD3 PRO 28 2.077 10.631 -10.523
142 H PHE 29 H PHE 29 2.938 12.944 -15.512
143 HA PHE 29 HA PHE 29 0.664 14.724 -15.686
144 HB2 PHE 29 HB2 PHE 29 3.252 14.421 -17.149
145 HB3 PHE 29 HB3 PHE 29 1.938 15.294 -17.931
146 HD1 PHE 29 HD1 PHE 29 1.298 17.467 -17.215
147 HD2 PHE 29 HD2 PHE 29 4.211 15.254 -15.039
148 HE1 PHE 29 HE1 PHE 29 1.896 19.496 -15.958
149 HE2 PHE 29 HE2 PHE 29 4.813 17.279 -13.779
150 HZ PHE 29 HZ PHE 29 3.655 19.403 -14.237
151 H HIS 30 H HIS 30 -1.191 13.949 -16.447
152 HA HIS 30 HA HIS 30 -1.239 11.765 -18.347
153 HB2 HIS 30 HB2 HIS 30 -2.876 11.707 -16.581
154 HB3 HIS 30 HB3 HIS 30 -3.441 13.325 -16.985
155 HD1 HIS 30 HD1 HIS 30 -3.702 9.759 -18.045
156 HD2 HIS 30 HD2 HIS 30 -5.159 13.474 -19.202
157 HE1 HIS 30 HE1 HIS 30 -5.555 9.276 -19.675
158 H CYS 31 H CYS 31 -1.227 12.029 -20.471
159 HA CYS 31 HA CYS 31 -1.618 14.665 -21.612
160 HB2 CYS 31 HB2 CYS 31 0.088 12.673 -22.249
161 HB3 CYS 31 HB3 CYS 31 -1.209 12.329 -23.388
162 H SER 32 H SER 32 -3.391 15.362 -22.626
163 HA SER 32 HA SER 32 -5.666 13.545 -22.825
164 HB2 SER 32 HB2 SER 32 -5.471 16.158 -21.992
165 HB3 SER 32 HB3 SER 32 -6.085 16.336 -23.635
166 HG SER 32 HG SER 32 -7.743 16.080 -22.028
167 H PHE 33 H PHE 33 -3.280 13.695 -24.716
168 HA PHE 33 HA PHE 33 -4.824 14.064 -27.199
169 HB2 PHE 33 HB2 PHE 33 -1.821 14.225 -27.048
170 HB3 PHE 33 HB3 PHE 33 -2.887 14.816 -28.318
171 HD1 PHE 33 HD1 PHE 33 -4.895 16.289 -26.752
172 HD2 PHE 33 HD2 PHE 33 -0.662 16.104 -26.341
173 HE1 PHE 33 HE1 PHE 33 -4.902 18.519 -25.711
174 HE2 PHE 33 HE2 PHE 33 -0.662 18.333 -25.299
175 HZ PHE 33 HZ PHE 33 -2.784 19.543 -24.982
176 H CYS 34 H CYS 34 -2.188 12.214 -25.699
177 HA CYS 34 HA CYS 34 -2.689 10.045 -27.619
178 HB2 CYS 34 HB2 CYS 34 -0.475 9.195 -26.996
179 HB3 CYS 34 HB3 CYS 34 -0.377 10.862 -27.552
180 H ASN 35 H ASN 35 -3.118 10.970 -24.377
181 HA ASN 35 HA ASN 35 -4.063 9.919 -22.593
182 HB2 ASN 35 HB2 ASN 35 -5.371 8.830 -24.633
183 HB3 ASN 35 HB3 ASN 35 -4.502 7.389 -24.114
184 HD21 ASN 35 HD21 ASN 35 -5.199 6.298 -22.381
185 HD22 ASN 35 HD22 ASN 35 -6.523 6.781 -21.381
186 H GLU 36 H GLU 36 -1.529 9.966 -22.286
187 HA GLU 36 HA GLU 36 -0.845 7.350 -21.203
188 HB2 GLU 36 HB2 GLU 36 0.809 8.818 -23.249
189 HB3 GLU 36 HB3 GLU 36 1.515 7.639 -22.152
190 HG2 GLU 36 HG2 GLU 36 -0.653 6.304 -23.190
191 HG3 GLU 36 HG3 GLU 36 -0.059 7.243 -24.559
192 H ASP 37 H ASP 37 0.801 7.421 -19.587
193 HA ASP 37 HA ASP 37 0.973 10.044 -18.299
194 HB2 ASP 37 HB2 ASP 37 1.816 8.631 -16.336
195 HB3 ASP 37 HB3 ASP 37 0.127 8.436 -16.796
196 H PHE 38 H PHE 38 2.891 11.014 -17.761
197 HA PHE 38 HA PHE 38 5.404 9.663 -18.294
198 HB2 PHE 38 HB2 PHE 38 4.689 12.219 -19.747
199 HB3 PHE 38 HB3 PHE 38 6.223 11.360 -19.842
200 HD1 PHE 38 HD1 PHE 38 6.228 9.025 -20.820
201 HD2 PHE 38 HD2 PHE 38 2.923 11.683 -21.173
202 HE1 PHE 38 HE1 PHE 38 5.374 7.706 -22.713
203 HE2 PHE 38 HE2 PHE 38 2.063 10.368 -23.066
204 HZ PHE 38 HZ PHE 38 3.288 8.376 -23.838
205 H CYS 39 H CYS 39 7.037 10.397 -17.035
206 HA CYS 39 HA CYS 39 6.562 11.838 -14.743
207 HB2 CYS 39 HB2 CYS 39 8.902 11.867 -14.385
208 HB3 CYS 39 HB3 CYS 39 8.590 10.408 -15.319
209 H SER 40 H SER 40 7.355 13.950 -14.057
210 HA SER 40 HA SER 40 6.357 16.045 -15.563
211 HB2 SER 40 HB2 SER 40 8.588 16.818 -13.817
212 HB3 SER 40 HB3 SER 40 6.896 17.312 -13.771
213 HG SER 40 HG SER 40 6.753 16.028 -12.123
214 H ASN 41 H ASN 41 9.593 14.682 -15.504
215 HA ASN 41 HA ASN 41 10.919 16.703 -16.934
216 HB2 ASN 41 HB2 ASN 41 11.590 14.215 -15.835
217 HB3 ASN 41 HB3 ASN 41 11.951 14.068 -17.553
218 HD21 ASN 41 HD21 ASN 41 13.345 14.698 -14.753
219 HD22 ASN 41 HD22 ASN 41 14.566 15.822 -15.234
220 H HIS 42 H HIS 42 8.819 14.129 -17.953
221 HA HIS 42 HA HIS 42 9.269 14.909 -20.760
222 HB2 HIS 42 HB2 HIS 42 8.538 12.227 -19.584
223 HB3 HIS 42 HB3 HIS 42 8.358 12.595 -21.297
224 HD2 HIS 42 HD2 HIS 42 11.037 13.590 -22.353
225 HE1 HIS 42 HE1 HIS 42 13.021 10.790 -19.859
226 HE2 HIS 42 HE2 HIS 42 13.235 12.323 -21.847
227 H ARG 43 H ARG 43 7.384 15.911 -18.613
228 HA ARG 43 HA ARG 43 4.763 15.103 -19.113
229 HB2 ARG 43 HB2 ARG 43 4.087 17.254 -18.159
230 HB3 ARG 43 HB3 ARG 43 5.382 16.525 -17.220
231 HG2 ARG 43 HG2 ARG 43 6.943 18.003 -18.644
232 HG3 ARG 43 HG3 ARG 43 5.474 18.903 -19.028
233 HD2 ARG 43 HD2 ARG 43 5.119 19.485 -16.775
234 HD3 ARG 43 HD3 ARG 43 6.273 18.283 -16.200
235 HE ARG 43 HE ARG 43 7.551 20.191 -17.861
236 HH11 ARG 43 HH11 ARG 43 6.224 19.764 -14.671
237 HH12 ARG 43 HH12 ARG 43 7.258 20.946 -13.940
238 HH21 ARG 43 HH21 ARG 43 8.918 21.750 -16.911
239 HH22 ARG 43 HH22 ARG 43 8.789 22.076 -15.215
240 H LEU 44 H LEU 44 6.777 17.486 -20.758
241 HA LEU 44 HA LEU 44 4.912 18.743 -22.352
242 HB2 LEU 44 HB2 LEU 44 7.650 17.908 -23.281
243 HB3 LEU 44 HB3 LEU 44 6.696 19.275 -23.852
244 HG LEU 44 HG LEU 44 7.942 19.009 -21.116
245 HD11 LEU 44 HD11 LEU 44 8.720 21.141 -23.006
246 HD12 LEU 44 HD12 LEU 44 9.290 19.512 -23.369
247 HD13 LEU 44 HD13 LEU 44 9.686 20.261 -21.822
248 HD21 LEU 44 HD21 LEU 44 5.746 20.539 -21.936
249 HD22 LEU 44 HD22 LEU 44 7.111 21.654 -21.872
250 HD23 LEU 44 HD23 LEU 44 6.677 20.707 -20.448
251 H LYS 45 H LYS 45 4.588 18.462 -24.731
252 HA LYS 45 HA LYS 45 3.549 15.859 -25.251
253 HB2 LYS 45 HB2 LYS 45 3.354 18.485 -26.404
254 HB3 LYS 45 HB3 LYS 45 3.678 17.310 -27.672
255 HG2 LYS 45 HG2 LYS 45 1.746 16.022 -26.297
256 HG3 LYS 45 HG3 LYS 45 1.280 17.702 -26.020
257 HD2 LYS 45 HD2 LYS 45 1.859 16.538 -28.741
258 HD3 LYS 45 HD3 LYS 45 0.243 16.655 -28.041
259 HE2 LYS 45 HE2 LYS 45 2.068 19.022 -28.406
260 HE3 LYS 45 HE3 LYS 45 0.889 18.513 -29.615
261 HZ1 LYS 45 HZ1 LYS 45 -0.858 18.806 -27.952
262 HZ2 LYS 45 HZ2 LYS 45 -0.018 20.248 -28.227
263 HZ3 LYS 45 HZ3 LYS 45 0.286 19.346 -26.828
264 H GLU 46 H GLU 46 5.989 17.765 -27.032
265 HA GLU 46 HA GLU 46 6.908 15.692 -28.645
266 HB2 GLU 46 HB2 GLU 46 8.917 17.060 -28.988
267 HB3 GLU 46 HB3 GLU 46 7.453 18.030 -29.075
268 HG2 GLU 46 HG2 GLU 46 7.903 18.551 -26.599
269 HG3 GLU 46 HG3 GLU 46 9.527 17.947 -26.922
270 H ASP 47 H ASP 47 7.651 16.479 -25.336
271 HA ASP 47 HA ASP 47 10.053 15.207 -24.917
272 HB2 ASP 47 HB2 ASP 47 7.733 15.912 -23.265
273 HB3 ASP 47 HB3 ASP 47 8.653 14.542 -22.647
274 H HIS 48 H HIS 48 6.817 13.731 -24.674
275 HA HIS 48 HA HIS 48 8.046 11.079 -24.667
276 HB2 HIS 48 HB2 HIS 48 5.794 10.260 -24.109
277 HB3 HIS 48 HB3 HIS 48 6.321 11.511 -22.987
278 HD1 HIS 48 HD1 HIS 48 4.830 13.505 -22.728
279 HD2 HIS 48 HD2 HIS 48 3.840 11.200 -26.040
280 HE1 HIS 48 HE1 HIS 48 2.676 14.468 -23.597
281 H HIS 49 H HIS 49 7.785 12.943 -27.044
282 HA HIS 49 HA HIS 49 7.262 12.853 -29.262
283 HB2 HIS 49 HB2 HIS 49 7.415 9.873 -28.758
284 HB3 HIS 49 HB3 HIS 49 7.553 10.666 -30.324
285 HD1 HIS 49 HD1 HIS 49 9.785 11.825 -30.875
286 HD2 HIS 49 HD2 HIS 49 9.694 10.034 -27.127
287 HE1 HIS 49 HE1 HIS 49 12.173 11.793 -30.086
288 H CYS 50 H CYS 50 5.047 13.482 -28.045
289 HA CYS 50 HA CYS 50 2.862 11.796 -28.026
290 HB2 CYS 50 HB2 CYS 50 3.058 14.257 -27.275
291 HB3 CYS 50 HB3 CYS 50 2.636 14.655 -28.937
292 H ARG 51 H ARG 51 1.790 10.719 -29.540
293 HA ARG 51 HA ARG 51 2.502 10.612 -32.208
294 HB2 ARG 51 HB2 ARG 51 0.285 9.513 -32.568
295 HB3 ARG 51 HB3 ARG 51 1.213 8.840 -31.234
296 HG2 ARG 51 HG2 ARG 51 -0.143 10.099 -29.645
297 HG3 ARG 51 HG3 ARG 51 -1.066 10.793 -30.979
298 HD2 ARG 51 HD2 ARG 51 -2.379 9.015 -30.181
299 HD3 ARG 51 HD3 ARG 51 -1.610 8.401 -31.644
300 HE ARG 51 HE ARG 51 0.070 7.658 -29.626
301 HH11 ARG 51 HH11 ARG 51 -3.311 7.192 -30.311
302 HH12 ARG 51 HH12 ARG 51 -3.399 5.663 -29.500
303 HH21 ARG 51 HH21 ARG 51 -0.032 5.646 -28.556
304 HH22 ARG 51 HH22 ARG 51 -1.533 4.785 -28.502
305 H TRP 52 H TRP 52 0.154 12.680 -30.611
306 HA TRP 52 HA TRP 52 -1.160 13.678 -32.873
307 HB2 TRP 52 HB2 TRP 52 -1.779 13.995 -30.415
308 HB3 TRP 52 HB3 TRP 52 -0.591 15.295 -30.391
309 HD1 TRP 52 HD1 TRP 52 -4.100 14.478 -31.548
310 HE1 TRP 52 HE1 TRP 52 -5.206 16.610 -32.474
311 HE3 TRP 52 HE3 TRP 52 -0.006 17.539 -31.644
312 HZ2 TRP 52 HZ2 TRP 52 -4.443 19.240 -33.156
313 HZ3 TRP 52 HZ3 TRP 52 -0.279 19.848 -32.448
314 HH2 TRP 52 HH2 TRP 52 -2.452 20.679 -33.189
315 H LEU 53 H LEU 53 1.816 14.709 -31.275
316 HA LEU 53 HA LEU 53 2.212 17.062 -32.786
317 HB2 LEU 53 HB2 LEU 53 3.678 15.488 -30.848
318 HB3 LEU 53 HB3 LEU 53 4.738 16.120 -32.106
319 HG LEU 53 HG LEU 53 2.941 17.746 -30.308
320 HD11 LEU 53 HD11 LEU 53 5.948 17.627 -30.419
321 HD12 LEU 53 HD12 LEU 53 4.964 16.756 -29.244
322 HD13 LEU 53 HD13 LEU 53 4.950 18.519 -29.270
323 HD21 LEU 53 HD21 LEU 53 4.614 18.438 -32.684
324 HD22 LEU 53 HD22 LEU 53 4.418 19.605 -31.376
325 HD23 LEU 53 HD23 LEU 53 3.003 19.004 -32.241
326 H LEU 54 H LEU 54 3.130 13.704 -33.299
327 HA LEU 54 HA LEU 54 4.813 14.207 -35.542
328 HB2 LEU 54 HB2 LEU 54 3.393 11.613 -35.100
329 HB3 LEU 54 HB3 LEU 54 5.005 11.903 -35.751
330 HG LEU 54 HG LEU 54 4.165 12.117 -32.861
331 HD11 LEU 54 HD11 LEU 54 6.181 10.328 -32.958
332 HD12 LEU 54 HD12 LEU 54 5.403 10.020 -34.510
333 HD13 LEU 54 HD13 LEU 54 4.472 9.895 -33.017
334 HD21 LEU 54 HD21 LEU 54 6.790 12.702 -34.218
335 HD22 LEU 54 HD22 LEU 54 6.619 12.446 -32.481
336 HD23 LEU 54 HD23 LEU 54 5.802 13.804 -33.257
337 H GLU 55 H GLU 55 1.524 12.850 -35.283
338 HA GLU 55 HA GLU 55 1.011 12.721 -38.030
339 HB2 GLU 55 HB2 GLU 55 -1.324 12.502 -37.437
340 HB3 GLU 55 HB3 GLU 55 -0.347 11.592 -36.293
341 HG2 GLU 55 HG2 GLU 55 -0.495 13.612 -34.774
342 HG3 GLU 55 HG3 GLU 55 -1.737 14.216 -35.869
343 H HIS 56 H HIS 56 0.636 15.345 -35.723
344 HA HIS 56 HA HIS 56 -0.077 17.124 -37.961
345 HB2 HIS 56 HB2 HIS 56 -1.294 16.801 -35.300
346 HB3 HIS 56 HB3 HIS 56 -0.979 18.471 -35.762
347 HD1 HIS 56 HD1 HIS 56 -2.733 19.542 -37.146
348 HD2 HIS 56 HD2 HIS 56 -2.902 15.396 -37.359
349 HE1 HIS 56 HE1 HIS 56 -4.776 19.022 -38.517
350 H GLU 57 H GLU 57 2.237 17.411 -38.222
351 HA GLU 57 HA GLU 57 3.478 19.051 -36.121
352 HB2 GLU 57 HB2 GLU 57 5.613 18.555 -37.395
353 HB3 GLU 57 HB3 GLU 57 4.858 17.186 -36.590
354 HG2 GLU 57 HG2 GLU 57 4.550 16.093 -38.501
355 HG3 GLU 57 HG3 GLU 57 3.939 17.527 -39.325
356 H GLU 58 H GLU 58 2.954 21.125 -36.511
357 HA GLU 58 HA GLU 58 2.556 22.228 -39.086
358 HB2 GLU 58 HB2 GLU 58 2.309 23.088 -36.380
359 HB3 GLU 58 HB3 GLU 58 3.270 24.281 -37.243
360 HG2 GLU 58 HG2 GLU 58 0.916 24.854 -37.297
361 HG3 GLU 58 HG3 GLU 58 1.515 24.503 -38.917
362 H VAL 59 H VAL 59 3.858 23.532 -40.350
363 HA VAL 59 HA VAL 59 6.647 22.981 -40.273
364 HB VAL 59 HB VAL 59 6.823 24.507 -42.185
365 HG11 VAL 59 HG11 VAL 59 4.880 22.304 -42.046
366 HG12 VAL 59 HG12 VAL 59 4.741 23.348 -43.462
367 HG13 VAL 59 HG13 VAL 59 6.265 22.533 -43.112
368 HG21 VAL 59 HG21 VAL 59 4.549 25.702 -41.043
369 HG22 VAL 59 HG22 VAL 59 5.400 26.183 -42.510
370 HG23 VAL 59 HG23 VAL 59 4.044 25.061 -42.606
Start of MODEL 5
1 H MET 11 H MET 11 -6.173 -0.590 -6.263
2 HA MET 11 HA MET 11 -3.435 -1.528 -6.412
3 HB2 MET 11 HB2 MET 11 -5.122 0.349 -8.030
4 HB3 MET 11 HB3 MET 11 -3.372 0.369 -8.208
5 HG2 MET 11 HG2 MET 11 -4.017 -2.311 -8.364
6 HG3 MET 11 HG3 MET 11 -5.325 -1.508 -9.229
7 HE1 MET 11 HE1 MET 11 -1.489 -1.453 -8.721
8 HE2 MET 11 HE2 MET 11 -1.776 -2.953 -9.604
9 HE3 MET 11 HE3 MET 11 -0.890 -1.633 -10.370
10 H LEU 12 H LEU 12 -1.688 0.200 -6.637
11 HA LEU 12 HA LEU 12 -2.122 2.480 -4.855
12 HB2 LEU 12 HB2 LEU 12 0.196 1.889 -3.864
13 HB3 LEU 12 HB3 LEU 12 -1.246 1.073 -3.261
14 HG LEU 12 HG LEU 12 0.299 -0.243 -5.435
15 HD11 LEU 12 HD11 LEU 12 2.204 -0.155 -4.276
16 HD12 LEU 12 HD12 LEU 12 1.428 -1.279 -3.161
17 HD13 LEU 12 HD13 LEU 12 1.401 0.453 -2.828
18 HD21 LEU 12 HD21 LEU 12 -1.431 -1.601 -4.905
19 HD22 LEU 12 HD22 LEU 12 -1.576 -0.963 -3.267
20 HD23 LEU 12 HD23 LEU 12 -0.317 -2.139 -3.647
21 H ASP 13 H ASP 13 -1.550 4.198 -5.999
22 HA ASP 13 HA ASP 13 0.571 3.958 -8.003
23 HB2 ASP 13 HB2 ASP 13 -1.698 5.868 -7.578
24 HB3 ASP 13 HB3 ASP 13 -0.303 6.376 -8.527
25 H VAL 14 H VAL 14 2.014 3.822 -5.992
26 HA VAL 14 HA VAL 14 2.539 6.334 -4.662
27 HB VAL 14 HB VAL 14 4.414 5.087 -3.582
28 HG11 VAL 14 HG11 VAL 14 3.023 3.818 -2.135
29 HG12 VAL 14 HG12 VAL 14 2.061 5.189 -2.692
30 HG13 VAL 14 HG13 VAL 14 1.809 3.590 -3.394
31 HG21 VAL 14 HG21 VAL 14 4.065 3.351 -5.746
32 HG22 VAL 14 HG22 VAL 14 5.151 3.142 -4.372
33 HG23 VAL 14 HG23 VAL 14 3.530 2.450 -4.327
34 H GLY 15 H GLY 15 2.839 6.991 -7.181
35 HA2 GLY 15 HA2 GLY 15 4.561 8.345 -8.150
36 HA3 GLY 15 HA3 GLY 15 5.754 7.239 -7.486
37 H LYS 16 H LYS 16 4.597 8.266 -10.290
38 HA LYS 16 HA LYS 16 4.622 5.627 -11.587
39 HB2 LYS 16 HB2 LYS 16 3.023 7.956 -11.967
40 HB3 LYS 16 HB3 LYS 16 3.969 7.704 -13.428
41 HG2 LYS 16 HG2 LYS 16 2.280 5.581 -12.125
42 HG3 LYS 16 HG3 LYS 16 1.737 6.615 -13.449
43 HD2 LYS 16 HD2 LYS 16 3.567 5.762 -14.848
44 HD3 LYS 16 HD3 LYS 16 4.082 4.714 -13.524
45 HE2 LYS 16 HE2 LYS 16 2.808 3.270 -14.789
46 HE3 LYS 16 HE3 LYS 16 1.624 3.853 -13.620
47 HZ1 LYS 16 HZ1 LYS 16 0.421 4.266 -15.449
48 HZ2 LYS 16 HZ2 LYS 16 1.762 4.282 -16.478
49 HZ3 LYS 16 HZ3 LYS 16 1.373 5.659 -15.576
50 H HIS 17 H HIS 17 6.103 5.123 -13.139
51 HA HIS 17 HA HIS 17 8.431 6.863 -13.305
52 HB2 HIS 17 HB2 HIS 17 8.127 4.135 -14.555
53 HB3 HIS 17 HB3 HIS 17 9.617 4.979 -14.143
54 HD1 HIS 17 HD1 HIS 17 6.658 3.341 -12.428
55 HD2 HIS 17 HD2 HIS 17 10.608 4.386 -11.676
56 HE1 HIS 17 HE1 HIS 17 7.200 2.348 -10.182
57 H CYS 18 H CYS 18 9.150 7.860 -15.125
58 HA CYS 18 HA CYS 18 7.394 8.650 -17.100
59 HB2 CYS 18 HB2 CYS 18 9.656 9.654 -16.516
60 HB3 CYS 18 HB3 CYS 18 10.372 8.405 -17.530
61 H ALA 19 H ALA 19 7.028 8.056 -19.240
62 HA ALA 19 HA ALA 19 7.581 5.240 -19.815
63 HB1 ALA 19 HB1 ALA 19 5.443 5.256 -20.415
64 HB2 ALA 19 HB2 ALA 19 5.367 7.015 -20.306
65 HB3 ALA 19 HB3 ALA 19 5.901 6.247 -21.801
66 H TYR 20 H TYR 20 9.388 7.712 -20.215
67 HA TYR 20 HA TYR 20 10.155 7.028 -22.971
68 HB2 TYR 20 HB2 TYR 20 9.057 9.220 -22.998
69 HB3 TYR 20 HB3 TYR 20 10.164 9.801 -21.758
70 HD1 TYR 20 HD1 TYR 20 12.506 10.264 -22.300
71 HD2 TYR 20 HD2 TYR 20 9.761 9.001 -25.296
72 HE1 TYR 20 HE1 TYR 20 14.081 10.994 -24.042
73 HE2 TYR 20 HE2 TYR 20 11.329 9.726 -27.046
74 HH TYR 20 HH TYR 20 14.551 10.928 -26.244
75 H CYS 21 H CYS 21 11.179 8.404 -19.871
76 HA CYS 21 HA CYS 21 13.931 7.543 -20.475
77 HB2 CYS 21 HB2 CYS 21 14.760 9.284 -19.120
78 HB3 CYS 21 HB3 CYS 21 13.455 10.023 -20.043
79 H ARG 22 H ARG 22 11.209 6.983 -18.535
80 HA ARG 22 HA ARG 22 10.787 5.546 -16.824
81 HB2 ARG 22 HB2 ARG 22 13.578 4.498 -17.321
82 HB3 ARG 22 HB3 ARG 22 12.274 3.667 -16.483
83 HG2 ARG 22 HG2 ARG 22 11.508 4.479 -19.158
84 HG3 ARG 22 HG3 ARG 22 12.928 3.429 -19.151
85 HD2 ARG 22 HD2 ARG 22 10.330 2.832 -17.741
86 HD3 ARG 22 HD3 ARG 22 10.791 2.189 -19.317
87 HE ARG 22 HE ARG 22 12.852 1.470 -17.709
88 HH11 ARG 22 HH11 ARG 22 9.399 1.066 -17.532
89 HH12 ARG 22 HH12 ARG 22 9.487 -0.425 -16.655
90 HH21 ARG 22 HH21 ARG 22 12.981 -0.493 -16.554
91 HH22 ARG 22 HH22 ARG 22 11.525 -1.311 -16.098
92 H GLN 23 H GLN 23 11.059 7.744 -15.697
93 HA GLN 23 HA GLN 23 13.169 7.506 -13.654
94 HB2 GLN 23 HB2 GLN 23 13.625 9.462 -14.942
95 HB3 GLN 23 HB3 GLN 23 11.941 9.966 -14.892
96 HG2 GLN 23 HG2 GLN 23 12.111 10.827 -12.803
97 HG3 GLN 23 HG3 GLN 23 13.341 9.667 -12.303
98 HE21 GLN 23 HE21 GLN 23 14.907 10.963 -11.565
99 HE22 GLN 23 HE22 GLN 23 15.697 12.187 -12.493
100 H LEU 24 H LEU 24 12.386 6.936 -11.745
101 HA LEU 24 HA LEU 24 9.649 6.903 -11.098
102 HB2 LEU 24 HB2 LEU 24 11.603 5.550 -10.111
103 HB3 LEU 24 HB3 LEU 24 11.836 6.936 -9.048
104 HG LEU 24 HG LEU 24 9.187 5.537 -9.212
105 HD11 LEU 24 HD11 LEU 24 11.447 4.816 -7.353
106 HD12 LEU 24 HD12 LEU 24 10.927 3.849 -8.733
107 HD13 LEU 24 HD13 LEU 24 9.829 4.114 -7.378
108 HD21 LEU 24 HD21 LEU 24 8.658 7.152 -7.783
109 HD22 LEU 24 HD22 LEU 24 10.329 7.714 -7.716
110 HD23 LEU 24 HD23 LEU 24 9.784 6.432 -6.632
111 H ASP 25 H ASP 25 8.471 8.700 -10.934
112 HA ASP 25 HA ASP 25 9.566 10.938 -9.359
113 HB2 ASP 25 HB2 ASP 25 8.962 11.184 -11.917
114 HB3 ASP 25 HB3 ASP 25 7.322 11.341 -11.293
115 H PHE 26 H PHE 26 8.063 12.132 -8.048
116 HA PHE 26 HA PHE 26 6.114 10.390 -6.801
117 HB2 PHE 26 HB2 PHE 26 6.785 13.240 -6.059
118 HB3 PHE 26 HB3 PHE 26 6.010 12.025 -5.048
119 HD1 PHE 26 HD1 PHE 26 9.183 13.053 -6.603
120 HD2 PHE 26 HD2 PHE 26 7.284 10.419 -3.851
121 HE1 PHE 26 HE1 PHE 26 11.384 12.389 -5.725
122 HE2 PHE 26 HE2 PHE 26 9.481 9.751 -2.969
123 HZ PHE 26 HZ PHE 26 11.535 10.735 -3.906
124 H LEU 27 H LEU 27 6.160 13.413 -8.619
125 HA LEU 27 HA LEU 27 3.217 13.366 -8.684
126 HB2 LEU 27 HB2 LEU 27 5.172 15.493 -8.414
127 HB3 LEU 27 HB3 LEU 27 4.040 15.798 -9.730
128 HG LEU 27 HG LEU 27 3.185 15.176 -6.908
129 HD11 LEU 27 HD11 LEU 27 3.948 17.209 -6.394
130 HD12 LEU 27 HD12 LEU 27 2.603 17.814 -7.359
131 HD13 LEU 27 HD13 LEU 27 4.202 17.643 -8.084
132 HD21 LEU 27 HD21 LEU 27 1.787 16.049 -9.412
133 HD22 LEU 27 HD22 LEU 27 1.106 16.386 -7.821
134 HD23 LEU 27 HD23 LEU 27 1.392 14.719 -8.323
135 HA PRO 28 HA PRO 28 4.467 12.072 -12.919
136 HB2 PRO 28 HB2 PRO 28 2.350 10.407 -13.260
137 HB3 PRO 28 HB3 PRO 28 3.842 9.911 -12.450
138 HG2 PRO 28 HG2 PRO 28 1.239 10.785 -11.257
139 HG3 PRO 28 HG3 PRO 28 2.297 9.446 -10.775
140 HD2 PRO 28 HD2 PRO 28 2.264 11.820 -9.472
141 HD3 PRO 28 HD3 PRO 28 3.731 10.831 -9.619
142 H PHE 29 H PHE 29 3.904 13.268 -14.620
143 HA PHE 29 HA PHE 29 1.471 14.846 -14.525
144 HB2 PHE 29 HB2 PHE 29 3.930 14.847 -16.242
145 HB3 PHE 29 HB3 PHE 29 2.480 15.681 -16.791
146 HD1 PHE 29 HD1 PHE 29 1.867 17.776 -15.907
147 HD2 PHE 29 HD2 PHE 29 5.003 15.537 -14.100
148 HE1 PHE 29 HE1 PHE 29 2.481 19.736 -14.552
149 HE2 PHE 29 HE2 PHE 29 5.621 17.492 -12.741
150 HZ PHE 29 HZ PHE 29 4.360 19.596 -12.967
151 H HIS 30 H HIS 30 -0.348 13.899 -15.173
152 HA HIS 30 HA HIS 30 -0.321 11.810 -17.178
153 HB2 HIS 30 HB2 HIS 30 -1.793 11.475 -15.312
154 HB3 HIS 30 HB3 HIS 30 -2.542 13.051 -15.548
155 HD1 HIS 30 HD1 HIS 30 -2.650 9.537 -16.719
156 HD2 HIS 30 HD2 HIS 30 -4.367 13.185 -17.720
157 HE1 HIS 30 HE1 HIS 30 -4.565 8.981 -18.252
158 H CYS 31 H CYS 31 -0.576 12.137 -19.281
159 HA CYS 31 HA CYS 31 -1.285 14.774 -20.255
160 HB2 CYS 31 HB2 CYS 31 0.529 13.037 -21.149
161 HB3 CYS 31 HB3 CYS 31 -0.837 12.491 -22.116
162 H SER 32 H SER 32 -3.204 15.361 -21.047
163 HA SER 32 HA SER 32 -5.335 13.369 -21.114
164 HB2 SER 32 HB2 SER 32 -5.335 15.848 -20.071
165 HB3 SER 32 HB3 SER 32 -5.923 16.223 -21.691
166 HG SER 32 HG SER 32 -7.661 15.743 -20.341
167 H PHE 33 H PHE 33 -3.185 13.760 -23.219
168 HA PHE 33 HA PHE 33 -4.990 14.138 -25.518
169 HB2 PHE 33 HB2 PHE 33 -2.001 14.488 -25.643
170 HB3 PHE 33 HB3 PHE 33 -3.217 15.050 -26.785
171 HD1 PHE 33 HD1 PHE 33 -5.158 16.342 -25.009
172 HD2 PHE 33 HD2 PHE 33 -0.903 16.401 -24.942
173 HE1 PHE 33 HE1 PHE 33 -5.210 18.528 -23.880
174 HE2 PHE 33 HE2 PHE 33 -0.947 18.586 -23.813
175 HZ PHE 33 HZ PHE 33 -3.102 19.652 -23.280
176 H CYS 34 H CYS 34 -2.114 12.395 -24.373
177 HA CYS 34 HA CYS 34 -2.690 10.276 -26.331
178 HB2 CYS 34 HB2 CYS 34 -0.367 9.550 -25.988
179 HB3 CYS 34 HB3 CYS 34 -0.443 11.232 -26.502
180 H ASN 35 H ASN 35 -2.877 11.050 -23.046
181 HA ASN 35 HA ASN 35 -3.550 9.869 -21.221
182 HB2 ASN 35 HB2 ASN 35 -4.938 8.718 -23.171
183 HB3 ASN 35 HB3 ASN 35 -3.897 7.351 -22.786
184 HD21 ASN 35 HD21 ASN 35 -4.041 6.388 -20.751
185 HD22 ASN 35 HD22 ASN 35 -5.414 6.625 -19.729
186 H GLU 36 H GLU 36 -1.010 10.145 -21.147
187 HA GLU 36 HA GLU 36 0.002 7.583 -20.205
188 HB2 GLU 36 HB2 GLU 36 1.326 9.222 -22.360
189 HB3 GLU 36 HB3 GLU 36 2.219 8.073 -21.374
190 HG2 GLU 36 HG2 GLU 36 0.090 6.582 -22.230
191 HG3 GLU 36 HG3 GLU 36 0.418 7.619 -23.617
192 H ASP 37 H ASP 37 1.692 7.761 -18.687
193 HA ASP 37 HA ASP 37 1.836 10.402 -17.429
194 HB2 ASP 37 HB2 ASP 37 2.518 7.644 -16.394
195 HB3 ASP 37 HB3 ASP 37 2.761 9.128 -15.477
196 H PHE 38 H PHE 38 3.754 11.437 -16.986
197 HA PHE 38 HA PHE 38 6.273 10.191 -17.708
198 HB2 PHE 38 HB2 PHE 38 5.370 12.737 -19.070
199 HB3 PHE 38 HB3 PHE 38 6.920 11.931 -19.286
200 HD1 PHE 38 HD1 PHE 38 6.962 9.653 -20.346
201 HD2 PHE 38 HD2 PHE 38 3.493 12.119 -20.328
202 HE1 PHE 38 HE1 PHE 38 6.018 8.332 -22.194
203 HE2 PHE 38 HE2 PHE 38 2.543 10.801 -22.175
204 HZ PHE 38 HZ PHE 38 3.805 8.905 -23.110
205 H CYS 39 H CYS 39 8.018 11.068 -16.663
206 HA CYS 39 HA CYS 39 7.682 12.376 -14.268
207 HB2 CYS 39 HB2 CYS 39 10.040 12.635 -14.184
208 HB3 CYS 39 HB3 CYS 39 9.751 11.169 -15.115
209 H SER 40 H SER 40 8.302 14.526 -13.570
210 HA SER 40 HA SER 40 6.961 16.565 -14.856
211 HB2 SER 40 HB2 SER 40 8.052 18.089 -13.342
212 HB3 SER 40 HB3 SER 40 7.768 16.580 -12.476
213 HG SER 40 HG SER 40 9.932 16.040 -12.790
214 H ASN 41 H ASN 41 10.423 15.790 -15.007
215 HA ASN 41 HA ASN 41 11.288 17.903 -16.575
216 HB2 ASN 41 HB2 ASN 41 12.328 15.092 -16.904
217 HB3 ASN 41 HB3 ASN 41 13.212 16.607 -17.068
218 HD21 ASN 41 HD21 ASN 41 13.913 17.680 -15.243
219 HD22 ASN 41 HD22 ASN 41 13.927 16.945 -13.680
220 H HIS 42 H HIS 42 9.432 15.106 -17.456
221 HA HIS 42 HA HIS 42 9.556 15.930 -20.283
222 HB2 HIS 42 HB2 HIS 42 9.206 13.218 -19.024
223 HB3 HIS 42 HB3 HIS 42 8.712 13.528 -20.686
224 HD2 HIS 42 HD2 HIS 42 11.206 15.022 -21.938
225 HE1 HIS 42 HE1 HIS 42 13.599 11.974 -20.210
226 HE2 HIS 42 HE2 HIS 42 13.496 13.818 -21.924
227 H ARG 43 H ARG 43 7.788 16.804 -17.984
228 HA ARG 43 HA ARG 43 5.197 15.801 -18.296
229 HB2 ARG 43 HB2 ARG 43 4.444 17.752 -17.130
230 HB3 ARG 43 HB3 ARG 43 5.994 17.285 -16.442
231 HG2 ARG 43 HG2 ARG 43 7.096 19.020 -17.789
232 HG3 ARG 43 HG3 ARG 43 5.520 19.507 -18.418
233 HD2 ARG 43 HD2 ARG 43 5.892 19.376 -15.469
234 HD3 ARG 43 HD3 ARG 43 6.624 20.720 -16.346
235 HE ARG 43 HE ARG 43 3.865 20.312 -17.008
236 HH11 ARG 43 HH11 ARG 43 6.058 21.789 -14.743
237 HH12 ARG 43 HH12 ARG 43 4.932 23.009 -14.248
238 HH21 ARG 43 HH21 ARG 43 2.373 21.913 -16.364
239 HH22 ARG 43 HH22 ARG 43 2.835 23.078 -15.170
240 H LEU 44 H LEU 44 6.959 18.253 -20.087
241 HA LEU 44 HA LEU 44 4.890 19.466 -21.476
242 HB2 LEU 44 HB2 LEU 44 7.573 18.792 -22.660
243 HB3 LEU 44 HB3 LEU 44 6.511 20.129 -23.095
244 HG LEU 44 HG LEU 44 8.001 19.842 -20.486
245 HD11 LEU 44 HD11 LEU 44 8.514 22.003 -22.462
246 HD12 LEU 44 HD12 LEU 44 9.199 20.406 -22.763
247 HD13 LEU 44 HD13 LEU 44 9.596 21.270 -21.278
248 HD21 LEU 44 HD21 LEU 44 6.073 21.883 -21.539
249 HD22 LEU 44 HD22 LEU 44 7.287 22.302 -20.329
250 HD23 LEU 44 HD23 LEU 44 6.080 21.064 -19.977
251 H LYS 45 H LYS 45 4.514 19.210 -23.897
252 HA LYS 45 HA LYS 45 3.515 16.567 -24.362
253 HB2 LYS 45 HB2 LYS 45 3.163 19.201 -25.493
254 HB3 LYS 45 HB3 LYS 45 3.389 18.011 -26.768
255 HG2 LYS 45 HG2 LYS 45 1.541 16.709 -25.951
256 HG3 LYS 45 HG3 LYS 45 1.365 17.771 -24.552
257 HD2 LYS 45 HD2 LYS 45 -0.307 18.401 -26.126
258 HD3 LYS 45 HD3 LYS 45 0.937 19.653 -26.163
259 HE2 LYS 45 HE2 LYS 45 1.842 17.938 -28.069
260 HE3 LYS 45 HE3 LYS 45 0.097 17.753 -28.240
261 HZ1 LYS 45 HZ1 LYS 45 1.082 19.526 -29.643
262 HZ2 LYS 45 HZ2 LYS 45 1.485 20.376 -28.237
263 HZ3 LYS 45 HZ3 LYS 45 -0.138 20.078 -28.610
264 H GLU 46 H GLU 46 5.742 18.600 -26.276
265 HA GLU 46 HA GLU 46 6.639 16.612 -27.991
266 HB2 GLU 46 HB2 GLU 46 8.413 18.069 -28.579
267 HB3 GLU 46 HB3 GLU 46 7.055 19.103 -28.159
268 HG2 GLU 46 HG2 GLU 46 8.076 19.307 -25.863
269 HG3 GLU 46 HG3 GLU 46 9.508 18.523 -26.528
270 H ASP 47 H ASP 47 7.554 17.314 -24.705
271 HA ASP 47 HA ASP 47 10.010 16.100 -24.471
272 HB2 ASP 47 HB2 ASP 47 7.706 16.483 -22.624
273 HB3 ASP 47 HB3 ASP 47 8.974 15.367 -22.123
274 H HIS 48 H HIS 48 6.837 14.521 -24.091
275 HA HIS 48 HA HIS 48 8.143 11.910 -24.263
276 HB2 HIS 48 HB2 HIS 48 5.986 10.993 -23.550
277 HB3 HIS 48 HB3 HIS 48 6.526 12.254 -22.445
278 HD1 HIS 48 HD1 HIS 48 5.002 14.229 -22.114
279 HD2 HIS 48 HD2 HIS 48 3.819 11.797 -25.268
280 HE1 HIS 48 HE1 HIS 48 2.737 15.077 -22.805
281 H HIS 49 H HIS 49 7.629 13.860 -26.537
282 HA HIS 49 HA HIS 49 6.909 13.844 -28.703
283 HB2 HIS 49 HB2 HIS 49 7.362 10.877 -28.319
284 HB3 HIS 49 HB3 HIS 49 7.212 11.687 -29.876
285 HD1 HIS 49 HD1 HIS 49 9.269 12.832 -30.798
286 HD2 HIS 49 HD2 HIS 49 9.770 11.486 -26.900
287 HE1 HIS 49 HE1 HIS 49 11.722 13.091 -30.308
288 H CYS 50 H CYS 50 4.763 14.268 -27.305
289 HA CYS 50 HA CYS 50 2.708 12.431 -27.182
290 HB2 CYS 50 HB2 CYS 50 2.780 14.858 -26.337
291 HB3 CYS 50 HB3 CYS 50 2.238 15.305 -27.951
292 H ARG 51 H ARG 51 1.364 11.488 -28.598
293 HA ARG 51 HA ARG 51 1.925 11.357 -31.310
294 HB2 ARG 51 HB2 ARG 51 -0.350 10.344 -31.536
295 HB3 ARG 51 HB3 ARG 51 0.633 9.628 -30.266
296 HG2 ARG 51 HG2 ARG 51 -0.582 10.823 -28.574
297 HG3 ARG 51 HG3 ARG 51 -1.485 11.714 -29.801
298 HD2 ARG 51 HD2 ARG 51 -1.554 8.717 -29.494
299 HD3 ARG 51 HD3 ARG 51 -2.730 9.809 -28.764
300 HE ARG 51 HE ARG 51 -2.463 10.190 -31.588
301 HH11 ARG 51 HH11 ARG 51 -3.993 8.268 -29.121
302 HH12 ARG 51 HH12 ARG 51 -5.334 7.817 -30.120
303 HH21 ARG 51 HH21 ARG 51 -4.224 9.603 -32.914
304 HH22 ARG 51 HH22 ARG 51 -5.464 8.576 -32.278
305 H TRP 52 H TRP 52 -0.245 13.497 -29.562
306 HA TRP 52 HA TRP 52 -1.690 14.555 -31.695
