Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
520826 | 2l60 RC | 17291 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA TYR 1 HA TYR 1 -2.262 12.638 -10.894
2 HB2 TYR 1 HB2 TYR 1 -3.945 14.336 -11.505
3 HB3 TYR 1 HB3 TYR 1 -2.924 15.601 -10.845
4 HD1 TYR 1 HD2 TYR 1 -2.699 12.794 -13.394
5 HD2 TYR 1 HD1 TYR 1 -1.662 16.860 -12.358
6 HE1 TYR 1 HE2 TYR 1 -1.600 13.083 -15.596
7 HE2 TYR 1 HE1 TYR 1 -0.579 17.144 -14.570
8 HH TYR 1 HH TYR 1 -0.566 14.593 -17.051
9 H LEU 2 H LEU 2 -0.571 12.382 -8.771
10 HA LEU 2 HA LEU 2 1.691 14.201 -9.419
11 HB2 LEU 2 HB2 LEU 2 0.633 13.267 -6.747
12 HB3 LEU 2 HB3 LEU 2 2.339 13.586 -6.938
13 HG LEU 2 HG LEU 2 1.238 15.454 -5.966
14 HD11 LEU 2 HD11 LEU 2 1.858 17.073 -8.194
15 HD12 LEU 2 HD12 LEU 2 2.924 16.571 -6.875
16 HD13 LEU 2 HD13 LEU 2 2.875 15.645 -8.373
17 HD21 LEU 2 HD21 LEU 2 -0.231 16.276 -8.437
18 HD22 LEU 2 HD22 LEU 2 -0.968 15.070 -7.351
19 HD23 LEU 2 HD23 LEU 2 -0.511 16.655 -6.726
20 H GLU 3 H GLU 3 1.582 12.303 -11.104
21 HA GLU 3 HA GLU 3 2.764 9.777 -10.387
22 HB2 GLU 3 HB2 GLU 3 2.175 11.331 -12.898
23 HB3 GLU 3 HB3 GLU 3 3.428 10.119 -12.998
24 HG2 GLU 3 HG2 GLU 3 1.177 8.926 -11.625
25 HG3 GLU 3 HG3 GLU 3 0.573 9.761 -13.045
26 H ARG 4 H ARG 4 4.181 12.848 -11.558
27 HA ARG 4 HA ARG 4 6.880 11.844 -11.679
28 HB2 ARG 4 HB2 ARG 4 6.232 13.871 -12.878
29 HB3 ARG 4 HB3 ARG 4 5.846 14.705 -11.362
30 HG2 ARG 4 HG2 ARG 4 8.099 14.828 -10.681
31 HG3 ARG 4 HG3 ARG 4 8.609 13.524 -11.752
32 HD2 ARG 4 HD2 ARG 4 7.563 16.157 -12.849
33 HD3 ARG 4 HD3 ARG 4 9.252 15.962 -12.380
34 HE ARG 4 HE ARG 4 7.958 14.923 -14.739
35 HH11 ARG 4 HH22 ARG 4 10.596 14.182 -12.543
36 HH12 ARG 4 HH21 ARG 4 11.488 13.256 -13.720
37 HH21 ARG 4 HH12 ARG 4 9.099 13.657 -16.195
38 HH22 ARG 4 HH11 ARG 4 10.624 12.936 -15.730
39 H GLU 5 H GLU 5 5.229 13.781 -9.170
40 HA GLU 5 HA GLU 5 7.361 13.740 -7.304
41 HB2 GLU 5 HB2 GLU 5 4.612 14.617 -7.309
42 HB3 GLU 5 HB3 GLU 5 4.852 13.605 -5.891
43 HG2 GLU 5 HG2 GLU 5 7.112 15.152 -5.747
44 HG3 GLU 5 HG3 GLU 5 6.041 16.265 -6.588
45 H LEU 6 H LEU 6 4.836 11.278 -7.924
46 HA LEU 6 HA LEU 6 5.266 9.555 -5.812
47 HB2 LEU 6 HB2 LEU 6 4.034 9.465 -8.353
48 HB3 LEU 6 HB3 LEU 6 5.128 8.106 -8.378
49 HG LEU 6 HG LEU 6 3.047 8.682 -6.225
50 HD11 LEU 6 HD11 LEU 6 2.881 6.419 -8.227
51 HD12 LEU 6 HD12 LEU 6 1.594 7.202 -7.284
52 HD13 LEU 6 HD13 LEU 6 2.306 8.032 -8.670
53 HD21 LEU 6 HD21 LEU 6 4.815 7.333 -5.260
54 HD22 LEU 6 HD22 LEU 6 3.479 6.233 -5.645
55 HD23 LEU 6 HD23 LEU 6 4.903 6.306 -6.702
56 H LYS 7 H LYS 7 7.342 9.908 -8.699
57 HA LYS 7 HA LYS 7 9.165 7.786 -7.971
58 HB2 LYS 7 HB2 LYS 7 8.797 9.244 -10.232
59 HB3 LYS 7 HB3 LYS 7 10.164 10.138 -9.582
60 HG2 LYS 7 HG2 LYS 7 10.069 7.113 -10.017
61 HG3 LYS 7 HG3 LYS 7 10.737 8.260 -11.181
62 HD2 LYS 7 HD2 LYS 7 12.494 8.926 -9.601
63 HD3 LYS 7 HD3 LYS 7 11.773 7.912 -8.348
64 HE2 LYS 7 HE2 LYS 7 12.092 6.062 -10.324
65 HE3 LYS 7 HE3 LYS 7 13.467 7.129 -10.641
66 HZ1 LYS 7 HZ1 LYS 7 14.177 5.521 -9.037
67 HZ2 LYS 7 HZ2 LYS 7 13.919 6.892 -8.161
68 HZ3 LYS 7 HZ3 LYS 7 12.815 5.683 -8.136
69 H LYS 8 H LYS 8 9.140 11.274 -7.319
70 HA LYS 8 HA LYS 8 11.598 11.270 -5.756
71 HB2 LYS 8 HB2 LYS 8 10.498 13.289 -6.934
72 HB3 LYS 8 HB3 LYS 8 9.356 13.326 -5.584
73 HG2 LYS 8 HG2 LYS 8 11.253 13.622 -4.004
74 HG3 LYS 8 HG3 LYS 8 12.397 13.569 -5.346
75 HD2 LYS 8 HD2 LYS 8 10.158 15.630 -5.278
76 HD3 LYS 8 HD3 LYS 8 11.617 15.858 -4.325
77 HE2 LYS 8 HE2 LYS 8 12.771 16.611 -6.068
78 HE3 LYS 8 HE3 LYS 8 12.497 15.103 -6.940
79 HZ1 LYS 8 HZ1 LYS 8 11.646 16.894 -8.209
80 HZ2 LYS 8 HZ2 LYS 8 10.335 16.069 -7.643
81 HZ3 LYS 8 HZ3 LYS 8 10.767 17.503 -6.959
82 H LEU 9 H LEU 9 8.394 10.344 -5.071
83 HA LEU 9 HA LEU 9 8.667 10.377 -2.179
84 HB2 LEU 9 HB2 LEU 9 6.509 10.449 -3.881
85 HB3 LEU 9 HB3 LEU 9 6.522 8.746 -3.507
86 HG LEU 9 HG LEU 9 5.031 9.841 -2.017
87 HD11 LEU 9 HD11 LEU 9 5.851 9.298 0.175
88 HD12 LEU 9 HD12 LEU 9 6.508 8.103 -0.960
89 HD13 LEU 9 HD13 LEU 9 7.539 9.415 -0.345
90 HD21 LEU 9 HD21 LEU 9 7.269 11.761 -1.236
91 HD22 LEU 9 HD22 LEU 9 5.905 12.136 -2.300
92 HD23 LEU 9 HD23 LEU 9 5.616 11.738 -0.597
93 H GLU 10 H GLU 10 8.346 7.695 -4.608
94 HA GLU 10 HA GLU 10 8.931 5.600 -2.804
95 HB2 GLU 10 HB2 GLU 10 8.313 5.671 -5.484
96 HB3 GLU 10 HB3 GLU 10 10.027 5.258 -5.555
97 HG2 GLU 10 HG2 GLU 10 9.455 3.423 -3.789
98 HG3 GLU 10 HG3 GLU 10 7.771 3.763 -4.169
99 H ARG 11 H ARG 11 11.162 7.750 -4.573
100 HA ARG 11 HA ARG 11 13.625 6.502 -3.841
101 HB2 ARG 11 HB2 ARG 11 13.300 8.333 -5.533
102 HB3 ARG 11 HB3 ARG 11 13.005 9.463 -4.218
103 HG2 ARG 11 HG2 ARG 11 15.559 8.016 -3.819
104 HG3 ARG 11 HG3 ARG 11 15.475 8.711 -5.418
105 HD2 ARG 11 HD2 ARG 11 16.336 10.515 -4.401
106 HD3 ARG 11 HD3 ARG 11 14.642 10.888 -4.064
107 HE ARG 11 HE ARG 11 15.613 9.290 -1.931
108 HH11 ARG 11 HH22 ARG 11 16.122 12.497 -3.244
109 HH12 ARG 11 HH21 ARG 11 16.785 13.151 -1.771
110 HH21 ARG 11 HH12 ARG 11 16.416 10.198 -0.004
111 HH22 ARG 11 HH11 ARG 11 16.876 11.882 0.037
112 H GLU 12 H GLU 12 11.525 8.682 -1.939
113 HA GLU 12 HA GLU 12 13.603 8.865 0.145
114 HB2 GLU 12 HB2 GLU 12 11.534 10.626 -0.568
115 HB3 GLU 12 HB3 GLU 12 10.944 9.872 0.913
116 HG2 GLU 12 HG2 GLU 12 13.631 10.387 1.529
117 HG3 GLU 12 HG3 GLU 12 13.242 11.719 0.459
118 H LEU 13 H LEU 13 10.316 7.436 -0.215
119 HA LEU 13 HA LEU 13 10.239 6.088 2.302
120 HB2 LEU 13 HB2 LEU 13 8.208 6.001 1.314
121 HB3 LEU 13 HB3 LEU 13 8.849 5.993 -0.315
122 HG LEU 13 HG LEU 13 9.307 3.586 -0.182
123 HD11 LEU 13 HD11 LEU 13 8.686 3.943 2.672
124 HD12 LEU 13 HD12 LEU 13 7.708 2.657 1.940
125 HD13 LEU 13 HD13 LEU 13 9.466 2.593 1.831
126 HD21 LEU 13 HD21 LEU 13 7.266 4.303 -1.184
127 HD22 LEU 13 HD22 LEU 13 6.902 2.882 -0.202
128 HD23 LEU 13 HD23 LEU 13 6.474 4.503 0.396
129 H LYS 14 H LYS 14 11.742 5.021 -0.778
130 HA LYS 14 HA LYS 14 12.659 2.516 -0.012
131 HB2 LYS 14 HB2 LYS 14 12.895 3.214 -2.274
132 HB3 LYS 14 HB3 LYS 14 13.786 4.669 -1.824
133 HG2 LYS 14 HG2 LYS 14 15.259 3.063 -2.903
134 HG3 LYS 14 HG3 LYS 14 15.748 3.411 -1.261
135 HD2 LYS 14 HD2 LYS 14 14.124 1.163 -0.908
136 HD3 LYS 14 HD3 LYS 14 14.814 0.849 -2.490
137 HE2 LYS 14 HE2 LYS 14 16.813 1.865 -0.570
138 HE3 LYS 14 HE3 LYS 14 15.970 0.491 0.109
139 HZ1 LYS 14 HZ1 LYS 14 16.715 -0.880 -1.607
140 HZ2 LYS 14 HZ2 LYS 14 17.095 0.376 -2.606
141 HZ3 LYS 14 HZ3 LYS 14 18.033 0.050 -1.296
142 H LYS 15 H LYS 15 13.715 5.490 1.442
143 HA LYS 15 HA LYS 15 16.266 4.908 2.471
144 HB2 LYS 15 HB2 LYS 15 14.903 6.971 2.863
145 HB3 LYS 15 HB3 LYS 15 13.814 6.039 3.890
146 HG2 LYS 15 HG2 LYS 15 15.176 7.202 5.362
147 HG3 LYS 15 HG3 LYS 15 15.867 5.584 5.393
148 HD2 LYS 15 HD2 LYS 15 17.795 6.211 4.284
149 HD3 LYS 15 HD3 LYS 15 17.024 7.510 3.376
150 HE2 LYS 15 HE2 LYS 15 17.130 7.808 6.367
151 HE3 LYS 15 HE3 LYS 15 18.659 7.945 5.491
152 HZ1 LYS 15 HZ1 LYS 15 17.519 9.609 4.059
153 HZ2 LYS 15 HZ2 LYS 15 16.244 9.608 5.088
154 HZ3 LYS 15 HZ3 LYS 15 17.737 10.099 5.615
155 H LEU 16 H LEU 16 13.116 3.565 3.492
156 HA LEU 16 HA LEU 16 14.493 1.742 5.411
157 HB2 LEU 16 HB2 LEU 16 11.593 2.565 5.004
158 HB3 LEU 16 HB3 LEU 16 12.029 1.077 5.841
159 HG LEU 16 HG LEU 16 13.514 2.435 7.376
160 HD11 LEU 16 HD11 LEU 16 12.009 4.792 6.180
161 HD12 LEU 16 HD12 LEU 16 12.939 4.829 7.697
162 HD13 LEU 16 HD13 LEU 16 13.770 4.528 6.181
163 HD21 LEU 16 HD21 LEU 16 11.461 1.582 8.209
164 HD22 LEU 16 HD22 LEU 16 11.535 3.269 8.727
165 HD23 LEU 16 HD23 LEU 16 10.505 2.810 7.355
166 H SER 17 H SER 17 14.578 -0.387 5.084
167 HA SER 17 HA SER 17 14.941 -1.515 2.647
168 HB2 SER 17 HB2 SER 17 15.676 -2.709 4.511
169 HB3 SER 17 HB3 SER 17 14.050 -2.777 5.218
170 HG SER 17 HG SER 17 14.521 -4.760 4.220
171 HA PRO 18 HA PRO 18 10.701 -1.555 1.083
172 HB2 PRO 18 HB2 PRO 18 11.233 -2.359 -1.499
173 HB3 PRO 18 HB3 PRO 18 11.469 -0.696 -0.890
174 HG2 PRO 18 HG2 PRO 18 13.533 -2.837 -1.343
175 HG3 PRO 18 HG3 PRO 18 13.652 -1.078 -1.608
176 HD2 PRO 18 HD2 PRO 18 14.620 -2.455 0.624
177 HD3 PRO 18 HD3 PRO 18 14.253 -0.706 0.607
178 H GLU 19 H GLU 19 12.817 -4.178 1.619
179 HA GLU 19 HA GLU 19 10.798 -6.245 0.969
180 HB2 GLU 19 HB2 GLU 19 13.365 -6.387 0.497
181 HB3 GLU 19 HB3 GLU 19 13.523 -6.698 2.221
182 HG2 GLU 19 HG2 GLU 19 11.464 -8.453 1.378
183 HG3 GLU 19 HG3 GLU 19 12.549 -8.408 0.004
184 H GLU 20 H GLU 20 12.055 -4.421 3.730
185 HA GLU 20 HA GLU 20 11.128 -6.308 5.757
186 HB2 GLU 20 HB2 GLU 20 12.996 -4.535 5.910
187 HB3 GLU 20 HB3 GLU 20 11.735 -3.357 6.233
188 HG2 GLU 20 HG2 GLU 20 12.008 -5.941 7.842
189 HG3 GLU 20 HG3 GLU 20 13.085 -4.586 8.133
190 H LEU 21 H LEU 21 9.887 -3.279 4.281
191 HA LEU 21 HA LEU 21 7.540 -3.167 5.841
192 HB2 LEU 21 HB2 LEU 21 8.655 -1.757 3.581
193 HB3 LEU 21 HB3 LEU 21 7.015 -2.202 3.166
194 HG LEU 21 HG LEU 21 7.856 -0.687 5.682
195 HD11 LEU 21 HD11 LEU 21 6.618 0.191 3.046
196 HD12 LEU 21 HD12 LEU 21 6.589 1.195 4.515
197 HD13 LEU 21 HD13 LEU 21 8.137 0.735 3.792
198 HD21 LEU 21 HD21 LEU 21 5.075 -1.412 4.650
199 HD22 LEU 21 HD22 LEU 21 5.812 -1.918 6.185
200 HD23 LEU 21 HD23 LEU 21 5.403 -0.228 5.937
201 H ASN 22 H ASN 22 8.037 -4.738 2.627
202 HA ASN 22 HA ASN 22 5.447 -5.753 2.286
203 HB2 ASN 22 HB2 ASN 22 7.540 -5.770 0.719
204 HB3 ASN 22 HB3 ASN 22 7.911 -7.320 1.481
205 HD21 ASN 22 HD21 ASN 22 7.659 -7.791 -1.016
206 HD22 ASN 22 HD22 ASN 22 6.007 -8.233 -1.465
207 H ARG 23 H ARG 23 8.131 -7.164 4.169
208 HA ARG 23 HA ARG 23 6.896 -9.610 4.959
209 HB2 ARG 23 HB2 ARG 23 9.322 -8.857 5.328
210 HB3 ARG 23 HB3 ARG 23 8.739 -7.859 6.641
211 HG2 ARG 23 HG2 ARG 23 9.023 -9.566 8.011
212 HG3 ARG 23 HG3 ARG 23 7.589 -10.283 7.302
213 HD2 ARG 23 HD2 ARG 23 9.782 -10.915 5.542
214 HD3 ARG 23 HD3 ARG 23 10.367 -11.160 7.181
215 HE ARG 23 HE ARG 23 8.484 -12.767 5.712
216 HH11 ARG 23 HH22 ARG 23 9.290 -11.842 8.956
217 HH12 ARG 23 HH21 ARG 23 8.486 -13.195 9.709
218 HH21 ARG 23 HH12 ARG 23 7.469 -14.526 6.646
219 HH22 ARG 23 HH11 ARG 23 7.332 -14.636 8.374
220 H TYR 24 H TYR 24 6.915 -6.455 6.647
221 HA TYR 24 HA TYR 24 4.962 -7.208 8.644
222 HB2 TYR 24 HB2 TYR 24 6.338 -4.686 7.755
223 HB3 TYR 24 HB3 TYR 24 4.882 -4.547 8.716
224 HD1 TYR 24 HD2 TYR 24 7.903 -6.849 8.867
225 HD2 TYR 24 HD1 TYR 24 5.353 -4.039 10.920
226 HE1 TYR 24 HE2 TYR 24 9.219 -7.174 10.933
227 HE2 TYR 24 HE1 TYR 24 6.692 -4.366 13.002
228 HH TYR 24 HH TYR 24 9.714 -6.084 12.961
229 H TYR 25 H TYR 25 4.685 -6.077 5.400
230 HA TYR 25 HA TYR 25 1.960 -5.185 5.517
231 HB2 TYR 25 HB2 TYR 25 3.852 -4.758 3.738
232 HB3 TYR 25 HB3 TYR 25 3.316 -6.263 3.019
233 HD1 TYR 25 HD2 TYR 25 2.044 -2.980 4.281
234 HD2 TYR 25 HD1 TYR 25 1.668 -6.121 1.351
235 HE1 TYR 25 HE2 TYR 25 0.428 -1.581 2.991
236 HE2 TYR 25 HE1 TYR 25 0.069 -4.734 0.058
237 HH TYR 25 HH TYR 25 -0.582 -2.479 -0.229
238 H ALA 26 H ALA 26 3.438 -8.289 4.387
239 HA ALA 26 HA ALA 26 0.928 -9.485 3.742
240 HB1 ALA 26 HB1 ALA 26 3.264 -11.142 4.750
241 HB2 ALA 26 HB2 ALA 26 2.137 -11.465 3.412
242 HB3 ALA 26 HB3 ALA 26 3.409 -10.243 3.224
243 H SER 27 H SER 27 2.747 -9.473 6.864
244 HA SER 27 HA SER 27 0.839 -11.076 8.304
245 HB2 SER 27 HB2 SER 27 2.034 -10.162 10.299
246 HB3 SER 27 HB3 SER 27 3.109 -10.911 9.102
247 HG SER 27 HG SER 27 3.726 -8.772 9.975
248 H LEU 28 H LEU 28 0.592 -7.900 7.140
249 HA LEU 28 HA LEU 28 -1.579 -7.220 9.070
250 HB2 LEU 28 HB2 LEU 28 0.146 -5.624 7.152
251 HB3 LEU 28 HB3 LEU 28 -1.404 -4.994 7.673
252 HG LEU 28 HG LEU 28 0.844 -5.815 9.566
253 HD11 LEU 28 HD11 LEU 28 -0.076 -3.043 8.705
254 HD12 LEU 28 HD12 LEU 28 1.175 -3.418 9.918
255 HD13 LEU 28 HD13 LEU 28 1.442 -3.844 8.225
256 HD21 LEU 28 HD21 LEU 28 -1.973 -4.829 9.976
257 HD22 LEU 28 HD22 LEU 28 -1.007 -5.962 10.940
258 HD23 LEU 28 HD23 LEU 28 -0.720 -4.223 11.072
259 H ARG 29 H ARG 29 -0.977 -7.717 5.576
260 HA ARG 29 HA ARG 29 -3.673 -7.248 4.758
261 HB2 ARG 29 HB2 ARG 29 -1.423 -7.482 3.381
262 HB3 ARG 29 HB3 ARG 29 -1.806 -9.190 3.335
263 HG2 ARG 29 HG2 ARG 29 -3.735 -6.991 2.430
264 HG3 ARG 29 HG3 ARG 29 -2.584 -7.791 1.366
265 HD2 ARG 29 HD2 ARG 29 -3.894 -9.949 2.567
266 HD3 ARG 29 HD3 ARG 29 -5.188 -8.769 2.403
267 HE ARG 29 HE ARG 29 -3.752 -10.232 0.318
268 HH11 ARG 29 HH22 ARG 29 -5.798 -7.446 0.834
269 HH12 ARG 29 HH21 ARG 29 -6.178 -7.290 -0.869
270 HH21 ARG 29 HH12 ARG 29 -4.377 -10.075 -1.808
271 HH22 ARG 29 HH11 ARG 29 -5.519 -8.869 -2.304
272 H HIS 30 H HIS 30 -1.994 -10.284 5.680
273 HA HIS 30 HA HIS 30 -4.200 -12.013 5.191
274 HB2 HIS 30 HB2 HIS 30 -1.693 -12.509 5.732
275 HB3 HIS 30 HB3 HIS 30 -2.195 -12.476 7.415
276 HD1 HIS 30 HD1 HIS 30 -1.110 -15.131 6.574
277 HD2 HIS 30 HD2 HIS 30 -5.112 -14.058 5.858
278 HE1 HIS 30 HE1 HIS 30 -2.402 -17.308 6.158
279 H TYR 31 H TYR 31 -3.473 -9.894 7.939
280 HA TYR 31 HA TYR 31 -5.542 -10.824 9.714
281 HB2 TYR 31 HB2 TYR 31 -3.825 -8.379 9.420
282 HB3 TYR 31 HB3 TYR 31 -5.322 -8.210 10.276
283 HD1 TYR 31 HD1 TYR 31 -3.156 -11.290 10.298
284 HD2 TYR 31 HD2 TYR 31 -4.340 -7.681 12.367
285 HE1 TYR 31 HE1 TYR 31 -1.958 -12.054 12.321
286 HE2 TYR 31 HE2 TYR 31 -3.142 -8.447 14.384
287 HH TYR 31 HH TYR 31 -2.182 -10.286 15.356
288 H LEU 32 H LEU 32 -5.470 -7.972 7.472
289 HA LEU 32 HA LEU 32 -8.147 -7.286 7.839
290 HB2 LEU 32 HB2 LEU 32 -6.631 -6.925 5.242
291 HB3 LEU 32 HB3 LEU 32 -8.006 -5.993 5.780
292 HG LEU 32 HG LEU 32 -5.201 -5.959 6.747
293 HD11 LEU 32 HD11 LEU 32 -6.788 -3.468 6.373
294 HD12 LEU 32 HD12 LEU 32 -5.084 -3.823 6.018
295 HD13 LEU 32 HD13 LEU 32 -6.355 -4.402 4.929
296 HD21 LEU 32 HD21 LEU 32 -7.460 -4.675 8.332
297 HD22 LEU 32 HD22 LEU 32 -6.480 -6.049 8.878
298 HD23 LEU 32 HD23 LEU 32 -5.713 -4.488 8.634
299 H ASN 33 H ASN 33 -6.938 -9.763 5.768
300 HA ASN 33 HA ASN 33 -9.093 -10.575 4.184
301 HB2 ASN 33 HB2 ASN 33 -6.616 -11.520 4.651
302 HB3 ASN 33 HB3 ASN 33 -7.482 -12.612 5.724
303 HD21 ASN 33 HD21 ASN 33 -7.201 -14.559 4.568
304 HD22 ASN 33 HD22 ASN 33 -7.752 -14.695 2.904
305 H LEU 34 H LEU 34 -8.726 -10.997 7.685
306 HA LEU 34 HA LEU 34 -11.581 -11.707 7.845
307 HB2 LEU 34 HB2 LEU 34 -11.232 -13.495 9.412
308 HB3 LEU 34 HB3 LEU 34 -10.462 -13.816 7.880
309 HG LEU 34 HG LEU 34 -8.470 -12.552 9.559
310 HD11 LEU 34 HD11 LEU 34 -8.379 -14.428 11.319
311 HD12 LEU 34 HD12 LEU 34 -9.561 -13.131 11.563
312 HD13 LEU 34 HD13 LEU 34 -10.093 -14.710 10.947
313 HD21 LEU 34 HD21 LEU 34 -7.281 -14.674 9.229
314 HD22 LEU 34 HD22 LEU 34 -8.776 -15.434 8.628
315 HD23 LEU 34 HD23 LEU 34 -8.010 -14.105 7.725
316 H VAL 35 H VAL 35 -9.330 -9.577 8.830
317 HA VAL 35 HA VAL 35 -10.541 -8.948 11.453
318 HB VAL 35 HB VAL 35 -8.149 -7.992 9.916
319 HG11 VAL 35 HG11 VAL 35 -9.207 -6.598 12.366
320 HG12 VAL 35 HG12 VAL 35 -7.533 -6.479 11.769
321 HG13 VAL 35 HG13 VAL 35 -8.861 -5.907 10.760
322 HG21 VAL 35 HG21 VAL 35 -6.941 -8.796 11.902
323 HG22 VAL 35 HG22 VAL 35 -8.480 -9.138 12.716
324 HG23 VAL 35 HG23 VAL 35 -8.001 -10.069 11.283
325 H THR 36 H THR 36 -10.819 -7.974 8.211
326 HA THR 36 HA THR 36 -12.400 -5.553 8.997
327 HB THR 36 HB THR 36 -11.997 -5.729 6.121
328 HG1 THR 36 HG1 THR 36 -10.097 -6.807 6.591
329 HG21 THR 36 HG21 THR 36 -11.113 -3.779 8.295
330 HG22 THR 36 HG22 THR 36 -10.834 -3.521 6.565
331 HG23 THR 36 HG23 THR 36 -12.495 -3.613 7.185
332 H ARG 37 H ARG 37 -12.709 -8.630 7.500
333 HA ARG 37 HA ARG 37 -15.194 -8.420 6.174
334 HB2 ARG 37 HB2 ARG 37 -15.166 -10.734 6.025
335 HB3 ARG 37 HB3 ARG 37 -13.473 -10.345 6.223
336 HG2 ARG 37 HG2 ARG 37 -13.618 -12.070 7.698
337 HG3 ARG 37 HG3 ARG 37 -13.986 -10.768 8.820
338 HD2 ARG 37 HD2 ARG 37 -15.987 -11.725 9.282
339 HD3 ARG 37 HD3 ARG 37 -16.454 -11.687 7.579
340 HE ARG 37 HE ARG 37 -14.617 -13.839 8.370
341 HH11 ARG 37 HH22 ARG 37 -18.033 -13.112 7.945
342 HH12 ARG 37 HH21 ARG 37 -18.486 -14.797 7.804
343 HH21 ARG 37 HH12 ARG 37 -15.247 -15.973 8.176
344 HH22 ARG 37 HH11 ARG 37 -16.920 -16.332 7.852
345 H GLN 38 H GLN 38 -14.657 -8.112 9.407
346 HA GLN 38 HA GLN 38 -17.547 -8.122 10.078
347 HB2 GLN 38 HB2 GLN 38 -17.156 -9.292 12.148
348 HB3 GLN 38 HB3 GLN 38 -16.534 -10.261 10.821
349 HG2 GLN 38 HG2 GLN 38 -14.199 -9.390 11.351
350 HG3 GLN 38 HG3 GLN 38 -14.880 -8.590 12.772
351 HE21 GLN 38 HE21 GLN 38 -16.578 -10.458 13.913
352 HE22 GLN 38 HE22 GLN 38 -15.624 -11.920 14.232
353 H ARG 39 H ARG 39 -15.167 -6.125 9.656