307 HB2 TRP 52 HB2 TRP 52 -2.060 14.945 -29.209
308 HB3 TRP 52 HB3 TRP 52 -0.784 16.155 -29.302
309 HD1 TRP 52 HD1 TRP 52 -4.434 15.601 -30.116
310 HE1 TRP 52 HE1 TRP 52 -5.459 17.803 -30.968
311 HE3 TRP 52 HE3 TRP 52 -0.149 18.337 -30.649
312 HZ2 TRP 52 HZ2 TRP 52 -4.568 20.361 -31.762
313 HZ3 TRP 52 HZ3 TRP 52 -0.322 20.654 -31.461
314 HH2 TRP 52 HH2 TRP 52 -2.487 21.643 -32.005
315 H LEU 53 H LEU 53 1.421 15.587 -30.336
316 HA LEU 53 HA LEU 53 1.806 17.845 -31.941
317 HB2 LEU 53 HB2 LEU 53 3.366 16.226 -30.135
318 HB3 LEU 53 HB3 LEU 53 4.334 16.733 -31.518
319 HG LEU 53 HG LEU 53 2.823 18.592 -29.683
320 HD11 LEU 53 HD11 LEU 53 5.801 18.343 -29.846
321 HD12 LEU 53 HD12 LEU 53 4.864 17.299 -28.776
322 HD13 LEU 53 HD13 LEU 53 4.806 19.050 -28.572
323 HD21 LEU 53 HD21 LEU 53 3.868 18.956 -32.288
324 HD22 LEU 53 HD22 LEU 53 4.915 19.827 -31.167
325 HD23 LEU 53 HD23 LEU 53 3.184 20.166 -31.202
326 H LEU 54 H LEU 54 2.588 14.447 -32.498
327 HA LEU 54 HA LEU 54 3.973 14.900 -34.949
328 HB2 LEU 54 HB2 LEU 54 2.638 12.313 -34.269
329 HB3 LEU 54 HB3 LEU 54 4.155 12.593 -35.122
330 HG LEU 54 HG LEU 54 3.679 12.876 -32.156
331 HD11 LEU 54 HD11 LEU 54 5.270 10.894 -33.776
332 HD12 LEU 54 HD12 LEU 54 3.803 10.569 -32.854
333 HD13 LEU 54 HD13 LEU 54 5.290 11.014 -32.017
334 HD21 LEU 54 HD21 LEU 54 6.414 12.914 -32.719
335 HD22 LEU 54 HD22 LEU 54 5.422 14.252 -32.138
336 HD23 LEU 54 HD23 LEU 54 5.683 14.034 -33.869
337 H GLU 55 H GLU 55 0.647 14.171 -34.076
338 HA GLU 55 HA GLU 55 -0.353 13.508 -36.596
339 HB2 GLU 55 HB2 GLU 55 -1.413 14.081 -34.015
340 HB3 GLU 55 HB3 GLU 55 -2.322 15.017 -35.193
341 HG2 GLU 55 HG2 GLU 55 -2.237 12.613 -36.423
342 HG3 GLU 55 HG3 GLU 55 -2.243 12.121 -34.731
343 H HIS 56 H HIS 56 0.229 16.641 -35.104
344 HA HIS 56 HA HIS 56 -0.658 17.958 -37.582
345 HB2 HIS 56 HB2 HIS 56 -0.472 18.903 -34.733
346 HB3 HIS 56 HB3 HIS 56 -0.529 20.053 -36.065
347 HD1 HIS 56 HD1 HIS 56 -2.701 19.484 -37.770
348 HD2 HIS 56 HD2 HIS 56 -2.930 18.350 -33.780
349 HE1 HIS 56 HE1 HIS 56 -5.152 19.176 -37.298
350 H GLU 57 H GLU 57 1.430 17.222 -38.501
351 HA GLU 57 HA GLU 57 3.818 18.536 -37.517
352 HB2 GLU 57 HB2 GLU 57 3.217 16.537 -39.656
353 HB3 GLU 57 HB3 GLU 57 4.716 17.451 -39.747
354 HG2 GLU 57 HG2 GLU 57 4.515 16.525 -37.105
355 HG3 GLU 57 HG3 GLU 57 4.077 15.172 -38.146
356 H GLU 58 H GLU 58 3.195 20.730 -37.803
357 HA GLU 58 HA GLU 58 2.347 21.846 -40.235
358 HB2 GLU 58 HB2 GLU 58 2.941 23.993 -39.278
359 HB3 GLU 58 HB3 GLU 58 2.173 22.992 -38.054
360 HG2 GLU 58 HG2 GLU 58 4.318 22.485 -37.067
361 HG3 GLU 58 HG3 GLU 58 5.143 23.385 -38.338
362 H VAL 59 H VAL 59 3.402 22.634 -41.986
363 HA VAL 59 HA VAL 59 5.999 21.666 -42.566
364 HB VAL 59 HB VAL 59 5.839 23.007 -44.631
365 HG11 VAL 59 HG11 VAL 59 4.001 21.819 -45.609
366 HG12 VAL 59 HG12 VAL 59 4.763 20.771 -44.411
367 HG13 VAL 59 HG13 VAL 59 3.247 21.591 -44.031
368 HG21 VAL 59 HG21 VAL 59 3.390 24.107 -43.276
369 HG22 VAL 59 HG22 VAL 59 4.766 24.992 -43.934
370 HG23 VAL 59 HG23 VAL 59 3.631 24.193 -45.021
Start of MODEL 6
1 H MET 11 H MET 11 0.937 -4.925 -5.933
2 HA MET 11 HA MET 11 1.593 -2.620 -7.327
3 HB2 MET 11 HB2 MET 11 -0.827 -4.380 -7.759
4 HB3 MET 11 HB3 MET 11 -0.130 -3.279 -8.939
5 HG2 MET 11 HG2 MET 11 1.509 -4.701 -9.493
6 HG3 MET 11 HG3 MET 11 1.741 -5.245 -7.834
7 HE1 MET 11 HE1 MET 11 0.761 -8.522 -7.790
8 HE2 MET 11 HE2 MET 11 1.749 -8.274 -9.229
9 HE3 MET 11 HE3 MET 11 2.039 -7.305 -7.783
10 H LEU 12 H LEU 12 1.190 -0.704 -6.305
11 HA LEU 12 HA LEU 12 -1.647 -0.021 -5.911
12 HB2 LEU 12 HB2 LEU 12 0.521 1.268 -4.308
13 HB3 LEU 12 HB3 LEU 12 -1.201 1.142 -3.956
14 HG LEU 12 HG LEU 12 -0.282 -1.489 -3.951
15 HD11 LEU 12 HD11 LEU 12 1.999 -0.943 -3.850
16 HD12 LEU 12 HD12 LEU 12 1.532 -1.278 -2.183
17 HD13 LEU 12 HD13 LEU 12 1.719 0.388 -2.728
18 HD21 LEU 12 HD21 LEU 12 -0.752 0.394 -1.641
19 HD22 LEU 12 HD22 LEU 12 -0.757 -1.368 -1.560
20 HD23 LEU 12 HD23 LEU 12 -1.991 -0.524 -2.497
21 H ASP 13 H ASP 13 -1.315 2.671 -5.351
22 HA ASP 13 HA ASP 13 -0.296 3.670 -7.925
23 HB2 ASP 13 HB2 ASP 13 -2.531 4.620 -6.141
24 HB3 ASP 13 HB3 ASP 13 -1.847 5.644 -7.400
25 H VAL 14 H VAL 14 1.562 3.284 -5.937
26 HA VAL 14 HA VAL 14 1.983 5.754 -4.497
27 HB VAL 14 HB VAL 14 4.129 4.688 -3.792
28 HG11 VAL 14 HG11 VAL 14 2.399 4.387 -2.272
29 HG12 VAL 14 HG12 VAL 14 1.487 3.344 -3.365
30 HG13 VAL 14 HG13 VAL 14 2.946 2.739 -2.579
31 HG21 VAL 14 HG21 VAL 14 3.787 3.127 -6.027
32 HG22 VAL 14 HG22 VAL 14 4.937 2.823 -4.725
33 HG23 VAL 14 HG23 VAL 14 3.362 2.031 -4.713
34 H GLY 15 H GLY 15 1.833 6.608 -6.968
35 HA2 GLY 15 HA2 GLY 15 3.148 8.183 -8.144
36 HA3 GLY 15 HA3 GLY 15 4.594 7.347 -7.597
37 H LYS 16 H LYS 16 3.437 8.184 -10.309
38 HA LYS 16 HA LYS 16 3.443 5.562 -11.627
39 HB2 LYS 16 HB2 LYS 16 1.972 7.957 -12.051
40 HB3 LYS 16 HB3 LYS 16 2.987 7.704 -13.465
41 HG2 LYS 16 HG2 LYS 16 1.095 6.560 -14.059
42 HG3 LYS 16 HG3 LYS 16 2.062 5.269 -13.343
43 HD2 LYS 16 HD2 LYS 16 0.846 5.904 -11.147
44 HD3 LYS 16 HD3 LYS 16 -0.312 6.706 -12.211
45 HE2 LYS 16 HE2 LYS 16 0.497 3.872 -12.723
46 HE3 LYS 16 HE3 LYS 16 -0.712 4.239 -11.494
47 HZ1 LYS 16 HZ1 LYS 16 -1.376 5.676 -13.787
48 HZ2 LYS 16 HZ2 LYS 16 -2.214 4.381 -13.093
49 HZ3 LYS 16 HZ3 LYS 16 -1.043 4.091 -14.278
50 H HIS 17 H HIS 17 5.013 4.957 -13.023
51 HA HIS 17 HA HIS 17 7.406 6.607 -13.114
52 HB2 HIS 17 HB2 HIS 17 7.074 3.870 -14.334
53 HB3 HIS 17 HB3 HIS 17 8.564 4.663 -13.829
54 HD1 HIS 17 HD1 HIS 17 5.438 3.146 -12.315
55 HD2 HIS 17 HD2 HIS 17 9.351 4.087 -11.283
56 HE1 HIS 17 HE1 HIS 17 5.781 2.171 -10.022
57 H CYS 18 H CYS 18 8.213 7.589 -14.890
58 HA CYS 18 HA CYS 18 6.595 8.353 -16.988
59 HB2 CYS 18 HB2 CYS 18 8.802 9.376 -16.296
60 HB3 CYS 18 HB3 CYS 18 9.597 8.083 -17.188
61 H ALA 19 H ALA 19 6.287 7.689 -19.096
62 HA ALA 19 HA ALA 19 6.887 4.873 -19.600
63 HB1 ALA 19 HB1 ALA 19 5.317 5.893 -21.690
64 HB2 ALA 19 HB2 ALA 19 4.801 4.861 -20.356
65 HB3 ALA 19 HB3 ALA 19 4.692 6.615 -20.207
66 H TYR 20 H TYR 20 8.758 7.278 -19.927
67 HA TYR 20 HA TYR 20 9.636 6.580 -22.646
68 HB2 TYR 20 HB2 TYR 20 8.527 8.890 -22.423
69 HB3 TYR 20 HB3 TYR 20 9.965 9.354 -21.519
70 HD1 TYR 20 HD1 TYR 20 11.827 10.154 -22.658
71 HD2 TYR 20 HD2 TYR 20 8.927 7.880 -24.784
72 HE1 TYR 20 HE1 TYR 20 12.998 10.642 -24.765
73 HE2 TYR 20 HE2 TYR 20 10.091 8.361 -26.897
74 HH TYR 20 HH TYR 20 12.962 9.152 -27.276
75 H CYS 21 H CYS 21 10.557 7.955 -19.510
76 HA CYS 21 HA CYS 21 13.297 6.970 -19.967
77 HB2 CYS 21 HB2 CYS 21 14.135 8.712 -18.596
78 HB3 CYS 21 HB3 CYS 21 12.958 9.473 -19.661
79 H ARG 22 H ARG 22 10.473 6.631 -18.112
80 HA ARG 22 HA ARG 22 9.912 5.246 -16.396
81 HB2 ARG 22 HB2 ARG 22 12.694 4.096 -16.548
82 HB3 ARG 22 HB3 ARG 22 11.231 3.317 -15.962
83 HG2 ARG 22 HG2 ARG 22 10.664 4.029 -18.595
84 HG3 ARG 22 HG3 ARG 22 12.318 3.415 -18.623
85 HD2 ARG 22 HD2 ARG 22 11.367 1.481 -17.191
86 HD3 ARG 22 HD3 ARG 22 9.799 2.030 -17.782
87 HE ARG 22 HE ARG 22 11.747 0.551 -19.236
88 HH11 ARG 22 HH11 ARG 22 9.281 2.986 -19.566
89 HH12 ARG 22 HH12 ARG 22 8.964 2.626 -21.231
90 HH21 ARG 22 HH21 ARG 22 11.340 0.067 -21.427
91 HH22 ARG 22 HH22 ARG 22 10.135 0.965 -22.288
92 H GLN 23 H GLN 23 10.115 7.439 -15.303
93 HA GLN 23 HA GLN 23 12.126 7.275 -13.155
94 HB2 GLN 23 HB2 GLN 23 11.200 9.553 -14.808
95 HB3 GLN 23 HB3 GLN 23 11.448 9.883 -13.099
96 HG2 GLN 23 HG2 GLN 23 13.738 9.140 -13.246
97 HG3 GLN 23 HG3 GLN 23 13.508 8.675 -14.930
98 HE21 GLN 23 HE21 GLN 23 15.480 10.180 -14.897
99 HE22 GLN 23 HE22 GLN 23 15.155 11.843 -15.231
100 H LEU 24 H LEU 24 11.206 6.668 -11.317
101 HA LEU 24 HA LEU 24 8.444 6.714 -10.806
102 HB2 LEU 24 HB2 LEU 24 9.784 5.147 -9.644
103 HB3 LEU 24 HB3 LEU 24 10.837 6.411 -9.013
104 HG LEU 24 HG LEU 24 8.193 6.909 -8.085
105 HD11 LEU 24 HD11 LEU 24 7.384 4.796 -8.118
106 HD12 LEU 24 HD12 LEU 24 8.317 4.676 -6.627
107 HD13 LEU 24 HD13 LEU 24 8.987 4.061 -8.137
108 HD21 LEU 24 HD21 LEU 24 10.083 7.690 -6.897
109 HD22 LEU 24 HD22 LEU 24 10.783 6.074 -6.802
110 HD23 LEU 24 HD23 LEU 24 9.332 6.462 -5.876
111 H ASP 25 H ASP 25 7.347 8.580 -10.780
112 HA ASP 25 HA ASP 25 8.393 10.770 -9.107
113 HB2 ASP 25 HB2 ASP 25 7.057 10.743 -11.747
114 HB3 ASP 25 HB3 ASP 25 6.532 12.005 -10.636
115 H PHE 26 H PHE 26 6.719 12.126 -8.071
116 HA PHE 26 HA PHE 26 4.667 10.416 -6.907
117 HB2 PHE 26 HB2 PHE 26 5.318 13.251 -6.110
118 HB3 PHE 26 HB3 PHE 26 4.513 12.014 -5.151
119 HD1 PHE 26 HD1 PHE 26 7.741 13.115 -6.527
120 HD2 PHE 26 HD2 PHE 26 5.750 10.402 -3.920
121 HE1 PHE 26 HE1 PHE 26 9.905 12.472 -5.549
122 HE2 PHE 26 HE2 PHE 26 7.911 9.755 -2.937
123 HZ PHE 26 HZ PHE 26 9.993 10.789 -3.752
124 H LEU 27 H LEU 27 4.971 13.394 -8.763
125 HA LEU 27 HA LEU 27 2.041 13.476 -9.035
126 HB2 LEU 27 HB2 LEU 27 2.446 15.841 -9.807
127 HB3 LEU 27 HB3 LEU 27 2.764 15.510 -8.106
128 HG LEU 27 HG LEU 27 5.120 15.274 -9.834
129 HD11 LEU 27 HD11 LEU 27 3.990 18.020 -9.362
130 HD12 LEU 27 HD12 LEU 27 3.813 17.153 -10.887
131 HD13 LEU 27 HD13 LEU 27 5.419 17.574 -10.294
132 HD21 LEU 27 HD21 LEU 27 4.989 17.151 -7.563
133 HD22 LEU 27 HD22 LEU 27 6.198 15.930 -7.962
134 HD23 LEU 27 HD23 LEU 27 4.686 15.455 -7.186
135 HA PRO 28 HA PRO 28 3.549 12.038 -13.143
136 HB2 PRO 28 HB2 PRO 28 1.417 10.418 -13.593
137 HB3 PRO 28 HB3 PRO 28 2.836 9.905 -12.673
138 HG2 PRO 28 HG2 PRO 28 0.182 10.870 -11.679
139 HG3 PRO 28 HG3 PRO 28 1.169 9.517 -11.098
140 HD2 PRO 28 HD2 PRO 28 1.111 11.919 -9.850
141 HD3 PRO 28 HD3 PRO 28 2.558 10.891 -9.875
142 H PHE 29 H PHE 29 3.134 13.208 -14.903
143 HA PHE 29 HA PHE 29 0.778 14.885 -15.003
144 HB2 PHE 29 HB2 PHE 29 3.308 14.676 -16.590
145 HB3 PHE 29 HB3 PHE 29 1.929 15.527 -17.278
146 HD1 PHE 29 HD1 PHE 29 1.293 17.676 -16.502
147 HD2 PHE 29 HD2 PHE 29 4.351 15.490 -14.506
148 HE1 PHE 29 HE1 PHE 29 1.910 19.697 -15.243
149 HE2 PHE 29 HE2 PHE 29 4.973 17.507 -13.243
150 HZ PHE 29 HZ PHE 29 3.752 19.614 -13.610
151 H HIS 30 H HIS 30 -1.053 13.907 -15.605
152 HA HIS 30 HA HIS 30 -1.062 11.764 -17.541
153 HB2 HIS 30 HB2 HIS 30 -2.598 11.586 -15.695
154 HB3 HIS 30 HB3 HIS 30 -3.284 13.169 -16.049
155 HD1 HIS 30 HD1 HIS 30 -3.413 9.599 -17.090
156 HD2 HIS 30 HD2 HIS 30 -5.089 13.231 -18.216
157 HE1 HIS 30 HE1 HIS 30 -5.308 9.015 -18.637
158 H CYS 31 H CYS 31 -1.210 12.024 -19.661
159 HA CYS 31 HA CYS 31 -1.805 14.637 -20.763
160 HB2 CYS 31 HB2 CYS 31 -0.015 12.799 -21.516
161 HB3 CYS 31 HB3 CYS 31 -1.360 12.285 -22.530
162 H SER 32 H SER 32 -3.673 15.245 -21.653
163 HA SER 32 HA SER 32 -5.859 13.313 -21.725
164 HB2 SER 32 HB2 SER 32 -5.784 15.885 -20.841
165 HB3 SER 32 HB3 SER 32 -6.403 16.118 -22.475
166 HG SER 32 HG SER 32 -8.044 15.741 -20.865
167 H PHE 33 H PHE 33 -3.613 13.560 -23.756
168 HA PHE 33 HA PHE 33 -5.317 13.874 -26.140
169 HB2 PHE 33 HB2 PHE 33 -2.320 14.147 -26.175
170 HB3 PHE 33 HB3 PHE 33 -3.486 14.705 -27.371
171 HD1 PHE 33 HD1 PHE 33 -5.438 16.113 -25.703
172 HD2 PHE 33 HD2 PHE 33 -1.187 16.046 -25.496
173 HE1 PHE 33 HE1 PHE 33 -5.458 18.336 -24.647
174 HE2 PHE 33 HE2 PHE 33 -1.200 18.268 -24.439
175 HZ PHE 33 HZ PHE 33 -3.337 19.415 -24.013
176 H CYS 34 H CYS 34 -2.529 12.123 -24.807
177 HA CYS 34 HA CYS 34 -3.074 9.934 -26.694
178 HB2 CYS 34 HB2 CYS 34 -0.786 9.172 -26.222
179 HB3 CYS 34 HB3 CYS 34 -0.799 10.834 -26.806
180 H ASN 35 H ASN 35 -3.354 10.853 -23.446
181 HA ASN 35 HA ASN 35 -4.133 9.767 -21.603
182 HB2 ASN 35 HB2 ASN 35 -5.476 8.572 -23.564
183 HB3 ASN 35 HB3 ASN 35 -4.499 7.194 -23.065
184 HD21 ASN 35 HD21 ASN 35 -6.952 9.469 -22.106
185 HD22 ASN 35 HD22 ASN 35 -7.511 8.588 -20.729
186 H GLU 36 H GLU 36 -1.592 9.974 -21.442
187 HA GLU 36 HA GLU 36 -0.691 7.423 -20.365
188 HB2 GLU 36 HB2 GLU 36 0.752 8.939 -22.532
189 HB3 GLU 36 HB3 GLU 36 1.585 7.819 -21.463
190 HG2 GLU 36 HG2 GLU 36 -0.553 6.342 -22.339
191 HG3 GLU 36 HG3 GLU 36 -0.126 7.298 -23.757
192 H ASP 37 H ASP 37 0.942 7.613 -18.788
193 HA ASP 37 HA ASP 37 1.114 10.295 -17.625
194 HB2 ASP 37 HB2 ASP 37 1.579 7.538 -16.490
195 HB3 ASP 37 HB3 ASP 37 2.002 9.008 -15.615
196 H PHE 38 H PHE 38 3.048 11.284 -17.125
197 HA PHE 38 HA PHE 38 5.554 9.945 -17.705
198 HB2 PHE 38 HB2 PHE 38 4.765 12.452 -19.204
199 HB3 PHE 38 HB3 PHE 38 6.313 11.621 -19.312
200 HD1 PHE 38 HD1 PHE 38 6.374 9.296 -20.268
201 HD2 PHE 38 HD2 PHE 38 2.948 11.807 -20.533
202 HE1 PHE 38 HE1 PHE 38 5.504 7.909 -22.105
203 HE2 PHE 38 HE2 PHE 38 2.072 10.424 -22.369
204 HZ PHE 38 HZ PHE 38 3.350 8.472 -23.157
205 H CYS 39 H CYS 39 7.266 10.790 -16.596
206 HA CYS 39 HA CYS 39 6.864 12.221 -14.282
207 HB2 CYS 39 HB2 CYS 39 9.214 12.356 -14.067
208 HB3 CYS 39 HB3 CYS 39 8.923 10.889 -14.996
209 H SER 40 H SER 40 7.546 14.373 -13.650
210 HA SER 40 HA SER 40 6.374 16.401 -15.122
211 HB2 SER 40 HB2 SER 40 8.686 17.068 -13.347
212 HB3 SER 40 HB3 SER 40 7.111 17.851 -13.478
213 HG SER 40 HG SER 40 7.349 16.631 -11.539
214 H ASN 41 H ASN 41 9.685 15.227 -15.180
215 HA ASN 41 HA ASN 41 10.842 17.306 -16.666
216 HB2 ASN 41 HB2 ASN 41 11.730 14.940 -15.548
217 HB3 ASN 41 HB3 ASN 41 11.920 14.655 -17.275
218 HD21 ASN 41 HD21 ASN 41 13.104 16.273 -14.518
219 HD22 ASN 41 HD22 ASN 41 14.410 17.106 -15.283
220 H HIS 42 H HIS 42 8.821 14.643 -17.601
221 HA HIS 42 HA HIS 42 9.134 15.426 -20.425
222 HB2 HIS 42 HB2 HIS 42 8.566 12.730 -19.199
223 HB3 HIS 42 HB3 HIS 42 8.259 13.072 -20.899
224 HD2 HIS 42 HD2 HIS 42 10.839 14.208 -22.101
225 HE1 HIS 42 HE1 HIS 42 13.061 11.434 -19.785
226 HE2 HIS 42 HE2 HIS 42 13.104 13.009 -21.751
227 H ARG 43 H ARG 43 7.297 16.375 -18.211
228 HA ARG 43 HA ARG 43 4.689 15.479 -18.603
229 HB2 ARG 43 HB2 ARG 43 3.972 17.570 -17.604
230 HB3 ARG 43 HB3 ARG 43 5.390 16.964 -16.759
231 HG2 ARG 43 HG2 ARG 43 6.767 18.525 -18.166
232 HG3 ARG 43 HG3 ARG 43 5.250 19.230 -18.728
233 HD2 ARG 43 HD2 ARG 43 4.650 19.800 -16.439
234 HD3 ARG 43 HD3 ARG 43 6.132 19.048 -15.849
235 HE ARG 43 HE ARG 43 7.013 20.910 -17.616
236 HH11 ARG 43 HH11 ARG 43 4.905 21.007 -14.848
237 HH12 ARG 43 HH12 ARG 43 5.313 22.638 -14.430
238 HH21 ARG 43 HH21 ARG 43 7.560 23.058 -17.077
239 HH22 ARG 43 HH22 ARG 43 6.823 23.804 -15.699
240 H LEU 44 H LEU 44 6.585 17.847 -20.387
241 HA LEU 44 HA LEU 44 4.625 19.064 -21.905
242 HB2 LEU 44 HB2 LEU 44 7.319 18.240 -22.964
243 HB3 LEU 44 HB3 LEU 44 6.326 19.598 -23.490
244 HG LEU 44 HG LEU 44 7.723 19.357 -20.826
245 HD11 LEU 44 HD11 LEU 44 8.314 21.111 -23.206
246 HD12 LEU 44 HD12 LEU 44 9.260 19.714 -22.695
247 HD13 LEU 44 HD13 LEU 44 9.157 21.136 -21.657
248 HD21 LEU 44 HD21 LEU 44 5.508 20.946 -21.641
249 HD22 LEU 44 HD22 LEU 44 6.906 22.000 -21.429
250 HD23 LEU 44 HD23 LEU 44 6.374 20.962 -20.105
251 H LYS 45 H LYS 45 4.308 18.734 -24.320
252 HA LYS 45 HA LYS 45 3.228 16.113 -24.726
253 HB2 LYS 45 HB2 LYS 45 3.001 18.717 -25.953
254 HB3 LYS 45 HB3 LYS 45 3.227 17.480 -27.182
255 HG2 LYS 45 HG2 LYS 45 1.313 16.261 -26.370
256 HG3 LYS 45 HG3 LYS 45 1.123 17.392 -25.029
257 HD2 LYS 45 HD2 LYS 45 -0.471 17.984 -26.703
258 HD3 LYS 45 HD3 LYS 45 0.800 19.209 -26.723
259 HE2 LYS 45 HE2 LYS 45 1.747 17.395 -28.524
260 HE3 LYS 45 HE3 LYS 45 0.007 17.272 -28.777
261 HZ1 LYS 45 HZ1 LYS 45 -0.118 19.589 -29.232
262 HZ2 LYS 45 HZ2 LYS 45 1.132 18.960 -30.181
263 HZ3 LYS 45 HZ3 LYS 45 1.494 19.839 -28.782
264 H GLU 46 H GLU 46 5.580 18.000 -26.641
265 HA GLU 46 HA GLU 46 6.455 15.922 -28.258
266 HB2 GLU 46 HB2 GLU 46 8.298 17.296 -28.843
267 HB3 GLU 46 HB3 GLU 46 6.962 18.387 -28.506
268 HG2 GLU 46 HG2 GLU 46 7.951 18.548 -26.145
269 HG3 GLU 46 HG3 GLU 46 9.399 17.841 -26.860
270 H ASP 47 H ASP 47 7.299 16.709 -24.974
271 HA ASP 47 HA ASP 47 9.705 15.425 -24.624
272 HB2 ASP 47 HB2 ASP 47 7.366 15.961 -22.865
273 HB3 ASP 47 HB3 ASP 47 8.562 14.804 -22.287
274 H HIS 48 H HIS 48 6.471 13.964 -24.286
275 HA HIS 48 HA HIS 48 7.691 11.307 -24.325
276 HB2 HIS 48 HB2 HIS 48 5.476 10.490 -23.660
277 HB3 HIS 48 HB3 HIS 48 6.031 11.762 -22.575
278 HD1 HIS 48 HD1 HIS 48 4.560 13.782 -22.328
279 HD2 HIS 48 HD2 HIS 48 3.412 11.345 -25.491
280 HE1 HIS 48 HE1 HIS 48 2.357 14.702 -23.121
281 H HIS 49 H HIS 49 7.321 13.188 -26.682
282 HA HIS 49 HA HIS 49 6.673 13.118 -28.870
283 HB2 HIS 49 HB2 HIS 49 7.120 10.189 -28.282
284 HB3 HIS 49 HB3 HIS 49 6.837 10.816 -29.903
285 HD1 HIS 49 HD1 HIS 49 8.636 13.351 -29.697
286 HD2 HIS 49 HD2 HIS 49 9.763 9.528 -28.526
287 HE1 HIS 49 HE1 HIS 49 11.149 13.337 -29.777
288 H CYS 50 H CYS 50 4.499 13.671 -27.571
289 HA CYS 50 HA CYS 50 2.376 11.908 -27.454
290 HB2 CYS 50 HB2 CYS 50 2.512 14.360 -26.684
291 HB3 CYS 50 HB3 CYS 50 2.029 14.769 -28.327
292 H ARG 51 H ARG 51 1.088 10.934 -28.893
293 HA ARG 51 HA ARG 51 1.721 10.716 -31.577
294 HB2 ARG 51 HB2 ARG 51 -0.547 9.739 -31.858
295 HB3 ARG 51 HB3 ARG 51 0.333 9.071 -30.489
296 HG2 ARG 51 HG2 ARG 51 -0.928 10.660 -29.020
297 HG3 ARG 51 HG3 ARG 51 -1.912 11.069 -30.427
298 HD2 ARG 51 HD2 ARG 51 -1.566 8.209 -29.639
299 HD3 ARG 51 HD3 ARG 51 -2.704 9.225 -28.755
300 HE ARG 51 HE ARG 51 -3.057 8.134 -31.361
301 HH11 ARG 51 HH11 ARG 51 -3.802 10.888 -29.366
302 HH12 ARG 51 HH12 ARG 51 -5.245 11.292 -30.235
303 HH21 ARG 51 HH21 ARG 51 -4.955 8.654 -32.513
304 HH22 ARG 51 HH22 ARG 51 -5.901 10.020 -32.024
305 H TRP 52 H TRP 52 -0.442 12.972 -29.971
306 HA TRP 52 HA TRP 52 -1.783 14.008 -32.178
307 HB2 TRP 52 HB2 TRP 52 -2.216 14.495 -29.722
308 HB3 TRP 52 HB3 TRP 52 -0.890 15.652 -29.809
309 HD1 TRP 52 HD1 TRP 52 -4.532 15.212 -30.723
310 HE1 TRP 52 HE1 TRP 52 -5.443 17.423 -31.675
311 HE3 TRP 52 HE3 TRP 52 -0.129 17.764 -31.204
312 HZ2 TRP 52 HZ2 TRP 52 -4.429 19.919 -32.519
313 HZ3 TRP 52 HZ3 TRP 52 -0.186 20.058 -32.092
314 HH2 TRP 52 HH2 TRP 52 -2.292 21.111 -32.736
315 H LEU 53 H LEU 53 1.358 14.897 -30.810
316 HA LEU 53 HA LEU 53 1.847 17.107 -32.488
317 HB2 LEU 53 HB2 LEU 53 3.302 15.528 -30.549
318 HB3 LEU 53 HB3 LEU 53 4.328 15.988 -31.907
319 HG LEU 53 HG LEU 53 2.771 17.898 -30.164
320 HD11 LEU 53 HD11 LEU 53 5.551 16.853 -30.076
321 HD12 LEU 53 HD12 LEU 53 4.462 17.289 -28.760
322 HD13 LEU 53 HD13 LEU 53 5.280 18.551 -29.680
323 HD21 LEU 53 HD21 LEU 53 4.008 18.180 -32.748
324 HD22 LEU 53 HD22 LEU 53 4.802 19.215 -31.560
325 HD23 LEU 53 HD23 LEU 53 3.062 19.346 -31.823
326 H LEU 54 H LEU 54 2.425 13.662 -32.869
327 HA LEU 54 HA LEU 54 4.012 13.891 -35.225
328 HB2 LEU 54 HB2 LEU 54 2.382 11.472 -34.568
329 HB3 LEU 54 HB3 LEU 54 3.973 11.572 -35.320
330 HG LEU 54 HG LEU 54 3.329 12.005 -32.404
331 HD11 LEU 54 HD11 LEU 54 5.240 9.950 -33.310
332 HD12 LEU 54 HD12 LEU 54 3.540 9.645 -33.665
333 HD13 LEU 54 HD13 LEU 54 4.059 9.910 -32.001
334 HD21 LEU 54 HD21 LEU 54 5.141 13.322 -32.447
335 HD22 LEU 54 HD22 LEU 54 5.643 12.750 -34.038
336 HD23 LEU 54 HD23 LEU 54 6.040 11.813 -32.597
337 H GLU 55 H GLU 55 0.631 12.872 -34.713
338 HA GLU 55 HA GLU 55 -0.051 12.671 -37.421
339 HB2 GLU 55 HB2 GLU 55 -2.361 12.703 -36.687
340 HB3 GLU 55 HB3 GLU 55 -1.402 11.736 -35.576
341 HG2 GLU 55 HG2 GLU 55 -1.270 13.763 -34.096
342 HG3 GLU 55 HG3 GLU 55 -2.466 14.512 -35.152
343 H HIS 56 H HIS 56 -0.070 15.410 -35.217
344 HA HIS 56 HA HIS 56 -0.844 17.147 -37.468
345 HB2 HIS 56 HB2 HIS 56 -1.684 17.086 -34.652
346 HB3 HIS 56 HB3 HIS 56 -1.251 18.688 -35.241
347 HD1 HIS 56 HD1 HIS 56 -2.574 19.419 -37.512
348 HD2 HIS 56 HD2 HIS 56 -4.203 16.306 -35.294
349 HE1 HIS 56 HE1 HIS 56 -4.962 19.225 -38.278
350 H GLU 57 H GLU 57 1.366 17.266 -38.135
351 HA GLU 57 HA GLU 57 3.060 18.888 -36.352
352 HB2 GLU 57 HB2 GLU 57 4.973 18.007 -37.724
353 HB3 GLU 57 HB3 GLU 57 4.141 16.801 -36.753
354 HG2 GLU 57 HG2 GLU 57 3.694 15.585 -38.542
355 HG3 GLU 57 HG3 GLU 57 2.936 16.958 -39.346
356 H GLU 58 H GLU 58 2.811 20.956 -36.930
357 HA GLU 58 HA GLU 58 2.922 21.611 -39.801
358 HB2 GLU 58 HB2 GLU 58 1.768 23.757 -39.108
359 HB3 GLU 58 HB3 GLU 58 0.799 22.294 -39.002
360 HG2 GLU 58 HG2 GLU 58 2.160 22.767 -36.519
361 HG3 GLU 58 HG3 GLU 58 1.249 24.195 -37.007
362 H VAL 59 H VAL 59 4.961 22.171 -40.246
363 HA VAL 59 HA VAL 59 6.282 24.103 -38.451
364 HB VAL 59 HB VAL 59 8.449 23.181 -39.383
365 HG11 VAL 59 HG11 VAL 59 8.100 22.591 -37.187
366 HG12 VAL 59 HG12 VAL 59 6.616 21.706 -37.548
367 HG13 VAL 59 HG13 VAL 59 8.184 21.006 -37.955
368 HG21 VAL 59 HG21 VAL 59 8.378 20.885 -40.264
369 HG22 VAL 59 HG22 VAL 59 6.616 20.958 -40.279
370 HG23 VAL 59 HG23 VAL 59 7.551 22.028 -41.322
Start of MODEL 7
1 H MET 11 H MET 11 2.387 1.737 3.188
2 HA MET 11 HA MET 11 4.363 1.638 2.047
3 HB2 MET 11 HB2 MET 11 5.353 -0.690 1.976
4 HB3 MET 11 HB3 MET 11 4.842 -0.124 3.561
5 HG2 MET 11 HG2 MET 11 3.020 -1.549 3.628
6 HG3 MET 11 HG3 MET 11 2.999 -1.763 1.879
7 HE1 MET 11 HE1 MET 11 3.164 -3.232 4.815
8 HE2 MET 11 HE2 MET 11 3.138 -4.756 3.928
9 HE3 MET 11 HE3 MET 11 4.502 -4.369 4.978
10 H LEU 12 H LEU 12 2.827 2.307 0.169
11 HA LEU 12 HA LEU 12 3.245 0.390 -2.028
12 HB2 LEU 12 HB2 LEU 12 1.002 2.366 -2.056
13 HB3 LEU 12 HB3 LEU 12 1.177 0.867 -2.967
14 HG LEU 12 HG LEU 12 1.067 0.072 -0.297
15 HD11 LEU 12 HD11 LEU 12 -0.874 1.111 0.624
16 HD12 LEU 12 HD12 LEU 12 -1.117 2.075 -0.832
17 HD13 LEU 12 HD13 LEU 12 0.274 2.383 0.206
18 HD21 LEU 12 HD21 LEU 12 -0.762 0.011 -2.652
19 HD22 LEU 12 HD22 LEU 12 -1.353 -0.547 -1.086
20 HD23 LEU 12 HD23 LEU 12 0.054 -1.315 -1.822
21 H ASP 13 H ASP 13 2.450 2.025 -4.117
22 HA ASP 13 HA ASP 13 3.948 4.505 -3.953
23 HB2 ASP 13 HB2 ASP 13 5.120 2.114 -5.021
24 HB3 ASP 13 HB3 ASP 13 4.900 3.281 -6.322
25 H VAL 14 H VAL 14 2.158 5.666 -4.511
26 HA VAL 14 HA VAL 14 0.536 4.913 -6.783
27 HB VAL 14 HB VAL 14 -0.687 7.035 -6.299
28 HG11 VAL 14 HG11 VAL 14 -0.282 5.030 -4.093
29 HG12 VAL 14 HG12 VAL 14 -1.533 6.274 -4.045
30 HG13 VAL 14 HG13 VAL 14 -1.546 5.057 -5.323
31 HG21 VAL 14 HG21 VAL 14 1.665 7.636 -4.864
32 HG22 VAL 14 HG22 VAL 14 0.218 8.628 -5.042
33 HG23 VAL 14 HG23 VAL 14 0.360 7.511 -3.684
34 H GLY 15 H GLY 15 2.915 5.128 -7.866
35 HA2 GLY 15 HA2 GLY 15 2.848 7.736 -9.248
36 HA3 GLY 15 HA3 GLY 15 4.366 7.008 -8.746
37 H LYS 16 H LYS 16 3.391 7.756 -11.427
38 HA LYS 16 HA LYS 16 3.268 5.123 -12.721
39 HB2 LYS 16 HB2 LYS 16 1.971 7.611 -13.225
40 HB3 LYS 16 HB3 LYS 16 2.994 7.241 -14.607
41 HG2 LYS 16 HG2 LYS 16 1.329 5.974 -15.344
42 HG3 LYS 16 HG3 LYS 16 1.744 4.839 -14.058
43 HD2 LYS 16 HD2 LYS 16 0.225 6.383 -12.598
44 HD3 LYS 16 HD3 LYS 16 -0.432 6.887 -14.157
45 HE2 LYS 16 HE2 LYS 16 -0.600 4.313 -14.583
46 HE3 LYS 16 HE3 LYS 16 -0.532 4.216 -12.824
47 HZ1 LYS 16 HZ1 LYS 16 -2.748 4.446 -13.043
48 HZ2 LYS 16 HZ2 LYS 16 -2.650 5.216 -14.545
49 HZ3 LYS 16 HZ3 LYS 16 -2.378 6.095 -13.126
50 H HIS 17 H HIS 17 4.815 4.442 -14.129
51 HA HIS 17 HA HIS 17 7.315 5.938 -14.125
52 HB2 HIS 17 HB2 HIS 17 6.838 3.218 -15.339
53 HB3 HIS 17 HB3 HIS 17 8.370 3.924 -14.832
54 HD1 HIS 17 HD1 HIS 17 5.140 2.640 -13.314
55 HD2 HIS 17 HD2 HIS 17 9.110 3.306 -12.284
56 HE1 HIS 17 HE1 HIS 17 5.411 1.665 -11.011
57 H CYS 18 H CYS 18 8.282 6.799 -15.900
58 HA CYS 18 HA CYS 18 6.785 7.716 -18.025
59 HB2 CYS 18 HB2 CYS 18 9.104 8.468 -17.272
60 HB3 CYS 18 HB3 CYS 18 9.738 7.137 -18.234
61 H ALA 19 H ALA 19 6.578 7.124 -20.201
62 HA ALA 19 HA ALA 19 6.848 4.243 -20.669
63 HB1 ALA 19 HB1 ALA 19 5.440 5.404 -22.796
64 HB2 ALA 19 HB2 ALA 19 4.787 4.446 -21.467
65 HB3 ALA 19 HB3 ALA 19 4.861 6.203 -21.334
66 H TYR 20 H TYR 20 8.912 6.533 -20.982
67 HA TYR 20 HA TYR 20 9.823 5.684 -23.647
68 HB2 TYR 20 HB2 TYR 20 8.892 8.015 -23.681
69 HB3 TYR 20 HB3 TYR 20 10.153 8.480 -22.545
70 HD1 TYR 20 HD1 TYR 20 11.621 9.869 -23.678
71 HD2 TYR 20 HD2 TYR 20 10.270 6.313 -25.583
72 HE1 TYR 20 HE1 TYR 20 13.156 10.296 -25.552
73 HE2 TYR 20 HE2 TYR 20 11.802 6.729 -27.461
74 HH TYR 20 HH TYR 20 13.768 9.671 -27.610
75 H CYS 21 H CYS 21 10.687 6.961 -20.471
76 HA CYS 21 HA CYS 21 13.397 5.862 -20.839
77 HB2 CYS 21 HB2 CYS 21 14.293 7.568 -19.499
78 HB3 CYS 21 HB3 CYS 21 13.111 8.399 -20.506
79 H ARG 22 H ARG 22 10.486 5.605 -19.145
80 HA ARG 22 HA ARG 22 9.787 4.288 -17.427
81 HB2 ARG 22 HB2 ARG 22 12.492 2.967 -17.699
82 HB3 ARG 22 HB3 ARG 22 11.081 2.297 -16.892
83 HG2 ARG 22 HG2 ARG 22 10.844 3.062 -19.755
84 HG3 ARG 22 HG3 ARG 22 11.727 1.592 -19.338
85 HD2 ARG 22 HD2 ARG 22 9.199 1.843 -17.915
86 HD3 ARG 22 HD3 ARG 22 8.999 1.817 -19.667
87 HE ARG 22 HE ARG 22 9.832 -0.359 -17.982
88 HH11 ARG 22 HH11 ARG 22 9.892 0.959 -21.204
89 HH12 ARG 22 HH12 ARG 22 10.141 -0.576 -21.968
90 HH21 ARG 22 HH21 ARG 22 10.160 -2.386 -18.976
91 HH22 ARG 22 HH22 ARG 22 10.292 -2.478 -20.700
92 H GLN 23 H GLN 23 10.166 6.476 -16.328
93 HA GLN 23 HA GLN 23 12.082 6.116 -14.118
94 HB2 GLN 23 HB2 GLN 23 12.808 7.986 -15.410
95 HB3 GLN 23 HB3 GLN 23 11.177 8.636 -15.506
96 HG2 GLN 23 HG2 GLN 23 11.212 9.405 -13.327
97 HG3 GLN 23 HG3 GLN 23 12.510 8.309 -12.854
98 HE21 GLN 23 HE21 GLN 23 14.645 8.740 -13.730
99 HE22 GLN 23 HE22 GLN 23 15.110 10.373 -14.047
100 H LEU 24 H LEU 24 11.128 5.713 -12.246
101 HA LEU 24 HA LEU 24 8.347 5.928 -11.825
102 HB2 LEU 24 HB2 LEU 24 9.572 4.304 -10.600
103 HB3 LEU 24 HB3 LEU 24 10.660 5.525 -9.945
104 HG LEU 24 HG LEU 24 8.045 6.208 -9.114
105 HD11 LEU 24 HD11 LEU 24 7.863 3.972 -7.690
106 HD12 LEU 24 HD12 LEU 24 8.578 3.295 -9.152
107 HD13 LEU 24 HD13 LEU 24 7.051 4.172 -9.243
108 HD21 LEU 24 HD21 LEU 24 10.623 5.387 -7.911
109 HD22 LEU 24 HD22 LEU 24 9.192 5.306 -6.884
110 HD23 LEU 24 HD23 LEU 24 9.651 6.833 -7.638
111 H ASP 25 H ASP 25 7.326 7.824 -11.780
112 HA ASP 25 HA ASP 25 8.492 9.989 -10.153
113 HB2 ASP 25 HB2 ASP 25 8.186 10.243 -12.757
114 HB3 ASP 25 HB3 ASP 25 6.509 10.555 -12.321
115 H PHE 26 H PHE 26 6.983 11.368 -9.035
116 HA PHE 26 HA PHE 26 4.754 9.854 -7.969
117 HB2 PHE 26 HB2 PHE 26 5.616 12.640 -7.185
118 HB3 PHE 26 HB3 PHE 26 4.653 11.507 -6.242
119 HD1 PHE 26 HD1 PHE 26 8.027 12.266 -7.489
120 HD2 PHE 26 HD2 PHE 26 5.674 9.795 -4.945
121 HE1 PHE 26 HE1 PHE 26 10.075 11.432 -6.411
122 HE2 PHE 26 HE2 PHE 26 7.719 8.957 -3.862
123 HZ PHE 26 HZ PHE 26 9.923 9.775 -4.596
124 H LEU 27 H LEU 27 5.298 12.810 -9.811
125 HA LEU 27 HA LEU 27 2.388 13.074 -10.168
126 HB2 LEU 27 HB2 LEU 27 4.528 14.987 -9.744
127 HB3 LEU 27 HB3 LEU 27 3.567 15.374 -11.170
128 HG LEU 27 HG LEU 27 2.342 14.896 -8.463
129 HD11 LEU 27 HD11 LEU 27 3.683 16.738 -8.018
130 HD12 LEU 27 HD12 LEU 27 2.155 17.465 -8.515
131 HD13 LEU 27 HD13 LEU 27 3.505 17.388 -9.648
132 HD21 LEU 27 HD21 LEU 27 0.406 15.200 -9.504
133 HD22 LEU 27 HD22 LEU 27 1.274 15.174 -11.039
134 HD23 LEU 27 HD23 LEU 27 0.974 16.708 -10.221
135 HA PRO 28 HA PRO 28 3.892 11.535 -14.235
136 HB2 PRO 28 HB2 PRO 28 1.651 10.094 -14.753
137 HB3 PRO 28 HB3 PRO 28 2.995 9.467 -13.792
138 HG2 PRO 28 HG2 PRO 28 0.399 10.644 -12.877
139 HG3 PRO 28 HG3 PRO 28 1.256 9.215 -12.269
140 HD2 PRO 28 HD2 PRO 28 1.354 11.614 -11.018
141 HD3 PRO 28 HD3 PRO 28 2.714 10.472 -11.002
142 H PHE 29 H PHE 29 3.628 12.735 -16.005
143 HA PHE 29 HA PHE 29 1.426 14.603 -16.170
144 HB2 PHE 29 HB2 PHE 29 3.983 14.182 -17.657
145 HB3 PHE 29 HB3 PHE 29 2.698 15.100 -18.435
146 HD1 PHE 29 HD1 PHE 29 2.126 17.297 -17.703
147 HD2 PHE 29 HD2 PHE 29 5.024 15.001 -15.594
148 HE1 PHE 29 HE1 PHE 29 2.819 19.310 -16.470
149 HE2 PHE 29 HE2 PHE 29 5.721 17.010 -14.357
150 HZ PHE 29 HZ PHE 29 4.619 19.169 -14.795
151 H HIS 30 H HIS 30 -0.469 13.842 -16.858
152 HA HIS 30 HA HIS 30 -0.626 11.672 -18.761
153 HB2 HIS 30 HB2 HIS 30 -2.222 11.734 -16.927
154 HB3 HIS 30 HB3 HIS 30 -2.782 13.325 -17.432
155 HD1 HIS 30 HD1 HIS 30 -3.035 9.698 -18.289
156 HD2 HIS 30 HD2 HIS 30 -4.538 13.337 -19.615
157 HE1 HIS 30 HE1 HIS 30 -4.904 9.118 -19.868
158 H CYS 31 H CYS 31 -0.627 11.930 -20.886
159 HA CYS 31 HA CYS 31 -0.953 14.572 -22.033
160 HB2 CYS 31 HB2 CYS 31 0.700 12.558 -22.684
161 HB3 CYS 31 HB3 CYS 31 -0.628 12.192 -23.780
162 H SER 32 H SER 32 -2.722 15.321 -23.013
163 HA SER 32 HA SER 32 -5.052 13.573 -23.179
164 HB2 SER 32 HB2 SER 32 -4.660 16.312 -22.553
165 HB3 SER 32 HB3 SER 32 -5.622 16.250 -24.030
166 HG SER 32 HG SER 32 -6.704 16.111 -21.840
167 H PHE 33 H PHE 33 -2.694 13.631 -25.102
168 HA PHE 33 HA PHE 33 -4.256 14.048 -27.566
169 HB2 PHE 33 HB2 PHE 33 -1.247 14.107 -27.442
170 HB3 PHE 33 HB3 PHE 33 -2.301 14.712 -28.716
171 HD1 PHE 33 HD1 PHE 33 -4.254 16.267 -27.154
172 HD2 PHE 33 HD2 PHE 33 -0.025 15.961 -26.777
173 HE1 PHE 33 HE1 PHE 33 -4.185 18.511 -26.146
174 HE2 PHE 33 HE2 PHE 33 0.050 18.203 -25.767
175 HZ PHE 33 HZ PHE 33 -2.031 19.482 -25.452
176 H CYS 34 H CYS 34 -1.671 12.108 -26.092
177 HA CYS 34 HA CYS 34 -2.286 9.948 -27.991
178 HB2 CYS 34 HB2 CYS 34 -0.088 9.025 -27.413
179 HB3 CYS 34 HB3 CYS 34 0.054 10.683 -27.987
180 H ASN 35 H ASN 35 -2.613 10.909 -24.750
181 HA ASN 35 HA ASN 35 -3.556 9.901 -22.939
182 HB2 ASN 35 HB2 ASN 35 -4.931 8.830 -24.946
183 HB3 ASN 35 HB3 ASN 35 -4.095 7.370 -24.423
184 HD21 ASN 35 HD21 ASN 35 -4.716 6.368 -22.585
185 HD22 ASN 35 HD22 ASN 35 -6.038 6.884 -21.600
186 H GLU 36 H GLU 36 -1.017 9.880 -22.677
187 HA GLU 36 HA GLU 36 -0.385 7.254 -21.587
188 HB2 GLU 36 HB2 GLU 36 1.269 8.664 -23.672
189 HB3 GLU 36 HB3 GLU 36 1.966 7.479 -22.577
190 HG2 GLU 36 HG2 GLU 36 -0.258 6.195 -23.571
191 HG3 GLU 36 HG3 GLU 36 0.353 7.097 -24.957
192 H ASP 37 H ASP 37 1.276 7.290 -19.991
193 HA ASP 37 HA ASP 37 1.548 9.919 -18.731
194 HB2 ASP 37 HB2 ASP 37 2.222 7.222 -17.547
195 HB3 ASP 37 HB3 ASP 37 2.027 8.748 -16.689
196 H PHE 38 H PHE 38 3.502 10.834 -18.232
197 HA PHE 38 HA PHE 38 5.964 9.397 -18.783
198 HB2 PHE 38 HB2 PHE 38 5.321 11.968 -20.242
199 HB3 PHE 38 HB3 PHE 38 6.817 11.046 -20.358
200 HD1 PHE 38 HD1 PHE 38 6.714 8.712 -21.329
201 HD2 PHE 38 HD2 PHE 38 3.506 11.493 -21.629
202 HE1 PHE 38 HE1 PHE 38 5.773 7.420 -23.199
203 HE2 PHE 38 HE2 PHE 38 2.559 10.205 -23.499
204 HZ PHE 38 HZ PHE 38 3.693 8.165 -24.286
205 H CYS 39 H CYS 39 7.639 10.088 -17.555
206 HA CYS 39 HA CYS 39 7.243 11.555 -15.264
207 HB2 CYS 39 HB2 CYS 39 9.589 11.519 -14.944
208 HB3 CYS 39 HB3 CYS 39 9.220 10.064 -15.866
209 H SER 40 H SER 40 8.114 13.646 -14.604
210 HA SER 40 HA SER 40 7.148 15.764 -16.097
211 HB2 SER 40 HB2 SER 40 9.474 16.139 -14.231
212 HB3 SER 40 HB3 SER 40 8.076 17.184 -14.484
213 HG SER 40 HG SER 40 8.152 15.813 -12.504
214 H ASN 41 H ASN 41 10.351 14.317 -16.093
215 HA ASN 41 HA ASN 41 11.702 16.285 -17.566
216 HB2 ASN 41 HB2 ASN 41 12.354 13.833 -16.440
217 HB3 ASN 41 HB3 ASN 41 12.587 13.572 -18.166
218 HD21 ASN 41 HD21 ASN 41 14.040 14.574 -15.394
219 HD22 ASN 41 HD22 ASN 41 15.336 15.498 -16.066
220 H HIS 42 H HIS 42 9.513 13.760 -18.533
221 HA HIS 42 HA HIS 42 9.925 14.517 -21.352
222 HB2 HIS 42 HB2 HIS 42 9.121 11.877 -20.135
223 HB3 HIS 42 HB3 HIS 42 8.892 12.238 -21.843
224 HD2 HIS 42 HD2 HIS 42 11.536 13.053 -23.058
225 HE1 HIS 42 HE1 HIS 42 13.554 10.313 -20.524
226 HE2 HIS 42 HE2 HIS 42 13.716 11.740 -22.595
227 H ARG 43 H ARG 43 8.128 15.613 -19.174
228 HA ARG 43 HA ARG 43 5.466 14.915 -19.613
229 HB2 ARG 43 HB2 ARG 43 4.899 17.088 -18.655
230 HB3 ARG 43 HB3 ARG 43 6.202 16.330 -17.749
231 HG2 ARG 43 HG2 ARG 43 7.761 17.744 -19.236
232 HG3 ARG 43 HG3 ARG 43 6.309 18.683 -19.589
233 HD2 ARG 43 HD2 ARG 43 6.840 18.091 -16.743
234 HD3 ARG 43 HD3 ARG 43 7.951 19.210 -17.532
235 HE ARG 43 HE ARG 43 5.191 19.838 -17.994
236 HH11 ARG 43 HH11 ARG 43 7.867 20.207 -15.800
237 HH12 ARG 43 HH12 ARG 43 7.255 21.665 -15.091
238 HH21 ARG 43 HH21 ARG 43 4.374 21.757 -17.070
239 HH22 ARG 43 HH22 ARG 43 5.267 22.545 -15.814
240 H LEU 44 H LEU 44 7.552 17.179 -21.332
241 HA LEU 44 HA LEU 44 5.702 18.504 -22.897
242 HB2 LEU 44 HB2 LEU 44 8.393 17.554 -23.856
243 HB3 LEU 44 HB3 LEU 44 7.479 18.941 -24.443
244 HG LEU 44 HG LEU 44 8.688 18.708 -21.688
245 HD11 LEU 44 HD11 LEU 44 10.539 19.802 -22.402
246 HD12 LEU 44 HD12 LEU 44 9.680 20.653 -23.686
247 HD13 LEU 44 HD13 LEU 44 10.144 18.966 -23.904
248 HD21 LEU 44 HD21 LEU 44 6.584 20.210 -22.309
249 HD22 LEU 44 HD22 LEU 44 7.854 21.284 -22.897
250 HD23 LEU 44 HD23 LEU 44 7.848 20.765 -21.211
251 H LYS 45 H LYS 45 5.346 18.214 -25.278
252 HA LYS 45 HA LYS 45 4.189 15.649 -25.751
253 HB2 LYS 45 HB2 LYS 45 4.081 18.270 -26.930
254 HB3 LYS 45 HB3 LYS 45 4.328 17.066 -28.188
255 HG2 LYS 45 HG2 LYS 45 2.368 15.903 -26.704
256 HG3 LYS 45 HG3 LYS 45 1.974 17.616 -26.541
257 HD2 LYS 45 HD2 LYS 45 2.516 16.293 -29.192
258 HD3 LYS 45 HD3 LYS 45 0.902 16.423 -28.490
259 HE2 LYS 45 HE2 LYS 45 2.707 18.781 -29.000
260 HE3 LYS 45 HE3 LYS 45 1.490 18.215 -30.143
261 HZ1 LYS 45 HZ1 LYS 45 -0.216 18.626 -28.502
262 HZ2 LYS 45 HZ2 LYS 45 0.677 20.038 -28.764
263 HZ3 LYS 45 HZ3 LYS 45 0.939 19.119 -27.368
264 H GLU 46 H GLU 46 6.670 17.441 -27.592
265 HA GLU 46 HA GLU 46 7.480 15.315 -29.196
266 HB2 GLU 46 HB2 GLU 46 9.431 16.613 -29.716
267 HB3 GLU 46 HB3 GLU 46 8.073 17.716 -29.542
268 HG2 GLU 46 HG2 GLU 46 8.900 17.983 -27.113
269 HG3 GLU 46 HG3 GLU 46 10.403 17.293 -27.721
270 H ASP 47 H ASP 47 8.304 16.110 -25.910
271 HA ASP 47 HA ASP 47 10.669 14.764 -25.515
272 HB2 ASP 47 HB2 ASP 47 8.400 15.562 -23.836
273 HB3 ASP 47 HB3 ASP 47 9.279 14.166 -23.218
274 H HIS 48 H HIS 48 7.392 13.396 -25.207
275 HA HIS 48 HA HIS 48 8.533 10.706 -25.189
276 HB2 HIS 48 HB2 HIS 48 6.268 9.965 -24.592
277 HB3 HIS 48 HB3 HIS 48 6.838 11.221 -23.497
278 HD1 HIS 48 HD1 HIS 48 5.422 13.279 -23.284
279 HD2 HIS 48 HD2 HIS 48 4.304 10.901 -26.502
280 HE1 HIS 48 HE1 HIS 48 3.282 14.279 -24.147
281 H HIS 49 H HIS 49 8.308 12.552 -27.583
282 HA HIS 49 HA HIS 49 7.750 12.460 -29.793
283 HB2 HIS 49 HB2 HIS 49 7.942 9.507 -29.172
284 HB3 HIS 49 HB3 HIS 49 7.867 10.174 -30.800
285 HD1 HIS 49 HD1 HIS 49 9.928 11.817 -31.431
286 HD2 HIS 49 HD2 HIS 49 10.450 9.350 -28.129
287 HE1 HIS 49 HE1 HIS 49 12.407 11.771 -31.011
288 H CYS 50 H CYS 50 5.566 13.154 -28.557
289 HA CYS 50 HA CYS 50 3.341 11.522 -28.498
290 HB2 CYS 50 HB2 CYS 50 3.599 13.979 -27.764
291 HB3 CYS 50 HB3 CYS 50 3.185 14.382 -29.427
292 H ARG 51 H ARG 51 2.197 10.480 -29.985
293 HA ARG 51 HA ARG 51 2.881 10.313 -32.659
294 HB2 ARG 51 HB2 ARG 51 0.530 9.374 -32.954
295 HB3 ARG 51 HB3 ARG 51 1.559 8.573 -31.774
296 HG2 ARG 51 HG2 ARG 51 0.369 9.419 -29.971
297 HG3 ARG 51 HG3 ARG 51 -0.343 10.720 -30.929
298 HD2 ARG 51 HD2 ARG 51 -1.314 8.600 -32.256
299 HD3 ARG 51 HD3 ARG 51 -1.161 7.893 -30.648
300 HE ARG 51 HE ARG 51 -2.464 10.436 -30.606
301 HH11 ARG 51 HH11 ARG 51 -2.932 7.037 -31.194
302 HH12 ARG 51 HH12 ARG 51 -4.622 7.071 -30.815
303 HH21 ARG 51 HH21 ARG 51 -4.689 10.494 -30.105
304 HH22 ARG 51 HH22 ARG 51 -5.621 9.038 -30.197
305 H TRP 52 H TRP 52 0.624 12.482 -31.064
306 HA TRP 52 HA TRP 52 -0.670 13.501 -33.330
307 HB2 TRP 52 HB2 TRP 52 -1.270 13.858 -30.874
308 HB3 TRP 52 HB3 TRP 52 -0.039 15.118 -30.863
309 HD1 TRP 52 HD1 TRP 52 -3.577 14.408 -32.006
310 HE1 TRP 52 HE1 TRP 52 -4.614 16.569 -32.944
311 HE3 TRP 52 HE3 TRP 52 0.614 17.333 -32.131
312 HZ2 TRP 52 HZ2 TRP 52 -3.767 19.169 -33.645
313 HZ3 TRP 52 HZ3 TRP 52 0.415 19.644 -32.950
314 HH2 TRP 52 HH2 TRP 52 -1.731 20.541 -33.691
315 H LEU 53 H LEU 53 2.346 14.443 -31.755
316 HA LEU 53 HA LEU 53 2.815 16.772 -33.277
317 HB2 LEU 53 HB2 LEU 53 4.239 15.153 -31.346
318 HB3 LEU 53 HB3 LEU 53 5.311 15.740 -32.616
319 HG LEU 53 HG LEU 53 3.595 17.434 -30.802
320 HD11 LEU 53 HD11 LEU 53 5.619 18.119 -29.769
321 HD12 LEU 53 HD12 LEU 53 6.595 17.266 -30.964
322 HD13 LEU 53 HD13 LEU 53 5.629 16.356 -29.802
323 HD21 LEU 53 HD21 LEU 53 5.286 19.158 -31.969
324 HD22 LEU 53 HD22 LEU 53 3.669 18.818 -32.587
325 HD23 LEU 53 HD23 LEU 53 5.071 18.012 -33.292
326 H LEU 54 H LEU 54 3.622 13.383 -33.783
327 HA LEU 54 HA LEU 54 5.297 13.821 -36.044
328 HB2 LEU 54 HB2 LEU 54 3.792 11.280 -35.579
329 HB3 LEU 54 HB3 LEU 54 5.406 11.510 -36.249
330 HG LEU 54 HG LEU 54 4.604 11.761 -33.351
331 HD11 LEU 54 HD11 LEU 54 6.337 9.878 -33.206
332 HD12 LEU 54 HD12 LEU 54 6.086 9.697 -34.942
333 HD13 LEU 54 HD13 LEU 54 4.735 9.484 -33.828
334 HD21 LEU 54 HD21 LEU 54 6.334 13.174 -33.222
335 HD22 LEU 54 HD22 LEU 54 6.920 12.752 -34.831
336 HD23 LEU 54 HD23 LEU 54 7.338 11.741 -33.447
337 H GLU 55 H GLU 55 1.965 12.578 -35.752
338 HA GLU 55 HA GLU 55 1.426 12.463 -38.496
339 HB2 GLU 55 HB2 GLU 55 -0.906 12.310 -37.885
340 HB3 GLU 55 HB3 GLU 55 0.050 11.380 -36.740
341 HG2 GLU 55 HG2 GLU 55 -0.032 13.415 -35.235
342 HG3 GLU 55 HG3 GLU 55 -1.264 14.045 -36.327
343 H HIS 56 H HIS 56 1.161 15.098 -36.188
344 HA HIS 56 HA HIS 56 0.640 16.923 -38.435
345 HB2 HIS 56 HB2 HIS 56 -0.985 16.485 -36.045
346 HB3 HIS 56 HB3 HIS 56 -0.540 18.174 -36.270
347 HD1 HIS 56 HD1 HIS 56 -1.469 19.372 -38.381
348 HD2 HIS 56 HD2 HIS 56 -2.802 15.467 -37.896
349 HE1 HIS 56 HE1 HIS 56 -3.403 19.120 -39.968
350 H GLU 57 H GLU 57 2.875 17.397 -38.465
351 HA GLU 57 HA GLU 57 4.261 18.322 -36.151
352 HB2 GLU 57 HB2 GLU 57 5.040 18.887 -39.007
353 HB3 GLU 57 HB3 GLU 57 6.089 18.761 -37.602
354 HG2 GLU 57 HG2 GLU 57 4.932 16.303 -37.630
355 HG3 GLU 57 HG3 GLU 57 5.018 16.674 -39.351
356 H GLU 58 H GLU 58 2.926 19.962 -35.296
357 HA GLU 58 HA GLU 58 1.990 22.196 -36.687
358 HB2 GLU 58 HB2 GLU 58 1.919 23.290 -34.424
359 HB3 GLU 58 HB3 GLU 58 1.104 21.736 -34.522
360 HG2 GLU 58 HG2 GLU 58 2.915 20.638 -33.416
361 HG3 GLU 58 HG3 GLU 58 3.900 22.099 -33.477
362 H VAL 59 H VAL 59 2.759 24.507 -35.932
363 HA VAL 59 HA VAL 59 5.625 24.654 -36.577
364 HB VAL 59 HB VAL 59 4.063 25.756 -38.167
365 HG11 VAL 59 HG11 VAL 59 2.816 26.657 -35.848
366 HG12 VAL 59 HG12 VAL 59 3.552 28.097 -36.555
367 HG13 VAL 59 HG13 VAL 59 2.433 27.119 -37.506
368 HG21 VAL 59 HG21 VAL 59 5.592 27.342 -38.633
369 HG22 VAL 59 HG22 VAL 59 5.507 28.049 -37.020
370 HG23 VAL 59 HG23 VAL 59 6.481 26.606 -37.300
Start of MODEL 8
1 H MET 11 H MET 11 -4.648 -1.312 -3.552
2 HA MET 11 HA MET 11 -3.061 -1.631 -5.902
3 HB2 MET 11 HB2 MET 11 -4.141 0.825 -4.515
4 HB3 MET 11 HB3 MET 11 -3.280 0.871 -6.048
5 HG2 MET 11 HG2 MET 11 -5.032 0.072 -7.214
6 HG3 MET 11 HG3 MET 11 -5.558 -0.988 -5.909
7 HE1 MET 11 HE1 MET 11 -8.309 -0.335 -6.062
8 HE2 MET 11 HE2 MET 11 -7.393 -0.723 -4.606
9 HE3 MET 11 HE3 MET 11 -8.533 0.624 -4.598
10 H LEU 12 H LEU 12 -0.924 -1.604 -6.054
11 HA LEU 12 HA LEU 12 0.617 -0.171 -3.992
12 HB2 LEU 12 HB2 LEU 12 1.726 -2.560 -5.397
13 HB3 LEU 12 HB3 LEU 12 2.171 -1.874 -3.836
14 HG LEU 12 HG LEU 12 -0.433 -2.722 -3.454
15 HD11 LEU 12 HD11 LEU 12 0.314 -3.985 -5.754
16 HD12 LEU 12 HD12 LEU 12 -0.895 -4.576 -4.615
17 HD13 LEU 12 HD13 LEU 12 0.764 -5.165 -4.523
18 HD21 LEU 12 HD21 LEU 12 2.276 -3.754 -2.752
19 HD22 LEU 12 HD22 LEU 12 0.854 -4.710 -2.335
20 HD23 LEU 12 HD23 LEU 12 1.026 -3.068 -1.714
21 H ASP 13 H ASP 13 1.368 1.602 -4.963
22 HA ASP 13 HA ASP 13 3.230 1.383 -7.111
23 HB2 ASP 13 HB2 ASP 13 0.542 1.690 -7.875
24 HB3 ASP 13 HB3 ASP 13 1.277 3.278 -8.072
25 H VAL 14 H VAL 14 4.698 2.539 -5.977
26 HA VAL 14 HA VAL 14 3.972 4.999 -4.643
27 HB VAL 14 HB VAL 14 6.404 5.129 -4.094
28 HG11 VAL 14 HG11 VAL 14 6.353 2.858 -2.788
29 HG12 VAL 14 HG12 VAL 14 5.215 4.146 -2.390
30 HG13 VAL 14 HG13 VAL 14 4.697 2.788 -3.389
31 HG21 VAL 14 HG21 VAL 14 7.915 3.912 -5.177
32 HG22 VAL 14 HG22 VAL 14 7.071 2.420 -4.765
33 HG23 VAL 14 HG23 VAL 14 6.628 3.311 -6.221
34 H GLY 15 H GLY 15 3.281 5.506 -7.122
35 HA2 GLY 15 HA2 GLY 15 3.698 7.565 -8.314
36 HA3 GLY 15 HA3 GLY 15 5.419 7.285 -8.098
37 H LYS 16 H LYS 16 4.276 7.884 -10.575
38 HA LYS 16 HA LYS 16 4.303 5.322 -12.010
39 HB2 LYS 16 HB2 LYS 16 2.764 7.697 -12.296
40 HB3 LYS 16 HB3 LYS 16 3.749 7.524 -13.743
41 HG2 LYS 16 HG2 LYS 16 1.983 6.292 -14.413
42 HG3 LYS 16 HG3 LYS 16 2.851 5.019 -13.552
43 HD2 LYS 16 HD2 LYS 16 1.486 5.857 -11.498
44 HD3 LYS 16 HD3 LYS 16 0.426 6.561 -12.721
45 HE2 LYS 16 HE2 LYS 16 -0.138 4.476 -13.602
46 HE3 LYS 16 HE3 LYS 16 1.257 3.685 -12.870
47 HZ1 LYS 16 HZ1 LYS 16 -0.335 3.005 -11.435
48 HZ2 LYS 16 HZ2 LYS 16 -1.329 4.347 -11.697
49 HZ3 LYS 16 HZ3 LYS 16 0.022 4.480 -10.688
50 H HIS 17 H HIS 17 5.887 4.805 -13.413
51 HA HIS 17 HA HIS 17 8.207 6.558 -13.518
52 HB2 HIS 17 HB2 HIS 17 7.962 3.815 -14.749
53 HB3 HIS 17 HB3 HIS 17 9.432 4.671 -14.292
54 HD1 HIS 17 HD1 HIS 17 6.422 3.033 -12.670
55 HD2 HIS 17 HD2 HIS 17 10.333 4.115 -11.782
56 HE1 HIS 17 HE1 HIS 17 6.885 2.069 -10.394
57 H CYS 18 H CYS 18 8.997 7.530 -15.324
58 HA CYS 18 HA CYS 18 7.319 8.306 -17.367
59 HB2 CYS 18 HB2 CYS 18 9.572 9.296 -16.721
60 HB3 CYS 18 HB3 CYS 18 10.305 8.029 -17.699
61 H ALA 19 H ALA 19 7.078 7.718 -19.543
62 HA ALA 19 HA ALA 19 7.592 4.879 -20.054
63 HB1 ALA 19 HB1 ALA 19 6.012 5.922 -22.119
64 HB2 ALA 19 HB2 ALA 19 5.492 4.908 -20.773
65 HB3 ALA 19 HB3 ALA 19 5.419 6.664 -20.633
66 H TYR 20 H TYR 20 9.447 7.327 -20.407
67 HA TYR 20 HA TYR 20 10.321 6.595 -23.119
68 HB2 TYR 20 HB2 TYR 20 9.187 8.951 -22.759
69 HB3 TYR 20 HB3 TYR 20 10.771 9.379 -22.123
70 HD1 TYR 20 HD1 TYR 20 12.593 9.796 -23.573
71 HD2 TYR 20 HD2 TYR 20 9.004 8.116 -25.123
72 HE1 TYR 20 HE1 TYR 20 13.415 10.165 -25.861
73 HE2 TYR 20 HE2 TYR 20 9.817 8.480 -27.416
74 HH TYR 20 HH TYR 20 13.011 9.193 -28.141
75 H CYS 21 H CYS 21 11.250 8.052 -20.020
76 HA CYS 21 HA CYS 21 13.999 7.098 -20.478
77 HB2 CYS 21 HB2 CYS 21 14.816 8.868 -19.140
78 HB3 CYS 21 HB3 CYS 21 13.594 9.601 -20.175
79 H ARG 22 H ARG 22 11.192 6.615 -18.681
80 HA ARG 22 HA ARG 22 10.666 5.274 -16.921
81 HB2 ARG 22 HB2 ARG 22 13.230 4.164 -17.912
82 HB3 ARG 22 HB3 ARG 22 12.736 3.667 -16.299
83 HG2 ARG 22 HG2 ARG 22 10.559 3.508 -18.207
84 HG3 ARG 22 HG3 ARG 22 11.948 2.529 -18.684
85 HD2 ARG 22 HD2 ARG 22 11.899 1.750 -16.199
86 HD3 ARG 22 HD3 ARG 22 10.237 2.337 -16.240
87 HE ARG 22 HE ARG 22 11.282 -0.019 -17.525
88 HH11 ARG 22 HH11 ARG 22 8.744 2.364 -17.506
89 HH12 ARG 22 HH12 ARG 22 7.602 1.343 -18.316
90 HH21 ARG 22 HH21 ARG 22 9.788 -1.372 -18.591
91 HH22 ARG 22 HH22 ARG 22 8.196 -0.782 -18.931
92 H GLN 23 H GLN 23 10.830 7.423 -15.785
93 HA GLN 23 HA GLN 23 12.908 7.299 -13.699
94 HB2 GLN 23 HB2 GLN 23 11.880 9.555 -15.308
95 HB3 GLN 23 HB3 GLN 23 12.107 9.884 -13.595
96 HG2 GLN 23 HG2 GLN 23 14.433 9.188 -13.756
97 HG3 GLN 23 HG3 GLN 23 14.212 8.821 -15.466
98 HE21 GLN 23 HE21 GLN 23 16.097 10.640 -14.344
99 HE22 GLN 23 HE22 GLN 23 15.727 12.211 -14.959
100 H LEU 24 H LEU 24 12.066 6.633 -11.845
101 HA LEU 24 HA LEU 24 9.323 6.563 -11.252
102 HB2 LEU 24 HB2 LEU 24 11.234 5.205 -10.238
103 HB3 LEU 24 HB3 LEU 24 11.499 6.591 -9.183
104 HG LEU 24 HG LEU 24 8.845 5.188 -9.329
105 HD11 LEU 24 HD11 LEU 24 9.462 3.792 -7.513
106 HD12 LEU 24 HD12 LEU 24 11.020 4.599 -7.336
107 HD13 LEU 24 HD13 LEU 24 10.702 3.598 -8.753
108 HD21 LEU 24 HD21 LEU 24 9.061 6.121 -6.839
109 HD22 LEU 24 HD22 LEU 24 8.426 7.090 -8.169
110 HD23 LEU 24 HD23 LEU 24 10.104 7.282 -7.660
111 H ASP 25 H ASP 25 8.153 8.384 -11.176
112 HA ASP 25 HA ASP 25 9.150 10.589 -9.493
113 HB2 ASP 25 HB2 ASP 25 8.587 10.798 -12.118
114 HB3 ASP 25 HB3 ASP 25 6.989 11.126 -11.452
115 H PHE 26 H PHE 26 7.435 11.876 -8.423
116 HA PHE 26 HA PHE 26 5.457 10.073 -7.265
117 HB2 PHE 26 HB2 PHE 26 6.040 12.906 -6.407
118 HB3 PHE 26 HB3 PHE 26 5.281 11.625 -5.468
119 HD1 PHE 26 HD1 PHE 26 8.460 12.849 -6.855
120 HD2 PHE 26 HD2 PHE 26 6.578 10.017 -4.294
121 HE1 PHE 26 HE1 PHE 26 10.653 12.243 -5.919
122 HE2 PHE 26 HE2 PHE 26 8.769 9.407 -3.354
123 HZ PHE 26 HZ PHE 26 10.810 10.520 -4.167
124 H LEU 27 H LEU 27 5.647 13.129 -9.016
125 HA LEU 27 HA LEU 27 2.714 13.120 -9.266
126 HB2 LEU 27 HB2 LEU 27 4.674 15.214 -8.844
127 HB3 LEU 27 HB3 LEU 27 3.642 15.551 -10.233
128 HG LEU 27 HG LEU 27 2.448 14.815 -7.584
129 HD11 LEU 27 HD11 LEU 27 3.525 16.610 -6.739
130 HD12 LEU 27 HD12 LEU 27 2.234 17.485 -7.560
131 HD13 LEU 27 HD13 LEU 27 3.814 17.324 -8.325
132 HD21 LEU 27 HD21 LEU 27 0.999 16.778 -8.984
133 HD22 LEU 27 HD22 LEU 27 0.577 15.082 -8.745
134 HD23 LEU 27 HD23 LEU 27 1.491 15.572 -10.172
135 HA PRO 28 HA PRO 28 4.192 11.852 -13.433
136 HB2 PRO 28 HB2 PRO 28 2.064 10.240 -13.925
137 HB3 PRO 28 HB3 PRO 28 3.490 9.701 -13.031
138 HG2 PRO 28 HG2 PRO 28 0.838 10.622 -11.991
139 HG3 PRO 28 HG3 PRO 28 1.834 9.254 -11.461
140 HD2 PRO 28 HD2 PRO 28 1.774 11.613 -10.132
141 HD3 PRO 28 HD3 PRO 28 3.225 10.592 -10.200
142 H PHE 29 H PHE 29 3.763 13.076 -15.153
143 HA PHE 29 HA PHE 29 1.377 14.723 -15.186
144 HB2 PHE 29 HB2 PHE 29 3.903 14.636 -16.810
145 HB3 PHE 29 HB3 PHE 29 2.513 15.560 -17.371
146 HD1 PHE 29 HD1 PHE 29 1.973 17.654 -16.430
147 HD2 PHE 29 HD2 PHE 29 4.970 15.220 -14.640
148 HE1 PHE 29 HE1 PHE 29 2.652 19.543 -15.008
149 HE2 PHE 29 HE2 PHE 29 5.654 17.104 -13.214
150 HZ PHE 29 HZ PHE 29 4.494 19.269 -13.396
151 H HIS 30 H HIS 30 -0.427 13.763 -15.881
152 HA HIS 30 HA HIS 30 -0.386 11.676 -17.862
153 HB2 HIS 30 HB2 HIS 30 -2.006 11.556 -16.058
154 HB3 HIS 30 HB3 HIS 30 -2.680 13.117 -16.516
155 HD1 HIS 30 HD1 HIS 30 -2.649 9.513 -17.500
156 HD2 HIS 30 HD2 HIS 30 -4.415 13.072 -18.714
157 HE1 HIS 30 HE1 HIS 30 -4.455 8.849 -19.118
158 H CYS 31 H CYS 31 -0.531 11.914 -19.990
159 HA CYS 31 HA CYS 31 -0.934 14.560 -21.105
160 HB2 CYS 31 HB2 CYS 31 0.793 12.719 -21.836
161 HB3 CYS 31 HB3 CYS 31 -0.561 12.105 -22.780
162 H SER 32 H SER 32 -2.714 15.273 -22.113
163 HA SER 32 HA SER 32 -5.047 13.526 -22.149
164 HB2 SER 32 HB2 SER 32 -4.781 16.127 -21.409
165 HB3 SER 32 HB3 SER 32 -5.327 16.319 -23.074
166 HG SER 32 HG SER 32 -7.195 15.323 -22.596
167 H PHE 33 H PHE 33 -2.708 13.552 -24.137
168 HA PHE 33 HA PHE 33 -4.338 13.821 -26.578
169 HB2 PHE 33 HB2 PHE 33 -1.551 14.587 -25.963
170 HB3 PHE 33 HB3 PHE 33 -1.793 13.809 -27.524
171 HD1 PHE 33 HD1 PHE 33 -4.307 15.929 -25.877
172 HD2 PHE 33 HD2 PHE 33 -1.289 15.702 -28.870
173 HE1 PHE 33 HE1 PHE 33 -5.084 18.066 -26.817
174 HE2 PHE 33 HE2 PHE 33 -2.061 17.839 -29.814
175 HZ PHE 33 HZ PHE 33 -3.960 19.024 -28.788
176 H CYS 34 H CYS 34 -1.716 11.957 -25.071
177 HA CYS 34 HA CYS 34 -2.382 9.704 -26.842
178 HB2 CYS 34 HB2 CYS 34 -0.156 8.821 -26.304
179 HB3 CYS 34 HB3 CYS 34 -0.049 10.446 -26.974
180 H ASN 35 H ASN 35 -2.558 10.827 -23.635
181 HA ASN 35 HA ASN 35 -3.420 9.911 -21.737
182 HB2 ASN 35 HB2 ASN 35 -4.884 8.744 -23.627
183 HB3 ASN 35 HB3 ASN 35 -4.027 7.311 -23.066
184 HD21 ASN 35 HD21 ASN 35 -4.680 6.339 -21.255
185 HD22 ASN 35 HD22 ASN 35 -5.913 6.935 -20.202
186 H GLU 36 H GLU 36 -0.872 9.898 -21.593
187 HA GLU 36 HA GLU 36 -0.183 7.302 -20.448
188 HB2 GLU 36 HB2 GLU 36 1.393 8.716 -22.590
189 HB3 GLU 36 HB3 GLU 36 2.143 7.565 -21.493
190 HG2 GLU 36 HG2 GLU 36 -0.079 6.220 -22.418
191 HG3 GLU 36 HG3 GLU 36 0.494 7.105 -23.830
192 H ASP 37 H ASP 37 1.702 7.408 -19.021
193 HA ASP 37 HA ASP 37 1.816 10.006 -17.677
194 HB2 ASP 37 HB2 ASP 37 2.720 7.279 -16.727
195 HB3 ASP 37 HB3 ASP 37 2.736 8.756 -15.767
196 H PHE 38 H PHE 38 3.707 11.097 -17.292
197 HA PHE 38 HA PHE 38 6.246 9.946 -18.091
198 HB2 PHE 38 HB2 PHE 38 5.173 12.431 -19.445
199 HB3 PHE 38 HB3 PHE 38 6.785 11.758 -19.660
200 HD1 PHE 38 HD1 PHE 38 6.967 9.406 -20.623
201 HD2 PHE 38 HD2 PHE 38 3.406 11.732 -20.783
202 HE1 PHE 38 HE1 PHE 38 6.136 8.001 -22.464
203 HE2 PHE 38 HE2 PHE 38 2.569 10.330 -22.624
204 HZ PHE 38 HZ PHE 38 3.934 8.461 -23.466
205 H CYS 39 H CYS 39 7.930 10.781 -16.973
206 HA CYS 39 HA CYS 39 7.562 12.173 -14.627
207 HB2 CYS 39 HB2 CYS 39 9.915 12.342 -14.469
208 HB3 CYS 39 HB3 CYS 39 9.622 10.882 -15.407
209 H SER 40 H SER 40 8.270 14.328 -13.989
210 HA SER 40 HA SER 40 7.013 16.361 -15.385
211 HB2 SER 40 HB2 SER 40 7.800 17.795 -13.753
212 HB3 SER 40 HB3 SER 40 8.006 16.245 -12.939
213 HG SER 40 HG SER 40 9.867 18.055 -13.602
214 H ASN 41 H ASN 41 10.328 15.219 -15.600
215 HA ASN 41 HA ASN 41 11.392 17.333 -17.115
216 HB2 ASN 41 HB2 ASN 41 12.392 15.025 -16.018
217 HB3 ASN 41 HB3 ASN 41 12.470 14.673 -17.742
218 HD21 ASN 41 HD21 ASN 41 13.784 16.458 -15.138
219 HD22 ASN 41 HD22 ASN 41 15.038 17.254 -16.021
220 H HIS 42 H HIS 42 9.381 14.640 -17.976
221 HA HIS 42 HA HIS 42 9.561 15.442 -20.807
222 HB2 HIS 42 HB2 HIS 42 9.112 12.719 -19.588
223 HB3 HIS 42 HB3 HIS 42 8.754 13.071 -21.276
224 HD2 HIS 42 HD2 HIS 42 11.266 14.276 -22.540
225 HE1 HIS 42 HE1 HIS 42 13.630 11.565 -20.289
226 HE2 HIS 42 HE2 HIS 42 13.575 13.144 -22.252
227 H ARG 43 H ARG 43 7.791 16.317 -18.510
228 HA ARG 43 HA ARG 43 5.195 15.338 -18.819
229 HB2 ARG 43 HB2 ARG 43 4.457 17.422 -17.773
230 HB3 ARG 43 HB3 ARG 43 5.873 16.776 -16.954
231 HG2 ARG 43 HG2 ARG 43 7.203 18.378 -18.477
232 HG3 ARG 43 HG3 ARG 43 5.648 19.177 -18.720
233 HD2 ARG 43 HD2 ARG 43 6.177 18.600 -15.922
234 HD3 ARG 43 HD3 ARG 43 7.422 19.620 -16.643
235 HE ARG 43 HE ARG 43 4.690 20.338 -16.098
236 HH11 ARG 43 HH11 ARG 43 7.515 21.033 -18.010
237 HH12 ARG 43 HH12 ARG 43 7.057 22.673 -18.328
238 HH21 ARG 43 HH21 ARG 43 4.075 22.496 -16.510
239 HH22 ARG 43 HH22 ARG 43 5.101 23.504 -17.473
240 H LEU 44 H LEU 44 6.924 17.864 -20.573
241 HA LEU 44 HA LEU 44 4.836 18.988 -22.005
242 HB2 LEU 44 HB2 LEU 44 7.567 18.454 -23.145
243 HB3 LEU 44 HB3 LEU 44 6.458 19.759 -23.562
244 HG LEU 44 HG LEU 44 7.965 19.460 -20.965
245 HD11 LEU 44 HD11 LEU 44 8.276 21.702 -22.912
246 HD12 LEU 44 HD12 LEU 44 9.138 20.185 -23.169
247 HD13 LEU 44 HD13 LEU 44 9.402 21.109 -21.690
248 HD21 LEU 44 HD21 LEU 44 5.970 21.508 -21.907
249 HD22 LEU 44 HD22 LEU 44 7.080 21.778 -20.564
250 HD23 LEU 44 HD23 LEU 44 5.881 20.488 -20.472
251 H LYS 45 H LYS 45 4.494 18.735 -24.417
252 HA LYS 45 HA LYS 45 3.667 16.043 -24.934
253 HB2 LYS 45 HB2 LYS 45 3.155 18.667 -26.021
254 HB3 LYS 45 HB3 LYS 45 3.479 17.524 -27.318
255 HG2 LYS 45 HG2 LYS 45 1.749 16.183 -25.595
256 HG3 LYS 45 HG3 LYS 45 1.128 17.833 -25.685
257 HD2 LYS 45 HD2 LYS 45 1.880 16.262 -28.137
258 HD3 LYS 45 HD3 LYS 45 0.269 16.177 -27.420
259 HE2 LYS 45 HE2 LYS 45 1.646 18.662 -28.435
260 HE3 LYS 45 HE3 LYS 45 0.327 17.804 -29.229
261 HZ1 LYS 45 HZ1 LYS 45 -0.893 19.341 -28.150
262 HZ2 LYS 45 HZ2 LYS 45 0.261 19.596 -26.940
263 HZ3 LYS 45 HZ3 LYS 45 -0.766 18.254 -26.859
264 H GLU 46 H GLU 46 5.785 18.244 -26.786
265 HA GLU 46 HA GLU 46 6.819 16.352 -28.530
266 HB2 GLU 46 HB2 GLU 46 7.320 19.069 -27.890
267 HB3 GLU 46 HB3 GLU 46 8.871 18.241 -27.888
268 HG2 GLU 46 HG2 GLU 46 7.611 17.296 -30.162
269 HG3 GLU 46 HG3 GLU 46 7.179 19.004 -30.105
270 H ASP 47 H ASP 47 7.590 16.964 -25.205
271 HA ASP 47 HA ASP 47 10.127 15.939 -24.935
272 HB2 ASP 47 HB2 ASP 47 7.740 16.069 -23.170