354 HA ARG 39 HA ARG 39 -15.958 -4.160 11.642
355 HB2 ARG 39 HB2 ARG 39 -13.497 -5.782 12.081
356 HB3 ARG 39 HB3 ARG 39 -13.248 -4.065 12.252
357 HG2 ARG 39 HG2 ARG 39 -15.664 -4.867 13.706
358 HG3 ARG 39 HG3 ARG 39 -14.286 -5.868 14.151
359 HD2 ARG 39 HD2 ARG 39 -14.320 -4.026 15.639
360 HD3 ARG 39 HD3 ARG 39 -12.953 -3.757 14.546
361 HE ARG 39 HE ARG 39 -14.952 -2.394 13.296
362 HH11 ARG 39 HH22 ARG 39 -13.769 -2.194 16.589
363 HH12 ARG 39 HH21 ARG 39 -14.515 -0.651 16.884
364 HH21 ARG 39 HH12 ARG 39 -15.757 -0.331 13.645
365 HH22 ARG 39 HH11 ARG 39 -15.566 0.423 15.186
366 H TYR 40 H TYR 40 -16.455 -3.735 9.258
367 HA TYR 40 HA TYR 40 -14.366 -2.347 7.740
368 HB2 TYR 40 HB2 TYR 40 -17.346 -2.754 7.487
369 HB3 TYR 40 HB3 TYR 40 -16.603 -1.423 6.622
370 HD1 TYR 40 HD2 TYR 40 -14.985 -1.754 4.825
371 HD2 TYR 40 HD1 TYR 40 -16.849 -5.105 6.803
372 HE1 TYR 40 HE2 TYR 40 -14.235 -3.273 2.986
373 HE2 TYR 40 HE1 TYR 40 -16.101 -6.605 4.980
374 HH TYR 40 HH TYR 40 -14.970 -6.763 3.003
375 HN1 NH2 41 HN1 NH2 41 -16.869 -1.262 10.147
376 HN2 NH2 41 HN2 NH2 41 -16.241 0.393 10.080
Start of MODEL 2
1 HA TYR 1 HA TYR 1 -6.174 7.258 -5.197
2 HB2 TYR 1 HB2 TYR 1 -6.897 8.747 -6.984
3 HB3 TYR 1 HB3 TYR 1 -7.556 9.258 -5.440
4 HD1 TYR 1 HD2 TYR 1 -6.459 11.253 -4.215
5 HD2 TYR 1 HD1 TYR 1 -5.575 10.246 -8.335
6 HE1 TYR 1 HE2 TYR 1 -5.371 13.441 -4.519
7 HE2 TYR 1 HE1 TYR 1 -4.516 12.482 -8.628
8 HH TYR 1 HH TYR 1 -4.377 14.878 -6.009
9 H LEU 2 H LEU 2 -3.720 9.839 -5.892
10 HA LEU 2 HA LEU 2 -2.538 8.323 -7.976
11 HB2 LEU 2 HB2 LEU 2 -2.568 10.929 -7.296
12 HB3 LEU 2 HB3 LEU 2 -1.070 10.532 -6.513
13 HG LEU 2 HG LEU 2 -1.857 10.390 -9.437
14 HD11 LEU 2 HD11 LEU 2 -0.887 12.493 -8.235
15 HD12 LEU 2 HD12 LEU 2 0.656 11.634 -8.289
16 HD13 LEU 2 HD13 LEU 2 -0.193 12.014 -9.798
17 HD21 LEU 2 HD21 LEU 2 -0.555 8.288 -9.011
18 HD22 LEU 2 HD22 LEU 2 0.263 9.424 -10.090
19 HD23 LEU 2 HD23 LEU 2 0.772 9.296 -8.406
20 H GLU 3 H GLU 3 -2.506 6.279 -6.552
21 HA GLU 3 HA GLU 3 -0.664 5.883 -4.454
22 HB2 GLU 3 HB2 GLU 3 -2.148 4.211 -6.388
23 HB3 GLU 3 HB3 GLU 3 -0.605 3.507 -5.966
24 HG2 GLU 3 HG2 GLU 3 -2.143 4.530 -3.621
25 HG3 GLU 3 HG3 GLU 3 -2.948 3.253 -4.509
26 H ARG 4 H ARG 4 -0.019 5.870 -7.946
27 HA ARG 4 HA ARG 4 2.700 5.093 -7.806
28 HB2 ARG 4 HB2 ARG 4 1.100 5.475 -9.846
29 HB3 ARG 4 HB3 ARG 4 1.710 7.127 -9.842
30 HG2 ARG 4 HG2 ARG 4 3.661 4.807 -9.770
31 HG3 ARG 4 HG3 ARG 4 2.833 5.159 -11.281
32 HD2 ARG 4 HD2 ARG 4 3.927 7.129 -11.649
33 HD3 ARG 4 HD3 ARG 4 4.088 7.509 -9.938
34 HE ARG 4 HE ARG 4 5.671 5.214 -10.840
35 HH11 ARG 4 HH22 ARG 4 5.741 8.649 -10.288
36 HH12 ARG 4 HH21 ARG 4 7.487 8.739 -10.233
37 HH21 ARG 4 HH12 ARG 4 7.887 5.330 -10.722
38 HH22 ARG 4 HH11 ARG 4 8.686 6.873 -10.562
39 H GLU 5 H GLU 5 1.340 8.075 -6.639
40 HA GLU 5 HA GLU 5 3.747 9.678 -6.822
41 HB2 GLU 5 HB2 GLU 5 1.189 10.315 -6.429
42 HB3 GLU 5 HB3 GLU 5 1.604 10.112 -4.739
43 HG2 GLU 5 HG2 GLU 5 3.599 11.762 -6.134
44 HG3 GLU 5 HG3 GLU 5 1.987 12.348 -6.485
45 H LEU 6 H LEU 6 2.467 7.226 -4.531
46 HA LEU 6 HA LEU 6 4.261 7.737 -2.375
47 HB2 LEU 6 HB2 LEU 6 2.953 6.290 -1.462
48 HB3 LEU 6 HB3 LEU 6 2.126 6.011 -2.942
49 HG LEU 6 HG LEU 6 2.637 4.024 -2.015
50 HD11 LEU 6 HD11 LEU 6 4.858 3.594 -3.929
51 HD12 LEU 6 HD12 LEU 6 3.290 2.792 -3.763
52 HD13 LEU 6 HD13 LEU 6 3.413 4.332 -4.598
53 HD21 LEU 6 HD21 LEU 6 4.723 4.992 -0.695
54 HD22 LEU 6 HD22 LEU 6 4.511 3.251 -0.956
55 HD23 LEU 6 HD23 LEU 6 5.631 4.168 -1.967
56 H LYS 7 H LYS 7 4.647 6.201 -5.518
57 HA LYS 7 HA LYS 7 6.963 4.690 -4.773
58 HB2 LYS 7 HB2 LYS 7 5.331 4.858 -7.053
59 HB3 LYS 7 HB3 LYS 7 6.857 5.500 -7.637
60 HG2 LYS 7 HG2 LYS 7 6.352 2.791 -6.334
61 HG3 LYS 7 HG3 LYS 7 6.638 3.108 -8.035
62 HD2 LYS 7 HD2 LYS 7 8.700 2.340 -7.429
63 HD3 LYS 7 HD3 LYS 7 8.977 4.073 -7.195
64 HE2 LYS 7 HE2 LYS 7 8.841 3.883 -4.820
65 HE3 LYS 7 HE3 LYS 7 7.886 2.402 -4.914
66 HZ1 LYS 7 HZ1 LYS 7 9.983 1.350 -5.792
67 HZ2 LYS 7 HZ2 LYS 7 10.773 2.677 -5.186
68 HZ3 LYS 7 HZ3 LYS 7 9.871 1.732 -4.171
69 H LYS 8 H LYS 8 6.493 7.941 -5.917
70 HA LYS 8 HA LYS 8 9.361 8.531 -6.059
71 HB2 LYS 8 HB2 LYS 8 7.108 9.699 -7.240
72 HB3 LYS 8 HB3 LYS 8 7.454 10.812 -5.926
73 HG2 LYS 8 HG2 LYS 8 9.998 10.274 -7.013
74 HG3 LYS 8 HG3 LYS 8 8.963 10.226 -8.427
75 HD2 LYS 8 HD2 LYS 8 8.546 12.491 -8.370
76 HD3 LYS 8 HD3 LYS 8 8.617 12.594 -6.598
77 HE2 LYS 8 HE2 LYS 8 10.954 12.545 -6.515
78 HE3 LYS 8 HE3 LYS 8 11.118 11.921 -8.156
79 HZ1 LYS 8 HZ1 LYS 8 10.449 14.036 -9.026
80 HZ2 LYS 8 HZ2 LYS 8 10.112 14.651 -7.534
81 HZ3 LYS 8 HZ3 LYS 8 11.662 14.299 -7.963
82 H LEU 9 H LEU 9 7.214 8.119 -3.546
83 HA LEU 9 HA LEU 9 8.517 10.009 -1.695
84 HB2 LEU 9 HB2 LEU 9 5.887 9.299 -1.996
85 HB3 LEU 9 HB3 LEU 9 6.377 8.083 -0.825
86 HG LEU 9 HG LEU 9 7.338 10.049 0.559
87 HD11 LEU 9 HD11 LEU 9 6.394 12.257 0.114
88 HD12 LEU 9 HD12 LEU 9 7.215 11.720 -1.360
89 HD13 LEU 9 HD13 LEU 9 5.450 11.629 -1.260
90 HD21 LEU 9 HD21 LEU 9 4.321 9.942 0.089
91 HD22 LEU 9 HD22 LEU 9 5.239 8.823 1.119
92 HD23 LEU 9 HD23 LEU 9 5.149 10.537 1.546
93 H GLU 10 H GLU 10 7.792 6.479 -1.887
94 HA GLU 10 HA GLU 10 9.479 5.601 0.210
95 HB2 GLU 10 HB2 GLU 10 7.780 4.258 -1.135
96 HB3 GLU 10 HB3 GLU 10 8.999 4.156 -2.412
97 HG2 GLU 10 HG2 GLU 10 10.550 3.126 -0.589
98 HG3 GLU 10 HG3 GLU 10 9.110 3.034 0.419
99 H ARG 11 H ARG 11 10.276 6.540 -3.100
100 HA ARG 11 HA ARG 11 12.991 5.688 -3.166
101 HB2 ARG 11 HB2 ARG 11 11.290 7.595 -4.677
102 HB3 ARG 11 HB3 ARG 11 12.950 8.166 -4.544
103 HG2 ARG 11 HG2 ARG 11 12.163 5.393 -5.487
104 HG3 ARG 11 HG3 ARG 11 12.544 6.748 -6.558
105 HD2 ARG 11 HD2 ARG 11 14.811 6.582 -6.229
106 HD3 ARG 11 HD3 ARG 11 14.650 6.246 -4.518
107 HE ARG 11 HE ARG 11 14.874 4.034 -4.929
108 HH11 ARG 11 HH22 ARG 11 13.697 5.419 -7.897
109 HH12 ARG 11 HH21 ARG 11 13.636 3.906 -8.758
110 HH21 ARG 11 HH12 ARG 11 14.874 2.073 -6.053
111 HH22 ARG 11 HH11 ARG 11 14.338 2.042 -7.702
112 H GLU 12 H GLU 12 11.624 8.642 -1.719
113 HA GLU 12 HA GLU 12 14.300 9.653 -1.066
114 HB2 GLU 12 HB2 GLU 12 11.883 10.862 -1.464
115 HB3 GLU 12 HB3 GLU 12 11.826 10.730 0.275
116 HG2 GLU 12 HG2 GLU 12 14.462 11.722 -0.697
117 HG3 GLU 12 HG3 GLU 12 13.137 12.650 -1.362
118 H LEU 13 H LEU 13 11.678 7.917 0.512
119 HA LEU 13 HA LEU 13 13.035 7.700 3.106
120 HB2 LEU 13 HB2 LEU 13 10.462 6.648 1.925
121 HB3 LEU 13 HB3 LEU 13 11.056 6.050 3.462
122 HG LEU 13 HG LEU 13 9.354 7.889 3.609
123 HD11 LEU 13 HD11 LEU 13 10.442 7.535 5.608
124 HD12 LEU 13 HD12 LEU 13 12.029 8.032 4.997
125 HD13 LEU 13 HD13 LEU 13 10.788 9.248 5.333
126 HD21 LEU 13 HD21 LEU 13 11.583 9.778 2.768
127 HD22 LEU 13 HD22 LEU 13 10.141 9.377 1.805
128 HD23 LEU 13 HD23 LEU 13 9.975 10.213 3.349
129 H LYS 14 H LYS 14 13.903 6.320 0.284
130 HA LYS 14 HA LYS 14 14.443 3.632 0.812
131 HB2 LYS 14 HB2 LYS 14 14.879 4.555 -1.348
132 HB3 LYS 14 HB3 LYS 14 16.053 5.728 -0.714
133 HG2 LYS 14 HG2 LYS 14 17.668 4.043 -0.248
134 HG3 LYS 14 HG3 LYS 14 16.457 2.755 -0.403
135 HD2 LYS 14 HD2 LYS 14 16.395 3.584 -2.929
136 HD3 LYS 14 HD3 LYS 14 18.007 4.216 -2.510
137 HE2 LYS 14 HE2 LYS 14 17.931 1.657 -1.317
138 HE3 LYS 14 HE3 LYS 14 17.016 1.418 -2.802
139 HZ1 LYS 14 HZ1 LYS 14 19.827 2.111 -2.434
140 HZ2 LYS 14 HZ2 LYS 14 19.174 1.008 -3.458
141 HZ3 LYS 14 HZ3 LYS 14 19.090 2.618 -3.814
142 H LYS 15 H LYS 15 15.792 6.294 2.531
143 HA LYS 15 HA LYS 15 18.189 5.313 3.529
144 HB2 LYS 15 HB2 LYS 15 16.652 7.496 3.955
145 HB3 LYS 15 HB3 LYS 15 16.224 6.626 5.426
146 HG2 LYS 15 HG2 LYS 15 18.421 6.726 6.282
147 HG3 LYS 15 HG3 LYS 15 19.148 6.804 4.679
148 HD2 LYS 15 HD2 LYS 15 19.496 8.938 5.285
149 HD3 LYS 15 HD3 LYS 15 17.950 9.146 4.486
150 HE2 LYS 15 HE2 LYS 15 16.835 8.898 6.780
151 HE3 LYS 15 HE3 LYS 15 18.464 8.880 7.479
152 HZ1 LYS 15 HZ1 LYS 15 18.569 11.087 6.005
153 HZ2 LYS 15 HZ2 LYS 15 16.957 11.085 6.364
154 HZ3 LYS 15 HZ3 LYS 15 18.060 11.094 7.573
155 H LEU 16 H LEU 16 14.939 4.202 4.354
156 HA LEU 16 HA LEU 16 16.197 2.142 6.106
157 HB2 LEU 16 HB2 LEU 16 14.384 1.930 7.324
158 HB3 LEU 16 HB3 LEU 16 14.180 3.617 6.906
159 HG LEU 16 HG LEU 16 12.730 1.293 5.560
160 HD11 LEU 16 HD11 LEU 16 10.869 2.668 7.057
161 HD12 LEU 16 HD12 LEU 16 11.711 1.183 7.547
162 HD13 LEU 16 HD13 LEU 16 12.282 2.765 8.095
163 HD21 LEU 16 HD21 LEU 16 12.400 4.290 5.287
164 HD22 LEU 16 HD22 LEU 16 12.567 3.044 4.019
165 HD23 LEU 16 HD23 LEU 16 11.076 3.159 4.926
166 H SER 17 H SER 17 16.003 0.007 5.626
167 HA SER 17 HA SER 17 16.196 -0.944 3.109
168 HB2 SER 17 HB2 SER 17 15.220 -2.239 5.634
169 HB3 SER 17 HB3 SER 17 15.272 -3.164 4.117
170 HG SER 17 HG SER 17 17.273 -2.817 5.679
171 HA PRO 18 HA PRO 18 11.995 -0.167 1.633
172 HB2 PRO 18 HB2 PRO 18 12.388 -0.854 -1.031
173 HB3 PRO 18 HB3 PRO 18 12.792 0.721 -0.295
174 HG2 PRO 18 HG2 PRO 18 14.628 -1.533 -1.015
175 HG3 PRO 18 HG3 PRO 18 14.942 0.228 -1.006
176 HD2 PRO 18 HD2 PRO 18 15.719 -1.600 0.973
177 HD3 PRO 18 HD3 PRO 18 15.623 0.172 1.191
178 H GLU 19 H GLU 19 13.708 -3.181 1.527
179 HA GLU 19 HA GLU 19 11.386 -4.837 0.871
180 HB2 GLU 19 HB2 GLU 19 13.742 -5.438 0.360
181 HB3 GLU 19 HB3 GLU 19 14.090 -5.581 2.076
182 HG2 GLU 19 HG2 GLU 19 11.727 -7.164 1.116
183 HG3 GLU 19 HG3 GLU 19 13.233 -7.584 0.326
184 H GLU 20 H GLU 20 12.669 -3.342 3.808
185 HA GLU 20 HA GLU 20 11.548 -5.287 5.646
186 HB2 GLU 20 HB2 GLU 20 13.533 -3.672 5.968
187 HB3 GLU 20 HB3 GLU 20 12.351 -2.425 6.329
188 HG2 GLU 20 HG2 GLU 20 12.215 -5.069 7.820
189 HG3 GLU 20 HG3 GLU 20 13.544 -3.977 8.157
190 H LEU 21 H LEU 21 10.514 -2.034 4.443
191 HA LEU 21 HA LEU 21 8.077 -1.937 5.883
192 HB2 LEU 21 HB2 LEU 21 9.439 -0.586 3.613
193 HB3 LEU 21 HB3 LEU 21 7.718 -0.566 3.478
194 HG LEU 21 HG LEU 21 9.045 1.342 4.661
195 HD11 LEU 21 HD11 LEU 21 7.111 2.144 5.595
196 HD12 LEU 21 HD12 LEU 21 6.423 0.882 4.571
197 HD13 LEU 21 HD13 LEU 21 6.641 0.587 6.306
198 HD21 LEU 21 HD21 LEU 21 9.249 1.239 7.056
199 HD22 LEU 21 HD22 LEU 21 8.597 -0.380 7.137
200 HD23 LEU 21 HD23 LEU 21 10.164 -0.125 6.356
201 H ASN 22 H ASN 22 8.699 -3.107 2.539
202 HA ASN 22 HA ASN 22 6.098 -3.965 1.990
203 HB2 ASN 22 HB2 ASN 22 8.315 -3.939 0.551
204 HB3 ASN 22 HB3 ASN 22 8.411 -5.630 1.038
205 HD21 ASN 22 HD21 ASN 22 5.930 -6.676 0.906
206 HD22 ASN 22 HD22 ASN 22 5.285 -6.391 -0.724
207 H ARG 23 H ARG 23 8.495 -5.508 4.034
208 HA ARG 23 HA ARG 23 7.283 -8.068 4.352
209 HB2 ARG 23 HB2 ARG 23 9.615 -7.026 5.082
210 HB3 ARG 23 HB3 ARG 23 8.788 -6.712 6.609
211 HG2 ARG 23 HG2 ARG 23 8.490 -8.956 7.093
212 HG3 ARG 23 HG3 ARG 23 8.655 -9.471 5.398
213 HD2 ARG 23 HD2 ARG 23 11.011 -8.880 5.355
214 HD3 ARG 23 HD3 ARG 23 10.935 -8.213 6.988
215 HE ARG 23 HE ARG 23 11.106 -11.019 6.194
216 HH11 ARG 23 HH22 ARG 23 10.169 -8.888 8.816
217 HH12 ARG 23 HH21 ARG 23 10.248 -10.136 10.034
218 HH21 ARG 23 HH12 ARG 23 11.373 -12.522 7.780
219 HH22 ARG 23 HH11 ARG 23 10.921 -12.193 9.443
220 H TYR 24 H TYR 24 7.080 -5.249 6.570
221 HA TYR 24 HA TYR 24 4.868 -6.251 8.114
222 HB2 TYR 24 HB2 TYR 24 6.191 -3.569 7.680
223 HB3 TYR 24 HB3 TYR 24 4.622 -3.620 8.452
224 HD1 TYR 24 HD2 TYR 24 4.289 -5.269 10.437
225 HD2 TYR 24 HD1 TYR 24 8.139 -3.851 9.072
226 HE1 TYR 24 HE2 TYR 24 5.271 -5.758 12.680
227 HE2 TYR 24 HE1 TYR 24 9.099 -4.315 11.303
228 HH TYR 24 HH TYR 24 8.595 -4.818 13.479
229 H TYR 25 H TYR 25 5.054 -4.561 5.075
230 HA TYR 25 HA TYR 25 2.274 -3.923 4.841
231 HB2 TYR 25 HB2 TYR 25 4.578 -3.417 3.366
232 HB3 TYR 25 HB3 TYR 25 3.730 -4.503 2.300
233 HD1 TYR 25 HD2 TYR 25 3.858 -1.245 3.945
234 HD2 TYR 25 HD1 TYR 25 1.572 -3.751 1.291
235 HE1 TYR 25 HE2 TYR 25 2.519 0.742 3.228
236 HE2 TYR 25 HE1 TYR 25 0.227 -1.774 0.578
237 HH TYR 25 HH TYR 25 -0.224 0.469 0.993
238 H ALA 26 H ALA 26 4.117 -6.805 3.605
239 HA ALA 26 HA ALA 26 1.893 -8.012 2.315
240 HB1 ALA 26 HB1 ALA 26 3.279 -10.110 2.534
241 HB2 ALA 26 HB2 ALA 26 4.187 -8.724 1.898
242 HB3 ALA 26 HB3 ALA 26 4.395 -9.221 3.591
243 H SER 27 H SER 27 3.125 -8.506 5.659
244 HA SER 27 HA SER 27 1.003 -10.197 6.542
245 HB2 SER 27 HB2 SER 27 2.919 -8.340 8.011
246 HB3 SER 27 HB3 SER 27 1.780 -9.411 8.844
247 HG SER 27 HG SER 27 2.842 -11.139 8.171
248 H LEU 28 H LEU 28 0.835 -6.894 5.753
249 HA LEU 28 HA LEU 28 -1.656 -6.568 7.336
250 HB2 LEU 28 HB2 LEU 28 0.298 -4.627 6.073
251 HB3 LEU 28 HB3 LEU 28 -1.360 -4.128 6.374
252 HG LEU 28 HG LEU 28 0.467 -5.277 8.507
253 HD11 LEU 28 HD11 LEU 28 0.375 -2.758 9.296
254 HD12 LEU 28 HD12 LEU 28 1.544 -3.284 8.080
255 HD13 LEU 28 HD13 LEU 28 0.062 -2.442 7.575
256 HD21 LEU 28 HD21 LEU 28 -2.295 -5.069 8.625
257 HD22 LEU 28 HD22 LEU 28 -1.217 -4.984 10.022
258 HD23 LEU 28 HD23 LEU 28 -1.823 -3.499 9.254
259 H ARG 29 H ARG 29 -0.424 -6.546 4.000
260 HA ARG 29 HA ARG 29 -2.827 -5.817 2.725
261 HB2 ARG 29 HB2 ARG 29 -0.376 -5.991 1.853
262 HB3 ARG 29 HB3 ARG 29 -0.784 -7.655 1.437
263 HG2 ARG 29 HG2 ARG 29 -2.444 -6.976 -0.134
264 HG3 ARG 29 HG3 ARG 29 -2.623 -5.384 0.601
265 HD2 ARG 29 HD2 ARG 29 -1.244 -4.510 -0.894
266 HD3 ARG 29 HD3 ARG 29 0.075 -5.419 -0.189
267 HE ARG 29 HE ARG 29 0.022 -6.921 -1.946
268 HH11 ARG 29 HH22 ARG 29 -2.819 -4.912 -2.218
269 HH12 ARG 29 HH21 ARG 29 -3.185 -5.411 -3.846
270 HH21 ARG 29 HH12 ARG 29 -0.492 -7.602 -4.032
271 HH22 ARG 29 HH11 ARG 29 -1.910 -6.971 -4.810
272 H HIS 30 H HIS 30 -1.575 -9.033 3.575
273 HA HIS 30 HA HIS 30 -3.903 -10.447 2.554
274 HB2 HIS 30 HB2 HIS 30 -1.429 -11.236 3.334
275 HB3 HIS 30 HB3 HIS 30 -2.311 -11.613 4.809
276 HD1 HIS 30 HD1 HIS 30 -1.194 -13.337 1.979
277 HD2 HIS 30 HD2 HIS 30 -4.983 -12.941 3.765
278 HE1 HIS 30 HE1 HIS 30 -2.640 -15.278 1.107
279 H TYR 31 H TYR 31 -3.209 -8.684 5.503
280 HA TYR 31 HA TYR 31 -5.375 -9.772 7.087
281 HB2 TYR 31 HB2 TYR 31 -3.105 -8.468 7.708
282 HB3 TYR 31 HB3 TYR 31 -4.116 -7.053 7.542
283 HD1 TYR 31 HD1 TYR 31 -4.635 -10.431 9.172
284 HD2 TYR 31 HD2 TYR 31 -4.482 -6.141 9.603
285 HE1 TYR 31 HE1 TYR 31 -5.442 -10.636 11.519
286 HE2 TYR 31 HE2 TYR 31 -5.242 -6.354 11.959
287 HH TYR 31 HH TYR 31 -6.692 -9.193 13.142
288 H LEU 32 H LEU 32 -4.972 -6.498 5.650
289 HA LEU 32 HA LEU 32 -7.668 -5.697 5.871
290 HB2 LEU 32 HB2 LEU 32 -7.117 -3.933 4.272
291 HB3 LEU 32 HB3 LEU 32 -5.918 -4.140 5.537
292 HG LEU 32 HG LEU 32 -4.747 -5.665 3.657
293 HD11 LEU 32 HD11 LEU 32 -6.266 -3.675 1.964
294 HD12 LEU 32 HD12 LEU 32 -4.919 -4.710 1.435
295 HD13 LEU 32 HD13 LEU 32 -6.432 -5.448 1.929
296 HD21 LEU 32 HD21 LEU 32 -3.726 -3.294 2.839
297 HD22 LEU 32 HD22 LEU 32 -4.582 -2.750 4.291
298 HD23 LEU 32 HD23 LEU 32 -3.358 -4.018 4.404
299 H ASN 33 H ASN 33 -6.409 -7.958 3.623
300 HA ASN 33 HA ASN 33 -8.309 -8.029 1.559
301 HB2 ASN 33 HB2 ASN 33 -6.190 -9.576 2.333
302 HB3 ASN 33 HB3 ASN 33 -7.495 -10.614 2.868
303 HD21 ASN 33 HD21 ASN 33 -5.906 -9.089 0.120
304 HD22 ASN 33 HD22 ASN 33 -6.689 -10.091 -1.090
305 H LEU 34 H LEU 34 -8.582 -9.221 4.927
306 HA LEU 34 HA LEU 34 -11.535 -9.120 4.663
307 HB2 LEU 34 HB2 LEU 34 -11.905 -11.269 5.603
308 HB3 LEU 34 HB3 LEU 34 -11.016 -11.420 4.109
309 HG LEU 34 HG LEU 34 -9.539 -11.438 6.774
310 HD11 LEU 34 HD11 LEU 34 -9.841 -13.759 7.061
311 HD12 LEU 34 HD12 LEU 34 -11.461 -13.109 6.807
312 HD13 LEU 34 HD13 LEU 34 -10.631 -13.953 5.480
313 HD21 LEU 34 HD21 LEU 34 -7.920 -11.462 5.107
314 HD22 LEU 34 HD22 LEU 34 -8.189 -13.199 5.293
315 HD23 LEU 34 HD23 LEU 34 -8.948 -12.336 3.949
316 H VAL 35 H VAL 35 -9.110 -7.875 6.273
317 HA VAL 35 HA VAL 35 -10.348 -7.925 8.955
318 HB VAL 35 HB VAL 35 -7.809 -6.835 7.816
319 HG11 VAL 35 HG11 VAL 35 -7.091 -5.925 9.913
320 HG12 VAL 35 HG12 VAL 35 -8.461 -5.032 9.286
321 HG13 VAL 35 HG13 VAL 35 -8.700 -6.191 10.621
322 HG21 VAL 35 HG21 VAL 35 -7.085 -8.832 8.594
323 HG22 VAL 35 HG22 VAL 35 -7.504 -8.340 10.238
324 HG23 VAL 35 HG23 VAL 35 -8.657 -9.224 9.244
325 H THR 36 H THR 36 -10.314 -5.821 6.201
326 HA THR 36 HA THR 36 -11.472 -3.640 7.796
327 HB THR 36 HB THR 36 -11.780 -2.535 5.552
328 HG1 THR 36 HG1 THR 36 -9.903 -4.044 4.343
329 HG21 THR 36 HG21 THR 36 -9.796 -2.272 7.182
330 HG22 THR 36 HG22 THR 36 -8.888 -3.319 6.079
331 HG23 THR 36 HG23 THR 36 -9.542 -1.759 5.513
332 H ARG 37 H ARG 37 -12.598 -5.944 5.455
333 HA ARG 37 HA ARG 37 -15.363 -5.141 5.368
334 HB2 ARG 37 HB2 ARG 37 -14.083 -7.867 4.881
335 HB3 ARG 37 HB3 ARG 37 -15.806 -7.567 4.708
336 HG2 ARG 37 HG2 ARG 37 -15.054 -7.372 2.556