273 HB3 ASP 47 HB3 ASP 47 9.039 14.986 -22.676
274 H HIS 48 H HIS 48 7.082 14.094 -24.766
275 HA HIS 48 HA HIS 48 8.608 11.610 -25.039
276 HB2 HIS 48 HB2 HIS 48 6.499 10.485 -24.447
277 HB3 HIS 48 HB3 HIS 48 6.957 11.681 -23.238
278 HD1 HIS 48 HD1 HIS 48 5.456 13.770 -23.007
279 HD2 HIS 48 HD2 HIS 48 4.151 11.051 -25.864
280 HE1 HIS 48 HE1 HIS 48 3.111 14.473 -23.583
281 H HIS 49 H HIS 49 7.934 13.653 -27.203
282 HA HIS 49 HA HIS 49 7.200 13.709 -29.368
283 HB2 HIS 49 HB2 HIS 49 8.316 10.940 -29.025
284 HB3 HIS 49 HB3 HIS 49 7.660 11.458 -30.575
285 HD1 HIS 49 HD1 HIS 49 8.780 14.373 -30.538
286 HD2 HIS 49 HD2 HIS 49 10.977 10.956 -29.670
287 HE1 HIS 49 HE1 HIS 49 11.179 14.989 -30.971
288 H CYS 50 H CYS 50 4.991 13.811 -28.132
289 HA CYS 50 HA CYS 50 3.197 11.724 -28.033
290 HB2 CYS 50 HB2 CYS 50 2.976 14.260 -27.371
291 HB3 CYS 50 HB3 CYS 50 2.252 14.406 -28.969
292 H ARG 51 H ARG 51 1.922 10.648 -29.449
293 HA ARG 51 HA ARG 51 2.639 10.374 -32.103
294 HB2 ARG 51 HB2 ARG 51 0.501 9.201 -32.412
295 HB3 ARG 51 HB3 ARG 51 1.300 8.713 -30.923
296 HG2 ARG 51 HG2 ARG 51 -0.229 10.622 -29.910
297 HG3 ARG 51 HG3 ARG 51 -1.213 10.232 -31.322
298 HD2 ARG 51 HD2 ARG 51 -0.257 8.273 -29.237
299 HD3 ARG 51 HD3 ARG 51 -1.887 8.933 -29.358
300 HE ARG 51 HE ARG 51 -0.813 6.769 -30.853
301 HH11 ARG 51 HH11 ARG 51 -2.993 9.475 -31.066
302 HH12 ARG 51 HH12 ARG 51 -3.974 8.755 -32.299
303 HH21 ARG 51 HH21 ARG 51 -2.096 5.810 -32.476
304 HH22 ARG 51 HH22 ARG 51 -3.463 6.670 -33.100
305 H TRP 52 H TRP 52 0.214 12.492 -30.664
306 HA TRP 52 HA TRP 52 -1.054 13.376 -32.979
307 HB2 TRP 52 HB2 TRP 52 -1.692 13.855 -30.563
308 HB3 TRP 52 HB3 TRP 52 -0.477 15.130 -30.591
309 HD1 TRP 52 HD1 TRP 52 -3.991 14.330 -31.741
310 HE1 TRP 52 HE1 TRP 52 -5.038 16.432 -32.796
311 HE3 TRP 52 HE3 TRP 52 0.174 17.287 -31.964
312 HZ2 TRP 52 HZ2 TRP 52 -4.208 19.002 -33.614
313 HZ3 TRP 52 HZ3 TRP 52 -0.038 19.553 -32.898
314 HH2 TRP 52 HH2 TRP 52 -2.184 20.391 -33.706
315 H LEU 53 H LEU 53 1.898 14.548 -31.418
316 HA LEU 53 HA LEU 53 2.314 16.777 -33.085
317 HB2 LEU 53 HB2 LEU 53 3.781 15.315 -31.057
318 HB3 LEU 53 HB3 LEU 53 4.837 15.886 -32.348
319 HG LEU 53 HG LEU 53 2.948 17.716 -30.889
320 HD11 LEU 53 HD11 LEU 53 5.138 18.399 -29.698
321 HD12 LEU 53 HD12 LEU 53 5.681 16.775 -30.119
322 HD13 LEU 53 HD13 LEU 53 4.248 16.992 -29.115
323 HD21 LEU 53 HD21 LEU 53 3.648 18.811 -32.792
324 HD22 LEU 53 HD22 LEU 53 5.227 18.024 -32.795
325 HD23 LEU 53 HD23 LEU 53 4.880 19.303 -31.629
326 H LEU 54 H LEU 54 3.194 13.389 -33.399
327 HA LEU 54 HA LEU 54 4.904 13.732 -35.648
328 HB2 LEU 54 HB2 LEU 54 3.415 11.201 -35.084
329 HB3 LEU 54 HB3 LEU 54 5.038 11.415 -35.736
330 HG LEU 54 HG LEU 54 4.182 11.799 -32.869
331 HD11 LEU 54 HD11 LEU 54 5.617 9.652 -34.364
332 HD12 LEU 54 HD12 LEU 54 4.370 9.521 -33.124
333 HD13 LEU 54 HD13 LEU 54 6.018 9.957 -32.673
334 HD21 LEU 54 HD21 LEU 54 6.775 11.945 -32.643
335 HD22 LEU 54 HD22 LEU 54 5.846 13.380 -33.079
336 HD23 LEU 54 HD23 LEU 54 6.702 12.470 -34.325
337 H GLU 55 H GLU 55 1.579 12.474 -35.356
338 HA GLU 55 HA GLU 55 1.107 12.243 -38.114
339 HB2 GLU 55 HB2 GLU 55 -1.256 12.090 -37.528
340 HB3 GLU 55 HB3 GLU 55 -0.281 11.136 -36.418
341 HG2 GLU 55 HG2 GLU 55 -0.364 13.154 -34.870
342 HG3 GLU 55 HG3 GLU 55 -1.642 13.759 -35.921
343 H HIS 56 H HIS 56 0.699 14.925 -35.880
344 HA HIS 56 HA HIS 56 0.095 16.659 -38.181
345 HB2 HIS 56 HB2 HIS 56 -1.372 16.317 -35.662
346 HB3 HIS 56 HB3 HIS 56 -1.016 17.996 -36.056
347 HD1 HIS 56 HD1 HIS 56 -2.470 19.089 -37.775
348 HD2 HIS 56 HD2 HIS 56 -2.914 14.958 -37.715
349 HE1 HIS 56 HE1 HIS 56 -4.401 18.598 -39.309
350 H GLU 57 H GLU 57 2.267 17.254 -38.382
351 HA GLU 57 HA GLU 57 3.427 18.706 -36.104
352 HB2 GLU 57 HB2 GLU 57 5.576 18.502 -37.403
353 HB3 GLU 57 HB3 GLU 57 4.899 16.983 -36.832
354 HG2 GLU 57 HG2 GLU 57 4.850 16.181 -38.889
355 HG3 GLU 57 HG3 GLU 57 3.880 17.547 -39.439
356 H GLU 58 H GLU 58 2.729 20.766 -36.241
357 HA GLU 58 HA GLU 58 2.552 22.111 -38.801
358 HB2 GLU 58 HB2 GLU 58 1.590 23.950 -37.584
359 HB3 GLU 58 HB3 GLU 58 0.858 22.459 -37.010
360 HG2 GLU 58 HG2 GLU 58 2.447 22.501 -35.092
361 HG3 GLU 58 HG3 GLU 58 2.976 24.092 -35.636
362 H VAL 59 H VAL 59 3.560 24.247 -39.119
363 HA VAL 59 HA VAL 59 6.261 24.316 -37.941
364 HB VAL 59 HB VAL 59 5.392 25.381 -40.632
365 HG11 VAL 59 HG11 VAL 59 7.196 26.701 -40.010
366 HG12 VAL 59 HG12 VAL 59 7.995 25.382 -39.152
367 HG13 VAL 59 HG13 VAL 59 7.963 25.397 -40.916
368 HG21 VAL 59 HG21 VAL 59 5.581 23.284 -41.350
369 HG22 VAL 59 HG22 VAL 59 7.300 23.373 -40.968
370 HG23 VAL 59 HG23 VAL 59 6.164 22.736 -39.779
Start of MODEL 9
1 H MET 11 H MET 11 3.991 -0.616 3.130
2 HA MET 11 HA MET 11 3.652 1.641 2.131
3 HB2 MET 11 HB2 MET 11 5.534 -0.370 1.223
4 HB3 MET 11 HB3 MET 11 5.180 0.795 -0.046
5 HG2 MET 11 HG2 MET 11 5.659 2.588 1.696
6 HG3 MET 11 HG3 MET 11 6.346 1.290 2.669
7 HE1 MET 11 HE1 MET 11 8.021 3.916 1.726
8 HE2 MET 11 HE2 MET 11 8.590 2.628 2.786
9 HE3 MET 11 HE3 MET 11 9.551 3.107 1.386
10 H LEU 12 H LEU 12 3.448 2.682 -0.079
11 HA LEU 12 HA LEU 12 1.593 1.243 -1.832
12 HB2 LEU 12 HB2 LEU 12 1.064 4.095 -1.089
13 HB3 LEU 12 HB3 LEU 12 -0.023 2.925 -1.834
14 HG LEU 12 HG LEU 12 0.918 2.765 1.026
15 HD11 LEU 12 HD11 LEU 12 -1.711 3.796 -0.025
16 HD12 LEU 12 HD12 LEU 12 -0.411 4.803 0.609
17 HD13 LEU 12 HD13 LEU 12 -1.229 3.653 1.665
18 HD21 LEU 12 HD21 LEU 12 -0.342 0.906 -0.670
19 HD22 LEU 12 HD22 LEU 12 -1.576 1.488 0.448
20 HD23 LEU 12 HD23 LEU 12 -0.082 0.786 1.070
21 H ASP 13 H ASP 13 2.505 1.248 -3.769
22 HA ASP 13 HA ASP 13 4.152 3.540 -4.572
23 HB2 ASP 13 HB2 ASP 13 3.982 0.980 -6.126
24 HB3 ASP 13 HB3 ASP 13 5.316 2.125 -6.013
25 H VAL 14 H VAL 14 1.867 4.549 -4.763
26 HA VAL 14 HA VAL 14 0.404 3.834 -7.148
27 HB VAL 14 HB VAL 14 -0.981 5.841 -6.599
28 HG11 VAL 14 HG11 VAL 14 -1.927 4.883 -4.504
29 HG12 VAL 14 HG12 VAL 14 -1.673 3.694 -5.783
30 HG13 VAL 14 HG13 VAL 14 -0.544 3.792 -4.431
31 HG21 VAL 14 HG21 VAL 14 -0.506 7.279 -4.908
32 HG22 VAL 14 HG22 VAL 14 0.304 6.048 -3.938
33 HG23 VAL 14 HG23 VAL 14 1.146 6.795 -5.296
34 H GLY 15 H GLY 15 2.782 4.263 -8.135
35 HA2 GLY 15 HA2 GLY 15 2.617 6.960 -9.330
36 HA3 GLY 15 HA3 GLY 15 4.156 6.255 -8.857
37 H LYS 16 H LYS 16 3.126 7.165 -11.493
38 HA LYS 16 HA LYS 16 3.174 4.636 -12.984
39 HB2 LYS 16 HB2 LYS 16 1.741 7.083 -13.312
40 HB3 LYS 16 HB3 LYS 16 2.782 6.863 -14.712
41 HG2 LYS 16 HG2 LYS 16 0.671 5.886 -15.203
42 HG3 LYS 16 HG3 LYS 16 1.831 4.575 -14.973
43 HD2 LYS 16 HD2 LYS 16 0.905 3.932 -12.959
44 HD3 LYS 16 HD3 LYS 16 0.206 5.524 -12.653
45 HE2 LYS 16 HE2 LYS 16 -1.723 4.891 -13.555
46 HE3 LYS 16 HE3 LYS 16 -0.911 4.439 -15.053
47 HZ1 LYS 16 HZ1 LYS 16 -2.169 2.725 -13.399
48 HZ2 LYS 16 HZ2 LYS 16 -0.560 2.544 -12.912
49 HZ3 LYS 16 HZ3 LYS 16 -0.989 2.284 -14.528
50 H HIS 17 H HIS 17 4.754 4.164 -14.445
51 HA HIS 17 HA HIS 17 7.167 5.789 -14.296
52 HB2 HIS 17 HB2 HIS 17 6.851 3.160 -15.741
53 HB3 HIS 17 HB3 HIS 17 8.336 3.903 -15.154
54 HD1 HIS 17 HD1 HIS 17 5.173 2.310 -13.799
55 HD2 HIS 17 HD2 HIS 17 9.086 3.115 -12.656
56 HE1 HIS 17 HE1 HIS 17 5.478 1.157 -11.585
57 H CYS 18 H CYS 18 8.076 6.865 -15.978
58 HA CYS 18 HA CYS 18 6.532 7.856 -18.037
59 HB2 CYS 18 HB2 CYS 18 8.787 8.700 -17.195
60 HB3 CYS 18 HB3 CYS 18 9.520 7.499 -18.253
61 H ALA 19 H ALA 19 6.381 7.437 -20.257
62 HA ALA 19 HA ALA 19 6.847 4.630 -20.961
63 HB1 ALA 19 HB1 ALA 19 5.388 5.888 -23.003
64 HB2 ALA 19 HB2 ALA 19 4.790 4.763 -21.783
65 HB3 ALA 19 HB3 ALA 19 4.738 6.500 -21.482
66 H TYR 20 H TYR 20 8.763 7.062 -21.048
67 HA TYR 20 HA TYR 20 9.753 6.503 -23.760
68 HB2 TYR 20 HB2 TYR 20 8.649 8.797 -23.488
69 HB3 TYR 20 HB3 TYR 20 10.017 9.211 -22.461
70 HD1 TYR 20 HD1 TYR 20 11.856 10.210 -23.439
71 HD2 TYR 20 HD2 TYR 20 9.314 7.793 -25.847
72 HE1 TYR 20 HE1 TYR 20 13.169 10.820 -25.427
73 HE2 TYR 20 HE2 TYR 20 10.621 8.395 -27.842
74 HH TYR 20 HH TYR 20 12.228 9.724 -28.659
75 H CYS 21 H CYS 21 10.503 7.561 -20.476
76 HA CYS 21 HA CYS 21 13.283 6.674 -20.896
77 HB2 CYS 21 HB2 CYS 21 14.045 8.303 -19.382
78 HB3 CYS 21 HB3 CYS 21 12.833 9.144 -20.343
79 H ARG 22 H ARG 22 10.377 6.089 -19.263
80 HA ARG 22 HA ARG 22 9.751 4.576 -17.684
81 HB2 ARG 22 HB2 ARG 22 12.535 3.454 -18.041
82 HB3 ARG 22 HB3 ARG 22 11.161 2.627 -17.319
83 HG2 ARG 22 HG2 ARG 22 10.760 3.632 -20.058
84 HG3 ARG 22 HG3 ARG 22 11.922 2.317 -19.873
85 HD2 ARG 22 HD2 ARG 22 9.544 1.823 -18.318
86 HD3 ARG 22 HD3 ARG 22 9.140 2.116 -20.009
87 HE ARG 22 HE ARG 22 11.176 0.352 -20.170
88 HH11 ARG 22 HH11 ARG 22 8.193 0.383 -18.377
89 HH12 ARG 22 HH12 ARG 22 8.022 -1.341 -18.378
90 HH21 ARG 22 HH21 ARG 22 10.963 -1.919 -20.178
91 HH22 ARG 22 HH22 ARG 22 9.599 -2.650 -19.402
92 H GLN 23 H GLN 23 9.999 6.685 -16.395
93 HA GLN 23 HA GLN 23 11.907 6.232 -14.196
94 HB2 GLN 23 HB2 GLN 23 12.548 8.243 -15.308
95 HB3 GLN 23 HB3 GLN 23 10.886 8.814 -15.372
96 HG2 GLN 23 HG2 GLN 23 10.845 9.286 -13.073
97 HG3 GLN 23 HG3 GLN 23 12.314 8.358 -12.775
98 HE21 GLN 23 HE21 GLN 23 14.286 9.185 -13.884
99 HE22 GLN 23 HE22 GLN 23 14.497 10.898 -13.962
100 H LEU 24 H LEU 24 10.956 5.618 -12.380
101 HA LEU 24 HA LEU 24 8.163 5.655 -11.986
102 HB2 LEU 24 HB2 LEU 24 9.503 3.994 -10.907
103 HB3 LEU 24 HB3 LEU 24 10.453 5.226 -10.079
104 HG LEU 24 HG LEU 24 8.454 5.834 -8.760
105 HD11 LEU 24 HD11 LEU 24 6.420 5.129 -9.290
106 HD12 LEU 24 HD12 LEU 24 6.938 3.445 -9.235
107 HD13 LEU 24 HD13 LEU 24 7.103 4.368 -10.728
108 HD21 LEU 24 HD21 LEU 24 10.181 3.806 -8.343
109 HD22 LEU 24 HD22 LEU 24 8.650 2.930 -8.307
110 HD23 LEU 24 HD23 LEU 24 8.923 4.277 -7.200
111 H ASP 25 H ASP 25 7.055 7.495 -11.798
112 HA ASP 25 HA ASP 25 8.099 9.562 -9.974
113 HB2 ASP 25 HB2 ASP 25 7.317 9.789 -12.682
114 HB3 ASP 25 HB3 ASP 25 6.071 10.591 -11.730
115 H PHE 26 H PHE 26 6.520 10.757 -8.744
116 HA PHE 26 HA PHE 26 4.387 9.036 -7.806
117 HB2 PHE 26 HB2 PHE 26 5.096 11.796 -6.806
118 HB3 PHE 26 HB3 PHE 26 4.190 10.547 -5.957
119 HD1 PHE 26 HD1 PHE 26 7.525 11.557 -7.137
120 HD2 PHE 26 HD2 PHE 26 5.293 8.804 -4.779
121 HE1 PHE 26 HE1 PHE 26 9.611 10.745 -6.117
122 HE2 PHE 26 HE2 PHE 26 7.376 7.988 -3.755
123 HZ PHE 26 HZ PHE 26 9.539 8.959 -4.422
124 H LEU 27 H LEU 27 4.745 12.163 -9.398
125 HA LEU 27 HA LEU 27 1.823 12.276 -9.739
126 HB2 LEU 27 HB2 LEU 27 3.841 14.274 -9.151
127 HB3 LEU 27 HB3 LEU 27 2.862 14.718 -10.547
128 HG LEU 27 HG LEU 27 1.613 13.916 -7.935
129 HD11 LEU 27 HD11 LEU 27 1.724 16.774 -8.480
130 HD12 LEU 27 HD12 LEU 27 3.306 16.064 -8.162
131 HD13 LEU 27 HD13 LEU 27 2.008 15.892 -6.980
132 HD21 LEU 27 HD21 LEU 27 -0.338 14.640 -8.831
133 HD22 LEU 27 HD22 LEU 27 0.479 14.213 -10.335
134 HD23 LEU 27 HD23 LEU 27 0.440 15.893 -9.798
135 HA PRO 28 HA PRO 28 3.402 11.170 -13.917
136 HB2 PRO 28 HB2 PRO 28 1.245 9.651 -14.558
137 HB3 PRO 28 HB3 PRO 28 2.625 9.025 -13.648
138 HG2 PRO 28 HG2 PRO 28 -0.032 9.972 -12.645
139 HG3 PRO 28 HG3 PRO 28 0.907 8.549 -12.156
140 HD2 PRO 28 HD2 PRO 28 0.871 10.838 -10.710
141 HD3 PRO 28 HD3 PRO 28 2.293 9.779 -10.785
142 H PHE 29 H PHE 29 3.063 12.491 -15.585
143 HA PHE 29 HA PHE 29 0.710 14.192 -15.613
144 HB2 PHE 29 HB2 PHE 29 3.334 14.180 -17.056
145 HB3 PHE 29 HB3 PHE 29 1.988 15.100 -17.720
146 HD1 PHE 29 HD1 PHE 29 1.281 17.139 -16.734
147 HD2 PHE 29 HD2 PHE 29 4.247 14.749 -14.836
148 HE1 PHE 29 HE1 PHE 29 1.802 19.001 -15.213
149 HE2 PHE 29 HE2 PHE 29 4.773 16.607 -13.311
150 HZ PHE 29 HZ PHE 29 3.551 18.736 -13.499
151 H HIS 30 H HIS 30 -1.078 13.463 -16.547
152 HA HIS 30 HA HIS 30 -0.973 11.449 -18.622
153 HB2 HIS 30 HB2 HIS 30 -2.691 11.275 -16.901
154 HB3 HIS 30 HB3 HIS 30 -3.316 12.864 -17.333
155 HD1 HIS 30 HD1 HIS 30 -3.703 9.328 -18.074
156 HD2 HIS 30 HD2 HIS 30 -4.476 12.913 -20.026
157 HE1 HIS 30 HE1 HIS 30 -5.304 8.753 -19.926
158 H CYS 31 H CYS 31 -0.983 11.833 -20.733
159 HA CYS 31 HA CYS 31 -1.274 14.555 -21.688
160 HB2 CYS 31 HB2 CYS 31 0.467 12.743 -22.441
161 HB3 CYS 31 HB3 CYS 31 -0.838 12.200 -23.491
162 H SER 32 H SER 32 -2.986 15.373 -22.727
163 HA SER 32 HA SER 32 -5.336 13.674 -23.030
164 HB2 SER 32 HB2 SER 32 -4.841 16.543 -22.634
165 HB3 SER 32 HB3 SER 32 -6.128 16.192 -23.788
166 HG SER 32 HG SER 32 -5.969 15.604 -21.053
167 H PHE 33 H PHE 33 -2.892 13.792 -24.874
168 HA PHE 33 HA PHE 33 -4.367 14.291 -27.376
169 HB2 PHE 33 HB2 PHE 33 -1.604 14.928 -26.545
170 HB3 PHE 33 HB3 PHE 33 -1.773 14.280 -28.174
171 HD1 PHE 33 HD1 PHE 33 -4.333 16.334 -26.515
172 HD2 PHE 33 HD2 PHE 33 -1.141 16.260 -29.330
173 HE1 PHE 33 HE1 PHE 33 -5.001 18.559 -27.327
174 HE2 PHE 33 HE2 PHE 33 -1.804 18.484 -30.146
175 HZ PHE 33 HZ PHE 33 -3.735 19.637 -29.144
176 H CYS 34 H CYS 34 -1.885 12.245 -25.869
177 HA CYS 34 HA CYS 34 -2.498 10.152 -27.845
178 HB2 CYS 34 HB2 CYS 34 -0.329 9.167 -27.244
179 HB3 CYS 34 HB3 CYS 34 -0.146 10.831 -27.789
180 H ASN 35 H ASN 35 -2.833 11.033 -24.574
181 HA ASN 35 HA ASN 35 -3.829 10.001 -22.806
182 HB2 ASN 35 HB2 ASN 35 -5.213 9.027 -24.850
183 HB3 ASN 35 HB3 ASN 35 -4.413 7.531 -24.377
184 HD21 ASN 35 HD21 ASN 35 -6.545 10.094 -23.309
185 HD22 ASN 35 HD22 ASN 35 -7.288 9.201 -22.030
186 H GLU 36 H GLU 36 -1.295 9.907 -22.516
187 HA GLU 36 HA GLU 36 -0.735 7.213 -21.539
188 HB2 GLU 36 HB2 GLU 36 0.984 8.740 -23.481
189 HB3 GLU 36 HB3 GLU 36 1.663 7.512 -22.421
190 HG2 GLU 36 HG2 GLU 36 -0.527 6.267 -23.559
191 HG3 GLU 36 HG3 GLU 36 0.156 7.221 -24.874
192 H ASP 37 H ASP 37 1.085 7.162 -20.014
193 HA ASP 37 HA ASP 37 1.160 9.639 -18.454
194 HB2 ASP 37 HB2 ASP 37 2.124 8.117 -16.668
195 HB3 ASP 37 HB3 ASP 37 0.463 7.779 -17.145
196 H PHE 38 H PHE 38 3.038 10.669 -17.894
197 HA PHE 38 HA PHE 38 5.602 9.544 -18.650
198 HB2 PHE 38 HB2 PHE 38 4.654 12.163 -19.833
199 HB3 PHE 38 HB3 PHE 38 6.248 11.446 -20.046
200 HD1 PHE 38 HD1 PHE 38 6.377 9.173 -21.197
201 HD2 PHE 38 HD2 PHE 38 2.923 11.657 -21.297
202 HE1 PHE 38 HE1 PHE 38 5.570 7.964 -23.182
203 HE2 PHE 38 HE2 PHE 38 2.109 10.451 -23.281
204 HZ PHE 38 HZ PHE 38 3.432 8.602 -24.226
205 H CYS 39 H CYS 39 7.220 10.232 -17.358
206 HA CYS 39 HA CYS 39 6.740 11.452 -14.939
207 HB2 CYS 39 HB2 CYS 39 9.083 11.542 -14.624
208 HB3 CYS 39 HB3 CYS 39 8.809 10.159 -15.680
209 H SER 40 H SER 40 7.453 13.530 -14.092
210 HA SER 40 HA SER 40 6.347 15.700 -15.410
211 HB2 SER 40 HB2 SER 40 8.538 16.477 -13.642
212 HB3 SER 40 HB3 SER 40 6.808 16.788 -13.493
213 HG SER 40 HG SER 40 6.698 15.224 -12.107
214 H ASN 41 H ASN 41 9.630 14.461 -15.502
215 HA ASN 41 HA ASN 41 10.857 16.655 -16.763
216 HB2 ASN 41 HB2 ASN 41 11.697 14.206 -15.807
217 HB3 ASN 41 HB3 ASN 41 11.927 14.045 -17.546
218 HD21 ASN 41 HD21 ASN 41 12.303 16.711 -15.233
219 HD22 ASN 41 HD22 ASN 41 13.929 17.091 -15.678
220 H HIS 42 H HIS 42 8.835 14.107 -17.968
221 HA HIS 42 HA HIS 42 9.226 15.126 -20.706
222 HB2 HIS 42 HB2 HIS 42 8.637 12.321 -19.759
223 HB3 HIS 42 HB3 HIS 42 8.432 12.826 -21.434
224 HD2 HIS 42 HD2 HIS 42 11.081 14.105 -22.333
225 HE1 HIS 42 HE1 HIS 42 13.163 11.080 -20.209
226 HE2 HIS 42 HE2 HIS 42 13.325 12.869 -21.976
227 H ARG 43 H ARG 43 7.321 15.851 -18.468
228 HA ARG 43 HA ARG 43 4.737 14.954 -19.018
229 HB2 ARG 43 HB2 ARG 43 3.967 16.982 -17.875
230 HB3 ARG 43 HB3 ARG 43 5.297 16.225 -17.008
231 HG2 ARG 43 HG2 ARG 43 6.786 17.894 -18.293
232 HG3 ARG 43 HG3 ARG 43 5.278 18.763 -18.586
233 HD2 ARG 43 HD2 ARG 43 4.906 19.088 -16.274
234 HD3 ARG 43 HD3 ARG 43 6.153 17.920 -15.836
235 HE ARG 43 HE ARG 43 7.538 19.800 -17.187
236 HH11 ARG 43 HH11 ARG 43 5.277 19.957 -14.544
237 HH12 ARG 43 HH12 ARG 43 5.998 21.367 -13.841
238 HH21 ARG 43 HH21 ARG 43 8.496 21.657 -16.270
239 HH22 ARG 43 HH22 ARG 43 7.827 22.334 -14.824
240 H LEU 44 H LEU 44 6.604 17.592 -20.441
241 HA LEU 44 HA LEU 44 4.643 18.865 -21.914
242 HB2 LEU 44 HB2 LEU 44 7.426 18.336 -22.926
243 HB3 LEU 44 HB3 LEU 44 6.377 19.697 -23.316
244 HG LEU 44 HG LEU 44 7.714 19.175 -20.662
245 HD11 LEU 44 HD11 LEU 44 8.260 21.074 -22.921
246 HD12 LEU 44 HD12 LEU 44 9.364 19.948 -22.133
247 HD13 LEU 44 HD13 LEU 44 8.816 21.390 -21.278
248 HD21 LEU 44 HD21 LEU 44 5.640 21.126 -21.544
249 HD22 LEU 44 HD22 LEU 44 6.855 21.636 -20.372
250 HD23 LEU 44 HD23 LEU 44 5.802 20.266 -20.012
251 H LYS 45 H LYS 45 4.449 18.804 -24.358
252 HA LYS 45 HA LYS 45 3.580 16.186 -25.125
253 HB2 LYS 45 HB2 LYS 45 3.212 18.897 -26.041
254 HB3 LYS 45 HB3 LYS 45 3.585 17.843 -27.398
255 HG2 LYS 45 HG2 LYS 45 1.712 16.440 -25.883
256 HG3 LYS 45 HG3 LYS 45 1.144 18.111 -25.900
257 HD2 LYS 45 HD2 LYS 45 2.013 16.683 -28.401
258 HD3 LYS 45 HD3 LYS 45 0.356 16.601 -27.796
259 HE2 LYS 45 HE2 LYS 45 1.864 19.104 -28.549
260 HE3 LYS 45 HE3 LYS 45 0.576 18.343 -29.482
261 HZ1 LYS 45 HZ1 LYS 45 0.411 19.964 -27.068
262 HZ2 LYS 45 HZ2 LYS 45 -0.669 18.667 -27.176
263 HZ3 LYS 45 HZ3 LYS 45 -0.656 19.859 -28.377
264 H GLU 46 H GLU 46 5.868 18.444 -26.681
265 HA GLU 46 HA GLU 46 6.957 16.646 -28.490
266 HB2 GLU 46 HB2 GLU 46 7.490 19.297 -27.629
267 HB3 GLU 46 HB3 GLU 46 9.015 18.423 -27.600
268 HG2 GLU 46 HG2 GLU 46 7.877 17.676 -30.002
269 HG3 GLU 46 HG3 GLU 46 7.467 19.384 -29.849
270 H ASP 47 H ASP 47 7.541 17.007 -25.091
271 HA ASP 47 HA ASP 47 10.029 15.889 -24.745
272 HB2 ASP 47 HB2 ASP 47 7.546 15.977 -23.117
273 HB3 ASP 47 HB3 ASP 47 8.779 14.819 -22.625
274 H HIS 48 H HIS 48 6.931 14.131 -24.881
275 HA HIS 48 HA HIS 48 8.403 11.626 -25.234
276 HB2 HIS 48 HB2 HIS 48 6.238 10.527 -24.842
277 HB3 HIS 48 HB3 HIS 48 6.643 11.635 -23.534
278 HD1 HIS 48 HD1 HIS 48 5.177 13.745 -23.270
279 HD2 HIS 48 HD2 HIS 48 3.999 11.238 -26.367
280 HE1 HIS 48 HE1 HIS 48 2.890 14.543 -23.948
281 H HIS 49 H HIS 49 7.919 13.830 -27.289
282 HA HIS 49 HA HIS 49 7.316 14.055 -29.484
283 HB2 HIS 49 HB2 HIS 49 8.292 11.210 -29.309
284 HB3 HIS 49 HB3 HIS 49 7.837 11.943 -30.845
285 HD1 HIS 49 HD1 HIS 49 9.707 13.005 -32.053
286 HD2 HIS 49 HD2 HIS 49 10.392 12.885 -27.957
287 HE1 HIS 49 HE1 HIS 49 12.013 13.955 -31.729
288 H CYS 50 H CYS 50 5.038 14.132 -28.383
289 HA CYS 50 HA CYS 50 3.195 12.093 -28.530
290 HB2 CYS 50 HB2 CYS 50 2.987 14.585 -27.721
291 HB3 CYS 50 HB3 CYS 50 2.376 14.854 -29.351
292 H ARG 51 H ARG 51 2.029 11.111 -30.090
293 HA ARG 51 HA ARG 51 2.897 11.015 -32.710
294 HB2 ARG 51 HB2 ARG 51 0.580 10.039 -33.182
295 HB3 ARG 51 HB3 ARG 51 1.563 9.225 -31.972
296 HG2 ARG 51 HG2 ARG 51 0.301 10.195 -30.192
297 HG3 ARG 51 HG3 ARG 51 -0.575 11.237 -31.315
298 HD2 ARG 51 HD2 ARG 51 -1.231 8.945 -32.420
299 HD3 ARG 51 HD3 ARG 51 -0.853 8.310 -30.819
300 HE ARG 51 HE ARG 51 -2.779 9.258 -30.031
301 HH11 ARG 51 HH11 ARG 51 -1.988 10.684 -33.107
302 HH12 ARG 51 HH12 ARG 51 -3.474 11.566 -33.228
303 HH21 ARG 51 HH21 ARG 51 -4.741 10.413 -30.179
304 HH22 ARG 51 HH22 ARG 51 -5.039 11.411 -31.562
305 H TRP 52 H TRP 52 0.316 12.982 -31.304
306 HA TRP 52 HA TRP 52 -0.744 14.046 -33.649
307 HB2 TRP 52 HB2 TRP 52 -1.634 14.286 -31.277
308 HB3 TRP 52 HB3 TRP 52 -0.463 15.585 -31.068
309 HD1 TRP 52 HD1 TRP 52 -3.818 14.814 -32.635
310 HE1 TRP 52 HE1 TRP 52 -4.822 16.979 -33.600
311 HE3 TRP 52 HE3 TRP 52 0.251 17.873 -32.170
312 HZ2 TRP 52 HZ2 TRP 52 -3.998 19.632 -34.097
313 HZ3 TRP 52 HZ3 TRP 52 0.060 20.210 -32.914
314 HH2 TRP 52 HH2 TRP 52 -2.021 21.070 -33.858
315 H LEU 53 H LEU 53 2.045 15.060 -31.741
316 HA LEU 53 HA LEU 53 2.551 17.477 -33.097
317 HB2 LEU 53 HB2 LEU 53 3.868 15.808 -31.135
318 HB3 LEU 53 HB3 LEU 53 5.023 16.499 -32.273
319 HG LEU 53 HG LEU 53 3.066 18.069 -30.594
320 HD11 LEU 53 HD11 LEU 53 5.356 18.862 -29.630
321 HD12 LEU 53 HD12 LEU 53 5.926 17.304 -30.228
322 HD13 LEU 53 HD13 LEU 53 4.617 17.369 -29.048
323 HD21 LEU 53 HD21 LEU 53 4.955 18.779 -32.768
324 HD22 LEU 53 HD22 LEU 53 4.845 19.874 -31.390
325 HD23 LEU 53 HD23 LEU 53 3.403 19.496 -32.333
326 H LEU 54 H LEU 54 3.500 14.154 -33.734
327 HA LEU 54 HA LEU 54 5.366 14.773 -35.795
328 HB2 LEU 54 HB2 LEU 54 3.899 12.173 -35.632
329 HB3 LEU 54 HB3 LEU 54 5.561 12.484 -36.128
330 HG LEU 54 HG LEU 54 4.484 12.532 -33.310
331 HD11 LEU 54 HD11 LEU 54 6.255 10.680 -33.123
332 HD12 LEU 54 HD12 LEU 54 6.152 10.601 -34.881
333 HD13 LEU 54 HD13 LEU 54 4.719 10.293 -33.900
334 HD21 LEU 54 HD21 LEU 54 6.207 14.246 -33.664
335 HD22 LEU 54 HD22 LEU 54 7.294 13.010 -34.299
336 HD23 LEU 54 HD23 LEU 54 6.773 12.946 -32.615
337 H GLU 55 H GLU 55 2.058 13.442 -35.890
338 HA GLU 55 HA GLU 55 1.787 13.514 -38.682
339 HB2 GLU 55 HB2 GLU 55 -0.605 13.263 -38.293
340 HB3 GLU 55 HB3 GLU 55 0.305 12.215 -37.213
341 HG2 GLU 55 HG2 GLU 55 0.063 14.080 -35.488
342 HG3 GLU 55 HG3 GLU 55 -1.163 14.744 -36.566
343 H HIS 56 H HIS 56 1.131 15.922 -36.201
344 HA HIS 56 HA HIS 56 0.551 17.871 -38.335
345 HB2 HIS 56 HB2 HIS 56 -0.785 17.334 -35.767
346 HB3 HIS 56 HB3 HIS 56 -0.472 19.037 -36.087
347 HD1 HIS 56 HD1 HIS 56 -2.121 20.199 -37.538
348 HD2 HIS 56 HD2 HIS 56 -2.328 16.068 -37.931
349 HE1 HIS 56 HE1 HIS 56 -4.104 19.763 -39.023
350 H GLU 57 H GLU 57 2.781 18.365 -38.539
351 HA GLU 57 HA GLU 57 4.236 19.361 -36.252
352 HB2 GLU 57 HB2 GLU 57 4.841 18.669 -39.040
353 HB3 GLU 57 HB3 GLU 57 5.728 20.064 -38.441
354 HG2 GLU 57 HG2 GLU 57 6.014 18.302 -36.385
355 HG3 GLU 57 HG3 GLU 57 6.007 17.231 -37.785
356 H GLU 58 H GLU 58 3.020 21.145 -35.573
357 HA GLU 58 HA GLU 58 2.085 23.230 -37.151
358 HB2 GLU 58 HB2 GLU 58 2.079 24.578 -35.104
359 HB3 GLU 58 HB3 GLU 58 1.458 22.961 -34.806
360 HG2 GLU 58 HG2 GLU 58 4.010 22.536 -34.179
361 HG3 GLU 58 HG3 GLU 58 3.923 24.261 -33.824
362 H VAL 59 H VAL 59 2.967 25.575 -36.844
363 HA VAL 59 HA VAL 59 5.790 25.523 -37.671
364 HB VAL 59 HB VAL 59 3.736 27.678 -38.185
365 HG11 VAL 59 HG11 VAL 59 5.823 28.717 -38.259
366 HG12 VAL 59 HG12 VAL 59 6.602 27.312 -38.988
367 HG13 VAL 59 HG13 VAL 59 5.501 28.306 -39.943
368 HG21 VAL 59 HG21 VAL 59 2.935 26.256 -39.713
369 HG22 VAL 59 HG22 VAL 59 4.415 26.587 -40.613
370 HG23 VAL 59 HG23 VAL 59 4.319 25.174 -39.562
Start of MODEL 10
1 H MET 11 H MET 11 3.960 -2.669 1.160
2 HA MET 11 HA MET 11 4.223 -1.979 -1.046
3 HB2 MET 11 HB2 MET 11 1.947 -2.182 -2.192
4 HB3 MET 11 HB3 MET 11 2.507 -3.573 -1.273
5 HG2 MET 11 HG2 MET 11 1.089 -2.909 0.600
6 HG3 MET 11 HG3 MET 11 0.529 -1.514 -0.321
7 HE1 MET 11 HE1 MET 11 -0.978 -5.707 -0.307
8 HE2 MET 11 HE2 MET 11 0.291 -4.950 0.656
9 HE3 MET 11 HE3 MET 11 -1.387 -4.442 0.852
10 H LEU 12 H LEU 12 4.157 -0.304 -2.521
11 HA LEU 12 HA LEU 12 2.551 2.051 -1.846
12 HB2 LEU 12 HB2 LEU 12 5.417 2.377 -2.639
13 HB3 LEU 12 HB3 LEU 12 4.343 3.535 -1.858
14 HG LEU 12 HG LEU 12 5.407 1.063 -0.501
15 HD11 LEU 12 HD11 LEU 12 6.457 3.887 -0.475
16 HD12 LEU 12 HD12 LEU 12 7.290 2.444 -1.053
17 HD13 LEU 12 HD13 LEU 12 6.937 2.629 0.665
18 HD21 LEU 12 HD21 LEU 12 4.240 1.689 1.303
19 HD22 LEU 12 HD22 LEU 12 3.288 2.651 0.172
20 HD23 LEU 12 HD23 LEU 12 4.611 3.397 1.069
21 H ASP 13 H ASP 13 1.356 2.421 -3.587
22 HA ASP 13 HA ASP 13 2.665 2.549 -6.197
23 HB2 ASP 13 HB2 ASP 13 0.141 0.968 -5.661
24 HB3 ASP 13 HB3 ASP 13 0.802 1.307 -7.259
25 H VAL 14 H VAL 14 2.356 4.841 -5.417
26 HA VAL 14 HA VAL 14 -0.334 5.796 -6.160
27 HB VAL 14 HB VAL 14 0.358 6.156 -3.742
28 HG11 VAL 14 HG11 VAL 14 2.730 6.915 -4.697
29 HG12 VAL 14 HG12 VAL 14 1.953 8.497 -4.607
30 HG13 VAL 14 HG13 VAL 14 2.093 7.498 -3.159
31 HG21 VAL 14 HG21 VAL 14 -1.009 7.813 -5.564
32 HG22 VAL 14 HG22 VAL 14 -1.207 7.732 -3.814
33 HG23 VAL 14 HG23 VAL 14 -0.066 8.876 -4.520
34 H GLY 15 H GLY 15 2.081 5.308 -7.833
35 HA2 GLY 15 HA2 GLY 15 2.121 7.948 -9.097
36 HA3 GLY 15 HA3 GLY 15 3.667 7.245 -8.645
37 H LYS 16 H LYS 16 2.787 7.942 -11.292
38 HA LYS 16 HA LYS 16 2.553 5.291 -12.547
39 HB2 LYS 16 HB2 LYS 16 1.253 7.774 -13.057
40 HB3 LYS 16 HB3 LYS 16 2.252 7.392 -14.453
41 HG2 LYS 16 HG2 LYS 16 0.152 6.454 -14.904
42 HG3 LYS 16 HG3 LYS 16 1.176 5.099 -14.423
43 HD2 LYS 16 HD2 LYS 16 -0.112 4.638 -12.657
44 HD3 LYS 16 HD3 LYS 16 -0.157 6.330 -12.155
45 HE2 LYS 16 HE2 LYS 16 -1.767 5.490 -14.516
46 HE3 LYS 16 HE3 LYS 16 -2.343 5.064 -12.905
47 HZ1 LYS 16 HZ1 LYS 16 -1.687 7.814 -13.816
48 HZ2 LYS 16 HZ2 LYS 16 -2.292 7.389 -12.295
49 HZ3 LYS 16 HZ3 LYS 16 -3.249 7.179 -13.675
50 H HIS 17 H HIS 17 4.162 4.515 -13.774
51 HA HIS 17 HA HIS 17 6.642 5.994 -13.889
52 HB2 HIS 17 HB2 HIS 17 6.099 3.296 -15.124
53 HB3 HIS 17 HB3 HIS 17 7.648 3.966 -14.621
54 HD1 HIS 17 HD1 HIS 17 4.405 2.730 -13.094
55 HD2 HIS 17 HD2 HIS 17 8.393 3.311 -12.084
56 HE1 HIS 17 HE1 HIS 17 4.672 1.728 -10.802
57 H CYS 18 H CYS 18 7.600 6.863 -15.663
58 HA CYS 18 HA CYS 18 6.097 7.816 -17.769
59 HB2 CYS 18 HB2 CYS 18 8.424 8.544 -17.029
60 HB3 CYS 18 HB3 CYS 18 9.043 7.209 -17.995
61 H ALA 19 H ALA 19 5.841 7.237 -19.936
62 HA ALA 19 HA ALA 19 6.088 4.361 -20.435
63 HB1 ALA 19 HB1 ALA 19 4.039 4.569 -21.254
64 HB2 ALA 19 HB2 ALA 19 4.096 6.317 -21.027
65 HB3 ALA 19 HB3 ALA 19 4.674 5.604 -22.533
66 H TYR 20 H TYR 20 8.180 6.619 -20.742
67 HA TYR 20 HA TYR 20 9.051 5.795 -23.428
68 HB2 TYR 20 HB2 TYR 20 8.141 8.175 -23.319
69 HB3 TYR 20 HB3 TYR 20 9.539 8.559 -22.321
70 HD1 TYR 20 HD1 TYR 20 11.594 9.088 -23.311
71 HD2 TYR 20 HD2 TYR 20 8.568 7.231 -25.656