337 HG3 ARG 37 HG3 ARG 37 -15.236 -5.693 3.060
338 HD2 ARG 37 HD2 ARG 37 -12.904 -5.349 3.188
339 HD3 ARG 37 HD3 ARG 37 -12.549 -7.088 3.312
340 HE ARG 37 HE ARG 37 -13.690 -7.005 0.895
341 HH11 ARG 37 HH22 ARG 37 -11.049 -5.105 2.195
342 HH12 ARG 37 HH21 ARG 37 -10.362 -4.777 0.625
343 HH21 ARG 37 HH12 ARG 37 -12.750 -6.646 -1.075
344 HH22 ARG 37 HH11 ARG 37 -11.340 -5.632 -1.211
345 H GLN 38 H GLN 38 -13.741 -6.420 7.952
346 HA GLN 38 HA GLN 38 -16.268 -6.798 9.476
347 HB2 GLN 38 HB2 GLN 38 -14.057 -8.757 9.000
348 HB3 GLN 38 HB3 GLN 38 -14.645 -8.689 10.650
349 HG2 GLN 38 HG2 GLN 38 -16.721 -8.829 8.459
350 HG3 GLN 38 HG3 GLN 38 -15.757 -10.262 8.784
351 HE21 GLN 38 HE21 GLN 38 -16.831 -11.647 10.120
352 HE22 GLN 38 HE22 GLN 38 -17.754 -11.116 11.533
353 H ARG 39 H ARG 39 -13.847 -4.783 9.220
354 HA ARG 39 HA ARG 39 -14.020 -3.775 11.889
355 HB2 ARG 39 HB2 ARG 39 -12.213 -5.871 11.821
356 HB3 ARG 39 HB3 ARG 39 -11.141 -4.555 11.466
357 HG2 ARG 39 HG2 ARG 39 -11.108 -4.852 13.799
358 HG3 ARG 39 HG3 ARG 39 -12.031 -3.359 13.536
359 HD2 ARG 39 HD2 ARG 39 -14.123 -4.484 13.965
360 HD3 ARG 39 HD3 ARG 39 -13.375 -6.077 13.776
361 HE ARG 39 HE ARG 39 -12.322 -4.478 15.990
362 HH11 ARG 39 HH22 ARG 39 -14.809 -6.777 15.110
363 HH12 ARG 39 HH21 ARG 39 -15.084 -7.239 16.795
364 HH21 ARG 39 HH12 ARG 39 -12.690 -5.245 18.127
365 HH22 ARG 39 HH11 ARG 39 -13.956 -6.418 18.390
366 H TYR 40 H TYR 40 -14.711 -2.116 10.269
367 HA TYR 40 HA TYR 40 -12.583 -0.200 9.887
368 HB2 TYR 40 HB2 TYR 40 -12.344 -1.721 7.910
369 HB3 TYR 40 HB3 TYR 40 -14.001 -1.339 7.449
370 HD1 TYR 40 HD2 TYR 40 -11.237 0.965 8.636
371 HD2 TYR 40 HD1 TYR 40 -13.722 -0.355 5.358
372 HE1 TYR 40 HE2 TYR 40 -10.417 2.854 7.243
373 HE2 TYR 40 HE1 TYR 40 -12.863 1.511 3.959
374 HH TYR 40 HH TYR 40 -11.426 3.288 3.861
375 HN1 NH2 41 HN1 NH2 41 -13.789 1.683 8.223
376 HN2 NH2 41 HN2 NH2 41 -15.363 2.090 8.916
Start of MODEL 3
1 HA TYR 1 HA TYR 1 5.887 17.696 -13.305
2 HB2 TYR 1 HB2 TYR 1 4.008 18.688 -12.090
3 HB3 TYR 1 HB3 TYR 1 4.478 19.690 -13.444
4 HD1 TYR 1 HD2 TYR 1 3.037 19.764 -15.548
5 HD2 TYR 1 HD1 TYR 1 1.764 17.764 -11.923
6 HE1 TYR 1 HE2 TYR 1 0.704 19.689 -16.387
7 HE2 TYR 1 HE1 TYR 1 -0.560 17.726 -12.773
8 HH TYR 1 HH TYR 1 -1.999 18.443 -14.463
9 H LEU 2 H LEU 2 4.301 16.700 -11.375
10 HA LEU 2 HA LEU 2 3.323 14.935 -10.443
11 HB2 LEU 2 HB2 LEU 2 1.746 15.343 -12.651
12 HB3 LEU 2 HB3 LEU 2 2.291 13.710 -12.963
13 HG LEU 2 HG LEU 2 1.574 13.305 -10.423
14 HD11 LEU 2 HD11 LEU 2 1.106 15.810 -10.113
15 HD12 LEU 2 HD12 LEU 2 -0.279 15.599 -11.205
16 HD13 LEU 2 HD13 LEU 2 -0.217 14.722 -9.661
17 HD21 LEU 2 HD21 LEU 2 -0.306 13.600 -12.802
18 HD22 LEU 2 HD22 LEU 2 0.530 12.136 -12.240
19 HD23 LEU 2 HD23 LEU 2 -0.775 12.833 -11.266
20 H GLU 3 H GLU 3 4.499 13.629 -13.591
21 HA GLU 3 HA GLU 3 5.406 11.136 -12.786
22 HB2 GLU 3 HB2 GLU 3 6.492 11.079 -14.838
23 HB3 GLU 3 HB3 GLU 3 5.205 12.219 -15.099
24 HG2 GLU 3 HG2 GLU 3 7.054 13.180 -16.184
25 HG3 GLU 3 HG3 GLU 3 6.881 14.095 -14.696
26 H ARG 4 H ARG 4 7.053 14.208 -12.565
27 HA ARG 4 HA ARG 4 9.566 13.233 -11.623
28 HB2 ARG 4 HB2 ARG 4 9.026 15.537 -12.740
29 HB3 ARG 4 HB3 ARG 4 8.474 16.048 -11.149
30 HG2 ARG 4 HG2 ARG 4 10.722 16.734 -11.224
31 HG3 ARG 4 HG3 ARG 4 10.788 15.258 -10.263
32 HD2 ARG 4 HD2 ARG 4 11.499 13.959 -12.245
33 HD3 ARG 4 HD3 ARG 4 11.326 15.373 -13.274
34 HE ARG 4 HE ARG 4 13.520 14.735 -11.468
35 HH11 ARG 4 HH22 ARG 4 11.989 17.344 -13.158
36 HH12 ARG 4 HH21 ARG 4 13.354 18.427 -13.061
37 HH21 ARG 4 HH12 ARG 4 15.286 16.096 -11.315
38 HH22 ARG 4 HH11 ARG 4 15.229 17.689 -12.003
39 H GLU 5 H GLU 5 6.862 14.817 -9.962
40 HA GLU 5 HA GLU 5 7.834 14.664 -7.288
41 HB2 GLU 5 HB2 GLU 5 5.241 15.183 -8.648
42 HB3 GLU 5 HB3 GLU 5 5.063 14.407 -7.076
43 HG2 GLU 5 HG2 GLU 5 6.812 16.866 -7.470
44 HG3 GLU 5 HG3 GLU 5 5.086 16.969 -7.119
45 H LEU 6 H LEU 6 5.817 12.335 -9.165
46 HA LEU 6 HA LEU 6 5.667 10.313 -7.196
47 HB2 LEU 6 HB2 LEU 6 5.870 10.144 -10.229
48 HB3 LEU 6 HB3 LEU 6 5.548 8.753 -9.202
49 HG LEU 6 HG LEU 6 3.748 11.208 -9.421
50 HD11 LEU 6 HD11 LEU 6 3.880 8.597 -10.868
51 HD12 LEU 6 HD12 LEU 6 2.275 9.124 -10.346
52 HD13 LEU 6 HD13 LEU 6 3.253 10.173 -11.381
53 HD21 LEU 6 HD21 LEU 6 2.124 9.801 -8.161
54 HD22 LEU 6 HD22 LEU 6 3.438 8.647 -7.828
55 HD23 LEU 6 HD23 LEU 6 3.510 10.319 -7.214
56 H LYS 7 H LYS 7 8.400 11.079 -9.313
57 HA LYS 7 HA LYS 7 9.989 8.782 -8.509
58 HB2 LYS 7 HB2 LYS 7 10.117 10.595 -10.562
59 HB3 LYS 7 HB3 LYS 7 11.308 11.306 -9.499
60 HG2 LYS 7 HG2 LYS 7 12.837 9.715 -9.951
61 HG3 LYS 7 HG3 LYS 7 11.706 8.388 -9.730
62 HD2 LYS 7 HD2 LYS 7 11.801 10.091 -12.271
63 HD3 LYS 7 HD3 LYS 7 12.688 8.586 -12.034
64 HE2 LYS 7 HE2 LYS 7 10.907 7.541 -12.885
65 HE3 LYS 7 HE3 LYS 7 10.211 7.746 -11.287
66 HZ1 LYS 7 HZ1 LYS 7 8.593 8.950 -12.268
67 HZ2 LYS 7 HZ2 LYS 7 9.632 10.094 -12.754
68 HZ3 LYS 7 HZ3 LYS 7 9.312 8.846 -13.739
69 H LYS 8 H LYS 8 9.797 12.169 -7.452
70 HA LYS 8 HA LYS 8 11.734 11.864 -5.289
71 HB2 LYS 8 HB2 LYS 8 11.342 14.035 -6.295
72 HB3 LYS 8 HB3 LYS 8 9.633 14.002 -5.845
73 HG2 LYS 8 HG2 LYS 8 10.097 14.246 -3.545
74 HG3 LYS 8 HG3 LYS 8 11.799 13.815 -3.723
75 HD2 LYS 8 HD2 LYS 8 10.828 16.285 -5.159
76 HD3 LYS 8 HD3 LYS 8 10.946 16.332 -3.395
77 HE2 LYS 8 HE2 LYS 8 13.317 15.422 -3.614
78 HE3 LYS 8 HE3 LYS 8 13.185 15.694 -5.354
79 HZ1 LYS 8 HZ1 LYS 8 12.483 18.073 -4.547
80 HZ2 LYS 8 HZ2 LYS 8 13.301 17.646 -3.182
81 HZ3 LYS 8 HZ3 LYS 8 14.075 17.671 -4.641
82 H LEU 9 H LEU 9 8.452 10.984 -5.604
83 HA LEU 9 HA LEU 9 7.956 10.679 -2.758
84 HB2 LEU 9 HB2 LEU 9 6.340 10.964 -4.982
85 HB3 LEU 9 HB3 LEU 9 6.229 9.246 -4.747
86 HG LEU 9 HG LEU 9 4.423 10.472 -3.661
87 HD11 LEU 9 HD11 LEU 9 4.904 8.475 -2.500
88 HD12 LEU 9 HD12 LEU 9 6.323 9.165 -1.689
89 HD13 LEU 9 HD13 LEU 9 4.708 9.718 -1.252
90 HD21 LEU 9 HD21 LEU 9 6.441 12.382 -3.006
91 HD22 LEU 9 HD22 LEU 9 4.706 12.474 -2.749
92 HD23 LEU 9 HD23 LEU 9 5.754 11.810 -1.478
93 H GLU 10 H GLU 10 8.388 8.333 -5.489
94 HA GLU 10 HA GLU 10 8.424 6.035 -3.890
95 HB2 GLU 10 HB2 GLU 10 8.595 6.379 -6.527
96 HB3 GLU 10 HB3 GLU 10 10.317 6.196 -6.228
97 HG2 GLU 10 HG2 GLU 10 8.688 4.131 -4.840
98 HG3 GLU 10 HG3 GLU 10 8.357 4.175 -6.556
99 H ARG 11 H ARG 11 10.951 8.417 -4.317
100 HA ARG 11 HA ARG 11 13.118 7.066 -3.066
101 HB2 ARG 11 HB2 ARG 11 12.374 9.874 -3.665
102 HB3 ARG 11 HB3 ARG 11 13.289 9.746 -2.166
103 HG2 ARG 11 HG2 ARG 11 14.145 8.480 -4.793
104 HG3 ARG 11 HG3 ARG 11 14.707 10.056 -4.221
105 HD2 ARG 11 HD2 ARG 11 16.155 9.180 -2.736
106 HD3 ARG 11 HD3 ARG 11 15.012 7.973 -2.146
107 HE ARG 11 HE ARG 11 15.613 6.899 -4.525
108 HH11 ARG 11 HH22 ARG 11 17.777 8.143 -2.082
109 HH12 ARG 11 HH21 ARG 11 19.087 7.087 -2.531
110 HH21 ARG 11 HH12 ARG 11 17.303 5.540 -5.066
111 HH22 ARG 11 HH11 ARG 11 18.799 5.613 -4.189
112 H GLU 12 H GLU 12 10.475 8.881 -1.486
113 HA GLU 12 HA GLU 12 11.530 8.409 1.181
114 HB2 GLU 12 HB2 GLU 12 9.759 10.199 0.138
115 HB3 GLU 12 HB3 GLU 12 8.630 9.055 0.845
116 HG2 GLU 12 HG2 GLU 12 10.985 9.985 2.519
117 HG3 GLU 12 HG3 GLU 12 9.736 11.152 2.162
118 H LEU 13 H LEU 13 9.244 6.785 -0.963
119 HA LEU 13 HA LEU 13 8.376 4.824 0.995
120 HB2 LEU 13 HB2 LEU 13 8.366 4.735 -2.048
121 HB3 LEU 13 HB3 LEU 13 7.517 3.605 -1.000
122 HG LEU 13 HG LEU 13 6.950 6.610 -1.047
123 HD11 LEU 13 HD11 LEU 13 6.039 6.195 -3.047
124 HD12 LEU 13 HD12 LEU 13 6.073 4.436 -2.850
125 HD13 LEU 13 HD13 LEU 13 4.746 5.381 -2.156
126 HD21 LEU 13 HD21 LEU 13 6.276 5.652 1.057
127 HD22 LEU 13 HD22 LEU 13 4.832 5.910 0.086
128 HD23 LEU 13 HD23 LEU 13 5.502 4.269 0.250
129 H LYS 14 H LYS 14 10.778 4.489 -1.701
130 HA LYS 14 HA LYS 14 11.826 1.964 -0.788
131 HB2 LYS 14 HB2 LYS 14 12.193 2.541 -3.022
132 HB3 LYS 14 HB3 LYS 14 12.735 4.169 -2.657
133 HG2 LYS 14 HG2 LYS 14 14.425 1.815 -1.800
134 HG3 LYS 14 HG3 LYS 14 14.450 2.385 -3.457
135 HD2 LYS 14 HD2 LYS 14 15.167 4.581 -2.876
136 HD3 LYS 14 HD3 LYS 14 14.945 4.350 -1.161
137 HE2 LYS 14 HE2 LYS 14 16.757 2.439 -2.602
138 HE3 LYS 14 HE3 LYS 14 17.335 4.089 -2.337
139 HZ1 LYS 14 HZ1 LYS 14 17.650 3.648 -0.177