72 HE1 TYR 20 HE1 TYR 20 12.941 9.463 -25.335
73 HE2 TYR 20 HE2 TYR 20 9.907 7.599 -27.686
74 HH TYR 20 HH TYR 20 13.032 9.281 -27.545
75 H CYS 21 H CYS 21 9.970 7.014 -20.244
76 HA CYS 21 HA CYS 21 12.660 5.883 -20.659
77 HB2 CYS 21 HB2 CYS 21 13.585 7.544 -19.277
78 HB3 CYS 21 HB3 CYS 21 12.419 8.411 -20.271
79 H ARG 22 H ARG 22 9.764 5.666 -18.909
80 HA ARG 22 HA ARG 22 9.063 4.309 -17.223
81 HB2 ARG 22 HB2 ARG 22 11.742 2.940 -17.503
82 HB3 ARG 22 HB3 ARG 22 10.286 2.274 -16.777
83 HG2 ARG 22 HG2 ARG 22 9.789 3.132 -19.483
84 HG3 ARG 22 HG3 ARG 22 11.135 1.993 -19.408
85 HD2 ARG 22 HD2 ARG 22 8.884 1.215 -17.730
86 HD3 ARG 22 HD3 ARG 22 8.457 1.346 -19.436
87 HE ARG 22 HE ARG 22 10.044 -0.681 -18.227
88 HH11 ARG 22 HH11 ARG 22 9.653 1.174 -21.147
89 HH12 ARG 22 HH12 ARG 22 10.357 -0.037 -22.166
90 HH21 ARG 22 HH21 ARG 22 10.973 -2.284 -19.558
91 HH22 ARG 22 HH22 ARG 22 11.107 -2.004 -21.261
92 H GLN 23 H GLN 23 9.513 6.481 -16.098
93 HA GLN 23 HA GLN 23 11.432 6.029 -13.907
94 HB2 GLN 23 HB2 GLN 23 12.208 7.896 -15.174
95 HB3 GLN 23 HB3 GLN 23 10.597 8.596 -15.251
96 HG2 GLN 23 HG2 GLN 23 10.679 9.371 -13.090
97 HG3 GLN 23 HG3 GLN 23 11.885 8.183 -12.597
98 HE21 GLN 23 HE21 GLN 23 12.832 10.165 -11.645
99 HE22 GLN 23 HE22 GLN 23 13.896 11.104 -12.630
100 H LEU 24 H LEU 24 10.463 5.601 -12.048
101 HA LEU 24 HA LEU 24 7.698 5.904 -11.602
102 HB2 LEU 24 HB2 LEU 24 9.357 4.317 -10.476
103 HB3 LEU 24 HB3 LEU 24 9.753 5.675 -9.425
104 HG LEU 24 HG LEU 24 6.935 4.674 -9.693
105 HD11 LEU 24 HD11 LEU 24 7.227 3.004 -8.182
106 HD12 LEU 24 HD12 LEU 24 8.609 3.785 -7.414
107 HD13 LEU 24 HD13 LEU 24 8.813 2.949 -8.954
108 HD21 LEU 24 HD21 LEU 24 7.402 5.553 -7.129
109 HD22 LEU 24 HD22 LEU 24 6.634 6.481 -8.417
110 HD23 LEU 24 HD23 LEU 24 8.362 6.660 -8.112
111 H ASP 25 H ASP 25 6.733 7.827 -11.510
112 HA ASP 25 HA ASP 25 7.984 9.931 -9.866
113 HB2 ASP 25 HB2 ASP 25 6.831 10.003 -12.552
114 HB3 ASP 25 HB3 ASP 25 6.160 11.233 -11.484
115 H PHE 26 H PHE 26 6.507 11.365 -8.739
116 HA PHE 26 HA PHE 26 4.271 9.882 -7.632
117 HB2 PHE 26 HB2 PHE 26 5.197 12.642 -6.835
118 HB3 PHE 26 HB3 PHE 26 4.248 11.505 -5.882
119 HD1 PHE 26 HD1 PHE 26 7.595 12.252 -7.208
120 HD2 PHE 26 HD2 PHE 26 5.288 9.763 -4.638
121 HE1 PHE 26 HE1 PHE 26 9.663 11.383 -6.197
122 HE2 PHE 26 HE2 PHE 26 7.352 8.891 -3.623
123 HZ PHE 26 HZ PHE 26 9.544 9.701 -4.402
124 H LEU 27 H LEU 27 4.855 12.824 -9.480
125 HA LEU 27 HA LEU 27 1.945 13.168 -9.772
126 HB2 LEU 27 HB2 LEU 27 2.619 15.492 -10.570
127 HB3 LEU 27 HB3 LEU 27 2.773 15.140 -8.850
128 HG LEU 27 HG LEU 27 5.239 14.602 -10.273
129 HD11 LEU 27 HD11 LEU 27 4.837 16.287 -11.800
130 HD12 LEU 27 HD12 LEU 27 5.665 17.149 -10.504
131 HD13 LEU 27 HD13 LEU 27 3.911 17.253 -10.651
132 HD21 LEU 27 HD21 LEU 27 4.388 16.321 -7.956
133 HD22 LEU 27 HD22 LEU 27 6.055 16.239 -8.524
134 HD23 LEU 27 HD23 LEU 27 5.257 14.787 -7.918
135 HA PRO 28 HA PRO 28 3.360 11.627 -13.876
136 HB2 PRO 28 HB2 PRO 28 1.103 10.196 -14.352
137 HB3 PRO 28 HB3 PRO 28 2.466 9.559 -13.425
138 HG2 PRO 28 HG2 PRO 28 -0.104 10.739 -12.445
139 HG3 PRO 28 HG3 PRO 28 0.761 9.304 -11.865
140 HD2 PRO 28 HD2 PRO 28 0.895 11.696 -10.602
141 HD3 PRO 28 HD3 PRO 28 2.251 10.550 -10.623
142 H PHE 29 H PHE 29 3.059 12.838 -15.632
143 HA PHE 29 HA PHE 29 0.859 14.712 -15.738
144 HB2 PHE 29 HB2 PHE 29 3.390 14.302 -17.267
145 HB3 PHE 29 HB3 PHE 29 2.089 15.208 -18.033
146 HD1 PHE 29 HD1 PHE 29 1.545 17.414 -17.341
147 HD2 PHE 29 HD2 PHE 29 4.416 15.128 -15.185
148 HE1 PHE 29 HE1 PHE 29 2.240 19.438 -16.127
149 HE2 PHE 29 HE2 PHE 29 5.114 17.149 -13.966
150 HZ PHE 29 HZ PHE 29 4.027 19.307 -14.438
151 H HIS 30 H HIS 30 -1.051 14.052 -16.462
152 HA HIS 30 HA HIS 30 -1.258 11.861 -18.349
153 HB2 HIS 30 HB2 HIS 30 -2.832 11.893 -16.513
154 HB3 HIS 30 HB3 HIS 30 -3.357 13.520 -16.940
155 HD1 HIS 30 HD1 HIS 30 -3.755 9.940 -17.912
156 HD2 HIS 30 HD2 HIS 30 -5.136 13.672 -19.107
157 HE1 HIS 30 HE1 HIS 30 -5.668 9.479 -19.478
158 H CYS 31 H CYS 31 -1.296 12.130 -20.472
159 HA CYS 31 HA CYS 31 -1.614 14.783 -21.597
160 HB2 CYS 31 HB2 CYS 31 -0.013 12.718 -22.287
161 HB3 CYS 31 HB3 CYS 31 -1.355 12.442 -23.393
162 H SER 32 H SER 32 -3.387 15.553 -22.556
163 HA SER 32 HA SER 32 -5.739 13.832 -22.687
164 HB2 SER 32 HB2 SER 32 -5.457 16.389 -21.809
165 HB3 SER 32 HB3 SER 32 -5.992 16.671 -23.465
166 HG SER 32 HG SER 32 -7.701 16.443 -21.865
167 H PHE 33 H PHE 33 -3.405 13.887 -24.649
168 HA PHE 33 HA PHE 33 -5.006 14.314 -27.085
169 HB2 PHE 33 HB2 PHE 33 -1.997 14.354 -27.032
170 HB3 PHE 33 HB3 PHE 33 -3.082 14.996 -28.262
171 HD1 PHE 33 HD1 PHE 33 -4.967 16.553 -26.640
172 HD2 PHE 33 HD2 PHE 33 -0.738 16.168 -26.337
173 HE1 PHE 33 HE1 PHE 33 -4.843 18.775 -25.589
174 HE2 PHE 33 HE2 PHE 33 -0.608 18.388 -25.285
175 HZ PHE 33 HZ PHE 33 -2.662 19.694 -24.909
176 H CYS 34 H CYS 34 -2.402 12.363 -25.661
177 HA CYS 34 HA CYS 34 -3.044 10.214 -27.561
178 HB2 CYS 34 HB2 CYS 34 -0.847 9.278 -27.003
179 HB3 CYS 34 HB3 CYS 34 -0.701 10.941 -27.565
180 H ASN 35 H ASN 35 -3.334 11.157 -24.308
181 HA ASN 35 HA ASN 35 -4.266 10.144 -22.494
182 HB2 ASN 35 HB2 ASN 35 -5.680 9.110 -24.490
183 HB3 ASN 35 HB3 ASN 35 -4.852 7.635 -24.000
184 HD21 ASN 35 HD21 ASN 35 -7.251 9.963 -23.210
185 HD22 ASN 35 HD22 ASN 35 -7.856 9.181 -21.793
186 H GLU 36 H GLU 36 -1.723 10.090 -22.265
187 HA GLU 36 HA GLU 36 -1.111 7.449 -21.202
188 HB2 GLU 36 HB2 GLU 36 0.529 8.849 -23.304
189 HB3 GLU 36 HB3 GLU 36 1.231 7.653 -22.223
190 HG2 GLU 36 HG2 GLU 36 -1.024 6.398 -23.189
191 HG3 GLU 36 HG3 GLU 36 -0.415 7.293 -24.581
192 H ASP 37 H ASP 37 0.582 7.453 -19.635
193 HA ASP 37 HA ASP 37 0.899 10.068 -18.357
194 HB2 ASP 37 HB2 ASP 37 1.223 7.244 -17.342
195 HB3 ASP 37 HB3 ASP 37 1.713 8.653 -16.405
196 H PHE 38 H PHE 38 2.869 10.963 -17.884
197 HA PHE 38 HA PHE 38 5.308 9.510 -18.491
198 HB2 PHE 38 HB2 PHE 38 4.662 12.099 -19.915
199 HB3 PHE 38 HB3 PHE 38 6.148 11.167 -20.065
200 HD1 PHE 38 HD1 PHE 38 6.011 8.843 -21.055
201 HD2 PHE 38 HD2 PHE 38 2.819 11.650 -21.274
202 HE1 PHE 38 HE1 PHE 38 5.029 7.575 -22.921
203 HE2 PHE 38 HE2 PHE 38 1.831 10.386 -23.139
204 HZ PHE 38 HZ PHE 38 2.935 8.346 -23.964
205 H CYS 39 H CYS 39 7.007 10.171 -17.279
206 HA CYS 39 HA CYS 39 6.660 11.628 -14.973
207 HB2 CYS 39 HB2 CYS 39 9.010 11.560 -14.686
208 HB3 CYS 39 HB3 CYS 39 8.607 10.114 -15.605
209 H SER 40 H SER 40 7.571 13.703 -14.312
210 HA SER 40 HA SER 40 6.616 15.841 -15.786
211 HB2 SER 40 HB2 SER 40 7.128 15.982 -13.387
212 HB3 SER 40 HB3 SER 40 8.851 15.866 -13.742
213 HG SER 40 HG SER 40 7.352 18.040 -13.673
214 H ASN 41 H ASN 41 9.783 14.328 -15.838
215 HA ASN 41 HA ASN 41 11.153 16.296 -17.306
216 HB2 ASN 41 HB2 ASN 41 11.895 13.990 -16.111
217 HB3 ASN 41 HB3 ASN 41 11.886 13.468 -17.793
218 HD21 ASN 41 HD21 ASN 41 12.980 16.215 -15.831
219 HD22 ASN 41 HD22 ASN 41 14.501 16.397 -16.630
220 H HIS 42 H HIS 42 8.911 13.818 -18.254
221 HA HIS 42 HA HIS 42 9.305 14.578 -21.075
222 HB2 HIS 42 HB2 HIS 42 8.505 11.926 -19.878
223 HB3 HIS 42 HB3 HIS 42 8.291 12.304 -21.584
224 HD2 HIS 42 HD2 HIS 42 10.975 13.193 -22.717
225 HE1 HIS 42 HE1 HIS 42 12.918 10.313 -20.282
226 HE2 HIS 42 HE2 HIS 42 13.134 11.838 -22.276
227 H ARG 43 H ARG 43 7.531 15.653 -18.871
228 HA ARG 43 HA ARG 43 4.865 14.948 -19.288
229 HB2 ARG 43 HB2 ARG 43 4.305 17.125 -18.314
230 HB3 ARG 43 HB3 ARG 43 5.593 16.338 -17.412
231 HG2 ARG 43 HG2 ARG 43 7.178 17.751 -18.872
232 HG3 ARG 43 HG3 ARG 43 5.741 18.714 -19.219
233 HD2 ARG 43 HD2 ARG 43 5.533 19.435 -17.038
234 HD3 ARG 43 HD3 ARG 43 6.417 18.054 -16.389
235 HE ARG 43 HE ARG 43 8.153 19.595 -17.969
236 HH11 ARG 43 HH11 ARG 43 6.433 19.743 -14.946
237 HH12 ARG 43 HH12 ARG 43 7.586 20.794 -14.192
238 HH21 ARG 43 HH21 ARG 43 9.677 20.979 -16.988
239 HH22 ARG 43 HH22 ARG 43 9.430 21.498 -15.355
240 H LEU 44 H LEU 44 6.918 17.260 -20.989
241 HA LEU 44 HA LEU 44 5.053 18.590 -22.523
242 HB2 LEU 44 HB2 LEU 44 7.729 17.657 -23.538
243 HB3 LEU 44 HB3 LEU 44 6.810 19.063 -24.074
244 HG LEU 44 HG LEU 44 8.143 18.732 -21.386
245 HD11 LEU 44 HD11 LEU 44 9.846 20.074 -22.126
246 HD12 LEU 44 HD12 LEU 44 8.867 20.807 -23.396
247 HD13 LEU 44 HD13 LEU 44 9.485 19.168 -23.595
248 HD21 LEU 44 HD21 LEU 44 7.578 21.312 -21.470
249 HD22 LEU 44 HD22 LEU 44 6.423 20.132 -20.849
250 HD23 LEU 44 HD23 LEU 44 6.259 20.745 -22.495
251 H LYS 45 H LYS 45 4.635 18.330 -24.885
252 HA LYS 45 HA LYS 45 3.490 15.769 -25.381
253 HB2 LYS 45 HB2 LYS 45 3.358 18.404 -26.523
254 HB3 LYS 45 HB3 LYS 45 3.599 17.221 -27.802
255 HG2 LYS 45 HG2 LYS 45 1.663 15.999 -26.383
256 HG3 LYS 45 HG3 LYS 45 1.271 17.691 -26.068
257 HD2 LYS 45 HD2 LYS 45 1.726 16.563 -28.826
258 HD3 LYS 45 HD3 LYS 45 0.135 16.694 -28.072
259 HE2 LYS 45 HE2 LYS 45 1.884 19.106 -28.196
260 HE3 LYS 45 HE3 LYS 45 1.046 18.583 -29.657
261 HZ1 LYS 45 HZ1 LYS 45 -1.001 18.534 -28.102
262 HZ2 LYS 45 HZ2 LYS 45 -0.461 20.016 -28.712
263 HZ3 LYS 45 HZ3 LYS 45 -0.084 19.567 -27.125
264 H GLU 46 H GLU 46 5.943 17.588 -27.234
265 HA GLU 46 HA GLU 46 6.735 15.487 -28.877
266 HB2 GLU 46 HB2 GLU 46 8.636 16.799 -29.444
267 HB3 GLU 46 HB3 GLU 46 7.323 17.926 -29.134
268 HG2 GLU 46 HG2 GLU 46 8.212 18.387 -26.922
269 HG3 GLU 46 HG3 GLU 46 9.508 17.222 -27.188
270 H ASP 47 H ASP 47 7.607 16.235 -25.591
271 HA ASP 47 HA ASP 47 9.970 14.870 -25.249
272 HB2 ASP 47 HB2 ASP 47 7.732 15.660 -23.526
273 HB3 ASP 47 HB3 ASP 47 8.613 14.252 -22.939
274 H HIS 48 H HIS 48 6.689 13.518 -24.910
275 HA HIS 48 HA HIS 48 7.816 10.821 -24.947
276 HB2 HIS 48 HB2 HIS 48 5.551 10.087 -24.323
277 HB3 HIS 48 HB3 HIS 48 6.162 11.311 -23.213
278 HD1 HIS 48 HD1 HIS 48 4.758 13.359 -22.900
279 HD2 HIS 48 HD2 HIS 48 3.577 11.112 -26.189
280 HE1 HIS 48 HE1 HIS 48 2.617 14.409 -23.698
281 H HIS 49 H HIS 49 7.555 12.700 -27.311
282 HA HIS 49 HA HIS 49 6.963 12.637 -29.512
283 HB2 HIS 49 HB2 HIS 49 7.180 9.691 -28.882
284 HB3 HIS 49 HB3 HIS 49 6.965 10.313 -30.516
285 HD1 HIS 49 HD1 HIS 49 9.017 11.133 -31.716
286 HD2 HIS 49 HD2 HIS 49 9.696 10.420 -27.680
287 HE1 HIS 49 HE1 HIS 49 11.505 11.335 -31.407
288 H CYS 50 H CYS 50 4.813 13.348 -28.219
289 HA CYS 50 HA CYS 50 2.564 11.752 -28.142
290 HB2 CYS 50 HB2 CYS 50 2.880 14.197 -27.381
291 HB3 CYS 50 HB3 CYS 50 2.429 14.626 -29.028
292 H ARG 51 H ARG 51 1.377 10.749 -29.623
293 HA ARG 51 HA ARG 51 2.007 10.613 -32.312
294 HB2 ARG 51 HB2 ARG 51 -0.004 9.553 -30.589
295 HB3 ARG 51 HB3 ARG 51 -0.788 10.138 -32.050
296 HG2 ARG 51 HG2 ARG 51 0.484 8.707 -33.426
297 HG3 ARG 51 HG3 ARG 51 1.605 8.326 -32.117
298 HD2 ARG 51 HD2 ARG 51 -0.574 7.455 -30.939
299 HD3 ARG 51 HD3 ARG 51 -1.169 7.346 -32.595
300 HE ARG 51 HE ARG 51 0.727 5.623 -31.337
301 HH11 ARG 51 HH11 ARG 51 -0.222 7.007 -34.387
302 HH12 ARG 51 HH12 ARG 51 0.455 5.720 -35.330
303 HH21 ARG 51 HH21 ARG 51 1.622 3.923 -32.566
304 HH22 ARG 51 HH22 ARG 51 1.503 3.966 -34.293
305 H TRP 52 H TRP 52 -0.187 12.791 -30.643
306 HA TRP 52 HA TRP 52 -1.518 13.865 -32.856
307 HB2 TRP 52 HB2 TRP 52 -2.035 14.217 -30.383
308 HB3 TRP 52 HB3 TRP 52 -0.769 15.442 -30.395
309 HD1 TRP 52 HD1 TRP 52 -4.359 14.847 -31.431
310 HE1 TRP 52 HE1 TRP 52 -5.361 17.045 -32.320
311 HE3 TRP 52 HE3 TRP 52 -0.088 17.647 -31.672
312 HZ2 TRP 52 HZ2 TRP 52 -4.460 19.625 -33.030
313 HZ3 TRP 52 HZ3 TRP 52 -0.245 19.971 -32.467
314 HH2 TRP 52 HH2 TRP 52 -2.386 20.937 -33.132
315 H LEU 53 H LEU 53 1.570 14.724 -31.375
316 HA LEU 53 HA LEU 53 2.036 17.051 -32.911
317 HB2 LEU 53 HB2 LEU 53 3.483 15.411 -31.011
318 HB3 LEU 53 HB3 LEU 53 4.531 15.991 -32.304
319 HG LEU 53 HG LEU 53 2.866 17.708 -30.464
320 HD11 LEU 53 HD11 LEU 53 4.971 18.402 -29.516
321 HD12 LEU 53 HD12 LEU 53 5.856 17.368 -30.637
322 HD13 LEU 53 HD13 LEU 53 4.824 16.648 -29.401
323 HD21 LEU 53 HD21 LEU 53 4.586 18.330 -32.838
324 HD22 LEU 53 HD22 LEU 53 4.345 19.511 -31.551
325 HD23 LEU 53 HD23 LEU 53 2.961 18.903 -32.460
326 H LEU 54 H LEU 54 2.731 13.646 -33.435
327 HA LEU 54 HA LEU 54 4.381 14.039 -35.727
328 HB2 LEU 54 HB2 LEU 54 2.824 11.535 -35.233
329 HB3 LEU 54 HB3 LEU 54 4.433 11.728 -35.925
330 HG LEU 54 HG LEU 54 3.681 12.002 -33.016
331 HD11 LEU 54 HD11 LEU 54 3.826 9.694 -34.093
332 HD12 LEU 54 HD12 LEU 54 4.809 9.983 -32.658
333 HD13 LEU 54 HD13 LEU 54 5.553 10.011 -34.256
334 HD21 LEU 54 HD21 LEU 54 5.422 13.597 -33.611
335 HD22 LEU 54 HD22 LEU 54 6.361 12.311 -34.369
336 HD23 LEU 54 HD23 LEU 54 6.081 12.290 -32.627
337 H GLU 55 H GLU 55 1.026 12.878 -35.364
338 HA GLU 55 HA GLU 55 0.421 12.761 -38.090
339 HB2 GLU 55 HB2 GLU 55 -1.906 12.710 -37.424
340 HB3 GLU 55 HB3 GLU 55 -0.957 11.743 -36.304
341 HG2 GLU 55 HG2 GLU 55 -0.917 13.776 -34.797
342 HG3 GLU 55 HG3 GLU 55 -2.147 14.461 -35.858
343 H HIS 56 H HIS 56 0.288 15.431 -35.808
344 HA HIS 56 HA HIS 56 -0.364 17.228 -38.051
345 HB2 HIS 56 HB2 HIS 56 -1.466 17.085 -35.298
346 HB3 HIS 56 HB3 HIS 56 -1.177 18.695 -35.951
347 HD1 HIS 56 HD1 HIS 56 -3.366 19.554 -36.709
348 HD2 HIS 56 HD2 HIS 56 -2.839 15.560 -37.726
349 HE1 HIS 56 HE1 HIS 56 -5.398 18.928 -38.052
350 H GLU 57 H GLU 57 1.912 17.451 -38.415
351 HA GLU 57 HA GLU 57 3.334 18.974 -36.338
352 HB2 GLU 57 HB2 GLU 57 5.381 18.383 -37.735
353 HB3 GLU 57 HB3 GLU 57 4.608 17.063 -36.868
354 HG2 GLU 57 HG2 GLU 57 3.918 16.033 -38.761
355 HG3 GLU 57 HG3 GLU 57 3.712 17.545 -39.643
356 H GLU 58 H GLU 58 2.136 20.893 -36.991
357 HA GLU 58 HA GLU 58 2.959 22.012 -39.576
358 HB2 GLU 58 HB2 GLU 58 1.187 23.707 -39.150
359 HB3 GLU 58 HB3 GLU 58 0.577 22.060 -39.230
360 HG2 GLU 58 HG2 GLU 58 1.278 22.855 -36.529
361 HG3 GLU 58 HG3 GLU 58 0.058 23.901 -37.254
362 H VAL 59 H VAL 59 3.977 24.002 -39.734
363 HA VAL 59 HA VAL 59 5.418 25.663 -39.145
364 HB VAL 59 HB VAL 59 3.952 25.630 -36.503
365 HG11 VAL 59 HG11 VAL 59 5.972 27.414 -37.729
366 HG12 VAL 59 HG12 VAL 59 4.646 28.182 -36.853
367 HG13 VAL 59 HG13 VAL 59 5.687 27.016 -36.035
368 HG21 VAL 59 HG21 VAL 59 2.730 27.595 -37.621
369 HG22 VAL 59 HG22 VAL 59 3.316 26.914 -39.139
370 HG23 VAL 59 HG23 VAL 59 2.270 25.958 -38.090
Start of MODEL 11
1 H MET 11 H MET 11 -7.614 -0.151 -6.433
2 HA MET 11 HA MET 11 -5.442 -0.710 -7.320
3 HB2 MET 11 HB2 MET 11 -4.838 1.344 -8.549
4 HB3 MET 11 HB3 MET 11 -6.565 1.016 -8.606
5 HG2 MET 11 HG2 MET 11 -7.033 2.986 -7.721
6 HG3 MET 11 HG3 MET 11 -5.953 2.689 -6.360
7 HE1 MET 11 HE1 MET 11 -6.736 5.257 -7.385
8 HE2 MET 11 HE2 MET 11 -5.226 5.821 -6.669
9 HE3 MET 11 HE3 MET 11 -5.596 6.191 -8.354
10 H LEU 12 H LEU 12 -3.140 -0.020 -7.479
11 HA LEU 12 HA LEU 12 -2.124 1.375 -5.124
12 HB2 LEU 12 HB2 LEU 12 -0.398 -0.513 -4.912
13 HB3 LEU 12 HB3 LEU 12 -2.009 -0.762 -4.244
14 HG LEU 12 HG LEU 12 -1.922 -1.731 -6.943
15 HD11 LEU 12 HD11 LEU 12 0.392 -2.405 -5.211
16 HD12 LEU 12 HD12 LEU 12 0.289 -2.272 -6.966
17 HD13 LEU 12 HD13 LEU 12 -0.347 -3.701 -6.151
18 HD21 LEU 12 HD21 LEU 12 -2.247 -3.102 -4.275
19 HD22 LEU 12 HD22 LEU 12 -2.627 -3.809 -5.845
20 HD23 LEU 12 HD23 LEU 12 -3.538 -2.416 -5.261
21 H ASP 13 H ASP 13 -0.799 2.878 -5.873
22 HA ASP 13 HA ASP 13 1.303 2.185 -7.734
23 HB2 ASP 13 HB2 ASP 13 -1.077 3.710 -8.552
24 HB3 ASP 13 HB3 ASP 13 0.455 4.478 -8.961
25 H VAL 14 H VAL 14 2.792 2.757 -6.198
26 HA VAL 14 HA VAL 14 2.639 5.315 -4.857
27 HB VAL 14 HB VAL 14 4.833 4.648 -3.867
28 HG11 VAL 14 HG11 VAL 14 2.414 2.896 -3.653
29 HG12 VAL 14 HG12 VAL 14 3.851 2.577 -2.680
30 HG13 VAL 14 HG13 VAL 14 3.007 4.119 -2.530
31 HG21 VAL 14 HG21 VAL 14 4.456 1.919 -5.009
32 HG22 VAL 14 HG22 VAL 14 5.287 3.145 -5.966
33 HG23 VAL 14 HG23 VAL 14 5.916 2.685 -4.383
34 H GLY 15 H GLY 15 2.637 6.025 -7.382
35 HA2 GLY 15 HA2 GLY 15 3.917 7.850 -8.327
36 HA3 GLY 15 HA3 GLY 15 5.380 7.007 -7.842
37 H LYS 16 H LYS 16 4.191 8.005 -10.486
38 HA LYS 16 HA LYS 16 4.293 5.476 -11.979
39 HB2 LYS 16 HB2 LYS 16 2.669 7.799 -12.213
40 HB3 LYS 16 HB3 LYS 16 3.662 7.697 -13.661
41 HG2 LYS 16 HG2 LYS 16 1.982 5.434 -12.607
42 HG3 LYS 16 HG3 LYS 16 1.454 6.574 -13.847
43 HD2 LYS 16 HD2 LYS 16 2.728 5.618 -15.445
44 HD3 LYS 16 HD3 LYS 16 4.067 5.310 -14.337
45 HE2 LYS 16 HE2 LYS 16 1.957 3.650 -13.508
46 HE3 LYS 16 HE3 LYS 16 2.021 3.522 -15.265
47 HZ1 LYS 16 HZ1 LYS 16 4.377 3.184 -13.494
48 HZ2 LYS 16 HZ2 LYS 16 4.302 2.887 -15.157
49 HZ3 LYS 16 HZ3 LYS 16 3.445 1.901 -14.083
50 H HIS 17 H HIS 17 5.860 5.071 -13.452
51 HA HIS 17 HA HIS 17 8.139 6.881 -13.479
52 HB2 HIS 17 HB2 HIS 17 7.959 4.195 -14.839
53 HB3 HIS 17 HB3 HIS 17 9.407 5.064 -14.340
54 HD1 HIS 17 HD1 HIS 17 6.442 3.268 -12.807
55 HD2 HIS 17 HD2 HIS 17 10.321 4.411 -11.856
56 HE1 HIS 17 HE1 HIS 17 6.929 2.205 -10.580
57 H CYS 18 H CYS 18 8.879 7.972 -15.232
58 HA CYS 18 HA CYS 18 7.168 8.780 -17.237
59 HB2 CYS 18 HB2 CYS 18 9.363 9.844 -16.548
60 HB3 CYS 18 HB3 CYS 18 10.167 8.644 -17.554
61 H ALA 19 H ALA 19 6.878 8.250 -19.400
62 HA ALA 19 HA ALA 19 7.536 5.477 -20.060
63 HB1 ALA 19 HB1 ALA 19 5.429 5.454 -20.756
64 HB2 ALA 19 HB2 ALA 19 5.291 7.202 -20.558
65 HB3 ALA 19 HB3 ALA 19 5.904 6.532 -22.070
66 H TYR 20 H TYR 20 9.307 7.984 -20.295
67 HA TYR 20 HA TYR 20 10.179 7.438 -23.050
68 HB2 TYR 20 HB2 TYR 20 8.974 9.707 -22.642
69 HB3 TYR 20 HB3 TYR 20 10.472 10.174 -21.846
70 HD1 TYR 20 HD1 TYR 20 12.594 10.230 -23.155
71 HD2 TYR 20 HD2 TYR 20 8.817 9.606 -25.013
72 HE1 TYR 20 HE1 TYR 20 13.577 10.808 -25.334
73 HE2 TYR 20 HE2 TYR 20 9.790 10.181 -27.197
74 HH TYR 20 HH TYR 20 11.668 10.630 -28.316
75 H CYS 21 H CYS 21 11.102 8.785 -19.897
76 HA CYS 21 HA CYS 21 13.872 7.936 -20.424
77 HB2 CYS 21 HB2 CYS 21 14.636 9.641 -18.969
78 HB3 CYS 21 HB3 CYS 21 13.396 10.396 -19.965
79 H ARG 22 H ARG 22 11.098 7.303 -18.588
80 HA ARG 22 HA ARG 22 10.637 5.813 -16.932
81 HB2 ARG 22 HB2 ARG 22 13.466 4.825 -17.318
82 HB3 ARG 22 HB3 ARG 22 12.129 3.949 -16.585
83 HG2 ARG 22 HG2 ARG 22 11.441 4.807 -19.243
84 HG3 ARG 22 HG3 ARG 22 12.942 3.880 -19.247
85 HD2 ARG 22 HD2 ARG 22 11.603 2.257 -17.700
86 HD3 ARG 22 HD3 ARG 22 10.198 3.050 -18.411
87 HE ARG 22 HE ARG 22 10.631 1.980 -20.398
88 HH11 ARG 22 HH11 ARG 22 13.361 1.639 -18.265
89 HH12 ARG 22 HH12 ARG 22 14.163 0.473 -19.265
90 HH21 ARG 22 HH21 ARG 22 11.677 0.446 -21.723
91 HH22 ARG 22 HH22 ARG 22 13.204 -0.204 -21.233
92 H GLN 23 H GLN 23 10.758 7.924 -15.693
93 HA GLN 23 HA GLN 23 12.836 7.729 -13.613
94 HB2 GLN 23 HB2 GLN 23 11.748 10.055 -15.088
95 HB3 GLN 23 HB3 GLN 23 12.016 10.286 -13.365
96 HG2 GLN 23 HG2 GLN 23 14.343 9.646 -13.619
97 HG3 GLN 23 HG3 GLN 23 14.087 9.349 -15.338
98 HE21 GLN 23 HE21 GLN 23 16.044 11.009 -14.785
99 HE22 GLN 23 HE22 GLN 23 15.609 12.653 -15.090
100 H LEU 24 H LEU 24 12.003 6.950 -11.799
101 HA LEU 24 HA LEU 24 9.260 6.807 -11.215
102 HB2 LEU 24 HB2 LEU 24 11.225 5.443 -10.273
103 HB3 LEU 24 HB3 LEU 24 11.404 6.762 -9.119
104 HG LEU 24 HG LEU 24 8.801 5.299 -9.427
105 HD11 LEU 24 HD11 LEU 24 9.467 3.536 -8.216
106 HD12 LEU 24 HD12 LEU 24 10.528 4.507 -7.196
107 HD13 LEU 24 HD13 LEU 24 11.081 3.970 -8.782
108 HD21 LEU 24 HD21 LEU 24 8.529 7.265 -8.186
109 HD22 LEU 24 HD22 LEU 24 10.070 7.060 -7.353
110 HD23 LEU 24 HD23 LEU 24 8.712 6.001 -6.970
111 H ASP 25 H ASP 25 8.063 8.602 -11.037
112 HA ASP 25 HA ASP 25 9.036 10.736 -9.252
113 HB2 ASP 25 HB2 ASP 25 8.158 10.911 -11.909
114 HB3 ASP 25 HB3 ASP 25 6.832 11.549 -10.941
115 H PHE 26 H PHE 26 7.302 11.939 -8.106
116 HA PHE 26 HA PHE 26 5.400 10.036 -6.984
117 HB2 PHE 26 HB2 PHE 26 5.896 12.857 -6.038
118 HB3 PHE 26 HB3 PHE 26 5.206 11.514 -5.131
119 HD1 PHE 26 HD1 PHE 26 8.306 12.911 -6.532
120 HD2 PHE 26 HD2 PHE 26 6.588 9.918 -4.040
121 HE1 PHE 26 HE1 PHE 26 10.540 12.360 -5.660
122 HE2 PHE 26 HE2 PHE 26 8.819 9.363 -3.163
123 HZ PHE 26 HZ PHE 26 10.799 10.584 -3.974
124 H LEU 27 H LEU 27 5.456 13.167 -8.613
125 HA LEU 27 HA LEU 27 2.523 13.055 -8.833
126 HB2 LEU 27 HB2 LEU 27 4.403 15.202 -8.335
127 HB3 LEU 27 HB3 LEU 27 3.352 15.560 -9.704
128 HG LEU 27 HG LEU 27 2.255 14.704 -7.039
129 HD11 LEU 27 HD11 LEU 27 2.973 17.476 -7.969
130 HD12 LEU 27 HD12 LEU 27 3.554 16.635 -6.532
131 HD13 LEU 27 HD13 LEU 27 1.868 17.140 -6.636
132 HD21 LEU 27 HD21 LEU 27 0.431 16.329 -8.123
133 HD22 LEU 27 HD22 LEU 27 0.483 14.595 -8.447
134 HD23 LEU 27 HD23 LEU 27 1.187 15.730 -9.600
135 HA PRO 28 HA PRO 28 3.999 12.026 -13.066
136 HB2 PRO 28 HB2 PRO 28 1.931 10.352 -13.604
137 HB3 PRO 28 HB3 PRO 28 3.389 9.833 -12.750
138 HG2 PRO 28 HG2 PRO 28 0.715 10.600 -11.642
139 HG3 PRO 28 HG3 PRO 28 1.772 9.252 -11.183
140 HD2 PRO 28 HD2 PRO 28 1.634 11.548 -9.753
141 HD3 PRO 28 HD3 PRO 28 3.123 10.591 -9.881
142 H PHE 29 H PHE 29 3.500 13.306 -14.725
143 HA PHE 29 HA PHE 29 1.066 14.873 -14.658
144 HB2 PHE 29 HB2 PHE 29 3.573 14.914 -16.298
145 HB3 PHE 29 HB3 PHE 29 2.144 15.762 -16.879
146 HD1 PHE 29 HD1 PHE 29 1.487 17.829 -15.955
147 HD2 PHE 29 HD2 PHE 29 4.583 15.559 -14.117
148 HE1 PHE 29 HE1 PHE 29 2.052 19.756 -14.533
149 HE2 PHE 29 HE2 PHE 29 5.152 17.481 -12.692
150 HZ PHE 29 HZ PHE 29 3.885 19.583 -12.897
151 H HIS 30 H HIS 30 -0.725 13.856 -15.316
152 HA HIS 30 HA HIS 30 -0.668 11.865 -17.402
153 HB2 HIS 30 HB2 HIS 30 -2.181 11.585 -15.507
154 HB3 HIS 30 HB3 HIS 30 -2.985 13.101 -15.899
155 HD1 HIS 30 HD1 HIS 30 -2.985 9.513 -16.680
156 HD2 HIS 30 HD2 HIS 30 -4.542 12.996 -18.325
157 HE1 HIS 30 HE1 HIS 30 -4.736 8.758 -18.319
158 H CYS 31 H CYS 31 -0.878 12.238 -19.502
159 HA CYS 31 HA CYS 31 -1.530 14.905 -20.432
160 HB2 CYS 31 HB2 CYS 31 0.262 13.110 -21.323
161 HB3 CYS 31 HB3 CYS 31 -1.093 12.699 -22.370
162 H SER 32 H SER 32 -3.411 15.533 -21.292
163 HA SER 32 HA SER 32 -5.577 13.585 -21.418
164 HB2 SER 32 HB2 SER 32 -5.560 16.063 -20.381
165 HB3 SER 32 HB3 SER 32 -6.084 16.451 -22.019
166 HG SER 32 HG SER 32 -7.677 14.689 -21.655
167 H PHE 33 H PHE 33 -3.347 13.977 -23.465
168 HA PHE 33 HA PHE 33 -5.093 14.334 -25.813
169 HB2 PHE 33 HB2 PHE 33 -2.105 14.713 -25.855
170 HB3 PHE 33 HB3 PHE 33 -3.292 15.257 -27.036
171 HD1 PHE 33 HD1 PHE 33 -5.298 16.538 -25.324
172 HD2 PHE 33 HD2 PHE 33 -1.047 16.639 -25.130
173 HE1 PHE 33 HE1 PHE 33 -5.404 18.728 -24.207
174 HE2 PHE 33 HE2 PHE 33 -1.146 18.828 -24.012
175 HZ PHE 33 HZ PHE 33 -3.327 19.875 -23.549
176 H CYS 34 H CYS 34 -2.233 12.620 -24.588
177 HA CYS 34 HA CYS 34 -2.724 10.499 -26.564
178 HB2 CYS 34 HB2 CYS 34 -0.415 9.785 -26.135
179 HB3 CYS 34 HB3 CYS 34 -0.476 11.474 -26.630
180 H ASN 35 H ASN 35 -2.941 11.258 -23.251
181 HA ASN 35 HA ASN 35 -3.675 10.072 -21.452
182 HB2 ASN 35 HB2 ASN 35 -5.075 8.989 -23.433
183 HB3 ASN 35 HB3 ASN 35 -4.079 7.587 -23.055
184 HD21 ASN 35 HD21 ASN 35 -6.958 8.943 -22.474
185 HD22 ASN 35 HD22 ASN 35 -7.295 8.301 -20.905
186 H GLU 36 H GLU 36 -1.133 10.273 -21.340
187 HA GLU 36 HA GLU 36 -0.198 7.652 -20.469
188 HB2 GLU 36 HB2 GLU 36 1.179 9.363 -22.527
189 HB3 GLU 36 HB3 GLU 36 2.070 8.209 -21.544
190 HG2 GLU 36 HG2 GLU 36 -0.054 6.736 -22.508
191 HG3 GLU 36 HG3 GLU 36 0.389 7.772 -23.863
192 H ASP 37 H ASP 37 1.609 7.757 -19.004
193 HA ASP 37 HA ASP 37 1.638 10.276 -17.512
194 HB2 ASP 37 HB2 ASP 37 2.391 7.449 -16.779
195 HB3 ASP 37 HB3 ASP 37 2.775 8.824 -15.747
196 H PHE 38 H PHE 38 3.489 11.404 -17.063
197 HA PHE 38 HA PHE 38 6.069 10.371 -17.890
198 HB2 PHE 38 HB2 PHE 38 4.945 12.895 -19.125
199 HB3 PHE 38 HB3 PHE 38 6.569 12.260 -19.369
200 HD1 PHE 38 HD1 PHE 38 6.781 9.946 -20.433
201 HD2 PHE 38 HD2 PHE 38 3.204 12.252 -20.518
202 HE1 PHE 38 HE1 PHE 38 5.977 8.623 -22.345
203 HE2 PHE 38 HE2 PHE 38 2.394 10.931 -22.430
204 HZ PHE 38 HZ PHE 38 3.780 9.113 -23.345
205 H CYS 39 H CYS 39 7.720 11.207 -16.720
206 HA CYS 39 HA CYS 39 7.297 12.455 -14.308
207 HB2 CYS 39 HB2 CYS 39 9.641 12.715 -14.135
208 HB3 CYS 39 HB3 CYS 39 9.408 11.294 -15.148
209 H SER 40 H SER 40 7.882 14.597 -13.545
210 HA SER 40 HA SER 40 6.558 16.649 -14.846
211 HB2 SER 40 HB2 SER 40 7.582 18.156 -13.249
212 HB3 SER 40 HB3 SER 40 7.208 16.638 -12.433
213 HG SER 40 HG SER 40 9.287 17.245 -11.884
214 H ASN 41 H ASN 41 9.921 15.661 -15.074
215 HA ASN 41 HA ASN 41 10.919 17.902 -16.443
216 HB2 ASN 41 HB2 ASN 41 12.032 15.639 -15.444
217 HB3 ASN 41 HB3 ASN 41 12.063 15.273 -17.166
218 HD21 ASN 41 HD21 ASN 41 13.051 17.611 -14.738
219 HD22 ASN 41 HD22 ASN 41 14.395 18.239 -15.624
220 H HIS 42 H HIS 42 9.028 15.190 -17.500
221 HA HIS 42 HA HIS 42 9.215 16.169 -20.274
222 HB2 HIS 42 HB2 HIS 42 8.839 13.368 -19.219
223 HB3 HIS 42 HB3 HIS 42 8.481 13.804 -20.887
224 HD2 HIS 42 HD2 HIS 42 10.977 15.199 -22.021
225 HE1 HIS 42 HE1 HIS 42 13.383 12.366 -19.977
226 HE2 HIS 42 HE2 HIS 42 13.310 14.103 -21.800
227 H ARG 43 H ARG 43 7.387 16.853 -17.956
228 HA ARG 43 HA ARG 43 4.830 15.823 -18.335
229 HB2 ARG 43 HB2 ARG 43 4.014 17.788 -17.184
230 HB3 ARG 43 HB3 ARG 43 5.510 17.253 -16.430
231 HG2 ARG 43 HG2 ARG 43 6.722 18.991 -17.717
232 HG3 ARG 43 HG3 ARG 43 5.168 19.569 -18.321
233 HD2 ARG 43 HD2 ARG 43 4.451 19.939 -15.977
234 HD3 ARG 43 HD3 ARG 43 6.065 19.472 -15.443
235 HE ARG 43 HE ARG 43 5.281 21.978 -16.626
236 HH11 ARG 43 HH11 ARG 43 7.918 19.798 -15.980
237 HH12 ARG 43 HH12 ARG 43 9.132 21.031 -16.075
238 HH21 ARG 43 HH21 ARG 43 6.870 23.610 -16.753
239 HH22 ARG 43 HH22 ARG 43 8.535 23.199 -16.514