140 HZ2 LYS 14 HZ2 LYS 14 16.164 2.944 0.016
141 HZ3 LYS 14 HZ3 LYS 14 17.440 2.055 -0.520
142 H LYS 15 H LYS 15 12.225 5.115 0.549
143 HA LYS 15 HA LYS 15 14.777 5.052 1.648
144 HB2 LYS 15 HB2 LYS 15 12.795 6.783 1.768
145 HB3 LYS 15 HB3 LYS 15 12.456 6.023 3.324
146 HG2 LYS 15 HG2 LYS 15 14.738 6.594 4.076
147 HG3 LYS 15 HG3 LYS 15 15.135 7.194 2.459
148 HD2 LYS 15 HD2 LYS 15 14.392 9.222 2.997
149 HD3 LYS 15 HD3 LYS 15 12.758 8.603 3.198
150 HE2 LYS 15 HE2 LYS 15 14.855 8.480 5.386
151 HE3 LYS 15 HE3 LYS 15 13.744 9.854 5.195
152 HZ1 LYS 15 HZ1 LYS 15 12.623 7.158 5.335
153 HZ2 LYS 15 HZ2 LYS 15 13.069 7.914 6.732
154 HZ3 LYS 15 HZ3 LYS 15 11.932 8.581 5.733
155 H LEU 16 H LEU 16 11.911 3.325 2.750
156 HA LEU 16 HA LEU 16 13.594 1.869 4.726
157 HB2 LEU 16 HB2 LEU 16 11.864 1.428 6.035
158 HB3 LEU 16 HB3 LEU 16 11.287 2.956 5.407
159 HG LEU 16 HG LEU 16 10.416 0.220 4.356
160 HD11 LEU 16 HD11 LEU 16 8.433 0.455 5.662
161 HD12 LEU 16 HD12 LEU 16 9.814 0.595 6.747
162 HD13 LEU 16 HD13 LEU 16 8.917 2.056 6.254
163 HD21 LEU 16 HD21 LEU 16 9.504 1.423 2.696
164 HD22 LEU 16 HD22 LEU 16 8.393 2.130 3.879
165 HD23 LEU 16 HD23 LEU 16 9.871 2.977 3.479
166 H SER 17 H SER 17 13.616 -0.386 4.658
167 HA SER 17 HA SER 17 14.170 -1.549 2.246
168 HB2 SER 17 HB2 SER 17 13.429 -2.621 4.943
169 HB3 SER 17 HB3 SER 17 13.753 -3.741 3.597
170 HG SER 17 HG SER 17 15.752 -2.427 3.328
171 HA PRO 18 HA PRO 18 9.989 -1.910 0.621
172 HB2 PRO 18 HB2 PRO 18 10.630 -2.934 -1.883
173 HB3 PRO 18 HB3 PRO 18 10.694 -1.212 -1.422
174 HG2 PRO 18 HG2 PRO 18 12.948 -3.146 -1.752
175 HG3 PRO 18 HG3 PRO 18 12.925 -1.374 -1.989
176 HD2 PRO 18 HD2 PRO 18 13.915 -2.759 0.260
177 HD3 PRO 18 HD3 PRO 18 13.558 -1.009 0.184
178 H GLU 19 H GLU 19 12.210 -4.486 1.141
179 HA GLU 19 HA GLU 19 10.212 -6.627 0.759
180 HB2 GLU 19 HB2 GLU 19 12.606 -6.904 0.090
181 HB3 GLU 19 HB3 GLU 19 13.081 -6.764 1.788
182 HG2 GLU 19 HG2 GLU 19 11.828 -8.795 2.343
183 HG3 GLU 19 HG3 GLU 19 11.111 -8.839 0.729
184 H GLU 20 H GLU 20 11.289 -4.505 3.342
185 HA GLU 20 HA GLU 20 10.598 -6.365 5.501
186 HB2 GLU 20 HB2 GLU 20 12.304 -4.327 5.448
187 HB3 GLU 20 HB3 GLU 20 10.886 -3.383 5.896
188 HG2 GLU 20 HG2 GLU 20 10.981 -5.729 7.589
189 HG3 GLU 20 HG3 GLU 20 12.617 -5.101 7.481
190 H LEU 21 H LEU 21 9.129 -3.593 3.781
191 HA LEU 21 HA LEU 21 6.828 -3.439 5.432
192 HB2 LEU 21 HB2 LEU 21 7.802 -2.132 3.060
193 HB3 LEU 21 HB3 LEU 21 6.188 -2.718 2.697
194 HG LEU 21 HG LEU 21 6.952 -1.014 5.095
195 HD11 LEU 21 HD11 LEU 21 7.068 0.482 3.349
196 HD12 LEU 21 HD12 LEU 21 5.919 -0.391 2.333
197 HD13 LEU 21 HD13 LEU 21 5.333 0.601 3.677
198 HD21 LEU 21 HD21 LEU 21 4.619 -0.697 5.561
199 HD22 LEU 21 HD22 LEU 21 4.142 -1.702 4.172
200 HD23 LEU 21 HD23 LEU 21 4.944 -2.424 5.584
201 H ASN 22 H ASN 22 7.245 -5.110 2.257
202 HA ASN 22 HA ASN 22 4.742 -6.329 2.064
203 HB2 ASN 22 HB2 ASN 22 6.681 -6.333 0.399
204 HB3 ASN 22 HB3 ASN 22 7.352 -7.691 1.310
205 HD21 ASN 22 HD21 ASN 22 7.002 -8.553 -1.128
206 HD22 ASN 22 HD22 ASN 22 5.401 -9.255 -1.343
207 H ARG 23 H ARG 23 7.567 -7.464 3.913
208 HA ARG 23 HA ARG 23 6.440 -9.899 4.898
209 HB2 ARG 23 HB2 ARG 23 8.856 -9.186 5.083
210 HB3 ARG 23 HB3 ARG 23 8.395 -8.040 6.330
211 HG2 ARG 23 HG2 ARG 23 8.422 -9.619 7.910
212 HG3 ARG 23 HG3 ARG 23 7.189 -10.541 7.074
213 HD2 ARG 23 HD2 ARG 23 8.699 -12.160 6.828
214 HD3 ARG 23 HD3 ARG 23 9.399 -11.187 5.550
215 HE ARG 23 HE ARG 23 11.175 -10.605 6.944
216 HH11 ARG 23 HH22 ARG 23 8.708 -12.117 8.901
217 HH12 ARG 23 HH21 ARG 23 9.706 -12.228 10.324
218 HH21 ARG 23 HH12 ARG 23 12.468 -10.786 8.764
219 HH22 ARG 23 HH11 ARG 23 11.846 -11.517 10.213
220 H TYR 24 H TYR 24 6.563 -6.701 6.523
221 HA TYR 24 HA TYR 24 4.826 -7.377 8.682
222 HB2 TYR 24 HB2 TYR 24 5.910 -4.862 7.454
223 HB3 TYR 24 HB3 TYR 24 4.513 -4.717 8.500
224 HD1 TYR 24 HD1 TYR 24 7.901 -6.423 8.484
225 HD2 TYR 24 HD2 TYR 24 4.864 -4.381 10.770
226 HE1 TYR 24 HE1 TYR 24 9.308 -6.601 10.524
227 HE2 TYR 24 HE2 TYR 24 6.284 -4.535 12.798
228 HH TYR 24 HH TYR 24 8.212 -5.343 13.681
229 H TYR 25 H TYR 25 4.177 -6.419 5.430
230 HA TYR 25 HA TYR 25 1.434 -5.750 5.575
231 HB2 TYR 25 HB2 TYR 25 3.295 -5.694 3.597
232 HB3 TYR 25 HB3 TYR 25 2.475 -7.165 3.127
233 HD1 TYR 25 HD1 TYR 25 2.017 -3.576 3.947
234 HD2 TYR 25 HD2 TYR 25 0.483 -7.014 1.848
235 HE1 TYR 25 HE1 TYR 25 0.385 -2.115 2.760
236 HE2 TYR 25 HE2 TYR 25 -1.158 -5.545 0.653
237 HH TYR 25 HH TYR 25 -1.711 -2.252 1.637
238 H ALA 26 H ALA 26 2.998 -8.959 4.876
239 HA ALA 26 HA ALA 26 0.501 -10.293 4.528
240 HB1 ALA 26 HB1 ALA 26 3.192 -11.024 4.332
241 HB2 ALA 26 HB2 ALA 26 2.649 -11.963 5.734
242 HB3 ALA 26 HB3 ALA 26 1.812 -12.128 4.181
243 H SER 27 H SER 27 2.471 -9.816 7.507
244 HA SER 27 HA SER 27 0.653 -11.113 9.306
245 HB2 SER 27 HB2 SER 27 1.903 -9.804 11.046
246 HB3 SER 27 HB3 SER 27 2.907 -10.799 9.993
247 HG SER 27 HG SER 27 2.522 -8.071 9.276
248 H LEU 28 H LEU 28 0.225 -8.220 7.623
249 HA LEU 28 HA LEU 28 -1.832 -7.243 9.547
250 HB2 LEU 28 HB2 LEU 28 -0.182 -5.951 7.353
251 HB3 LEU 28 HB3 LEU 28 -1.710 -5.239 7.837
252 HG LEU 28 HG LEU 28 0.617 -5.799 9.734
253 HD11 LEU 28 HD11 LEU 28 0.960 -3.373 9.731
254 HD12 LEU 28 HD12 LEU 28 1.170 -4.044 8.109
255 HD13 LEU 28 HD13 LEU 28 -0.328 -3.172 8.522
256 HD21 LEU 28 HD21 LEU 28 -0.805 -4.072 11.134
257 HD22 LEU 28 HD22 LEU 28 -2.146 -4.605 10.105
258 HD23 LEU 28 HD23 LEU 28 -1.276 -5.776 11.123
259 H ARG 29 H ARG 29 -1.343 -8.353 6.207
260 HA ARG 29 HA ARG 29 -4.067 -7.964 5.420
261 HB2 ARG 29 HB2 ARG 29 -1.830 -8.262 3.966
262 HB3 ARG 29 HB3 ARG 29 -2.265 -9.953 4.028
263 HG2 ARG 29 HG2 ARG 29 -4.690 -8.447 3.448
264 HG3 ARG 29 HG3 ARG 29 -3.426 -7.822 2.409
265 HD2 ARG 29 HD2 ARG 29 -3.816 -10.813 2.661
266 HD3 ARG 29 HD3 ARG 29 -4.975 -9.868 1.722
267 HE ARG 29 HE ARG 29 -2.723 -8.949 0.631
268 HH11 ARG 29 HH22 ARG 29 -3.676 -12.255 1.204
269 HH12 ARG 29 HH21 ARG 29 -2.837 -12.865 -0.197
270 HH21 ARG 29 HH12 ARG 29 -1.562 -9.763 -1.104
271 HH22 ARG 29 HH11 ARG 29 -1.602 -11.455 -1.453
272 H HIS 30 H HIS 30 -2.259 -10.836 6.528
273 HA HIS 30 HA HIS 30 -4.292 -12.788 6.173
274 HB2 HIS 30 HB2 HIS 30 -1.780 -12.960 6.971
275 HB3 HIS 30 HB3 HIS 30 -2.458 -12.800 8.585
276 HD1 HIS 30 HD1 HIS 30 -1.205 -15.352 6.593
277 HD2 HIS 30 HD2 HIS 30 -4.892 -14.851 8.565
278 HE1 HIS 30 HE1 HIS 30 -2.242 -17.678 6.834
279 H TYR 31 H TYR 31 -3.814 -10.339 8.706
280 HA TYR 31 HA TYR 31 -5.924 -11.154 10.462
281 HB2 TYR 31 HB2 TYR 31 -4.229 -8.737 9.980
282 HB3 TYR 31 HB3 TYR 31 -5.787 -8.452 10.703
283 HD1 TYR 31 HD2 TYR 31 -3.388 -11.346 11.141
284 HD2 TYR 31 HD1 TYR 31 -5.299 -7.912 12.918
285 HE1 TYR 31 HE2 TYR 31 -2.432 -11.960 13.345
286 HE2 TYR 31 HE1 TYR 31 -4.300 -8.515 15.130
287 HH TYR 31 HH TYR 31 -2.046 -9.952 15.828
288 H LEU 32 H LEU 32 -5.864 -8.608 7.884
289 HA LEU 32 HA LEU 32 -8.511 -7.878 8.069
290 HB2 LEU 32 HB2 LEU 32 -7.145 -7.990 5.386
291 HB3 LEU 32 HB3 LEU 32 -8.414 -6.902 5.935
292 HG LEU 32 HG LEU 32 -5.496 -6.909 6.564
293 HD11 LEU 32 HD11 LEU 32 -6.417 -5.627 4.639
294 HD12 LEU 32 HD12 LEU 32 -7.269 -4.593 5.814
295 HD13 LEU 32 HD13 LEU 32 -5.491 -4.677 5.813
296 HD21 LEU 32 HD21 LEU 32 -6.014 -4.928 8.177
297 HD22 LEU 32 HD22 LEU 32 -7.628 -5.661 8.317
298 HD23 LEU 32 HD23 LEU 32 -6.171 -6.561 8.793
299 H ASN 33 H ASN 33 -7.348 -10.728 6.437
300 HA ASN 33 HA ASN 33 -9.476 -11.803 5.041
301 HB2 ASN 33 HB2 ASN 33 -7.129 -12.762 5.713
302 HB3 ASN 33 HB3 ASN 33 -7.962 -13.401 7.129
303 HD21 ASN 33 HD21 ASN 33 -6.773 -15.277 5.649
304 HD22 ASN 33 HD22 ASN 33 -7.967 -16.030 4.585
305 H LEU 34 H LEU 34 -9.178 -11.683 8.602
306 HA LEU 34 HA LEU 34 -12.093 -12.007 8.789
307 HB2 LEU 34 HB2 LEU 34 -12.055 -13.552 10.563
308 HB3 LEU 34 HB3 LEU 34 -11.251 -14.236 9.167
309 HG LEU 34 HG LEU 34 -9.446 -12.846 11.115
310 HD11 LEU 34 HD11 LEU 34 -11.265 -15.035 11.988
311 HD12 LEU 34 HD12 LEU 34 -9.560 -15.268 12.382
312 HD13 LEU 34 HD13 LEU 34 -10.395 -13.801 12.917
313 HD21 LEU 34 HD21 LEU 34 -8.977 -15.656 10.204
314 HD22 LEU 34 HD22 LEU 34 -8.940 -14.393 8.971
315 HD23 LEU 34 HD23 LEU 34 -7.861 -14.277 10.362
316 H VAL 35 H VAL 35 -9.901 -9.884 9.239
317 HA VAL 35 HA VAL 35 -10.835 -8.843 11.868
318 HB VAL 35 HB VAL 35 -8.443 -8.343 10.146
319 HG11 VAL 35 HG11 VAL 35 -9.174 -6.606 12.429
320 HG12 VAL 35 HG12 VAL 35 -7.602 -6.637 11.585
321 HG13 VAL 35 HG13 VAL 35 -9.040 -6.118 10.716
322 HG21 VAL 35 HG21 VAL 35 -9.007 -9.647 12.765
323 HG22 VAL 35 HG22 VAL 35 -7.692 -9.937 11.636
324 HG23 VAL 35 HG23 VAL 35 -7.589 -8.601 12.777
325 H THR 36 H THR 36 -11.407 -8.355 8.547
326 HA THR 36 HA THR 36 -12.731 -5.728 9.174
327 HB THR 36 HB THR 36 -12.862 -5.539 6.653
328 HG1 THR 36 HG1 THR 36 -10.810 -7.506 6.783
329 HG21 THR 36 HG21 THR 36 -11.451 -4.058 7.862
330 HG22 THR 36 HG22 THR 36 -10.254 -5.323 8.206
331 HG23 THR 36 HG23 THR 36 -10.455 -4.706 6.549
332 H ARG 37 H ARG 37 -13.303 -8.836 7.735
333 HA ARG 37 HA ARG 37 -16.073 -8.582 7.170
334 HB2 ARG 37 HB2 ARG 37 -16.128 -10.948 6.980
335 HB3 ARG 37 HB3 ARG 37 -14.500 -10.475 6.520
336 HG2 ARG 37 HG2 ARG 37 -14.057 -12.269 7.881
337 HG3 ARG 37 HG3 ARG 37 -13.896 -10.941 9.035
338 HD2 ARG 37 HD2 ARG 37 -15.496 -11.782 10.346
339 HD3 ARG 37 HD3 ARG 37 -16.659 -11.859 9.031
340 HE ARG 37 HE ARG 37 -15.101 -14.040 10.124
341 HH11 ARG 37 HH22 ARG 37 -16.616 -12.968 7.184
342 HH12 ARG 37 HH21 ARG 37 -16.804 -14.559 6.517
343 HH21 ARG 37 HH12 ARG 37 -15.368 -16.117 9.301
344 HH22 ARG 37 HH11 ARG 37 -16.152 -16.324 7.763
345 H GLN 38 H GLN 38 -14.610 -8.619 10.154
346 HA GLN 38 HA GLN 38 -17.199 -8.898 11.595
347 HB2 GLN 38 HB2 GLN 38 -14.739 -10.412 12.010
348 HB3 GLN 38 HB3 GLN 38 -15.040 -9.430 13.420
349 HG2 GLN 38 HG2 GLN 38 -17.551 -10.348 13.149
350 HG3 GLN 38 HG3 GLN 38 -16.734 -11.640 12.267
351 HE21 GLN 38 HE21 GLN 38 -15.628 -13.271 13.564
352 HE22 GLN 38 HE22 GLN 38 -15.475 -12.990 15.306
353 H ARG 39 H ARG 39 -15.537 -6.524 10.485
354 HA ARG 39 HA ARG 39 -15.193 -4.332 11.036
355 HB2 ARG 39 HB2 ARG 39 -17.155 -4.996 13.264
356 HB3 ARG 39 HB3 ARG 39 -16.699 -3.374 12.809
357 HG2 ARG 39 HG2 ARG 39 -17.943 -3.320 10.940
358 HG3 ARG 39 HG3 ARG 39 -17.717 -5.031 10.538
359 HD2 ARG 39 HD2 ARG 39 -19.328 -5.761 12.108
360 HD3 ARG 39 HD3 ARG 39 -19.341 -4.198 12.955
361 HE ARG 39 HE ARG 39 -20.142 -3.929 10.196
362 HH11 ARG 39 HH22 ARG 39 -21.408 -5.028 13.262
363 HH12 ARG 39 HH21 ARG 39 -23.043 -4.542 12.902
364 HH21 ARG 39 HH12 ARG 39 -22.226 -3.375 9.740
365 HH22 ARG 39 HH11 ARG 39 -23.514 -3.678 10.873
366 H TYR 40 H TYR 40 -13.269 -6.220 12.216
367 HA TYR 40 HA TYR 40 -11.529 -6.385 13.566
368 HB2 TYR 40 HB2 TYR 40 -11.577 -3.950 12.488
369 HB3 TYR 40 HB3 TYR 40 -11.655 -3.445 14.159
370 HD1 TYR 40 HD2 TYR 40 -9.738 -5.416 15.466
371 HD2 TYR 40 HD1 TYR 40 -9.519 -3.344 11.682
372 HE1 TYR 40 HE2 TYR 40 -7.290 -5.719 15.442
373 HE2 TYR 40 HE1 TYR 40 -7.042 -3.615 11.691
374 HH TYR 40 HH TYR 40 -5.427 -5.738 13.931
375 HN1 NH2 41 HN1 NH2 41 -13.812 -4.201 15.263
376 HN2 NH2 41 HN2 NH2 41 -13.632 -5.022 16.833
Start of MODEL 4
1 HA TYR 1 HA TYR 1 -3.441 9.418 -8.398
2 HB2 TYR 1 HB2 TYR 1 -4.002 10.463 -10.510
3 HB3 TYR 1 HB3 TYR 1 -5.379 10.444 -9.432
4 HD1 TYR 1 HD2 TYR 1 -6.098 12.644 -8.240
5 HD2 TYR 1 HD1 TYR 1 -3.191 12.512 -11.448
6 HE1 TYR 1 HE2 TYR 1 -6.290 15.093 -8.525
7 HE2 TYR 1 HE1 TYR 1 -3.447 14.968 -11.752
8 HH TYR 1 HH TYR 1 -4.683 16.989 -9.485
9 H LEU 2 H LEU 2 -1.531 10.770 -6.629
10 HA LEU 2 HA LEU 2 0.180 12.416 -8.366
11 HB2 LEU 2 HB2 LEU 2 0.032 11.790 -5.409
12 HB3 LEU 2 HB3 LEU 2 1.467 12.492 -6.103
13 HG LEU 2 HG LEU 2 -0.858 13.984 -7.048
14 HD11 LEU 2 HD11 LEU 2 -1.497 15.003 -4.903
15 HD12 LEU 2 HD12 LEU 2 -1.917 13.282 -4.958
16 HD13 LEU 2 HD13 LEU 2 -0.490 13.823 -4.036
17 HD21 LEU 2 HD21 LEU 2 0.441 15.877 -6.013
18 HD22 LEU 2 HD22 LEU 2 1.595 14.697 -5.387
19 HD23 LEU 2 HD23 LEU 2 1.390 14.892 -7.144
20 H GLU 3 H GLU 3 0.372 10.383 -9.748
21 HA GLU 3 HA GLU 3 2.051 8.196 -8.957
22 HB2 GLU 3 HB2 GLU 3 0.951 9.358 -11.479
23 HB3 GLU 3 HB3 GLU 3 2.456 8.495 -11.681
24 HG2 GLU 3 HG2 GLU 3 0.538 7.004 -9.980
25 HG3 GLU 3 HG3 GLU 3 -0.096 7.366 -11.577
26 H ARG 4 H ARG 4 2.918 11.202 -10.702
27 HA ARG 4 HA ARG 4 5.697 10.709 -10.908
28 HB2 ARG 4 HB2 ARG 4 4.263 12.669 -11.902
29 HB3 ARG 4 HB3 ARG 4 4.541 13.462 -10.351
30 HG2 ARG 4 HG2 ARG 4 7.127 12.676 -11.028
31 HG3 ARG 4 HG3 ARG 4 6.402 12.896 -12.618
32 HD2 ARG 4 HD2 ARG 4 5.550 15.186 -11.340
33 HD3 ARG 4 HD3 ARG 4 7.066 14.870 -10.475
34 HE ARG 4 HE ARG 4 7.554 14.626 -13.262
35 HH11 ARG 4 HH22 ARG 4 6.767 17.142 -10.978
36 HH12 ARG 4 HH21 ARG 4 7.407 18.427 -11.953
37 HH21 ARG 4 HH12 ARG 4 8.417 16.310 -14.545
38 HH22 ARG 4 HH11 ARG 4 8.295 17.927 -13.979
39 H GLU 5 H GLU 5 3.874 12.212 -8.249
40 HA GLU 5 HA GLU 5 6.169 12.727 -6.604
41 HB2 GLU 5 HB2 GLU 5 3.532 13.467 -6.447
42 HB3 GLU 5 HB3 GLU 5 3.594 12.187 -5.223
43 HG2 GLU 5 HG2 GLU 5 5.781 13.457 -4.440
44 HG3 GLU 5 HG3 GLU 5 5.122 14.801 -5.369
45 H LEU 6 H LEU 6 3.925 9.903 -6.832
46 HA LEU 6 HA LEU 6 4.979 8.353 -4.768
47 HB2 LEU 6 HB2 LEU 6 3.193 8.003 -6.881
48 HB3 LEU 6 HB3 LEU 6 4.423 6.805 -7.230
49 HG LEU 6 HG LEU 6 3.078 7.103 -4.506
50 HD11 LEU 6 HD11 LEU 6 1.335 6.683 -6.129
51 HD12 LEU 6 HD12 LEU 6 2.278 5.379 -6.882
52 HD13 LEU 6 HD13 LEU 6 1.645 5.181 -5.233
53 HD21 LEU 6 HD21 LEU 6 5.229 5.788 -4.580
54 HD22 LEU 6 HD22 LEU 6 3.827 4.829 -4.106
55 HD23 LEU 6 HD23 LEU 6 4.476 4.696 -5.757
56 H LYS 7 H LYS 7 6.462 9.046 -7.883
57 HA LYS 7 HA LYS 7 8.617 7.153 -7.690
58 HB2 LYS 7 HB2 LYS 7 7.731 9.030 -9.577
59 HB3 LYS 7 HB3 LYS 7 9.243 9.732 -9.043
60 HG2 LYS 7 HG2 LYS 7 10.305 8.350 -10.451
61 HG3 LYS 7 HG3 LYS 7 9.852 6.983 -9.433
62 HD2 LYS 7 HD2 LYS 7 7.677 6.802 -10.672
63 HD3 LYS 7 HD3 LYS 7 8.186 8.120 -11.736
64 HE2 LYS 7 HE2 LYS 7 9.640 5.467 -11.375
65 HE3 LYS 7 HE3 LYS 7 8.532 5.843 -12.709
66 HZ1 LYS 7 HZ1 LYS 7 9.998 7.521 -13.470
67 HZ2 LYS 7 HZ2 LYS 7 10.960 7.417 -12.129
68 HZ3 LYS 7 HZ3 LYS 7 10.931 6.189 -13.224
69 H LYS 8 H LYS 8 8.296 10.448 -6.380
70 HA LYS 8 HA LYS 8 11.034 10.416 -5.280
71 HB2 LYS 8 HB2 LYS 8 10.641 12.521 -4.334
72 HB3 LYS 8 HB3 LYS 8 9.945 12.586 -5.948
73 HG2 LYS 8 HG2 LYS 8 7.855 12.924 -5.196
74 HG3 LYS 8 HG3 LYS 8 7.996 11.802 -3.851
75 HD2 LYS 8 HD2 LYS 8 9.536 14.262 -3.381
76 HD3 LYS 8 HD3 LYS 8 7.805 14.530 -3.645
77 HE2 LYS 8 HE2 LYS 8 7.283 12.725 -1.992
78 HE3 LYS 8 HE3 LYS 8 9.010 12.574 -1.637
79 HZ1 LYS 8 HZ1 LYS 8 7.833 14.034 -0.062
80 HZ2 LYS 8 HZ2 LYS 8 8.972 14.889 -0.892
81 HZ3 LYS 8 HZ3 LYS 8 7.379 15.024 -1.281
82 H LEU 9 H LEU 9 8.118 8.991 -4.468
83 HA LEU 9 HA LEU 9 8.651 8.871 -1.580
84 HB2 LEU 9 HB2 LEU 9 6.316 8.899 -3.015
85 HB3 LEU 9 HB3 LEU 9 6.549 7.174 -2.852
86 HG LEU 9 HG LEU 9 7.065 8.063 -0.251
87 HD11 LEU 9 HD11 LEU 9 6.476 10.348 -0.728
88 HD12 LEU 9 HD12 LEU 9 4.941 9.866 -1.481
89 HD13 LEU 9 HD13 LEU 9 5.188 9.649 0.263
90 HD21 LEU 9 HD21 LEU 9 4.778 6.741 -1.613
91 HD22 LEU 9 HD22 LEU 9 5.686 6.310 -0.151
92 HD23 LEU 9 HD23 LEU 9 4.397 7.515 -0.067
93 H GLU 10 H GLU 10 8.309 6.477 -4.311
94 HA GLU 10 HA GLU 10 9.248 4.232 -2.948
95 HB2 GLU 10 HB2 GLU 10 8.206 4.370 -5.270
96 HB3 GLU 10 HB3 GLU 10 9.831 4.752 -5.868
97 HG2 GLU 10 HG2 GLU 10 10.649 2.609 -4.814
98 HG3 GLU 10 HG3 GLU 10 9.004 2.263 -4.291
99 H ARG 11 H ARG 11 11.078 6.869 -4.293
100 HA ARG 11 HA ARG 11 13.683 5.684 -4.041
101 HB2 ARG 11 HB2 ARG 11 12.918 7.745 -5.404
102 HB3 ARG 11 HB3 ARG 11 13.127 8.683 -3.923
103 HG2 ARG 11 HG2 ARG 11 15.454 8.416 -3.920
104 HG3 ARG 11 HG3 ARG 11 15.380 6.838 -4.696
105 HD2 ARG 11 HD2 ARG 11 16.074 7.828 -6.547
106 HD3 ARG 11 HD3 ARG 11 14.424 8.379 -6.757
107 HE ARG 11 HE ARG 11 16.767 9.963 -6.071
108 HH11 ARG 11 HH22 ARG 11 13.295 10.009 -5.793
109 HH12 ARG 11 HH21 ARG 11 13.230 11.744 -5.572
110 HH21 ARG 11 HH12 ARG 11 16.655 12.177 -5.879
111 HH22 ARG 11 HH11 ARG 11 15.108 12.932 -5.675
112 H GLU 12 H GLU 12 12.227 8.264 -1.903
113 HA GLU 12 HA GLU 12 14.180 7.775 0.140
114 HB2 GLU 12 HB2 GLU 12 11.903 9.556 -0.377
115 HB3 GLU 12 HB3 GLU 12 11.885 8.976 1.270
116 HG2 GLU 12 HG2 GLU 12 13.147 11.113 0.970
117 HG3 GLU 12 HG3 GLU 12 14.091 9.828 1.712
118 H LEU 13 H LEU 13 11.166 6.068 -0.622