240 H LEU 44 H LEU 44 6.532 18.380 -20.044
241 HA LEU 44 HA LEU 44 4.434 19.542 -21.437
242 HB2 LEU 44 HB2 LEU 44 7.159 19.021 -22.599
243 HB3 LEU 44 HB3 LEU 44 6.049 20.331 -22.996
244 HG LEU 44 HG LEU 44 7.558 19.999 -20.403
245 HD11 LEU 44 HD11 LEU 44 7.890 22.273 -22.302
246 HD12 LEU 44 HD12 LEU 44 8.717 20.749 -22.623
247 HD13 LEU 44 HD13 LEU 44 9.021 21.616 -21.118
248 HD21 LEU 44 HD21 LEU 44 5.209 21.532 -21.087
249 HD22 LEU 44 HD22 LEU 44 6.543 22.582 -20.609
250 HD23 LEU 44 HD23 LEU 44 5.991 21.306 -19.522
251 H LYS 45 H LYS 45 4.091 19.335 -23.858
252 HA LYS 45 HA LYS 45 3.239 16.659 -24.415
253 HB2 LYS 45 HB2 LYS 45 2.735 19.299 -25.449
254 HB3 LYS 45 HB3 LYS 45 3.073 18.194 -26.774
255 HG2 LYS 45 HG2 LYS 45 1.360 16.684 -25.379
256 HG3 LYS 45 HG3 LYS 45 0.783 18.287 -24.915
257 HD2 LYS 45 HD2 LYS 45 1.196 17.373 -27.761
258 HD3 LYS 45 HD3 LYS 45 -0.356 17.359 -26.919
259 HE2 LYS 45 HE2 LYS 45 1.336 19.818 -27.349
260 HE3 LYS 45 HE3 LYS 45 -0.015 19.345 -28.378
261 HZ1 LYS 45 HZ1 LYS 45 -1.515 19.592 -26.558
262 HZ2 LYS 45 HZ2 LYS 45 -0.591 21.006 -26.656
263 HZ3 LYS 45 HZ3 LYS 45 -0.252 19.855 -25.464
264 H GLU 46 H GLU 46 5.375 18.867 -26.236
265 HA GLU 46 HA GLU 46 6.390 16.991 -28.008
266 HB2 GLU 46 HB2 GLU 46 6.923 19.696 -27.320
267 HB3 GLU 46 HB3 GLU 46 8.463 18.847 -27.355
268 HG2 GLU 46 HG2 GLU 46 6.910 18.082 -29.626
269 HG3 GLU 46 HG3 GLU 46 6.978 19.840 -29.522
270 H ASP 47 H ASP 47 7.226 17.607 -24.686
271 HA ASP 47 HA ASP 47 9.738 16.512 -24.462
272 HB2 ASP 47 HB2 ASP 47 7.392 16.701 -22.638
273 HB3 ASP 47 HB3 ASP 47 8.708 15.631 -22.162
274 H HIS 48 H HIS 48 6.647 14.758 -24.193
275 HA HIS 48 HA HIS 48 8.089 12.226 -24.454
276 HB2 HIS 48 HB2 HIS 48 5.935 11.183 -23.843
277 HB3 HIS 48 HB3 HIS 48 6.465 12.357 -22.643
278 HD1 HIS 48 HD1 HIS 48 4.912 14.271 -22.139
279 HD2 HIS 48 HD2 HIS 48 3.746 12.095 -25.480
280 HE1 HIS 48 HE1 HIS 48 2.631 15.140 -22.744
281 H HIS 49 H HIS 49 7.516 14.229 -26.656
282 HA HIS 49 HA HIS 49 6.856 14.256 -28.839
283 HB2 HIS 49 HB2 HIS 49 7.601 11.387 -28.360
284 HB3 HIS 49 HB3 HIS 49 6.995 11.897 -29.933
285 HD1 HIS 49 HD1 HIS 49 8.666 12.870 -31.503
286 HD2 HIS 49 HD2 HIS 49 10.041 12.812 -27.583
287 HE1 HIS 49 HE1 HIS 49 11.069 13.602 -31.622
288 H CYS 50 H CYS 50 4.687 14.582 -27.403
289 HA CYS 50 HA CYS 50 2.653 12.715 -27.420
290 HB2 CYS 50 HB2 CYS 50 2.705 15.095 -26.423
291 HB3 CYS 50 HB3 CYS 50 2.131 15.621 -28.003
292 H ARG 51 H ARG 51 1.568 11.704 -28.968
293 HA ARG 51 HA ARG 51 2.087 11.934 -31.674
294 HB2 ARG 51 HB2 ARG 51 0.332 10.424 -30.017
295 HB3 ARG 51 HB3 ARG 51 -0.609 11.054 -31.363
296 HG2 ARG 51 HG2 ARG 51 0.139 9.339 -32.551
297 HG3 ARG 51 HG3 ARG 51 1.722 10.119 -32.537
298 HD2 ARG 51 HD2 ARG 51 2.305 8.919 -30.496
299 HD3 ARG 51 HD3 ARG 51 0.712 8.165 -30.473
300 HE ARG 51 HE ARG 51 1.457 6.658 -32.017
301 HH11 ARG 51 HH11 ARG 51 3.583 9.414 -32.026
302 HH12 ARG 51 HH12 ARG 51 4.724 8.695 -33.113
303 HH21 ARG 51 HH21 ARG 51 2.951 5.700 -33.449
304 HH22 ARG 51 HH22 ARG 51 4.363 6.582 -33.923
305 H TRP 52 H TRP 52 -0.301 13.607 -29.714
306 HA TRP 52 HA TRP 52 -1.894 14.693 -31.721
307 HB2 TRP 52 HB2 TRP 52 -2.262 14.791 -29.205
308 HB3 TRP 52 HB3 TRP 52 -1.139 16.148 -29.186
309 HD1 TRP 52 HD1 TRP 52 -4.713 15.244 -30.022
310 HE1 TRP 52 HE1 TRP 52 -6.007 17.380 -30.646
311 HE3 TRP 52 HE3 TRP 52 -0.792 18.510 -30.320
312 HZ2 TRP 52 HZ2 TRP 52 -5.440 20.090 -31.193
313 HZ3 TRP 52 HZ3 TRP 52 -1.253 20.857 -30.899
314 HH2 TRP 52 HH2 TRP 52 -3.529 21.628 -31.327
315 H LEU 53 H LEU 53 1.108 15.933 -30.297
316 HA LEU 53 HA LEU 53 1.183 18.365 -31.700
317 HB2 LEU 53 HB2 LEU 53 2.943 16.821 -30.010
318 HB3 LEU 53 HB3 LEU 53 3.832 17.579 -31.329
319 HG LEU 53 HG LEU 53 2.128 18.988 -29.276
320 HD11 LEU 53 HD11 LEU 53 4.638 18.023 -28.948
321 HD12 LEU 53 HD12 LEU 53 3.998 19.445 -28.124
322 HD13 LEU 53 HD13 LEU 53 4.974 19.635 -29.581
323 HD21 LEU 53 HD21 LEU 53 1.904 20.533 -30.881
324 HD22 LEU 53 HD22 LEU 53 3.164 19.814 -31.884
325 HD23 LEU 53 HD23 LEU 53 3.600 20.895 -30.560
326 H LEU 54 H LEU 54 2.359 15.144 -32.515
327 HA LEU 54 HA LEU 54 3.714 15.950 -34.893
328 HB2 LEU 54 HB2 LEU 54 2.671 13.183 -34.454
329 HB3 LEU 54 HB3 LEU 54 4.157 13.701 -35.248
330 HG LEU 54 HG LEU 54 3.618 13.683 -32.279
331 HD11 LEU 54 HD11 LEU 54 4.818 11.790 -34.153
332 HD12 LEU 54 HD12 LEU 54 4.206 11.540 -32.519
333 HD13 LEU 54 HD13 LEU 54 5.837 12.166 -32.764
334 HD21 LEU 54 HD21 LEU 54 5.048 15.456 -32.422
335 HD22 LEU 54 HD22 LEU 54 5.772 14.897 -33.930
336 HD23 LEU 54 HD23 LEU 54 6.218 14.137 -32.402
337 H GLU 55 H GLU 55 0.489 14.744 -34.157
338 HA GLU 55 HA GLU 55 -0.396 14.213 -36.749
339 HB2 GLU 55 HB2 GLU 55 -1.544 14.397 -34.148
340 HB3 GLU 55 HB3 GLU 55 -2.552 15.322 -35.251
341 HG2 GLU 55 HG2 GLU 55 -1.683 12.594 -36.052
342 HG3 GLU 55 HG3 GLU 55 -2.964 12.767 -34.854
343 H HIS 56 H HIS 56 -0.197 17.234 -34.963
344 HA HIS 56 HA HIS 56 -1.369 18.682 -37.226
345 HB2 HIS 56 HB2 HIS 56 -0.853 19.393 -34.352
346 HB3 HIS 56 HB3 HIS 56 -1.131 20.652 -35.551
347 HD1 HIS 56 HD1 HIS 56 -3.470 21.408 -35.449
348 HD2 HIS 56 HD2 HIS 56 -3.148 17.327 -34.739
349 HE1 HIS 56 HE1 HIS 56 -5.826 20.597 -35.110
350 H GLU 57 H GLU 57 0.874 17.813 -38.145
351 HA GLU 57 HA GLU 57 2.979 19.781 -37.603
352 HB2 GLU 57 HB2 GLU 57 2.942 17.027 -38.749
353 HB3 GLU 57 HB3 GLU 57 4.215 18.125 -39.263
354 HG2 GLU 57 HG2 GLU 57 3.771 17.976 -36.361
355 HG3 GLU 57 HG3 GLU 57 4.380 16.506 -37.118
356 H GLU 58 H GLU 58 2.211 21.560 -38.728
357 HA GLU 58 HA GLU 58 2.017 21.231 -41.650
358 HB2 GLU 58 HB2 GLU 58 0.684 23.394 -41.547
359 HB3 GLU 58 HB3 GLU 58 -0.104 21.958 -40.909
360 HG2 GLU 58 HG2 GLU 58 1.379 23.376 -38.867
361 HG3 GLU 58 HG3 GLU 58 0.168 24.396 -39.642
362 H VAL 59 H VAL 59 4.504 21.496 -40.444
363 HA VAL 59 HA VAL 59 5.274 24.217 -41.276
364 HB VAL 59 HB VAL 59 7.183 24.036 -39.666
365 HG11 VAL 59 HG11 VAL 59 5.372 24.056 -37.620
366 HG12 VAL 59 HG12 VAL 59 5.743 25.430 -38.663
367 HG13 VAL 59 HG13 VAL 59 4.355 24.401 -39.018
368 HG21 VAL 59 HG21 VAL 59 7.509 22.262 -38.323
369 HG22 VAL 59 HG22 VAL 59 5.785 22.031 -38.038
370 HG23 VAL 59 HG23 VAL 59 6.527 21.405 -39.510
Start of MODEL 12
1 H MET 11 H MET 11 2.707 -1.296 3.070
2 HA MET 11 HA MET 11 3.425 1.323 2.164
3 HB2 MET 11 HB2 MET 11 4.812 -1.337 2.240
4 HB3 MET 11 HB3 MET 11 5.517 0.006 1.352
5 HG2 MET 11 HG2 MET 11 4.669 0.575 4.117
6 HG3 MET 11 HG3 MET 11 6.040 -0.516 3.924
7 HE1 MET 11 HE1 MET 11 8.911 1.712 3.500
8 HE2 MET 11 HE2 MET 11 8.077 0.940 4.849
9 HE3 MET 11 HE3 MET 11 8.292 0.070 3.329
10 H LEU 12 H LEU 12 3.034 2.157 0.229
11 HA LEU 12 HA LEU 12 3.056 0.429 -2.125
12 HB2 LEU 12 HB2 LEU 12 0.845 2.421 -1.750
13 HB3 LEU 12 HB3 LEU 12 0.968 1.127 -2.941
14 HG LEU 12 HG LEU 12 0.641 0.607 0.006
15 HD11 LEU 12 HD11 LEU 12 -1.477 0.914 -2.114
16 HD12 LEU 12 HD12 LEU 12 -1.271 1.893 -0.662
17 HD13 LEU 12 HD13 LEU 12 -1.748 0.201 -0.524
18 HD21 LEU 12 HD21 LEU 12 0.715 -1.547 -0.542
19 HD22 LEU 12 HD22 LEU 12 1.285 -1.045 -2.134
20 HD23 LEU 12 HD23 LEU 12 -0.436 -1.320 -1.859
21 H ASP 13 H ASP 13 2.228 2.276 -3.999
22 HA ASP 13 HA ASP 13 3.626 4.765 -3.660
23 HB2 ASP 13 HB2 ASP 13 5.033 2.504 -4.744
24 HB3 ASP 13 HB3 ASP 13 4.844 3.734 -5.992
25 H VAL 14 H VAL 14 1.922 5.925 -4.369
26 HA VAL 14 HA VAL 14 0.408 5.136 -6.695
27 HB VAL 14 HB VAL 14 -0.806 7.290 -6.327
28 HG11 VAL 14 HG11 VAL 14 -1.908 6.577 -4.270
29 HG12 VAL 14 HG12 VAL 14 -1.571 5.197 -5.318
30 HG13 VAL 14 HG13 VAL 14 -0.556 5.504 -3.908
31 HG21 VAL 14 HG21 VAL 14 0.078 8.900 -5.079
32 HG22 VAL 14 HG22 VAL 14 0.110 7.826 -3.680
33 HG23 VAL 14 HG23 VAL 14 1.487 7.882 -4.781
34 H GLY 15 H GLY 15 2.800 5.279 -7.717
35 HA2 GLY 15 HA2 GLY 15 2.882 7.888 -9.103
36 HA3 GLY 15 HA3 GLY 15 4.345 7.046 -8.615
37 H LYS 16 H LYS 16 3.206 7.893 -11.283
38 HA LYS 16 HA LYS 16 3.014 5.280 -12.600
39 HB2 LYS 16 HB2 LYS 16 1.753 7.795 -13.028
40 HB3 LYS 16 HB3 LYS 16 2.732 7.441 -14.445
41 HG2 LYS 16 HG2 LYS 16 0.912 6.327 -15.121
42 HG3 LYS 16 HG3 LYS 16 1.526 5.053 -14.065
43 HD2 LYS 16 HD2 LYS 16 -0.288 5.202 -12.788
44 HD3 LYS 16 HD3 LYS 16 0.026 6.916 -12.503
45 HE2 LYS 16 HE2 LYS 16 -2.027 7.054 -13.495
46 HE3 LYS 16 HE3 LYS 16 -0.997 7.149 -14.923
47 HZ1 LYS 16 HZ1 LYS 16 -2.554 5.566 -15.501
48 HZ2 LYS 16 HZ2 LYS 16 -2.609 4.880 -13.956
49 HZ3 LYS 16 HZ3 LYS 16 -1.271 4.607 -14.954
50 H HIS 17 H HIS 17 4.549 4.531 -13.956
51 HA HIS 17 HA HIS 17 7.066 5.971 -14.053
52 HB2 HIS 17 HB2 HIS 17 6.483 3.292 -15.308
53 HB3 HIS 17 HB3 HIS 17 8.042 3.940 -14.806
54 HD1 HIS 17 HD1 HIS 17 4.799 2.702 -13.281
55 HD2 HIS 17 HD2 HIS 17 8.792 3.258 -12.276
56 HE1 HIS 17 HE1 HIS 17 5.069 1.671 -11.003
57 H CYS 18 H CYS 18 7.972 6.887 -15.821
58 HA CYS 18 HA CYS 18 6.433 7.837 -17.903
59 HB2 CYS 18 HB2 CYS 18 8.764 8.582 -17.172
60 HB3 CYS 18 HB3 CYS 18 9.383 7.276 -18.179
61 H ALA 19 H ALA 19 6.238 7.297 -20.106
62 HA ALA 19 HA ALA 19 6.470 4.421 -20.619
63 HB1 ALA 19 HB1 ALA 19 4.417 4.663 -21.424
64 HB2 ALA 19 HB2 ALA 19 4.511 6.416 -21.256
65 HB3 ALA 19 HB3 ALA 19 5.086 5.640 -22.731
66 H TYR 20 H TYR 20 8.548 6.720 -20.902
67 HA TYR 20 HA TYR 20 9.473 5.878 -23.565
68 HB2 TYR 20 HB2 TYR 20 8.556 8.199 -23.627
69 HB3 TYR 20 HB3 TYR 20 9.767 8.671 -22.441
70 HD1 TYR 20 HD1 TYR 20 11.504 9.872 -23.348
71 HD2 TYR 20 HD2 TYR 20 9.782 6.731 -25.644
72 HE1 TYR 20 HE1 TYR 20 13.106 10.325 -25.159
73 HE2 TYR 20 HE2 TYR 20 11.380 7.174 -27.460
74 HH TYR 20 HH TYR 20 14.047 9.380 -27.064
75 H CYS 21 H CYS 21 10.331 7.163 -20.387
76 HA CYS 21 HA CYS 21 13.045 6.071 -20.749
77 HB2 CYS 21 HB2 CYS 21 13.914 7.757 -19.362
78 HB3 CYS 21 HB3 CYS 21 12.741 8.597 -20.371
79 H ARG 22 H ARG 22 10.124 5.746 -19.088
80 HA ARG 22 HA ARG 22 9.425 4.414 -17.382
81 HB2 ARG 22 HB2 ARG 22 11.940 3.108 -18.293
82 HB3 ARG 22 HB3 ARG 22 11.255 2.576 -16.763
83 HG2 ARG 22 HG2 ARG 22 9.212 2.742 -18.780
84 HG3 ARG 22 HG3 ARG 22 10.551 1.729 -19.322
85 HD2 ARG 22 HD2 ARG 22 10.285 0.815 -16.814
86 HD3 ARG 22 HD3 ARG 22 8.623 1.320 -17.118
87 HE ARG 22 HE ARG 22 9.522 -0.192 -19.301
88 HH11 ARG 22 HH11 ARG 22 8.706 -0.580 -15.939
89 HH12 ARG 22 HH12 ARG 22 8.217 -2.233 -16.114
90 HH21 ARG 22 HH21 ARG 22 8.881 -2.368 -19.544
91 HH22 ARG 22 HH22 ARG 22 8.318 -3.249 -18.165
92 H GLN 23 H GLN 23 9.841 6.568 -16.230
93 HA GLN 23 HA GLN 23 11.768 6.123 -14.045
94 HB2 GLN 23 HB2 GLN 23 12.514 8.013 -15.299
95 HB3 GLN 23 HB3 GLN 23 10.893 8.694 -15.358
96 HG2 GLN 23 HG2 GLN 23 11.029 9.565 -13.278
97 HG3 GLN 23 HG3 GLN 23 12.046 8.257 -12.676
98 HE21 GLN 23 HE21 GLN 23 13.997 8.884 -12.136
99 HE22 GLN 23 HE22 GLN 23 14.906 10.157 -12.869
100 H LEU 24 H LEU 24 10.822 5.691 -12.175
101 HA LEU 24 HA LEU 24 8.043 5.963 -11.734
102 HB2 LEU 24 HB2 LEU 24 9.669 4.334 -10.648
103 HB3 LEU 24 HB3 LEU 24 10.122 5.664 -9.584
104 HG LEU 24 HG LEU 24 7.272 4.748 -9.806
105 HD11 LEU 24 HD11 LEU 24 9.042 2.916 -9.183
106 HD12 LEU 24 HD12 LEU 24 7.544 3.073 -8.267
107 HD13 LEU 24 HD13 LEU 24 9.043 3.749 -7.629
108 HD21 LEU 24 HD21 LEU 24 7.003 6.465 -8.422
109 HD22 LEU 24 HD22 LEU 24 8.745 6.709 -8.289
110 HD23 LEU 24 HD23 LEU 24 7.930 5.564 -7.222
111 H ASP 25 H ASP 25 7.139 7.929 -11.689
112 HA ASP 25 HA ASP 25 8.387 9.986 -9.988
113 HB2 ASP 25 HB2 ASP 25 7.764 10.205 -12.638
114 HB3 ASP 25 HB3 ASP 25 6.310 10.856 -11.886
115 H PHE 26 H PHE 26 6.900 11.433 -8.852
116 HA PHE 26 HA PHE 26 4.702 9.916 -7.702
117 HB2 PHE 26 HB2 PHE 26 5.627 12.666 -6.877
118 HB3 PHE 26 HB3 PHE 26 4.721 11.497 -5.922
119 HD1 PHE 26 HD1 PHE 26 8.020 12.309 -7.331
120 HD2 PHE 26 HD2 PHE 26 5.818 9.755 -4.734
121 HE1 PHE 26 HE1 PHE 26 10.127 11.450 -6.396
122 HE2 PHE 26 HE2 PHE 26 7.922 8.893 -3.794
123 HZ PHE 26 HZ PHE 26 10.080 9.739 -4.625
124 H LEU 27 H LEU 27 5.249 12.825 -9.589
125 HA LEU 27 HA LEU 27 2.333 13.187 -9.798
126 HB2 LEU 27 HB2 LEU 27 3.295 15.514 -10.734
127 HB3 LEU 27 HB3 LEU 27 2.874 15.232 -9.046
128 HG LEU 27 HG LEU 27 5.265 14.726 -8.593
129 HD11 LEU 27 HD11 LEU 27 6.951 15.186 -10.203
130 HD12 LEU 27 HD12 LEU 27 5.771 15.817 -11.352
131 HD13 LEU 27 HD13 LEU 27 5.790 14.097 -10.962
132 HD21 LEU 27 HD21 LEU 27 5.504 16.865 -8.032
133 HD22 LEU 27 HD22 LEU 27 4.005 17.179 -8.906
134 HD23 LEU 27 HD23 LEU 27 5.558 17.374 -9.720
135 HA PRO 28 HA PRO 28 3.698 11.723 -13.947
136 HB2 PRO 28 HB2 PRO 28 1.442 10.287 -14.416
137 HB3 PRO 28 HB3 PRO 28 2.822 9.643 -13.518
138 HG2 PRO 28 HG2 PRO 28 0.258 10.792 -12.483
139 HG3 PRO 28 HG3 PRO 28 1.140 9.352 -11.939
140 HD2 PRO 28 HD2 PRO 28 1.279 11.723 -10.639
141 HD3 PRO 28 HD3 PRO 28 2.640 10.585 -10.698
142 H PHE 29 H PHE 29 3.367 12.963 -15.678
143 HA PHE 29 HA PHE 29 1.117 14.794 -15.727
144 HB2 PHE 29 HB2 PHE 29 3.682 14.529 -17.234
145 HB3 PHE 29 HB3 PHE 29 2.363 15.430 -17.974
146 HD1 PHE 29 HD1 PHE 29 1.834 17.613 -17.274
147 HD2 PHE 29 HD2 PHE 29 4.572 15.261 -15.019
148 HE1 PHE 29 HE1 PHE 29 2.453 19.599 -15.960
149 HE2 PHE 29 HE2 PHE 29 5.194 17.243 -13.701
150 HZ PHE 29 HZ PHE 29 4.136 19.416 -14.172
151 H HIS 30 H HIS 30 -0.751 13.943 -16.403
152 HA HIS 30 HA HIS 30 -0.842 11.880 -18.418
153 HB2 HIS 30 HB2 HIS 30 -2.418 11.821 -16.551
154 HB3 HIS 30 HB3 HIS 30 -3.065 13.388 -17.026
155 HD1 HIS 30 HD1 HIS 30 -3.069 9.774 -18.016
156 HD2 HIS 30 HD2 HIS 30 -4.879 13.341 -19.138
157 HE1 HIS 30 HE1 HIS 30 -4.922 9.122 -19.586
158 H CYS 31 H CYS 31 -0.911 12.221 -20.531
159 HA CYS 31 HA CYS 31 -1.317 14.901 -21.556
160 HB2 CYS 31 HB2 CYS 31 0.384 12.996 -22.327
161 HB3 CYS 31 HB3 CYS 31 -0.961 12.576 -23.382
162 H SER 32 H SER 32 -3.135 15.654 -22.429
163 HA SER 32 HA SER 32 -5.416 13.850 -22.660
164 HB2 SER 32 HB2 SER 32 -5.077 16.582 -21.904
165 HB3 SER 32 HB3 SER 32 -6.133 16.528 -23.315
166 HG SER 32 HG SER 32 -7.356 14.908 -22.142
167 H PHE 33 H PHE 33 -3.128 14.051 -24.623
168 HA PHE 33 HA PHE 33 -4.741 14.633 -27.020
169 HB2 PHE 33 HB2 PHE 33 -1.730 14.677 -26.966
170 HB3 PHE 33 HB3 PHE 33 -2.814 15.380 -28.162
171 HD1 PHE 33 HD1 PHE 33 -4.715 16.823 -26.439
172 HD2 PHE 33 HD2 PHE 33 -0.480 16.471 -26.194
173 HE1 PHE 33 HE1 PHE 33 -4.606 18.985 -25.269
174 HE2 PHE 33 HE2 PHE 33 -0.364 18.631 -25.023
175 HZ PHE 33 HZ PHE 33 -2.429 19.891 -24.558
176 H CYS 34 H CYS 34 -2.131 12.596 -25.733
177 HA CYS 34 HA CYS 34 -2.781 10.572 -27.765
178 HB2 CYS 34 HB2 CYS 34 -0.578 9.595 -27.242
179 HB3 CYS 34 HB3 CYS 34 -0.443 11.273 -27.759
180 H ASN 35 H ASN 35 -3.103 11.312 -24.473
181 HA ASN 35 HA ASN 35 -4.034 10.184 -22.729
182 HB2 ASN 35 HB2 ASN 35 -5.403 9.232 -24.801
183 HB3 ASN 35 HB3 ASN 35 -4.558 7.748 -24.369
184 HD21 ASN 35 HD21 ASN 35 -5.068 6.698 -22.487
185 HD22 ASN 35 HD22 ASN 35 -6.433 7.117 -21.515
186 H GLU 36 H GLU 36 -1.493 10.165 -22.476
187 HA GLU 36 HA GLU 36 -0.843 7.482 -21.548
188 HB2 GLU 36 HB2 GLU 36 0.787 9.016 -23.562
189 HB3 GLU 36 HB3 GLU 36 1.505 7.782 -22.535
190 HG2 GLU 36 HG2 GLU 36 -0.719 6.534 -23.582
191 HG3 GLU 36 HG3 GLU 36 -0.115 7.506 -24.923
192 H ASP 37 H ASP 37 0.840 7.434 -19.970
193 HA ASP 37 HA ASP 37 1.100 9.983 -18.553
194 HB2 ASP 37 HB2 ASP 37 1.863 8.536 -16.647
195 HB3 ASP 37 HB3 ASP 37 0.218 8.218 -17.189
196 H PHE 38 H PHE 38 3.051 10.884 -18.015
197 HA PHE 38 HA PHE 38 5.522 9.509 -18.659
198 HB2 PHE 38 HB2 PHE 38 4.816 12.123 -20.008
199 HB3 PHE 38 HB3 PHE 38 6.344 11.261 -20.151
200 HD1 PHE 38 HD1 PHE 38 6.290 8.921 -21.166
201 HD2 PHE 38 HD2 PHE 38 3.066 11.684 -21.470
202 HE1 PHE 38 HE1 PHE 38 5.405 7.671 -23.092
203 HE2 PHE 38 HE2 PHE 38 2.175 10.437 -23.396
204 HZ PHE 38 HZ PHE 38 3.345 8.428 -24.208
205 H CYS 39 H CYS 39 7.202 10.171 -17.418
206 HA CYS 39 HA CYS 39 6.803 11.529 -15.060
207 HB2 CYS 39 HB2 CYS 39 9.147 11.494 -14.751
208 HB3 CYS 39 HB3 CYS 39 8.794 10.087 -15.749
209 H SER 40 H SER 40 7.564 13.603 -14.306
210 HA SER 40 HA SER 40 6.611 15.762 -15.750
211 HB2 SER 40 HB2 SER 40 7.435 17.127 -14.038
212 HB3 SER 40 HB3 SER 40 7.258 15.566 -13.238
213 HG SER 40 HG SER 40 9.271 16.137 -12.712
214 H ASN 41 H ASN 41 9.837 14.371 -15.683
215 HA ASN 41 HA ASN 41 11.218 16.424 -16.999
216 HB2 ASN 41 HB2 ASN 41 11.804 13.839 -16.052
217 HB3 ASN 41 HB3 ASN 41 12.225 13.829 -17.762
218 HD21 ASN 41 HD21 ASN 41 12.776 15.436 -14.696
219 HD22 ASN 41 HD22 ASN 41 14.318 16.099 -15.107
220 H HIS 42 H HIS 42 9.075 13.958 -18.183
221 HA HIS 42 HA HIS 42 9.592 14.864 -20.939
222 HB2 HIS 42 HB2 HIS 42 8.760 12.158 -19.898
223 HB3 HIS 42 HB3 HIS 42 8.587 12.611 -21.591
224 HD2 HIS 42 HD2 HIS 42 11.338 13.660 -22.520
225 HE1 HIS 42 HE1 HIS 42 13.159 10.518 -20.326
226 HE2 HIS 42 HE2 HIS 42 13.471 12.248 -22.132
227 H ARG 43 H ARG 43 7.709 15.831 -18.773
228 HA ARG 43 HA ARG 43 5.070 15.153 -19.329
229 HB2 ARG 43 HB2 ARG 43 4.453 17.249 -18.279
230 HB3 ARG 43 HB3 ARG 43 5.790 16.520 -17.399
231 HG2 ARG 43 HG2 ARG 43 7.336 18.032 -18.641
232 HG3 ARG 43 HG3 ARG 43 5.916 18.835 -19.315
233 HD2 ARG 43 HD2 ARG 43 5.156 19.248 -16.958
234 HD3 ARG 43 HD3 ARG 43 6.725 18.651 -16.419
235 HE ARG 43 HE ARG 43 6.156 21.207 -17.616
236 HH11 ARG 43 HH11 ARG 43 8.600 18.814 -16.968
237 HH12 ARG 43 HH12 ARG 43 9.914 19.938 -17.075
238 HH21 ARG 43 HH21 ARG 43 7.877 22.697 -17.758
239 HH22 ARG 43 HH22 ARG 43 9.501 22.146 -17.523
240 H LEU 44 H LEU 44 7.218 17.432 -20.933
241 HA LEU 44 HA LEU 44 5.434 18.851 -22.488
242 HB2 LEU 44 HB2 LEU 44 8.097 17.843 -23.465
243 HB3 LEU 44 HB3 LEU 44 7.242 19.296 -23.981
244 HG LEU 44 HG LEU 44 8.503 18.849 -21.275
245 HD11 LEU 44 HD11 LEU 44 9.342 20.415 -23.698
246 HD12 LEU 44 HD12 LEU 44 10.243 19.174 -22.827
247 HD13 LEU 44 HD13 LEU 44 9.969 20.749 -22.083
248 HD21 LEU 44 HD21 LEU 44 7.225 20.507 -20.546
249 HD22 LEU 44 HD22 LEU 44 6.460 20.653 -22.128
250 HD23 LEU 44 HD23 LEU 44 7.927 21.565 -21.770
251 H LYS 45 H LYS 45 5.197 18.629 -24.924
252 HA LYS 45 HA LYS 45 3.930 16.120 -25.471
253 HB2 LYS 45 HB2 LYS 45 3.999 18.774 -26.636
254 HB3 LYS 45 HB3 LYS 45 4.116 17.533 -27.877
255 HG2 LYS 45 HG2 LYS 45 2.046 16.600 -27.296
256 HG3 LYS 45 HG3 LYS 45 2.001 17.452 -25.751
257 HD2 LYS 45 HD2 LYS 45 0.691 18.926 -26.816
258 HD3 LYS 45 HD3 LYS 45 2.189 19.513 -27.542
259 HE2 LYS 45 HE2 LYS 45 1.473 18.911 -29.555
260 HE3 LYS 45 HE3 LYS 45 1.286 17.244 -29.012
261 HZ1 LYS 45 HZ1 LYS 45 -0.877 17.547 -29.332
262 HZ2 LYS 45 HZ2 LYS 45 -0.714 19.221 -29.509
263 HZ3 LYS 45 HZ3 LYS 45 -0.875 18.546 -27.967
264 H GLU 46 H GLU 46 6.509 17.871 -27.214
265 HA GLU 46 HA GLU 46 7.284 15.787 -28.873
266 HB2 GLU 46 HB2 GLU 46 9.413 16.985 -29.132
267 HB3 GLU 46 HB3 GLU 46 8.039 18.080 -29.210
268 HG2 GLU 46 HG2 GLU 46 9.227 19.318 -27.784
269 HG3 GLU 46 HG3 GLU 46 8.632 18.187 -26.570
270 H ASP 47 H ASP 47 8.057 16.394 -25.530
271 HA ASP 47 HA ASP 47 10.325 14.888 -25.138
272 HB2 ASP 47 HB2 ASP 47 7.972 15.568 -23.444
273 HB3 ASP 47 HB3 ASP 47 9.054 14.305 -22.863
274 H HIS 48 H HIS 48 6.963 13.716 -24.968
275 HA HIS 48 HA HIS 48 7.948 10.962 -25.068
276 HB2 HIS 48 HB2 HIS 48 5.659 10.319 -24.474
277 HB3 HIS 48 HB3 HIS 48 6.292 11.504 -23.336
278 HD1 HIS 48 HD1 HIS 48 5.001 13.645 -23.067
279 HD2 HIS 48 HD2 HIS 48 3.708 11.389 -26.307
280 HE1 HIS 48 HE1 HIS 48 2.900 14.768 -23.872
281 H HIS 49 H HIS 49 7.795 12.955 -27.358
282 HA HIS 49 HA HIS 49 7.192 13.021 -29.559
283 HB2 HIS 49 HB2 HIS 49 7.249 10.020 -29.178
284 HB3 HIS 49 HB3 HIS 49 7.311 10.852 -30.728
285 HD1 HIS 49 HD1 HIS 49 9.535 12.002 -31.369
286 HD2 HIS 49 HD2 HIS 49 9.634 10.029 -27.714
287 HE1 HIS 49 HE1 HIS 49 11.967 11.870 -30.742
288 H CYS 50 H CYS 50 5.041 13.700 -28.271
289 HA CYS 50 HA CYS 50 2.777 12.125 -28.262
290 HB2 CYS 50 HB2 CYS 50 3.102 14.534 -27.414
291 HB3 CYS 50 HB3 CYS 50 2.689 15.029 -29.052
292 H ARG 51 H ARG 51 1.509 11.249 -29.766
293 HA ARG 51 HA ARG 51 2.171 11.112 -32.447
294 HB2 ARG 51 HB2 ARG 51 -0.245 10.371 -32.763
295 HB3 ARG 51 HB3 ARG 51 0.713 9.460 -31.603
296 HG2 ARG 51 HG2 ARG 51 -0.723 9.906 -29.979
297 HG3 ARG 51 HG3 ARG 51 -0.616 11.640 -30.292
298 HD2 ARG 51 HD2 ARG 51 -2.905 10.904 -30.539
299 HD3 ARG 51 HD3 ARG 51 -2.262 11.386 -32.108
300 HE ARG 51 HE ARG 51 -2.528 9.234 -32.837
301 HH11 ARG 51 HH11 ARG 51 -2.700 9.288 -29.360
302 HH12 ARG 51 HH12 ARG 51 -3.183 7.629 -29.228
303 HH21 ARG 51 HH21 ARG 51 -3.164 7.049 -32.676
304 HH22 ARG 51 HH22 ARG 51 -3.446 6.356 -31.114
305 H TRP 52 H TRP 52 0.094 13.404 -30.780
306 HA TRP 52 HA TRP 52 -1.116 14.594 -33.007
307 HB2 TRP 52 HB2 TRP 52 -1.684 14.927 -30.544
308 HB3 TRP 52 HB3 TRP 52 -0.347 16.073 -30.492
309 HD1 TRP 52 HD1 TRP 52 -3.932 15.717 -31.655
310 HE1 TRP 52 HE1 TRP 52 -4.773 17.991 -32.518
311 HE3 TRP 52 HE3 TRP 52 0.501 18.263 -31.684
312 HZ2 TRP 52 HZ2 TRP 52 -3.699 20.529 -33.131
313 HZ3 TRP 52 HZ3 TRP 52 0.508 20.610 -32.423
314 HH2 TRP 52 HH2 TRP 52 -1.549 21.717 -33.132
315 H LEU 53 H LEU 53 1.968 15.248 -31.415
316 HA LEU 53 HA LEU 53 2.627 17.577 -32.856
317 HB2 LEU 53 HB2 LEU 53 3.921 15.765 -31.012
318 HB3 LEU 53 HB3 LEU 53 5.029 16.291 -32.278
319 HG LEU 53 HG LEU 53 3.509 18.072 -30.375
320 HD11 LEU 53 HD11 LEU 53 5.512 18.436 -29.261
321 HD12 LEU 53 HD12 LEU 53 6.483 17.810 -30.592
322 HD13 LEU 53 HD13 LEU 53 5.547 16.704 -29.588
323 HD21 LEU 53 HD21 LEU 53 5.215 18.650 -32.768
324 HD22 LEU 53 HD22 LEU 53 5.113 19.796 -31.431
325 HD23 LEU 53 HD23 LEU 53 3.656 19.340 -32.316
326 H LEU 54 H LEU 54 3.086 14.158 -33.534
327 HA LEU 54 HA LEU 54 4.780 14.542 -35.795
328 HB2 LEU 54 HB2 LEU 54 3.050 12.132 -35.427
329 HB3 LEU 54 HB3 LEU 54 4.675 12.244 -36.100
330 HG LEU 54 HG LEU 54 3.918 12.437 -33.186
331 HD11 LEU 54 HD11 LEU 54 5.774 10.413 -33.597
332 HD12 LEU 54 HD12 LEU 54 4.630 10.246 -34.928
333 HD13 LEU 54 HD13 LEU 54 4.053 10.222 -33.261
334 HD21 LEU 54 HD21 LEU 54 6.559 12.225 -33.115
335 HD22 LEU 54 HD22 LEU 54 5.750 13.790 -33.197
336 HD23 LEU 54 HD23 LEU 54 6.417 13.064 -34.660
337 H GLU 55 H GLU 55 1.350 13.603 -35.506
338 HA GLU 55 HA GLU 55 0.783 13.685 -38.252
339 HB2 GLU 55 HB2 GLU 55 -1.555 13.694 -37.612
340 HB3 GLU 55 HB3 GLU 55 -0.662 12.594 -36.570
341 HG2 GLU 55 HG2 GLU 55 -0.535 14.535 -34.921
342 HG3 GLU 55 HG3 GLU 55 -1.774 15.298 -35.915
343 H HIS 56 H HIS 56 0.734 16.180 -35.778
344 HA HIS 56 HA HIS 56 0.234 18.169 -37.892
345 HB2 HIS 56 HB2 HIS 56 -1.054 17.827 -35.249
346 HB3 HIS 56 HB3 HIS 56 -0.632 19.479 -35.690
347 HD1 HIS 56 HD1 HIS 56 -1.655 20.284 -38.077
348 HD2 HIS 56 HD2 HIS 56 -3.384 16.935 -36.329
349 HE1 HIS 56 HE1 HIS 56 -3.881 20.006 -39.214
350 H GLU 57 H GLU 57 2.556 18.280 -38.087
351 HA GLU 57 HA GLU 57 4.107 19.204 -35.837
352 HB2 GLU 57 HB2 GLU 57 4.633 18.238 -38.540
353 HB3 GLU 57 HB3 GLU 57 5.649 19.605 -38.102
354 HG2 GLU 57 HG2 GLU 57 5.735 17.967 -35.875
355 HG3 GLU 57 HG3 GLU 57 5.774 16.849 -37.238
356 H GLU 58 H GLU 58 3.084 21.157 -35.277
357 HA GLU 58 HA GLU 58 2.440 23.265 -36.944
358 HB2 GLU 58 HB2 GLU 58 2.656 24.710 -34.965
359 HB3 GLU 58 HB3 GLU 58 1.802 23.218 -34.596
360 HG2 GLU 58 HG2 GLU 58 3.446 22.442 -33.242
361 HG3 GLU 58 HG3 GLU 58 4.726 23.251 -34.144
362 H VAL 59 H VAL 59 3.507 25.176 -37.557
363 HA VAL 59 HA VAL 59 6.444 25.111 -37.369
364 HB VAL 59 HB VAL 59 5.746 24.339 -39.607
365 HG11 VAL 59 HG11 VAL 59 4.589 25.769 -41.137
366 HG12 VAL 59 HG12 VAL 59 3.627 25.661 -39.661
367 HG13 VAL 59 HG13 VAL 59 4.596 27.100 -39.981
368 HG21 VAL 59 HG21 VAL 59 7.842 25.670 -39.190
369 HG22 VAL 59 HG22 VAL 59 7.241 25.709 -40.847
370 HG23 VAL 59 HG23 VAL 59 6.970 27.085 -39.779
Start of MODEL 13
1 H MET 11 H MET 11 1.884 -2.903 -0.571
2 HA MET 11 HA MET 11 2.990 -1.105 -2.422
3 HB2 MET 11 HB2 MET 11 2.733 -4.087 -2.299
4 HB3 MET 11 HB3 MET 11 3.334 -3.328 -3.767
5 HG2 MET 11 HG2 MET 11 5.268 -3.816 -2.614
6 HG3 MET 11 HG3 MET 11 4.988 -2.125 -2.205
7 HE1 MET 11 HE1 MET 11 6.038 -2.528 1.287
8 HE2 MET 11 HE2 MET 11 6.473 -2.048 -0.353
9 HE3 MET 11 HE3 MET 11 5.057 -1.341 0.427
10 H LEU 12 H LEU 12 0.777 -0.043 -2.789
11 HA LEU 12 HA LEU 12 -0.248 -1.049 -5.335
12 HB2 LEU 12 HB2 LEU 12 -2.576 -0.315 -4.460
13 HB3 LEU 12 HB3 LEU 12 -1.944 -1.907 -4.043
14 HG LEU 12 HG LEU 12 -1.422 0.290 -2.123
15 HD11 LEU 12 HD11 LEU 12 -3.721 -0.262 -1.114
16 HD12 LEU 12 HD12 LEU 12 -4.146 -0.793 -2.741
17 HD13 LEU 12 HD13 LEU 12 -3.647 0.875 -2.460
18 HD21 LEU 12 HD21 LEU 12 -2.555 -2.216 -1.183
19 HD22 LEU 12 HD22 LEU 12 -1.048 -1.416 -0.736
20 HD23 LEU 12 HD23 LEU 12 -1.109 -2.449 -2.165
21 H ASP 13 H ASP 13 0.059 0.541 -6.734
22 HA ASP 13 HA ASP 13 0.178 2.607 -7.679
23 HB2 ASP 13 HB2 ASP 13 -1.741 3.535 -5.545
24 HB3 ASP 13 HB3 ASP 13 -1.552 4.159 -7.182
25 H VAL 14 H VAL 14 2.309 3.066 -7.178
26 HA VAL 14 HA VAL 14 2.675 4.966 -4.959
27 HB VAL 14 HB VAL 14 3.641 2.667 -4.479
28 HG11 VAL 14 HG11 VAL 14 6.020 3.285 -6.086
29 HG12 VAL 14 HG12 VAL 14 5.236 1.738 -5.762
30 HG13 VAL 14 HG13 VAL 14 4.600 2.805 -7.014
31 HG21 VAL 14 HG21 VAL 14 6.047 4.056 -4.190
32 HG22 VAL 14 HG22 VAL 14 4.787 5.290 -4.137
33 HG23 VAL 14 HG23 VAL 14 4.740 3.932 -3.013
34 H GLY 15 H GLY 15 2.237 5.286 -7.886
35 HA2 GLY 15 HA2 GLY 15 3.147 7.343 -8.904
36 HA3 GLY 15 HA3 GLY 15 4.743 6.732 -8.492
37 H LYS 16 H LYS 16 3.670 7.520 -11.096
38 HA LYS 16 HA LYS 16 3.681 4.948 -12.517
39 HB2 LYS 16 HB2 LYS 16 2.204 7.359 -12.865
40 HB3 LYS 16 HB3 LYS 16 3.217 7.137 -14.285
41 HG2 LYS 16 HG2 LYS 16 1.754 5.684 -15.077
42 HG3 LYS 16 HG3 LYS 16 2.069 4.630 -13.696
43 HD2 LYS 16 HD2 LYS 16 0.382 5.950 -12.406
44 HD3 LYS 16 HD3 LYS 16 -0.007 6.809 -13.899
45 HE2 LYS 16 HE2 LYS 16 -0.231 3.832 -13.464
46 HE3 LYS 16 HE3 LYS 16 -1.573 4.974 -13.467
47 HZ1 LYS 16 HZ1 LYS 16 -1.710 4.672 -15.642
48 HZ2 LYS 16 HZ2 LYS 16 -0.321 3.707 -15.660
49 HZ3 LYS 16 HZ3 LYS 16 -0.187 5.385 -15.827
50 H HIS 17 H HIS 17 5.278 4.408 -13.906
51 HA HIS 17 HA HIS 17 7.656 6.076 -13.908
52 HB2 HIS 17 HB2 HIS 17 7.327 3.397 -15.255
53 HB3 HIS 17 HB3 HIS 17 8.821 4.173 -14.739
54 HD1 HIS 17 HD1 HIS 17 5.714 2.607 -13.233
55 HD2 HIS 17 HD2 HIS 17 9.654 3.473 -12.242
56 HE1 HIS 17 HE1 HIS 17 6.095 1.535 -10.990
57 H CYS 18 H CYS 18 8.530 7.085 -15.654
58 HA CYS 18 HA CYS 18 6.930 8.011 -17.701
59 HB2 CYS 18 HB2 CYS 18 9.211 8.875 -16.952
60 HB3 CYS 18 HB3 CYS 18 9.910 7.638 -17.991
61 H ALA 19 H ALA 19 6.721 7.521 -19.903
62 HA ALA 19 HA ALA 19 7.162 4.690 -20.525
63 HB1 ALA 19 HB1 ALA 19 5.089 4.790 -21.306
64 HB2 ALA 19 HB2 ALA 19 5.032 6.531 -21.031
65 HB3 ALA 19 HB3 ALA 19 5.641 5.899 -22.561
66 H TYR 20 H TYR 20 9.072 7.120 -20.751
67 HA TYR 20 HA TYR 20 9.983 6.468 -23.471
68 HB2 TYR 20 HB2 TYR 20 8.900 8.745 -23.331
69 HB3 TYR 20 HB3 TYR 20 10.196 9.219 -22.240
70 HD1 TYR 20 HD1 TYR 20 12.281 9.921 -23.077
71 HD2 TYR 20 HD2 TYR 20 9.503 8.026 -25.683
72 HE1 TYR 20 HE1 TYR 20 13.691 10.515 -25.003
73 HE2 TYR 20 HE2 TYR 20 10.906 8.614 -27.616
74 HH TYR 20 HH TYR 20 12.612 10.225 -28.229
75 H CYS 21 H CYS 21 10.828 7.636 -20.247
76 HA CYS 21 HA CYS 21 13.594 6.732 -20.718
77 HB2 CYS 21 HB2 CYS 21 14.403 8.416 -19.293
78 HB3 CYS 21 HB3 CYS 21 13.159 9.222 -20.243
79 H ARG 22 H ARG 22 10.738 6.202 -18.988
80 HA ARG 22 HA ARG 22 10.158 4.750 -17.337
81 HB2 ARG 22 HB2 ARG 22 12.934 3.620 -17.730
82 HB3 ARG 22 HB3 ARG 22 11.586 2.819 -16.934
83 HG2 ARG 22 HG2 ARG 22 11.225 3.721 -19.741
84 HG3 ARG 22 HG3 ARG 22 12.225 2.300 -19.433
85 HD2 ARG 22 HD2 ARG 22 9.442 2.629 -18.336
86 HD3 ARG 22 HD3 ARG 22 9.782 1.856 -19.883
87 HE ARG 22 HE ARG 22 11.378 0.571 -18.053
88 HH11 ARG 22 HH11 ARG 22 7.966 1.133 -18.457
89 HH12 ARG 22 HH12 ARG 22 7.498 -0.340 -17.674
90 HH21 ARG 22 HH21 ARG 22 10.774 -1.371 -17.019
91 HH22 ARG 22 HH22 ARG 22 9.096 -1.763 -16.855
92 H GLN 23 H GLN 23 10.426 6.897 -16.127
93 HA GLN 23 HA GLN 23 12.402 6.537 -13.971
94 HB2 GLN 23 HB2 GLN 23 12.991 8.514 -15.171
95 HB3 GLN 23 HB3 GLN 23 11.322 9.069 -15.204
96 HG2 GLN 23 HG2 GLN 23 11.356 9.724 -12.989
97 HG3 GLN 23 HG3 GLN 23 12.720 8.679 -12.595
98 HE21 GLN 23 HE21 GLN 23 14.279 9.982 -11.925
99 HE22 GLN 23 HE22 GLN 23 14.855 11.380 -12.761
100 H LEU 24 H LEU 24 11.510 5.976 -12.109
101 HA LEU 24 HA LEU 24 8.730 5.999 -11.632
102 HB2 LEU 24 HB2 LEU 24 10.137 4.398 -10.536
103 HB3 LEU 24 HB3 LEU 24 11.074 5.678 -9.768
104 HG LEU 24 HG LEU 24 9.128 6.275 -8.401
105 HD11 LEU 24 HD11 LEU 24 7.570 3.900 -8.859
106 HD12 LEU 24 HD12 LEU 24 7.698 4.858 -10.334
107 HD13 LEU 24 HD13 LEU 24 7.068 5.590 -8.858
108 HD21 LEU 24 HD21 LEU 24 10.204 3.486 -8.357
109 HD22 LEU 24 HD22 LEU 24 8.981 3.984 -7.187
110 HD23 LEU 24 HD23 LEU 24 10.527 4.831 -7.262
111 H ASP 25 H ASP 25 7.596 7.822 -11.463
112 HA ASP 25 HA ASP 25 8.667 9.969 -9.750
113 HB2 ASP 25 HB2 ASP 25 7.422 11.573 -11.099
114 HB3 ASP 25 HB3 ASP 25 8.500 10.629 -12.125
115 H PHE 26 H PHE 26 7.096 11.202 -8.537
116 HA PHE 26 HA PHE 26 5.008 9.490 -7.482
117 HB2 PHE 26 HB2 PHE 26 5.706 12.289 -6.591
118 HB3 PHE 26 HB3 PHE 26 4.847 11.053 -5.678
119 HD1 PHE 26 HD1 PHE 26 8.128 12.086 -6.980
120 HD2 PHE 26 HD2 PHE 26 6.014 9.363 -4.482
121 HE1 PHE 26 HE1 PHE 26 10.256 11.342 -5.995
122 HE2 PHE 26 HE2 PHE 26 8.140 8.616 -3.493
123 HZ PHE 26 HZ PHE 26 10.264 9.605 -4.250
124 H LEU 27 H LEU 27 5.295 12.575 -9.172
125 HA LEU 27 HA LEU 27 2.366 12.641 -9.456
126 HB2 LEU 27 HB2 LEU 27 4.368 14.679 -8.961
127 HB3 LEU 27 HB3 LEU 27 3.358 15.073 -10.351
128 HG LEU 27 HG LEU 27 2.145 14.313 -7.713
129 HD11 LEU 27 HD11 LEU 27 2.929 16.159 -6.769
130 HD12 LEU 27 HD12 LEU 27 2.037 17.095 -7.968
131 HD13 LEU 27 HD13 LEU 27 3.717 16.653 -8.267
132 HD21 LEU 27 HD21 LEU 27 0.993 16.278 -9.615
133 HD22 LEU 27 HD22 LEU 27 0.192 15.093 -8.584
134 HD23 LEU 27 HD23 LEU 27 0.973 14.576 -10.079
135 HA PRO 28 HA PRO 28 3.875 11.443 -13.634
136 HB2 PRO 28 HB2 PRO 28 1.725 9.880 -14.189
137 HB3 PRO 28 HB3 PRO 28 3.132 9.295 -13.292
138 HG2 PRO 28 HG2 PRO 28 0.484 10.236 -12.260
139 HG3 PRO 28 HG3 PRO 28 1.450 8.839 -11.752
140 HD2 PRO 28 HD2 PRO 28 1.413 11.166 -10.368
141 HD3 PRO 28 HD3 PRO 28 2.848 10.122 -10.444
142 H PHE 29 H PHE 29 3.487 12.718 -15.326
143 HA PHE 29 HA PHE 29 1.156 14.431 -15.342
144 HB2 PHE 29 HB2 PHE 29 3.695 14.276 -16.917
145 HB3 PHE 29 HB3 PHE 29 2.331 15.168 -17.583
146 HD1 PHE 29 HD1 PHE 29 1.686 17.278 -16.703
147 HD2 PHE 29 HD2 PHE 29 4.730 14.991 -14.800
148 HE1 PHE 29 HE1 PHE 29 2.303 19.235 -15.345
149 HE2 PHE 29 HE2 PHE 29 5.351 16.944 -13.438
150 HZ PHE 29 HZ PHE 29 4.136 19.069 -13.709
151 H HIS 30 H HIS 30 -0.692 13.548 -16.023
152 HA HIS 30 HA HIS 30 -0.734 11.495 -18.053
153 HB2 HIS 30 HB2 HIS 30 -2.301 11.277 -16.242
154 HB3 HIS 30 HB3 HIS 30 -2.933 12.896 -16.526
155 HD1 HIS 30 HD1 HIS 30 -3.319 9.385 -17.557
156 HD2 HIS 30 HD2 HIS 30 -4.545 13.122 -18.894
157 HE1 HIS 30 HE1 HIS 30 -5.169 8.937 -19.200
158 H CYS 31 H CYS 31 -0.828 11.858 -20.161
159 HA CYS 31 HA CYS 31 -1.346 14.533 -21.151
160 HB2 CYS 31 HB2 CYS 31 0.393 12.634 -21.956
161 HB3 CYS 31 HB3 CYS 31 -0.940 12.298 -23.056
162 H SER 32 H SER 32 -3.174 15.220 -22.073
163 HA SER 32 HA SER 32 -5.405 13.348 -22.257
164 HB2 SER 32 HB2 SER 32 -5.302 15.864 -21.259
165 HB3 SER 32 HB3 SER 32 -5.838 16.205 -22.904
166 HG SER 32 HG SER 32 -7.690 15.222 -22.523
167 H PHE 33 H PHE 33 -3.100 13.650 -24.233
168 HA PHE 33 HA PHE 33 -4.754 14.063 -26.637
169 HB2 PHE 33 HB2 PHE 33 -1.755 14.323 -26.595
170 HB3 PHE 33 HB3 PHE 33 -2.890 14.922 -27.801
171 HD1 PHE 33 HD1 PHE 33 -4.882 16.265 -26.102
172 HD2 PHE 33 HD2 PHE 33 -0.633 16.212 -25.861
173 HE1 PHE 33 HE1 PHE 33 -4.922 18.452 -24.976
174 HE2 PHE 33 HE2 PHE 33 -0.666 18.399 -24.734
175 HZ PHE 33 HZ PHE 33 -2.812 19.523 -24.291
176 H CYS 34 H CYS 34 -2.000 12.248 -25.318
177 HA CYS 34 HA CYS 34 -2.509 10.139 -27.302
178 HB2 CYS 34 HB2 CYS 34 -0.244 9.343 -26.805
179 HB3 CYS 34 HB3 CYS 34 -0.224 11.033 -27.297
180 H ASN 35 H ASN 35 -2.821 10.922 -24.007
181 HA ASN 35 HA ASN 35 -3.654 9.770 -22.229
182 HB2 ASN 35 HB2 ASN 35 -5.015 8.720 -24.256
183 HB3 ASN 35 HB3 ASN 35 -4.082 7.289 -23.829
184 HD21 ASN 35 HD21 ASN 35 -5.450 6.001 -22.808
185 HD22 ASN 35 HD22 ASN 35 -6.443 6.449 -21.467
186 H GLU 36 H GLU 36 -1.112 9.888 -22.027
187 HA GLU 36 HA GLU 36 -0.299 7.252 -21.090
188 HB2 GLU 36 HB2 GLU 36 1.211 8.864 -23.137
189 HB3 GLU 36 HB3 GLU 36 2.011 7.675 -22.118
190 HG2 GLU 36 HG2 GLU 36 -0.160 6.306 -23.126
191 HG3 GLU 36 HG3 GLU 36 0.373 7.303 -24.479
192 H ASP 37 H ASP 37 1.428 7.312 -19.551
193 HA ASP 37 HA ASP 37 1.553 9.875 -18.142
194 HB2 ASP 37 HB2 ASP 37 1.898 7.017 -17.327
195 HB3 ASP 37 HB3 ASP 37 2.663 8.279 -16.365
196 H PHE 38 H PHE 38 3.454 10.900 -17.646
197 HA PHE 38 HA PHE 38 5.992 9.687 -18.357
198 HB2 PHE 38 HB2 PHE 38 5.104 12.272 -19.653
199 HB3 PHE 38 HB3 PHE 38 6.666 11.487 -19.857
200 HD1 PHE 38 HD1 PHE 38 6.721 9.198 -20.941
201 HD2 PHE 38 HD2 PHE 38 3.300 11.728 -21.025
202 HE1 PHE 38 HE1 PHE 38 5.835 7.930 -22.854
203 HE2 PHE 38 HE2 PHE 38 2.407 10.463 -22.938
204 HZ PHE 38 HZ PHE 38 3.675 8.561 -23.854
205 H CYS 39 H CYS 39 7.644 10.422 -17.128
206 HA CYS 39 HA CYS 39 7.215 11.745 -14.756
207 HB2 CYS 39 HB2 CYS 39 9.567 11.847 -14.493
208 HB3 CYS 39 HB3 CYS 39 9.266 10.417 -15.476
209 H SER 40 H SER 40 7.980 13.853 -14.012
210 HA SER 40 HA SER 40 6.838 15.974 -15.375
211 HB2 SER 40 HB2 SER 40 7.566 17.295 -13.642
212 HB3 SER 40 HB3 SER 40 7.804 15.712 -12.902
213 HG SER 40 HG SER 40 9.657 17.575 -13.725
214 H ASN 41 H ASN 41 10.114 14.720 -15.534
215 HA ASN 41 HA ASN 41 11.298 16.850 -16.935
216 HB2 ASN 41 HB2 ASN 41 12.087 14.304 -16.007
217 HB3 ASN 41 HB3 ASN 41 12.433 14.328 -17.734
218 HD21 ASN 41 HD21 ASN 41 12.934 16.087 -14.724
219 HD22 ASN 41 HD22 ASN 41 14.439 16.801 -15.181
220 H HIS 42 H HIS 42 9.243 14.243 -17.959
221 HA HIS 42 HA HIS 42 9.531 15.147 -20.749
222 HB2 HIS 42 HB2 HIS 42 8.959 12.394 -19.653
223 HB3 HIS 42 HB3 HIS 42 8.684 12.822 -21.339
224 HD2 HIS 42 HD2 HIS 42 11.264 13.948 -22.488
225 HE1 HIS 42 HE1 HIS 42 13.480 11.161 -20.182
226 HE2 HIS 42 HE2 HIS 42 13.533 12.759 -22.130
227 H ARG 43 H ARG 43 7.715 15.991 -18.480
228 HA ARG 43 HA ARG 43 5.105 15.097 -18.897
229 HB2 ARG 43 HB2 ARG 43 4.393 17.173 -17.812
230 HB3 ARG 43 HB3 ARG 43 5.758 16.455 -16.967
231 HG2 ARG 43 HG2 ARG 43 7.195 18.058 -18.380
232 HG3 ARG 43 HG3 ARG 43 5.678 18.912 -18.668
233 HD2 ARG 43 HD2 ARG 43 6.276 18.199 -15.864
234 HD3 ARG 43 HD3 ARG 43 7.304 19.431 -16.594
235 HE ARG 43 HE ARG 43 4.530 19.934 -17.040
236 HH11 ARG 43 HH11 ARG 43 7.102 20.228 -14.713
237 HH12 ARG 43 HH12 ARG 43 6.379 21.569 -13.888
238 HH21 ARG 43 HH21 ARG 43 3.567 21.700 -15.963
239 HH22 ARG 43 HH22 ARG 43 4.368 22.405 -14.600
240 H LEU 44 H LEU 44 6.951 17.630 -20.516
241 HA LEU 44 HA LEU 44 4.967 18.884 -21.963
242 HB2 LEU 44 HB2 LEU 44 7.692 18.204 -23.046
243 HB3 LEU 44 HB3 LEU 44 6.660 19.554 -23.515
244 HG LEU 44 HG LEU 44 8.024 19.224 -20.843
245 HD11 LEU 44 HD11 LEU 44 9.682 20.604 -21.552
246 HD12 LEU 44 HD12 LEU 44 8.648 21.437 -22.711
247 HD13 LEU 44 HD13 LEU 44 9.293 19.842 -23.094
248 HD21 LEU 44 HD21 LEU 44 6.575 21.638 -21.902
249 HD22 LEU 44 HD22 LEU 44 7.177 21.354 -20.268
250 HD23 LEU 44 HD23 LEU 44 5.802 20.430 -20.875
251 H LYS 45 H LYS 45 4.543 18.700 -24.334
252 HA LYS 45 HA LYS 45 3.583 16.084 -24.933
253 HB2 LYS 45 HB2 LYS 45 3.238 18.750 -25.951
254 HB3 LYS 45 HB3 LYS 45 3.549 17.648 -27.286
255 HG2 LYS 45 HG2 LYS 45 1.729 16.228 -25.878
256 HG3 LYS 45 HG3 LYS 45 1.210 17.879 -25.530
257 HD2 LYS 45 HD2 LYS 45 1.808 17.000 -28.335
258 HD3 LYS 45 HD3 LYS 45 0.233 16.691 -27.599
259 HE2 LYS 45 HE2 LYS 45 1.078 19.421 -27.172
260 HE3 LYS 45 HE3 LYS 45 1.064 19.018 -28.889
261 HZ1 LYS 45 HZ1 LYS 45 -1.128 19.443 -27.114
262 HZ2 LYS 45 HZ2 LYS 45 -1.258 17.956 -27.908
263 HZ3 LYS 45 HZ3 LYS 45 -1.111 19.383 -28.804
264 H GLU 46 H GLU 46 5.868 18.164 -26.725
265 HA GLU 46 HA GLU 46 6.792 16.200 -28.469
266 HB2 GLU 46 HB2 GLU 46 8.558 17.683 -29.021
267 HB3 GLU 46 HB3 GLU 46 7.182 18.697 -28.609
268 HG2 GLU 46 HG2 GLU 46 8.315 18.606 -26.215
269 HG3 GLU 46 HG3 GLU 46 9.753 18.315 -27.192
270 H ASP 47 H ASP 47 7.644 16.871 -25.163
271 HA ASP 47 HA ASP 47 10.115 15.693 -24.902
272 HB2 ASP 47 HB2 ASP 47 7.839 16.215 -23.127
273 HB3 ASP 47 HB3 ASP 47 8.839 14.859 -22.612
274 H HIS 48 H HIS 48 6.962 14.058 -24.599
275 HA HIS 48 HA HIS 48 8.306 11.469 -24.767
276 HB2 HIS 48 HB2 HIS 48 6.108 10.525 -24.175
277 HB3 HIS 48 HB3 HIS 48 6.635 11.732 -23.006
278 HD1 HIS 48 HD1 HIS 48 5.091 13.660 -22.587
279 HD2 HIS 48 HD2 HIS 48 4.034 11.480 -25.962
280 HE1 HIS 48 HE1 HIS 48 2.866 14.581 -23.312
281 H HIS 49 H HIS 49 7.874 13.423 -27.042
282 HA HIS 49 HA HIS 49 7.278 13.407 -29.243
283 HB2 HIS 49 HB2 HIS 49 7.819 10.498 -28.685
284 HB3 HIS 49 HB3 HIS 49 7.379 11.058 -30.296
285 HD1 HIS 49 HD1 HIS 49 9.275 11.752 -31.730
286 HD2 HIS 49 HD2 HIS 49 10.252 11.889 -27.694
287 HE1 HIS 49 HE1 HIS 49 11.718 12.342 -31.649
288 H CYS 50 H CYS 50 5.089 13.884 -27.894
289 HA CYS 50 HA CYS 50 2.971 12.113 -27.901
290 HB2 CYS 50 HB2 CYS 50 3.103 14.522 -26.990
291 HB3 CYS 50 HB3 CYS 50 2.608 15.016 -28.606
292 H ARG 51 H ARG 51 1.902 11.081 -29.446
293 HA ARG 51 HA ARG 51 2.503 11.196 -32.142
294 HB2 ARG 51 HB2 ARG 51 0.504 9.883 -32.521
295 HB3 ARG 51 HB3 ARG 51 1.288 9.342 -31.042
296 HG2 ARG 51 HG2 ARG 51 -0.348 10.893 -29.830
297 HG3 ARG 51 HG3 ARG 51 -1.236 10.923 -31.355
298 HD2 ARG 51 HD2 ARG 51 -0.424 8.298 -30.198
299 HD3 ARG 51 HD3 ARG 51 -1.797 9.153 -29.497
300 HE ARG 51 HE ARG 51 -1.709 7.805 -32.025
301 HH11 ARG 51 HH11 ARG 51 -3.231 10.363 -30.220
302 HH12 ARG 51 HH12 ARG 51 -4.685 10.339 -31.162
303 HH21 ARG 51 HH21 ARG 51 -3.618 7.764 -33.272
304 HH22 ARG 51 HH22 ARG 51 -4.904 8.860 -32.897
305 H TRP 52 H TRP 52 0.128 13.023 -30.309
306 HA TRP 52 HA TRP 52 -1.340 14.100 -32.431
307 HB2 TRP 52 HB2 TRP 52 -1.851 14.234 -29.938
308 HB3 TRP 52 HB3 TRP 52 -0.713 15.577 -29.876
309 HD1 TRP 52 HD1 TRP 52 -4.241 14.700 -30.927
310 HE1 TRP 52 HE1 TRP 52 -5.467 16.844 -31.650
311 HE3 TRP 52 HE3 TRP 52 -0.272 17.922 -30.993
312 HZ2 TRP 52 HZ2 TRP 52 -4.836 19.544 -32.180
313 HZ3 TRP 52 HZ3 TRP 52 -0.668 20.268 -31.620
314 HH2 TRP 52 HH2 TRP 52 -2.904 21.060 -32.201
315 H LEU 53 H LEU 53 1.626 15.239 -30.869
316 HA LEU 53 HA LEU 53 1.843 17.674 -32.262
317 HB2 LEU 53 HB2 LEU 53 3.469 16.075 -30.487
318 HB3 LEU 53 HB3 LEU 53 4.444 16.808 -31.759
319 HG LEU 53 HG LEU 53 2.683 18.263 -29.788
320 HD11 LEU 53 HD11 LEU 53 4.914 17.265 -29.033
321 HD12 LEU 53 HD12 LEU 53 4.639 18.981 -28.733
322 HD13 LEU 53 HD13 LEU 53 5.661 18.474 -30.078
323 HD21 LEU 53 HD21 LEU 53 4.371 20.060 -31.081
324 HD22 LEU 53 HD22 LEU 53 2.626 19.906 -31.284
325 HD23 LEU 53 HD23 LEU 53 3.720 19.043 -32.367
326 H LEU 54 H LEU 54 3.039 14.427 -32.985
327 HA LEU 54 HA LEU 54 4.484 15.202 -35.318
328 HB2 LEU 54 HB2 LEU 54 3.425 12.440 -34.881
329 HB3 LEU 54 HB3 LEU 54 4.940 12.947 -35.626
330 HG LEU 54 HG LEU 54 4.287 12.968 -32.680
331 HD11 LEU 54 HD11 LEU 54 5.108 10.883 -34.291
332 HD12 LEU 54 HD12 LEU 54 5.274 10.979 -32.538
333 HD13 LEU 54 HD13 LEU 54 6.608 11.477 -33.579
334 HD21 LEU 54 HD21 LEU 54 6.565 13.715 -32.338
335 HD22 LEU 54 HD22 LEU 54 5.696 14.877 -33.340
336 HD23 LEU 54 HD23 LEU 54 6.841 13.757 -34.079
337 H GLU 55 H GLU 55 1.224 14.046 -34.692
338 HA GLU 55 HA GLU 55 0.439 13.448 -37.302
339 HB2 GLU 55 HB2 GLU 55 -0.813 13.726 -34.758
340 HB3 GLU 55 HB3 GLU 55 -1.760 14.633 -35.929
341 HG2 GLU 55 HG2 GLU 55 -0.918 11.785 -36.368
342 HG3 GLU 55 HG3 GLU 55 -2.427 12.234 -35.576
343 H HIS 56 H HIS 56 0.612 16.519 -35.601
344 HA HIS 56 HA HIS 56 -0.271 17.889 -38.053
345 HB2 HIS 56 HB2 HIS 56 -0.396 18.693 -35.152
346 HB3 HIS 56 HB3 HIS 56 -0.574 19.871 -36.450
347 HD1 HIS 56 HD1 HIS 56 -2.739 19.746 -37.875
348 HD2 HIS 56 HD2 HIS 56 -2.584 17.010 -34.752
349 HE1 HIS 56 HE1 HIS 56 -5.080 18.858 -37.642
350 H GLU 57 H GLU 57 2.121 17.212 -38.538
351 HA GLU 57 HA GLU 57 4.083 19.023 -37.405
352 HB2 GLU 57 HB2 GLU 57 4.161 16.675 -39.245
353 HB3 GLU 57 HB3 GLU 57 5.493 17.822 -39.299
354 HG2 GLU 57 HG2 GLU 57 4.745 16.975 -36.601
355 HG3 GLU 57 HG3 GLU 57 5.336 15.678 -37.638
356 H GLU 58 H GLU 58 3.628 21.075 -38.080
357 HA GLU 58 HA GLU 58 3.518 21.536 -40.986
358 HB2 GLU 58 HB2 GLU 58 2.530 23.759 -40.362
359 HB3 GLU 58 HB3 GLU 58 1.536 22.369 -39.948
360 HG2 GLU 58 HG2 GLU 58 2.248 22.514 -37.636
361 HG3 GLU 58 HG3 GLU 58 3.312 23.863 -38.032
362 H VAL 59 H VAL 59 5.993 21.089 -40.297
363 HA VAL 59 HA VAL 59 7.244 23.717 -40.447
364 HB VAL 59 HB VAL 59 8.990 23.052 -38.783
365 HG11 VAL 59 HG11 VAL 59 6.208 23.219 -37.634
366 HG12 VAL 59 HG12 VAL 59 7.713 23.712 -36.855
367 HG13 VAL 59 HG13 VAL 59 7.116 24.595 -38.260
368 HG21 VAL 59 HG21 VAL 59 8.039 20.567 -38.964
369 HG22 VAL 59 HG22 VAL 59 8.886 21.157 -37.534
370 HG23 VAL 59 HG23 VAL 59 7.123 21.107 -37.557
Start of MODEL 14
1 H MET 11 H MET 11 0.942 -2.962 0.478
2 HA MET 11 HA MET 11 2.377 -0.571 1.227
3 HB2 MET 11 HB2 MET 11 3.677 -0.946 -0.787
4 HB3 MET 11 HB3 MET 11 3.510 -2.456 0.099
5 HG2 MET 11 HG2 MET 11 1.563 -2.965 -1.455
6 HG3 MET 11 HG3 MET 11 2.143 -1.619 -2.433
7 HE1 MET 11 HE1 MET 11 4.457 -5.074 -0.956
8 HE2 MET 11 HE2 MET 11 2.734 -4.772 -0.732
9 HE3 MET 11 HE3 MET 11 3.286 -5.788 -2.065
10 H LEU 12 H LEU 12 2.621 1.244 -0.319
11 HA LEU 12 HA LEU 12 0.286 1.704 -2.019
12 HB2 LEU 12 HB2 LEU 12 0.263 4.088 -1.029
13 HB3 LEU 12 HB3 LEU 12 -0.525 2.780 -0.148
14 HG LEU 12 HG LEU 12 2.281 3.314 0.592
15 HD11 LEU 12 HD11 LEU 12 1.410 5.590 0.224
16 HD12 LEU 12 HD12 LEU 12 1.759 5.260 1.921
17 HD13 LEU 12 HD13 LEU 12 0.092 5.245 1.345
18 HD21 LEU 12 HD21 LEU 12 1.560 2.682 2.712
19 HD22 LEU 12 HD22 LEU 12 0.583 1.684 1.634
20 HD23 LEU 12 HD23 LEU 12 -0.116 3.121 2.380
21 H ASP 13 H ASP 13 1.065 2.192 -3.951
22 HA ASP 13 HA ASP 13 3.241 4.142 -4.153
23 HB2 ASP 13 HB2 ASP 13 3.215 1.634 -5.832
24 HB3 ASP 13 HB3 ASP 13 4.494 2.839 -5.708
25 H VAL 14 H VAL 14 1.330 5.464 -4.664
26 HA VAL 14 HA VAL 14 -0.051 4.939 -7.147
27 HB VAL 14 HB VAL 14 -1.121 7.158 -6.732
28 HG11 VAL 14 HG11 VAL 14 -1.901 4.894 -5.813
29 HG12 VAL 14 HG12 VAL 14 -1.301 5.472 -4.257
30 HG13 VAL 14 HG13 VAL 14 -2.579 6.354 -5.094
31 HG21 VAL 14 HG21 VAL 14 -0.254 8.613 -5.295
32 HG22 VAL 14 HG22 VAL 14 -0.358 7.436 -3.986
33 HG23 VAL 14 HG23 VAL 14 1.078 7.495 -5.007
34 H GLY 15 H GLY 15 2.436 4.948 -7.947
35 HA2 GLY 15 HA2 GLY 15 2.831 7.616 -9.154
36 HA3 GLY 15 HA3 GLY 15 4.179 6.634 -8.601
37 H LYS 16 H LYS 16 3.326 7.721 -11.296
38 HA LYS 16 HA LYS 16 3.204 5.175 -12.767
39 HB2 LYS 16 HB2 LYS 16 1.799 7.619 -13.086
40 HB3 LYS 16 HB3 LYS 16 2.857 7.443 -14.480
41 HG2 LYS 16 HG2 LYS 16 0.733 6.478 -14.998
42 HG3 LYS 16 HG3 LYS 16 1.918 5.179 -14.847
43 HD2 LYS 16 HD2 LYS 16 1.127 4.690 -12.601
44 HD3 LYS 16 HD3 LYS 16 -0.013 6.035 -12.689
45 HE2 LYS 16 HE2 LYS 16 -1.332 4.187 -13.183
46 HE3 LYS 16 HE3 LYS 16 -0.931 4.831 -14.774
47 HZ1 LYS 16 HZ1 LYS 16 0.197 2.451 -13.429
48 HZ2 LYS 16 HZ2 LYS 16 0.971 3.181 -14.744
49 HZ3 LYS 16 HZ3 LYS 16 -0.583 2.539 -14.928
50 H HIS 17 H HIS 17 4.905 4.531 -13.925
51 HA HIS 17 HA HIS 17 7.305 6.131 -13.922
52 HB2 HIS 17 HB2 HIS 17 6.917 3.490 -15.325
53 HB3 HIS 17 HB3 HIS 17 8.420 4.197 -14.739
54 HD1 HIS 17 HD1 HIS 17 5.196 2.736 -13.376
55 HD2 HIS 17 HD2 HIS 17 9.132 3.412 -12.230
56 HE1 HIS 17 HE1 HIS 17 5.450 1.607 -11.143
57 H CYS 18 H CYS 18 8.152 7.268 -15.567
58 HA CYS 18 HA CYS 18 6.645 8.173 -17.687
59 HB2 CYS 18 HB2 CYS 18 8.778 9.184 -16.847
60 HB3 CYS 18 HB3 CYS 18 9.658 7.914 -17.692
61 H ALA 19 H ALA 19 6.221 7.526 -19.727
62 HA ALA 19 HA ALA 19 6.978 4.807 -20.442
63 HB1 ALA 19 HB1 ALA 19 4.910 4.754 -21.239
64 HB2 ALA 19 HB2 ALA 19 4.711 6.476 -20.913
65 HB3 ALA 19 HB3 ALA 19 5.368 5.942 -22.460
66 H TYR 20 H TYR 20 8.831 7.189 -20.577
67 HA TYR 20 HA TYR 20 9.676 6.773 -23.363
68 HB2 TYR 20 HB2 TYR 20 8.601 9.027 -23.024
69 HB3 TYR 20 HB3 TYR 20 9.909 9.414 -21.912
70 HD1 TYR 20 HD1 TYR 20 12.184 9.757 -22.736
71 HD2 TYR 20 HD2 TYR 20 8.976 8.940 -25.410
72 HE1 TYR 20 HE1 TYR 20 13.571 10.512 -24.622
73 HE2 TYR 20 HE2 TYR 20 10.355 9.691 -27.303
74 HH TYR 20 HH TYR 20 13.142 11.457 -26.959
75 H CYS 21 H CYS 21 10.582 7.637 -20.065
76 HA CYS 21 HA CYS 21 13.279 6.594 -20.614
77 HB2 CYS 21 HB2 CYS 21 14.308 8.307 -19.349
78 HB3 CYS 21 HB3 CYS 21 13.155 9.133 -20.392
79 H ARG 22 H ARG 22 10.559 5.865 -19.161
80 HA ARG 22 HA ARG 22 9.898 4.743 -17.282
81 HB2 ARG 22 HB2 ARG 22 12.692 3.602 -17.424
82 HB3 ARG 22 HB3 ARG 22 11.275 2.847 -16.708
83 HG2 ARG 22 HG2 ARG 22 11.370 1.751 -18.706
84 HG3 ARG 22 HG3 ARG 22 10.306 3.093 -19.132
85 HD2 ARG 22 HD2 ARG 22 11.898 4.133 -20.400
86 HD3 ARG 22 HD3 ARG 22 13.234 3.478 -19.454
87 HE ARG 22 HE ARG 22 11.997 1.362 -20.795
88 HH11 ARG 22 HH11 ARG 22 13.849 4.222 -21.511
89 HH12 ARG 22 HH12 ARG 22 14.539 3.570 -22.960
90 HH21 ARG 22 HH21 ARG 22 12.899 0.493 -22.701
91 HH22 ARG 22 HH22 ARG 22 13.998 1.449 -23.636
92 H GLN 23 H GLN 23 9.964 6.850 -16.126
93 HA GLN 23 HA GLN 23 11.988 6.800 -13.984
94 HB2 GLN 23 HB2 GLN 23 11.102 8.960 -15.721
95 HB3 GLN 23 HB3 GLN 23 10.942 9.374 -14.020
96 HG2 GLN 23 HG2 GLN 23 13.491 8.131 -14.828
97 HG3 GLN 23 HG3 GLN 23 13.179 9.757 -15.434
98 HE21 GLN 23 HE21 GLN 23 14.467 10.995 -14.233
99 HE22 GLN 23 HE22 GLN 23 14.465 11.056 -12.507
100 H LEU 24 H LEU 24 11.138 6.174 -12.122
101 HA LEU 24 HA LEU 24 8.336 6.112 -11.636
102 HB2 LEU 24 HB2 LEU 24 9.765 4.454 -10.648
103 HB3 LEU 24 HB3 LEU 24 10.703 5.695 -9.820
104 HG LEU 24 HG LEU 24 8.697 6.226 -8.455
105 HD11 LEU 24 HD11 LEU 24 7.334 4.810 -10.384
106 HD12 LEU 24 HD12 LEU 24 6.691 5.334 -8.828
107 HD13 LEU 24 HD13 LEU 24 7.355 3.709 -9.006
108 HD21 LEU 24 HD21 LEU 24 8.971 4.421 -6.958
109 HD22 LEU 24 HD22 LEU 24 10.518 4.603 -7.785
110 HD23 LEU 24 HD23 LEU 24 9.411 3.311 -8.256
111 H ASP 25 H ASP 25 7.268 7.988 -11.454
112 HA ASP 25 HA ASP 25 8.321 9.982 -9.554
113 HB2 ASP 25 HB2 ASP 25 7.202 10.272 -12.266
114 HB3 ASP 25 HB3 ASP 25 6.575 11.414 -11.081
115 H PHE 26 H PHE 26 6.610 11.331 -8.528
116 HA PHE 26 HA PHE 26 4.447 9.595 -7.632
117 HB2 PHE 26 HB2 PHE 26 5.098 12.337 -6.561
118 HB3 PHE 26 HB3 PHE 26 4.237 11.030 -5.755
119 HD1 PHE 26 HD1 PHE 26 7.540 12.196 -6.884
120 HD2 PHE 26 HD2 PHE 26 5.398 9.320 -4.591
121 HE1 PHE 26 HE1 PHE 26 9.648 11.448 -5.859
122 HE2 PHE 26 HE2 PHE 26 7.502 8.568 -3.561
123 HZ PHE 26 HZ PHE 26 9.631 9.633 -4.194
124 H LEU 27 H LEU 27 4.951 12.689 -9.232
125 HA LEU 27 HA LEU 27 2.045 12.904 -9.654
126 HB2 LEU 27 HB2 LEU 27 2.631 15.302 -10.277
127 HB3 LEU 27 HB3 LEU 27 2.732 14.853 -8.576
128 HG LEU 27 HG LEU 27 5.212 14.735 -10.220
129 HD11 LEU 27 HD11 LEU 27 5.515 16.956 -10.427
130 HD12 LEU 27 HD12 LEU 27 4.642 17.325 -8.940
131 HD13 LEU 27 HD13 LEU 27 3.751 16.987 -10.423
132 HD21 LEU 27 HD21 LEU 27 5.984 14.277 -8.187
133 HD22 LEU 27 HD22 LEU 27 4.440 14.688 -7.440
134 HD23 LEU 27 HD23 LEU 27 5.634 15.950 -7.750
135 HA PRO 28 HA PRO 28 3.707 11.683 -13.769
136 HB2 PRO 28 HB2 PRO 28 1.527 10.213 -14.446
137 HB3 PRO 28 HB3 PRO 28 2.865 9.564 -13.490
138 HG2 PRO 28 HG2 PRO 28 0.209 10.598 -12.574
139 HG3 PRO 28 HG3 PRO 28 1.094 9.158 -12.038
140 HD2 PRO 28 HD2 PRO 28 1.083 11.470 -10.628
141 HD3 PRO 28 HD3 PRO 28 2.477 10.371 -10.649
142 H PHE 29 H PHE 29 3.453 12.995 -15.459
143 HA PHE 29 HA PHE 29 1.272 14.864 -15.551
144 HB2 PHE 29 HB2 PHE 29 3.884 14.592 -16.768
145 HB3 PHE 29 HB3 PHE 29 2.674 15.022 -17.973
146 HD1 PHE 29 HD1 PHE 29 1.455 17.128 -17.814
147 HD2 PHE 29 HD2 PHE 29 4.512 16.116 -15.031
148 HE1 PHE 29 HE1 PHE 29 1.562 19.475 -17.084
149 HE2 PHE 29 HE2 PHE 29 4.623 18.462 -14.295
150 HZ PHE 29 HZ PHE 29 3.148 20.145 -15.323
151 H HIS 30 H HIS 30 -0.665 14.112 -16.149
152 HA HIS 30 HA HIS 30 -0.936 12.027 -18.129
153 HB2 HIS 30 HB2 HIS 30 -2.459 11.983 -16.263
154 HB3 HIS 30 HB3 HIS 30 -2.972 13.637 -16.581
155 HD1 HIS 30 HD1 HIS 30 -3.513 10.122 -17.666
156 HD2 HIS 30 HD2 HIS 30 -4.770 13.933 -18.739
157 HE1 HIS 30 HE1 HIS 30 -5.473 9.775 -19.202
158 H CYS 31 H CYS 31 -0.934 12.406 -20.235
159 HA CYS 31 HA CYS 31 -1.365 15.086 -21.250
160 HB2 CYS 31 HB2 CYS 31 0.358 13.204 -22.025
161 HB3 CYS 31 HB3 CYS 31 -0.980 12.770 -23.083
162 H SER 32 H SER 32 -3.182 15.824 -22.143
163 HA SER 32 HA SER 32 -5.455 14.011 -22.358
164 HB2 SER 32 HB2 SER 32 -5.125 16.755 -21.651
165 HB3 SER 32 HB3 SER 32 -6.165 16.679 -23.073
166 HG SER 32 HG SER 32 -7.692 15.874 -21.880
167 H PHE 33 H PHE 33 -3.145 14.215 -24.318
168 HA PHE 33 HA PHE 33 -4.761 14.710 -26.732
169 HB2 PHE 33 HB2 PHE 33 -1.753 14.822 -26.673
170 HB3 PHE 33 HB3 PHE 33 -2.851 15.482 -27.881
171 HD1 PHE 33 HD1 PHE 33 -4.778 16.934 -26.221
172 HD2 PHE 33 HD2 PHE 33 -0.545 16.633 -25.892
173 HE1 PHE 33 HE1 PHE 33 -4.715 19.116 -25.086
174 HE2 PHE 33 HE2 PHE 33 -0.475 18.814 -24.756
175 HZ PHE 33 HZ PHE 33 -2.561 20.059 -24.353
176 H CYS 34 H CYS 34 -2.113 12.759 -25.392
177 HA CYS 34 HA CYS 34 -2.726 10.673 -27.373
178 HB2 CYS 34 HB2 CYS 34 -0.491 9.776 -26.889
179 HB3 CYS 34 HB3 CYS 34 -0.406 11.456 -27.412
180 H ASN 35 H ASN 35 -3.041 11.492 -24.107
181 HA ASN 35 HA ASN 35 -3.913 10.383 -22.320
182 HB2 ASN 35 HB2 ASN 35 -5.263 9.319 -24.349
183 HB3 ASN 35 HB3 ASN 35 -4.360 7.881 -23.881
184 HD21 ASN 35 HD21 ASN 35 -7.177 9.457 -23.462
185 HD22 ASN 35 HD22 ASN 35 -7.633 8.854 -21.909
186 H GLU 36 H GLU 36 -1.359 10.464 -22.116
187 HA GLU 36 HA GLU 36 -0.610 7.850 -21.080
188 HB2 GLU 36 HB2 GLU 36 0.961 9.328 -23.186
189 HB3 GLU 36 HB3 GLU 36 1.692 8.118 -22.142
190 HG2 GLU 36 HG2 GLU 36 -0.499 6.797 -23.083
191 HG3 GLU 36 HG3 GLU 36 -0.048 7.796 -24.463
192 H ASP 37 H ASP 37 0.953 7.924 -19.445
193 HA ASP 37 HA ASP 37 1.296 10.582 -18.265
194 HB2 ASP 37 HB2 ASP 37 1.379 7.788 -17.162
195 HB3 ASP 37 HB3 ASP 37 2.099 9.124 -16.268
196 H PHE 38 H PHE 38 3.286 11.409 -17.684
197 HA PHE 38 HA PHE 38 5.695 9.881 -18.210
198 HB2 PHE 38 HB2 PHE 38 5.170 12.473 -19.679
199 HB3 PHE 38 HB3 PHE 38 6.635 11.500 -19.770
200 HD1 PHE 38 HD1 PHE 38 6.527 9.229 -20.810
201 HD2 PHE 38 HD2 PHE 38 3.303 12.000 -21.025
202 HE1 PHE 38 HE1 PHE 38 5.574 7.968 -22.695
203 HE2 PHE 38 HE2 PHE 38 2.344 10.742 -22.909
204 HZ PHE 38 HZ PHE 38 3.479 8.723 -23.746
205 H CYS 39 H CYS 39 7.490 10.643 -17.123
206 HA CYS 39 HA CYS 39 7.152 11.995 -14.751
207 HB2 CYS 39 HB2 CYS 39 9.513 12.052 -14.555
208 HB3 CYS 39 HB3 CYS 39 9.155 10.618 -15.511
209 H SER 40 H SER 40 7.840 14.095 -14.032
210 HA SER 40 HA SER 40 6.758 16.216 -15.419
211 HB2 SER 40 HB2 SER 40 8.275 15.860 -13.009
212 HB3 SER 40 HB3 SER 40 8.876 17.280 -13.863
213 HG SER 40 HG SER 40 6.185 16.756 -13.124
214 H ASN 41 H ASN 41 10.125 15.116 -15.377
215 HA ASN 41 HA ASN 41 11.305 17.152 -16.833
216 HB2 ASN 41 HB2 ASN 41 12.196 14.828 -15.773
217 HB3 ASN 41 HB3 ASN 41 12.214 14.410 -17.484
218 HD21 ASN 41 HD21 ASN 41 13.725 16.147 -14.970
219 HD22 ASN 41 HD22 ASN 41 15.000 16.844 -15.905
220 H HIS 42 H HIS 42 9.262 14.545 -17.915
221 HA HIS 42 HA HIS 42 9.625 15.430 -20.700
222 HB2 HIS 42 HB2 HIS 42 8.881 12.763 -19.524
223 HB3 HIS 42 HB3 HIS 42 8.500 13.156 -21.198
224 HD2 HIS 42 HD2 HIS 42 11.131 14.231 -22.449
225 HE1 HIS 42 HE1 HIS 42 13.195 11.106 -20.457
226 HE2 HIS 42 HE2 HIS 42 13.297 12.825 -22.297
227 H ARG 43 H ARG 43 7.840 16.473 -18.482
228 HA ARG 43 HA ARG 43 5.175 15.821 -18.907
229 HB2 ARG 43 HB2 ARG 43 4.622 17.908 -17.860
230 HB3 ARG 43 HB3 ARG 43 6.062 17.273 -17.075
231 HG2 ARG 43 HG2 ARG 43 7.453 18.796 -18.378
232 HG3 ARG 43 HG3 ARG 43 6.012 19.429 -19.176
233 HD2 ARG 43 HD2 ARG 43 5.166 20.277 -17.089
234 HD3 ARG 43 HD3 ARG 43 6.482 19.511 -16.200
235 HE ARG 43 HE ARG 43 7.398 21.355 -18.193
236 HH11 ARG 43 HH11 ARG 43 6.219 21.049 -14.932
237 HH12 ARG 43 HH12 ARG 43 6.980 22.505 -14.382
238 HH21 ARG 43 HH21 ARG 43 8.404 23.274 -17.481
239 HH22 ARG 43 HH22 ARG 43 8.222 23.770 -15.833
240 H LEU 44 H LEU 44 7.295 17.953 -20.716
241 HA LEU 44 HA LEU 44 5.433 19.339 -22.242
242 HB2 LEU 44 HB2 LEU 44 8.076 18.335 -23.270
243 HB3 LEU 44 HB3 LEU 44 7.189 19.765 -23.793
244 HG LEU 44 HG LEU 44 8.546 19.398 -21.122
245 HD11 LEU 44 HD11 LEU 44 10.371 20.309 -22.002
246 HD12 LEU 44 HD12 LEU 44 9.441 21.586 -22.786
247 HD13 LEU 44 HD13 LEU 44 9.652 20.029 -23.588
248 HD21 LEU 44 HD21 LEU 44 7.181 21.831 -22.268
249 HD22 LEU 44 HD22 LEU 44 7.967 21.700 -20.695
250 HD23 LEU 44 HD23 LEU 44 6.498 20.781 -21.026
251 H LYS 45 H LYS 45 5.127 19.029 -24.659
252 HA LYS 45 HA LYS 45 3.885 16.483 -25.082
253 HB2 LYS 45 HB2 LYS 45 3.848 19.097 -26.314
254 HB3 LYS 45 HB3 LYS 45 3.997 17.842 -27.537
255 HG2 LYS 45 HG2 LYS 45 1.989 16.783 -26.793
256 HG3 LYS 45 HG3 LYS 45 1.887 17.850 -25.391
257 HD2 LYS 45 HD2 LYS 45 0.503 19.056 -26.689
258 HD3 LYS 45 HD3 LYS 45 1.991 19.650 -27.429
259 HE2 LYS 45 HE2 LYS 45 1.126 18.913 -29.354
260 HE3 LYS 45 HE3 LYS 45 1.551 17.303 -28.775
261 HZ1 LYS 45 HZ1 LYS 45 -0.604 16.854 -28.169
262 HZ2 LYS 45 HZ2 LYS 45 -0.852 17.795 -29.551
263 HZ3 LYS 45 HZ3 LYS 45 -1.034 18.483 -28.016
264 H GLU 46 H GLU 46 6.377 18.216 -26.966
265 HA GLU 46 HA GLU 46 7.137 16.090 -28.576
266 HB2 GLU 46 HB2 GLU 46 9.131 17.328 -29.072
267 HB3 GLU 46 HB3 GLU 46 7.813 18.475 -28.879
268 HG2 GLU 46 HG2 GLU 46 8.594 18.848 -26.534
269 HG3 GLU 46 HG3 GLU 46 10.003 17.861 -26.914
270 H ASP 47 H ASP 47 7.985 16.810 -25.278
271 HA ASP 47 HA ASP 47 10.296 15.370 -24.899
272 HB2 ASP 47 HB2 ASP 47 7.971 16.047 -23.171
273 HB3 ASP 47 HB3 ASP 47 9.086 14.819 -22.580
274 H HIS 48 H HIS 48 6.969 14.123 -24.615
275 HA HIS 48 HA HIS 48 8.012 11.392 -24.643
276 HB2 HIS 48 HB2 HIS 48 5.748 10.717 -24.011
277 HB3 HIS 48 HB3 HIS 48 6.347 11.968 -22.926
278 HD1 HIS 48 HD1 HIS 48 4.955 14.037 -22.698
279 HD2 HIS 48 HD2 HIS 48 3.806 11.695 -25.932
280 HE1 HIS 48 HE1 HIS 48 2.832 15.075 -23.559
281 H HIS 49 H HIS 49 7.811 13.299 -27.000
282 HA HIS 49 HA HIS 49 7.199 13.277 -29.200
283 HB2 HIS 49 HB2 HIS 49 7.669 10.402 -28.504
284 HB3 HIS 49 HB3 HIS 49 7.086 10.817 -30.114
285 HD1 HIS 49 HD1 HIS 49 9.076 10.567 -31.574
286 HD2 HIS 49 HD2 HIS 49 9.961 12.623 -28.074
287 HE1 HIS 49 HE1 HIS 49 11.461 11.322 -31.823
288 H CYS 50 H CYS 50 5.039 13.965 -27.951
289 HA CYS 50 HA CYS 50 2.808 12.347 -27.861
290 HB2 CYS 50 HB2 CYS 50 3.087 14.803 -27.136
291 HB3 CYS 50 HB3 CYS 50 2.655 15.205 -28.795
292 H ARG 51 H ARG 51 1.500 11.420 -29.310
293 HA ARG 51 HA ARG 51 2.169 11.112 -31.974
294 HB2 ARG 51 HB2 ARG 51 0.056 10.285 -30.254
295 HB3 ARG 51 HB3 ARG 51 -0.664 10.881 -31.744
296 HG2 ARG 51 HG2 ARG 51 -0.347 8.616 -32.141
297 HG3 ARG 51 HG3 ARG 51 1.031 9.378 -32.938
298 HD2 ARG 51 HD2 ARG 51 2.333 8.950 -30.817
299 HD3 ARG 51 HD3 ARG 51 0.978 7.954 -30.287
300 HE ARG 51 HE ARG 51 1.753 7.082 -32.824
301 HH11 ARG 51 HH11 ARG 51 3.010 7.208 -29.580
302 HH12 ARG 51 HH12 ARG 51 3.996 5.795 -29.767
303 HH21 ARG 51 HH21 ARG 51 3.046 5.221 -33.083
304 HH22 ARG 51 HH22 ARG 51 4.016 4.667 -31.761
305 H TRP 52 H TRP 52 -0.171 13.361 -30.537
306 HA TRP 52 HA TRP 52 -1.216 14.475 -32.842
307 HB2 TRP 52 HB2 TRP 52 -1.946 14.925 -30.469
308 HB3 TRP 52 HB3 TRP 52 -0.580 16.030 -30.330
309 HD1 TRP 52 HD1 TRP 52 -4.083 15.779 -31.726
310 HE1 TRP 52 HE1 TRP 52 -4.777 18.060 -32.697
311 HE3 TRP 52 HE3 TRP 52 0.440 18.155 -31.531
312 HZ2 TRP 52 HZ2 TRP 52 -3.567 20.538 -33.301
313 HZ3 TRP 52 HZ3 TRP 52 0.586 20.480 -32.325
314 HH2 TRP 52 HH2 TRP 52 -1.377 21.644 -33.191
315 H LEU 53 H LEU 53 1.810 15.210 -31.188
316 HA LEU 53 HA LEU 53 2.489 17.500 -32.690
317 HB2 LEU 53 HB2 LEU 53 3.740 15.773 -30.735
318 HB3 LEU 53 HB3 LEU 53 4.883 16.271 -31.980
319 HG LEU 53 HG LEU 53 3.272 18.094 -30.195
320 HD11 LEU 53 HD11 LEU 53 5.259 18.560 -29.058
321 HD12 LEU 53 HD12 LEU 53 6.257 17.816 -30.307
322 HD13 LEU 53 HD13 LEU 53 5.269 16.807 -29.251
323 HD21 LEU 53 HD21 LEU 53 4.768 18.553 -32.684
324 HD22 LEU 53 HD22 LEU 53 5.153 19.653 -31.360
325 HD23 LEU 53 HD23 LEU 53 3.490 19.507 -31.931
326 H LEU 54 H LEU 54 3.029 14.061 -33.204
327 HA LEU 54 HA LEU 54 4.781 14.385 -35.431
328 HB2 LEU 54 HB2 LEU 54 3.098 11.952 -35.004
329 HB3 LEU 54 HB3 LEU 54 4.740 12.074 -35.634
330 HG LEU 54 HG LEU 54 3.889 12.377 -32.755
331 HD11 LEU 54 HD11 LEU 54 5.232 10.207 -34.322
332 HD12 LEU 54 HD12 LEU 54 3.867 10.099 -33.211
333 HD13 LEU 54 HD13 LEU 54 5.493 10.374 -32.586
334 HD21 LEU 54 HD21 LEU 54 5.708 13.679 -32.611
335 HD22 LEU 54 HD22 LEU 54 6.322 13.167 -34.183
336 HD23 LEU 54 HD23 LEU 54 6.604 12.167 -32.758
337 H GLU 55 H GLU 55 1.368 13.371 -35.197
338 HA GLU 55 HA GLU 55 0.880 13.321 -37.960
339 HB2 GLU 55 HB2 GLU 55 -1.471 13.281 -37.391
340 HB3 GLU 55 HB3 GLU 55 -0.582 12.267 -36.264
341 HG2 GLU 55 HG2 GLU 55 -0.567 14.312 -34.728
342 HG3 GLU 55 HG3 GLU 55 -1.816 14.953 -35.793
343 H HIS 56 H HIS 56 0.694 15.915 -35.597
344 HA HIS 56 HA HIS 56 0.162 17.796 -37.802
345 HB2 HIS 56 HB2 HIS 56 -1.116 17.525 -35.156
346 HB3 HIS 56 HB3 HIS 56 -0.691 19.171 -35.615
347 HD1 HIS 56 HD1 HIS 56 -1.705 19.952 -38.013
348 HD2 HIS 56 HD2 HIS 56 -3.442 16.623 -36.235
349 HE1 HIS 56 HE1 HIS 56 -3.927 19.662 -39.155
350 H GLU 57 H GLU 57 2.440 18.033 -38.072
351 HA GLU 57 HA GLU 57 4.091 18.941 -35.915
352 HB2 GLU 57 HB2 GLU 57 4.443 18.499 -38.841
353 HB3 GLU 57 HB3 GLU 57 5.591 19.550 -38.023
354 HG2 GLU 57 HG2 GLU 57 5.854 17.624 -36.349
355 HG3 GLU 57 HG3 GLU 57 5.066 16.638 -37.579
356 H GLU 58 H GLU 58 3.055 20.785 -35.102
357 HA GLU 58 HA GLU 58 2.198 22.983 -36.593
358 HB2 GLU 58 HB2 GLU 58 2.413 24.261 -34.475
359 HB3 GLU 58 HB3 GLU 58 1.559 22.736 -34.281
360 HG2 GLU 58 HG2 GLU 58 3.758 21.753 -33.517
361 HG3 GLU 58 HG3 GLU 58 4.362 23.408 -33.445
362 H VAL 59 H VAL 59 3.216 24.596 -37.600
363 HA VAL 59 HA VAL 59 6.139 24.750 -37.346
364 HB VAL 59 HB VAL 59 5.217 24.326 -39.612
365 HG11 VAL 59 HG11 VAL 59 3.195 25.869 -39.111
366 HG12 VAL 59 HG12 VAL 59 4.258 27.159 -39.677
367 HG13 VAL 59 HG13 VAL 59 3.853 25.815 -40.746
368 HG21 VAL 59 HG21 VAL 59 6.459 27.048 -39.635
369 HG22 VAL 59 HG22 VAL 59 7.369 25.658 -39.043
370 HG23 VAL 59 HG23 VAL 59 6.760 25.674 -40.698
Start of MODEL 15
1 H MET 11 H MET 11 -3.416 -2.955 -5.639
2 HA MET 11 HA MET 11 -4.088 -0.872 -6.284
3 HB2 MET 11 HB2 MET 11 -5.679 -1.131 -3.747
4 HB3 MET 11 HB3 MET 11 -5.658 0.377 -4.652
5 HG2 MET 11 HG2 MET 11 -6.256 -1.252 -6.652
6 HG3 MET 11 HG3 MET 11 -6.888 -2.229 -5.329
7 HE1 MET 11 HE1 MET 11 -6.745 0.839 -7.236
8 HE2 MET 11 HE2 MET 11 -8.450 1.216 -7.482
9 HE3 MET 11 HE3 MET 11 -7.546 2.018 -6.197
10 H LEU 12 H LEU 12 -1.837 -0.332 -6.059
11 HA LEU 12 HA LEU 12 -1.431 1.783 -4.101
12 HB2 LEU 12 HB2 LEU 12 0.917 0.819 -3.696
13 HB3 LEU 12 HB3 LEU 12 -0.449 0.119 -2.831
14 HG LEU 12 HG LEU 12 0.387 -1.164 -5.379
15 HD11 LEU 12 HD11 LEU 12 1.986 -1.153 -2.849
16 HD12 LEU 12 HD12 LEU 12 2.536 -1.007 -4.518
17 HD13 LEU 12 HD13 LEU 12 1.975 -2.564 -3.908
18 HD21 LEU 12 HD21 LEU 12 -1.176 -1.779 -3.009
19 HD22 LEU 12 HD22 LEU 12 -0.020 -3.051 -3.406
20 HD23 LEU 12 HD23 LEU 12 -1.201 -2.525 -4.607
21 H ASP 13 H ASP 13 -0.753 3.491 -5.194
22 HA ASP 13 HA ASP 13 1.008 3.068 -7.520
23 HB2 ASP 13 HB2 ASP 13 -0.047 5.313 -8.305
24 HB3 ASP 13 HB3 ASP 13 -0.959 3.821 -8.517
25 H VAL 14 H VAL 14 2.810 3.320 -6.086
26 HA VAL 14 HA VAL 14 3.158 5.829 -4.693
27 HB VAL 14 HB VAL 14 5.429 4.934 -4.163
28 HG11 VAL 14 HG11 VAL 14 4.627 3.712 -2.426
29 HG12 VAL 14 HG12 VAL 14 3.095 4.375 -2.997
30 HG13 VAL 14 HG13 VAL 14 3.573 2.739 -3.452
31 HG21 VAL 14 HG21 VAL 14 4.977 3.301 -6.352
32 HG22 VAL 14 HG22 VAL 14 6.304 3.162 -5.199
33 HG23 VAL 14 HG23 VAL 14 4.836 2.212 -4.972
34 H GLY 15 H GLY 15 2.743 6.646 -7.145
35 HA2 GLY 15 HA2 GLY 15 3.849 8.315 -8.415
36 HA3 GLY 15 HA3 GLY 15 5.387 7.567 -8.010
37 H LYS 16 H LYS 16 3.972 8.344 -10.601
38 HA LYS 16 HA LYS 16 3.893 5.742 -11.937
39 HB2 LYS 16 HB2 LYS 16 2.487 8.187 -12.275
40 HB3 LYS 16 HB3 LYS 16 3.428 7.917 -13.736
41 HG2 LYS 16 HG2 LYS 16 1.337 6.922 -14.122
42 HG3 LYS 16 HG3 LYS 16 2.445 5.590 -13.787
43 HD2 LYS 16 HD2 LYS 16 1.149 4.916 -12.112
44 HD3 LYS 16 HD3 LYS 16 1.335 6.483 -11.321
45 HE2 LYS 16 HE2 LYS 16 -0.482 7.278 -12.970
46 HE3 LYS 16 HE3 LYS 16 -0.805 5.562 -13.208
47 HZ1 LYS 16 HZ1 LYS 16 -1.787 5.398 -11.223
48 HZ2 LYS 16 HZ2 LYS 16 -1.909 7.083 -11.282
49 HZ3 LYS 16 HZ3 LYS 16 -0.633 6.356 -10.442
50 H HIS 17 H HIS 17 5.460 5.041 -13.253
51 HA HIS 17 HA HIS 17 7.861 6.643 -13.517
52 HB2 HIS 17 HB2 HIS 17 7.411 3.888 -14.658
53 HB3 HIS 17 HB3 HIS 17 8.941 4.655 -14.242
54 HD1 HIS 17 HD1 HIS 17 5.852 3.259 -12.546
55 HD2 HIS 17 HD2 HIS 17 9.833 4.117 -11.723
56 HE1 HIS 17 HE1 HIS 17 6.278 2.330 -10.248
57 H CYS 18 H CYS 18 8.644 7.539 -15.355
58 HA CYS 18 HA CYS 18 6.970 8.329 -17.397
59 HB2 CYS 18 HB2 CYS 18 9.278 9.231 -16.810
60 HB3 CYS 18 HB3 CYS 18 9.935 7.909 -17.770
61 H ALA 19 H ALA 19 6.736 7.711 -19.584
62 HA ALA 19 HA ALA 19 7.058 4.828 -20.000
63 HB1 ALA 19 HB1 ALA 19 5.006 6.715 -20.630
64 HB2 ALA 19 HB2 ALA 19 5.580 5.956 -22.115
65 HB3 ALA 19 HB3 ALA 19 4.988 4.958 -20.786
66 H TYR 20 H TYR 20 9.054 7.174 -20.420
67 HA TYR 20 HA TYR 20 9.933 6.268 -23.078
68 HB2 TYR 20 HB2 TYR 20 8.916 8.688 -22.862
69 HB3 TYR 20 HB3 TYR 20 10.500 9.072 -22.197
70 HD1 TYR 20 HD1 TYR 20 12.242 9.619 -23.633
71 HD2 TYR 20 HD2 TYR 20 8.902 7.472 -25.164
72 HE1 TYR 20 HE1 TYR 20 13.147 9.845 -25.908
73 HE2 TYR 20 HE2 TYR 20 9.799 7.691 -27.444
74 HH TYR 20 HH TYR 20 12.977 9.073 -28.042
75 H CYS 21 H CYS 21 10.921 7.902 -20.079
76 HA CYS 21 HA CYS 21 13.611 6.755 -20.426
77 HB2 CYS 21 HB2 CYS 21 14.496 8.549 -19.150
78 HB3 CYS 21 HB3 CYS 21 13.359 9.281 -20.277
79 H ARG 22 H ARG 22 10.768 6.373 -18.742
80 HA ARG 22 HA ARG 22 10.150 5.233 -16.871
81 HB2 ARG 22 HB2 ARG 22 12.851 3.903 -17.100
82 HB3 ARG 22 HB3 ARG 22 11.405 3.254 -16.339
83 HG2 ARG 22 HG2 ARG 22 11.362 2.136 -18.324
84 HG3 ARG 22 HG3 ARG 22 10.396 3.552 -18.745
85 HD2 ARG 22 HD2 ARG 22 12.018 4.433 -20.080
86 HD3 ARG 22 HD3 ARG 22 13.330 3.734 -19.131
87 HE ARG 22 HE ARG 22 11.776 1.785 -20.560
88 HH11 ARG 22 HH11 ARG 22 14.448 4.010 -20.744
89 HH12 ARG 22 HH12 ARG 22 15.241 3.155 -22.026
90 HH21 ARG 22 HH21 ARG 22 12.810 0.650 -22.247
91 HH22 ARG 22 HH22 ARG 22 14.308 1.244 -22.880
92 H GLN 23 H GLN 23 10.469 7.404 -15.821
93 HA GLN 23 HA GLN 23 12.549 7.222 -13.741
94 HB2 GLN 23 HB2 GLN 23 11.642 9.488 -15.418
95 HB3 GLN 23 HB3 GLN 23 11.948 9.852 -13.725
96 HG2 GLN 23 HG2 GLN 23 14.211 9.010 -13.924
97 HG3 GLN 23 HG3 GLN 23 13.913 8.558 -15.602
98 HE21 GLN 23 HE21 GLN 23 15.557 9.871 -16.366
99 HE22 GLN 23 HE22 GLN 23 15.427 11.593 -16.400
100 H LEU 24 H LEU 24 11.677 6.685 -11.859
101 HA LEU 24 HA LEU 24 8.950 6.792 -11.241
102 HB2 LEU 24 HB2 LEU 24 10.796 5.412 -10.152
103 HB3 LEU 24 HB3 LEU 24 11.149 6.849 -9.195
104 HG LEU 24 HG LEU 24 8.407 5.632 -9.213
105 HD11 LEU 24 HD11 LEU 24 9.502 4.735 -6.899
106 HD12 LEU 24 HD12 LEU 24 10.858 4.558 -8.013
107 HD13 LEU 24 HD13 LEU 24 9.320 3.768 -8.364
108 HD21 LEU 24 HD21 LEU 24 9.946 7.526 -7.478
109 HD22 LEU 24 HD22 LEU 24 8.574 6.624 -6.834
110 HD23 LEU 24 HD23 LEU 24 8.347 7.719 -8.198
111 H ASP 25 H ASP 25 7.858 8.661 -11.271
112 HA ASP 25 HA ASP 25 8.966 10.930 -9.751
113 HB2 ASP 25 HB2 ASP 25 7.902 10.794 -12.402
114 HB3 ASP 25 HB3 ASP 25 6.840 11.802 -11.422
115 H PHE 26 H PHE 26 7.425 12.271 -8.601
116 HA PHE 26 HA PHE 26 5.361 10.643 -7.354
117 HB2 PHE 26 HB2 PHE 26 6.133 13.460 -6.601
118 HB3 PHE 26 HB3 PHE 26 5.340 12.249 -5.600
119 HD1 PHE 26 HD1 PHE 26 8.528 13.253 -7.135
120 HD2 PHE 26 HD2 PHE 26 6.590 10.609 -4.420
121 HE1 PHE 26 HE1 PHE 26 10.718 12.553 -6.258
122 HE2 PHE 26 HE2 PHE 26 8.777 9.906 -3.538
123 HZ PHE 26 HZ PHE 26 10.845 10.879 -4.457
124 H LEU 27 H LEU 27 5.682 13.538 -9.312
125 HA LEU 27 HA LEU 27 2.745 13.730 -9.437
126 HB2 LEU 27 HB2 LEU 27 3.546 16.083 -10.457
127 HB3 LEU 27 HB3 LEU 27 3.192 15.821 -8.751
128 HG LEU 27 HG LEU 27 5.621 15.457 -8.362
129 HD11 LEU 27 HD11 LEU 27 6.115 14.803 -10.728
130 HD12 LEU 27 HD12 LEU 27 7.228 15.982 -10.036
131 HD13 LEU 27 HD13 LEU 27 5.975 16.507 -11.161
132 HD21 LEU 27 HD21 LEU 27 6.063 18.014 -9.264
133 HD22 LEU 27 HD22 LEU 27 5.331 17.575 -7.721
134 HD23 LEU 27 HD23 LEU 27 4.307 17.947 -9.109
135 HA PRO 28 HA PRO 28 4.047 12.239 -13.593
136 HB2 PRO 28 HB2 PRO 28 1.845 10.694 -13.960
137 HB3 PRO 28 HB3 PRO 28 3.278 10.133 -13.090
138 HG2 PRO 28 HG2 PRO 28 0.697 11.192 -12.004
139 HG3 PRO 28 HG3 PRO 28 1.658 9.806 -11.454
140 HD2 PRO 28 HD2 PRO 28 1.729 12.212 -10.213
141 HD3 PRO 28 HD3 PRO 28 3.137 11.134 -10.288
142 H PHE 29 H PHE 29 3.610 13.421 -15.340
143 HA PHE 29 HA PHE 29 1.297 15.165 -15.361
144 HB2 PHE 29 HB2 PHE 29 3.770 14.903 -17.035
145 HB3 PHE 29 HB3 PHE 29 2.396 15.818 -17.646
146 HD1 PHE 29 HD1 PHE 29 1.920 17.987 -16.856
147 HD2 PHE 29 HD2 PHE 29 4.873 15.611 -14.919
148 HE1 PHE 29 HE1 PHE 29 2.660 19.955 -15.578
149 HE2 PHE 29 HE2 PHE 29 5.617 17.575 -13.637
150 HZ PHE 29 HZ PHE 29 4.510 19.750 -13.965
151 H HIS 30 H HIS 30 -0.571 14.233 -15.924
152 HA HIS 30 HA HIS 30 -0.705 12.074 -17.817
153 HB2 HIS 30 HB2 HIS 30 -2.244 12.174 -15.906
154 HB3 HIS 30 HB3 HIS 30 -2.917 13.681 -16.520
155 HD1 HIS 30 HD1 HIS 30 -3.055 10.002 -16.956
156 HD2 HIS 30 HD2 HIS 30 -4.581 13.398 -18.800
157 HE1 HIS 30 HE1 HIS 30 -4.873 9.177 -18.486
158 H CYS 31 H CYS 31 -0.821 12.265 -19.947
159 HA CYS 31 HA CYS 31 -1.236 14.870 -21.148
160 HB2 CYS 31 HB2 CYS 31 0.500 13.057 -21.845
161 HB3 CYS 31 HB3 CYS 31 -0.856 12.329 -22.701
162 H SER 32 H SER 32 -3.048 15.562 -22.096
163 HA SER 32 HA SER 32 -5.359 13.782 -22.106
164 HB2 SER 32 HB2 SER 32 -5.141 16.356 -21.310
165 HB3 SER 32 HB3 SER 32 -5.664 16.598 -22.976
166 HG SER 32 HG SER 32 -7.217 16.118 -21.001
167 H PHE 33 H PHE 33 -3.100 13.739 -24.114
168 HA PHE 33 HA PHE 33 -4.743 14.096 -26.534
169 HB2 PHE 33 HB2 PHE 33 -1.738 14.304 -26.245
170 HB3 PHE 33 HB3 PHE 33 -2.612 14.395 -27.771
171 HD1 PHE 33 HD1 PHE 33 -4.941 16.047 -26.887
172 HD2 PHE 33 HD2 PHE 33 -0.771 16.426 -26.121
173 HE1 PHE 33 HE1 PHE 33 -5.221 18.472 -26.582
174 HE2 PHE 33 HE2 PHE 33 -1.045 18.852 -25.813
175 HZ PHE 33 HZ PHE 33 -3.272 19.879 -26.045
176 H CYS 34 H CYS 34 -2.149 12.154 -25.078
177 HA CYS 34 HA CYS 34 -2.911 9.929 -26.847
178 HB2 CYS 34 HB2 CYS 34 -0.685 8.995 -26.377
179 HB3 CYS 34 HB3 CYS 34 -0.572 10.610 -27.068
180 H ASN 35 H ASN 35 -3.018 11.048 -23.652
181 HA ASN 35 HA ASN 35 -3.840 10.140 -21.733
182 HB2 ASN 35 HB2 ASN 35 -5.334 8.959 -23.587
183 HB3 ASN 35 HB3 ASN 35 -4.459 7.531 -23.041
184 HD21 ASN 35 HD21 ASN 35 -5.988 6.467 -21.948
185 HD22 ASN 35 HD22 ASN 35 -6.847 7.095 -20.587
186 H GLU 36 H GLU 36 -1.289 10.137 -21.633
187 HA GLU 36 HA GLU 36 -0.574 7.562 -20.467
188 HB2 GLU 36 HB2 GLU 36 0.948 8.917 -22.684
189 HB3 GLU 36 HB3 GLU 36 1.723 7.787 -21.583
190 HG2 GLU 36 HG2 GLU 36 -0.545 6.447 -22.423
191 HG3 GLU 36 HG3 GLU 36 0.025 7.280 -23.868
192 H ASP 37 H ASP 37 1.278 7.682 -19.040
193 HA ASP 37 HA ASP 37 1.495 10.331 -17.813
194 HB2 ASP 37 HB2 ASP 37 2.473 9.066 -15.881
195 HB3 ASP 37 HB3 ASP 37 0.820 8.607 -16.281
196 H PHE 38 H PHE 38 3.434 11.356 -17.461
197 HA PHE 38 HA PHE 38 5.920 10.076 -18.228
198 HB2 PHE 38 HB2 PHE 38 4.927 12.544 -19.670
199 HB3 PHE 38 HB3 PHE 38 6.524 11.825 -19.853
200 HD1 PHE 38 HD1 PHE 38 6.649 9.432 -20.725
201 HD2 PHE 38 HD2 PHE 38 3.152 11.843 -20.995
202 HE1 PHE 38 HE1 PHE 38 5.791 7.981 -22.517
203 HE2 PHE 38 HE2 PHE 38 2.288 10.395 -22.786
204 HZ PHE 38 HZ PHE 38 3.607 8.460 -23.549
205 H CYS 39 H CYS 39 7.654 10.899 -17.168
206 HA CYS 39 HA CYS 39 7.360 12.369 -14.860
207 HB2 CYS 39 HB2 CYS 39 9.728 12.498 -14.753
208 HB3 CYS 39 HB3 CYS 39 9.367 10.995 -15.596
209 H SER 40 H SER 40 8.152 14.520 -14.298
210 HA SER 40 HA SER 40 6.925 16.553 -15.701
211 HB2 SER 40 HB2 SER 40 8.115 18.096 -14.295
212 HB3 SER 40 HB3 SER 40 7.776 16.659 -13.332
213 HG SER 40 HG SER 40 9.858 16.138 -13.335
214 H ASN 41 H ASN 41 10.329 15.552 -15.833
215 HA ASN 41 HA ASN 41 11.286 17.503 -17.560
216 HB2 ASN 41 HB2 ASN 41 12.193 14.630 -17.666
217 HB3 ASN 41 HB3 ASN 41 13.144 16.084 -17.951
218 HD21 ASN 41 HD21 ASN 41 13.775 17.356 -16.181
219 HD22 ASN 41 HD22 ASN 41 13.815 16.711 -14.579
220 H HIS 42 H HIS 42 9.273 14.756 -18.200
221 HA HIS 42 HA HIS 42 9.432 15.324 -21.088
222 HB2 HIS 42 HB2 HIS 42 8.947 12.758 -19.595
223 HB3 HIS 42 HB3 HIS 42 8.431 12.947 -21.268
224 HD2 HIS 42 HD2 HIS 42 10.950 14.141 -22.730
225 HE1 HIS 42 HE1 HIS 42 13.251 11.194 -20.724
226 HE2 HIS 42 HE2 HIS 42 13.182 12.836 -22.635
227 H ARG 43 H ARG 43 7.731 16.493 -18.869
228 HA ARG 43 HA ARG 43 5.079 15.617 -19.129
229 HB2 ARG 43 HB2 ARG 43 4.444 17.693 -18.094
230 HB3 ARG 43 HB3 ARG 43 5.929 17.129 -17.339
231 HG2 ARG 43 HG2 ARG 43 7.166 18.681 -18.896
232 HG3 ARG 43 HG3 ARG 43 5.594 19.363 -19.318
233 HD2 ARG 43 HD2 ARG 43 5.217 20.099 -17.098
234 HD3 ARG 43 HD3 ARG 43 6.572 19.154 -16.482
235 HE ARG 43 HE ARG 43 7.774 20.831 -18.206
236 HH11 ARG 43 HH11 ARG 43 5.492 21.351 -15.629
237 HH12 ARG 43 HH12 ARG 43 6.078 22.938 -15.255
238 HH21 ARG 43 HH21 ARG 43 8.554 22.919 -17.723
239 HH22 ARG 43 HH22 ARG 43 7.819 23.830 -16.448
240 H LEU 44 H LEU 44 6.993 17.875 -21.021
241 HA LEU 44 HA LEU 44 5.002 19.127 -22.491
242 HB2 LEU 44 HB2 LEU 44 7.674 18.262 -23.576
243 HB3 LEU 44 HB3 LEU 44 6.676 19.602 -24.138
244 HG LEU 44 HG LEU 44 8.033 19.470 -21.446
245 HD11 LEU 44 HD11 LEU 44 9.007 20.226 -24.072
246 HD12 LEU 44 HD12 LEU 44 9.887 19.986 -22.564
247 HD13 LEU 44 HD13 LEU 44 9.130 21.542 -22.903
248 HD21 LEU 44 HD21 LEU 44 6.239 20.897 -21.145
249 HD22 LEU 44 HD22 LEU 44 6.284 21.475 -22.811
250 HD23 LEU 44 HD23 LEU 44 7.511 22.005 -21.660
251 H LYS 45 H LYS 45 4.565 18.778 -24.862
252 HA LYS 45 HA LYS 45 3.466 16.168 -25.225
253 HB2 LYS 45 HB2 LYS 45 3.210 18.757 -26.444
254 HB3 LYS 45 HB3 LYS 45 3.454 17.544 -27.694
255 HG2 LYS 45 HG2 LYS 45 1.597 16.366 -26.045
256 HG3 LYS 45 HG3 LYS 45 1.132 18.069 -26.026
257 HD2 LYS 45 HD2 LYS 45 1.774 16.758 -28.630
258 HD3 LYS 45 HD3 LYS 45 0.209 16.452 -27.873
259 HE2 LYS 45 HE2 LYS 45 -0.139 18.280 -29.312
260 HE3 LYS 45 HE3 LYS 45 -0.029 18.973 -27.695
261 HZ1 LYS 45 HZ1 LYS 45 1.463 19.663 -29.913
262 HZ2 LYS 45 HZ2 LYS 45 2.533 18.845 -28.890
263 HZ3 LYS 45 HZ3 LYS 45 1.689 20.197 -28.324
264 H GLU 46 H GLU 46 5.794 17.997 -27.222
265 HA GLU 46 HA GLU 46 6.603 15.851 -28.806
266 HB2 GLU 46 HB2 GLU 46 8.609 17.212 -29.308
267 HB3 GLU 46 HB3 GLU 46 7.115 18.131 -29.428
268 HG2 GLU 46 HG2 GLU 46 7.532 19.275 -27.418
269 HG3 GLU 46 HG3 GLU 46 8.812 18.155 -26.955
270 H ASP 47 H ASP 47 7.529 16.763 -25.586
271 HA ASP 47 HA ASP 47 9.977 15.554 -25.261
272 HB2 ASP 47 HB2 ASP 47 7.740 16.271 -23.509
273 HB3 ASP 47 HB3 ASP 47 8.705 14.929 -22.901
274 H HIS 48 H HIS 48 6.794 14.018 -24.796
275 HA HIS 48 HA HIS 48 8.081 11.394 -24.778
276 HB2 HIS 48 HB2 HIS 48 5.914 10.539 -24.043
277 HB3 HIS 48 HB3 HIS 48 6.417 11.888 -23.028
278 HD1 HIS 48 HD1 HIS 48 4.976 13.997 -23.067
279 HD2 HIS 48 HD2 HIS 48 3.693 11.063 -25.714
280 HE1 HIS 48 HE1 HIS 48 2.703 14.741 -23.845
281 H HIS 49 H HIS 49 7.624 13.196 -27.187
282 HA HIS 49 HA HIS 49 6.930 13.046 -29.359
283 HB2 HIS 49 HB2 HIS 49 7.502 10.142 -28.741
284 HB3 HIS 49 HB3 HIS 49 7.246 10.773 -30.365
285 HD1 HIS 49 HD1 HIS 49 9.394 11.068 -31.528
286 HD2 HIS 49 HD2 HIS 49 9.728 11.879 -27.467
287 HE1 HIS 49 HE1 HIS 49 11.795 11.722 -31.169
288 H CYS 50 H CYS 50 4.747 13.542 -28.107
289 HA CYS 50 HA CYS 50 2.725 11.657 -27.889
290 HB2 CYS 50 HB2 CYS 50 2.729 14.124 -27.176
291 HB3 CYS 50 HB3 CYS 50 2.225 14.476 -28.826
292 H ARG 51 H ARG 51 1.530 10.539 -29.293
293 HA ARG 51 HA ARG 51 2.129 10.329 -31.985
294 HB2 ARG 51 HB2 ARG 51 0.231 9.203 -30.183
295 HB3 ARG 51 HB3 ARG 51 -0.626 9.681 -31.643
296 HG2 ARG 51 HG2 ARG 51 0.002 7.689 -32.426
297 HG3 ARG 51 HG3 ARG 51 1.576 8.448 -32.671
298 HD2 ARG 51 HD2 ARG 51 2.490 7.467 -30.794
299 HD3 ARG 51 HD3 ARG 51 0.922 7.252 -30.017
300 HE ARG 51 HE ARG 51 0.692 5.239 -31.095
301 HH11 ARG 51 HH11 ARG 51 3.327 7.022 -32.508
302 HH12 ARG 51 HH12 ARG 51 3.885 5.691 -33.467
303 HH21 ARG 51 HH21 ARG 51 1.417 3.479 -32.353
304 HH22 ARG 51 HH22 ARG 51 2.797 3.677 -33.379
305 H TRP 52 H TRP 52 -0.177 12.429 -30.371
306 HA TRP 52 HA TRP 52 -1.596 13.312 -32.623
307 HB2 TRP 52 HB2 TRP 52 -2.141 13.699 -30.156
308 HB3 TRP 52 HB3 TRP 52 -0.987 15.029 -30.219
309 HD1 TRP 52 HD1 TRP 52 -4.509 14.082 -31.231
310 HE1 TRP 52 HE1 TRP 52 -5.699 16.152 -32.192
311 HE3 TRP 52 HE3 TRP 52 -0.503 17.242 -31.560
312 HZ2 TRP 52 HZ2 TRP 52 -5.029 18.777 -32.985
313 HZ3 TRP 52 HZ3 TRP 52 -0.863 19.515 -32.431
314 HH2 TRP 52 HH2 TRP 52 -3.079 20.264 -33.129
315 H LEU 53 H LEU 53 1.416 14.440 -31.171
316 HA LEU 53 HA LEU 53 1.717 16.764 -32.739
317 HB2 LEU 53 HB2 LEU 53 3.290 15.237 -30.850
318 HB3 LEU 53 HB3 LEU 53 4.283 15.849 -32.171
319 HG LEU 53 HG LEU 53 2.575 17.495 -30.307
320 HD11 LEU 53 HD11 LEU 53 4.708 16.520 -29.399
321 HD12 LEU 53 HD12 LEU 53 4.604 18.280 -29.370
322 HD13 LEU 53 HD13 LEU 53 5.568 17.475 -30.608
323 HD21 LEU 53 HD21 LEU 53 4.011 19.330 -31.521
324 HD22 LEU 53 HD22 LEU 53 2.495 18.758 -32.217
325 HD23 LEU 53 HD23 LEU 53 4.032 18.140 -32.823
326 H LEU 54 H LEU 54 2.619 13.406 -33.259
327 HA LEU 54 HA LEU 54 4.194 13.889 -35.584
328 HB2 LEU 54 HB2 LEU 54 2.809 11.295 -35.047
329 HB3 LEU 54 HB3 LEU 54 4.389 11.584 -35.773
330 HG LEU 54 HG LEU 54 3.679 11.828 -32.851
331 HD11 LEU 54 HD11 LEU 54 4.681 9.820 -32.511
332 HD12 LEU 54 HD12 LEU 54 5.770 10.001 -33.886
333 HD13 LEU 54 HD13 LEU 54 4.086 9.547 -34.148
334 HD21 LEU 54 HD21 LEU 54 5.361 13.300 -32.790
335 HD22 LEU 54 HD22 LEU 54 5.901 12.892 -34.419
336 HD23 LEU 54 HD23 LEU 54 6.408 11.904 -33.048
337 H GLU 55 H GLU 55 0.928 12.521 -35.150
338 HA GLU 55 HA GLU 55 0.287 12.367 -37.872
339 HB2 GLU 55 HB2 GLU 55 -2.015 12.127 -37.165
340 HB3 GLU 55 HB3 GLU 55 -0.972 11.226 -36.074
341 HG2 GLU 55 HG2 GLU 55 -1.063 13.248 -34.549
342 HG3 GLU 55 HG3 GLU 55 -2.370 13.833 -35.577
343 H HIS 56 H HIS 56 -0.011 14.994 -35.557
344 HA HIS 56 HA HIS 56 -0.880 16.752 -37.758
345 HB2 HIS 56 HB2 HIS 56 -1.801 16.544 -34.937
346 HB3 HIS 56 HB3 HIS 56 -1.697 18.158 -35.633
347 HD1 HIS 56 HD1 HIS 56 -4.126 18.673 -35.962
348 HD2 HIS 56 HD2 HIS 56 -3.052 14.986 -37.549
349 HE1 HIS 56 HE1 HIS 56 -6.142 17.877 -37.239
350 H GLU 57 H GLU 57 1.356 17.133 -38.237
351 HA GLU 57 HA GLU 57 3.087 18.295 -36.268
352 HB2 GLU 57 HB2 GLU 57 3.261 17.704 -39.188
353 HB3 GLU 57 HB3 GLU 57 4.387 18.869 -38.506
354 HG2 GLU 57 HG2 GLU 57 4.422 16.690 -36.760
355 HG3 GLU 57 HG3 GLU 57 4.426 16.003 -38.384
356 H GLU 58 H GLU 58 2.058 20.126 -35.476
357 HA GLU 58 HA GLU 58 1.036 22.176 -37.178
358 HB2 GLU 58 HB2 GLU 58 0.659 23.432 -35.178
359 HB3 GLU 58 HB3 GLU 58 0.276 21.752 -34.827
360 HG2 GLU 58 HG2 GLU 58 2.555 21.525 -33.831
361 HG3 GLU 58 HG3 GLU 58 2.746 23.266 -34.025
362 H VAL 59 H VAL 59 1.901 24.541 -36.511
363 HA VAL 59 HA VAL 59 4.554 24.658 -37.631
364 HB VAL 59 HB VAL 59 2.753 26.886 -36.668
365 HG11 VAL 59 HG11 VAL 59 4.455 27.928 -38.555
366 HG12 VAL 59 HG12 VAL 59 4.611 28.122 -36.808
367 HG13 VAL 59 HG13 VAL 59 5.502 26.846 -37.637
368 HG21 VAL 59 HG21 VAL 59 1.661 26.748 -38.600
369 HG22 VAL 59 HG22 VAL 59 3.167 26.722 -39.517
370 HG23 VAL 59 HG23 VAL 59 2.490 25.219 -38.890