119 HA LEU 13 HA LEU 13 10.800 4.750 1.854
120 HB2 LEU 13 HB2 LEU 13 9.060 4.449 0.362
121 HB3 LEU 13 HB3 LEU 13 10.142 4.294 -1.011
122 HG LEU 13 HG LEU 13 10.735 2.073 -0.474
123 HD11 LEU 13 HD11 LEU 13 8.602 1.551 1.537
124 HD12 LEU 13 HD12 LEU 13 10.274 0.953 1.429
125 HD13 LEU 13 HD13 LEU 13 9.919 2.528 2.144
126 HD21 LEU 13 HD21 LEU 13 7.763 1.783 -0.399
127 HD22 LEU 13 HD22 LEU 13 8.390 2.852 -1.634
128 HD23 LEU 13 HD23 LEU 13 8.964 1.184 -1.553
129 H LYS 14 H LYS 14 13.213 4.102 -0.725
130 HA LYS 14 HA LYS 14 14.198 1.642 0.350
131 HB2 LYS 14 HB2 LYS 14 15.002 2.033 -1.743
132 HB3 LYS 14 HB3 LYS 14 15.279 3.733 -1.504
133 HG2 LYS 14 HG2 LYS 14 17.062 1.613 -0.280
134 HG3 LYS 14 HG3 LYS 14 17.337 2.321 -1.857
135 HD2 LYS 14 HD2 LYS 14 18.203 4.248 -1.040
136 HD3 LYS 14 HD3 LYS 14 16.927 4.431 0.146
137 HE2 LYS 14 HE2 LYS 14 18.127 2.534 1.472
138 HE3 LYS 14 HE3 LYS 14 19.501 2.824 0.411
139 HZ1 LYS 14 HZ1 LYS 14 18.170 4.960 1.958
140 HZ2 LYS 14 HZ2 LYS 14 19.438 4.102 2.560
141 HZ3 LYS 14 HZ3 LYS 14 19.636 5.040 1.214
142 H LYS 15 H LYS 15 14.320 4.736 1.862
143 HA LYS 15 HA LYS 15 16.657 4.789 3.398
144 HB2 LYS 15 HB2 LYS 15 13.777 5.480 4.018
145 HB3 LYS 15 HB3 LYS 15 14.996 5.646 5.257
146 HG2 LYS 15 HG2 LYS 15 15.643 6.848 2.568
147 HG3 LYS 15 HG3 LYS 15 14.428 7.664 3.540
148 HD2 LYS 15 HD2 LYS 15 17.005 6.882 4.903
149 HD3 LYS 15 HD3 LYS 15 17.032 8.220 3.750
150 HE2 LYS 15 HE2 LYS 15 14.692 8.560 5.386
151 HE3 LYS 15 HE3 LYS 15 16.016 8.167 6.482
152 HZ1 LYS 15 HZ1 LYS 15 17.292 9.980 5.479
153 HZ2 LYS 15 HZ2 LYS 15 16.060 10.324 4.448
154 HZ3 LYS 15 HZ3 LYS 15 15.867 10.557 6.066
155 H LEU 16 H LEU 16 13.869 2.722 3.896
156 HA LEU 16 HA LEU 16 15.371 1.156 5.939
157 HB2 LEU 16 HB2 LEU 16 13.065 0.232 6.504
158 HB3 LEU 16 HB3 LEU 16 13.461 1.835 7.095
159 HG LEU 16 HG LEU 16 12.040 1.553 4.455
160 HD11 LEU 16 HD11 LEU 16 9.869 1.507 5.505
161 HD12 LEU 16 HD12 LEU 16 10.802 0.101 6.042
162 HD13 LEU 16 HD13 LEU 16 10.591 1.492 7.128
163 HD21 LEU 16 HD21 LEU 16 11.077 3.638 6.313
164 HD22 LEU 16 HD22 LEU 16 12.803 3.785 6.016
165 HD23 LEU 16 HD23 LEU 16 11.674 3.785 4.650
166 H SER 17 H SER 17 15.139 -1.136 5.832
167 HA SER 17 HA SER 17 15.917 -2.262 3.471
168 HB2 SER 17 HB2 SER 17 14.799 -3.306 6.013
169 HB3 SER 17 HB3 SER 17 14.934 -4.444 4.646
170 HG SER 17 HG SER 17 16.759 -4.227 6.112
171 HA PRO 18 HA PRO 18 11.982 -2.246 1.228
172 HB2 PRO 18 HB2 PRO 18 12.922 -3.295 -1.169
173 HB3 PRO 18 HB3 PRO 18 13.048 -1.587 -0.668
174 HG2 PRO 18 HG2 PRO 18 15.171 -3.695 -0.691
175 HG3 PRO 18 HG3 PRO 18 15.321 -1.925 -0.894
176 HD2 PRO 18 HD2 PRO 18 15.846 -3.397 1.450
177 HD3 PRO 18 HD3 PRO 18 15.637 -1.625 1.353
178 H GLU 19 H GLU 19 13.783 -4.943 2.195
179 HA GLU 19 HA GLU 19 11.709 -6.898 1.386
180 HB2 GLU 19 HB2 GLU 19 14.461 -7.016 1.359
181 HB3 GLU 19 HB3 GLU 19 14.117 -7.777 2.912
182 HG2 GLU 19 HG2 GLU 19 12.581 -9.369 1.765
183 HG3 GLU 19 HG3 GLU 19 12.861 -8.536 0.229
184 H GLU 20 H GLU 20 12.646 -5.013 4.130
185 HA GLU 20 HA GLU 20 11.574 -6.837 6.175
186 HB2 GLU 20 HB2 GLU 20 13.435 -4.880 6.185
187 HB3 GLU 20 HB3 GLU 20 12.086 -3.942 6.795
188 HG2 GLU 20 HG2 GLU 20 11.949 -5.326 8.752
189 HG3 GLU 20 HG3 GLU 20 12.924 -6.603 8.016
190 H LEU 21 H LEU 21 10.564 -3.953 4.306
191 HA LEU 21 HA LEU 21 8.125 -3.572 5.735
192 HB2 LEU 21 HB2 LEU 21 9.513 -2.366 3.472
193 HB3 LEU 21 HB3 LEU 21 7.840 -2.632 3.039
194 HG LEU 21 HG LEU 21 8.821 -1.158 5.511
195 HD11 LEU 21 HD11 LEU 21 9.222 0.038 3.408
196 HD12 LEU 21 HD12 LEU 21 7.516 -0.159 2.941
197 HD13 LEU 21 HD13 LEU 21 7.944 0.850 4.338
198 HD21 LEU 21 HD21 LEU 21 6.435 -2.304 5.648
199 HD22 LEU 21 HD22 LEU 21 6.636 -0.616 6.113
200 HD23 LEU 21 HD23 LEU 21 5.954 -1.029 4.526
201 H ASN 22 H ASN 22 8.767 -5.196 2.576
202 HA ASN 22 HA ASN 22 6.150 -6.089 2.075
203 HB2 ASN 22 HB2 ASN 22 8.295 -6.220 0.630
204 HB3 ASN 22 HB3 ASN 22 8.628 -7.738 1.466
205 HD21 ASN 22 HD21 ASN 22 8.468 -8.068 -1.159
206 HD22 ASN 22 HD22 ASN 22 6.870 -8.643 -1.615
207 H ARG 23 H ARG 23 8.647 -7.574 4.139
208 HA ARG 23 HA ARG 23 7.155 -9.926 4.886
209 HB2 ARG 23 HB2 ARG 23 9.701 -9.222 5.248
210 HB3 ARG 23 HB3 ARG 23 9.105 -8.518 6.733
211 HG2 ARG 23 HG2 ARG 23 9.388 -10.533 7.661
212 HG3 ARG 23 HG3 ARG 23 7.947 -11.066 6.805
213 HD2 ARG 23 HD2 ARG 23 10.623 -11.163 5.362
214 HD3 ARG 23 HD3 ARG 23 10.297 -12.326 6.633
215 HE ARG 23 HE ARG 23 8.730 -13.404 5.355
216 HH11 ARG 23 HH22 ARG 23 9.478 -10.434 3.619
217 HH12 ARG 23 HH21 ARG 23 8.638 -10.950 2.185
218 HH21 ARG 23 HH12 ARG 23 7.720 -14.030 3.500
219 HH22 ARG 23 HH11 ARG 23 7.709 -12.978 2.118
220 H TYR 24 H TYR 24 7.397 -6.705 6.362
221 HA TYR 24 HA TYR 24 5.510 -7.148 8.486
222 HB2 TYR 24 HB2 TYR 24 7.266 -5.089 7.634
223 HB3 TYR 24 HB3 TYR 24 5.685 -4.381 7.509
224 HD1 TYR 24 HD1 TYR 24 8.042 -6.168 9.784
225 HD2 TYR 24 HD2 TYR 24 4.514 -3.706 9.500
226 HE1 TYR 24 HE1 TYR 24 8.155 -5.746 12.231
227 HE2 TYR 24 HE2 TYR 24 4.617 -3.289 11.971
228 HH TYR 24 HH TYR 24 7.267 -4.567 13.979
229 H TYR 25 H TYR 25 5.135 -6.468 5.126
230 HA TYR 25 HA TYR 25 2.489 -5.397 5.158
231 HB2 TYR 25 HB2 TYR 25 4.312 -5.400 3.279
232 HB3 TYR 25 HB3 TYR 25 3.638 -6.955 2.829
233 HD1 TYR 25 HD1 TYR 25 2.581 -3.431 3.560
234 HD2 TYR 25 HD2 TYR 25 1.890 -7.026 1.279
235 HE1 TYR 25 HE1 TYR 25 0.890 -2.228 2.174
236 HE2 TYR 25 HE2 TYR 25 0.209 -5.831 -0.106
237 HH TYR 25 HH TYR 25 -0.531 -3.717 -0.689
238 H ALA 26 H ALA 26 3.680 -8.745 4.572
239 HA ALA 26 HA ALA 26 1.106 -9.891 4.112
240 HB1 ALA 26 HB1 ALA 26 2.155 -12.018 4.466
241 HB2 ALA 26 HB2 ALA 26 3.410 -10.973 3.768
242 HB3 ALA 26 HB3 ALA 26 3.410 -11.320 5.510
243 H SER 27 H SER 27 2.868 -9.433 7.172
244 HA SER 27 HA SER 27 0.838 -10.501 8.921
245 HB2 SER 27 HB2 SER 27 3.167 -8.596 9.355
246 HB3 SER 27 HB3 SER 27 2.090 -9.122 10.661
247 HG SER 27 HG SER 27 3.419 -10.930 8.940
248 H LEU 28 H LEU 28 0.886 -7.586 7.118
249 HA LEU 28 HA LEU 28 -1.137 -6.287 8.842
250 HB2 LEU 28 HB2 LEU 28 0.129 -4.546 8.292
251 HB3 LEU 28 HB3 LEU 28 0.955 -5.396 7.012
252 HG LEU 28 HG LEU 28 -0.809 -4.898 5.434
253 HD11 LEU 28 HD11 LEU 28 -2.860 -4.535 6.472
254 HD12 LEU 28 HD12 LEU 28 -2.157 -3.691 7.856
255 HD13 LEU 28 HD13 LEU 28 -2.368 -2.867 6.294
256 HD21 LEU 28 HD21 LEU 28 -0.124 -2.763 4.954
257 HD22 LEU 28 HD22 LEU 28 -0.098 -2.244 6.657
258 HD23 LEU 28 HD23 LEU 28 1.178 -3.305 6.026
259 H ARG 29 H ARG 29 -0.667 -7.310 5.457
260 HA ARG 29 HA ARG 29 -3.201 -6.831 4.452
261 HB2 ARG 29 HB2 ARG 29 -1.020 -7.847 3.300
262 HB3 ARG 29 HB3 ARG 29 -1.791 -9.392 3.658
263 HG2 ARG 29 HG2 ARG 29 -3.911 -8.365 2.479
264 HG3 ARG 29 HG3 ARG 29 -2.810 -7.101 1.931
265 HD2 ARG 29 HD2 ARG 29 -2.803 -8.589 0.152
266 HD3 ARG 29 HD3 ARG 29 -1.336 -9.060 1.029
267 HE ARG 29 HE ARG 29 -3.346 -10.653 2.103
268 HH11 ARG 29 HH22 ARG 29 -2.144 -10.197 -1.141
269 HH12 ARG 29 HH21 ARG 29 -2.622 -11.779 -1.679
270 HH21 ARG 29 HH12 ARG 29 -3.993 -12.676 1.384
271 HH22 ARG 29 HH11 ARG 29 -3.667 -13.151 -0.261
272 H HIS 30 H HIS 30 -2.177 -9.635 6.329
273 HA HIS 30 HA HIS 30 -4.810 -10.886 6.315
274 HB2 HIS 30 HB2 HIS 30 -2.359 -11.874 6.698
275 HB3 HIS 30 HB3 HIS 30 -2.731 -11.536 8.386
276 HD1 HIS 30 HD1 HIS 30 -3.562 -13.867 5.546
277 HD2 HIS 30 HD2 HIS 30 -5.030 -12.879 9.365
278 HE1 HIS 30 HE1 HIS 30 -5.218 -15.707 6.188
279 H TYR 31 H TYR 31 -3.048 -8.739 8.576
280 HA TYR 31 HA TYR 31 -4.868 -8.797 10.772
281 HB2 TYR 31 HB2 TYR 31 -2.524 -7.864 10.670
282 HB3 TYR 31 HB3 TYR 31 -3.148 -6.465 9.822
283 HD1 TYR 31 HD1 TYR 31 -4.688 -4.868 11.006
284 HD2 TYR 31 HD2 TYR 31 -2.659 -8.112 12.996
285 HE1 TYR 31 HE1 TYR 31 -5.054 -3.746 13.191
286 HE2 TYR 31 HE2 TYR 31 -3.026 -6.988 15.193
287 HH TYR 31 HH TYR 31 -4.650 -3.819 15.402
288 H LEU 32 H LEU 32 -4.595 -6.429 8.063
289 HA LEU 32 HA LEU 32 -7.003 -5.059 8.697
290 HB2 LEU 32 HB2 LEU 32 -6.714 -3.788 6.788
291 HB3 LEU 32 HB3 LEU 32 -5.102 -4.206 7.319
292 HG LEU 32 HG LEU 32 -5.102 -6.032 5.551
293 HD11 LEU 32 HD11 LEU 32 -7.047 -6.516 4.514
294 HD12 LEU 32 HD12 LEU 32 -7.823 -5.006 5.058
295 HD13 LEU 32 HD13 LEU 32 -6.860 -5.046 3.586
296 HD21 LEU 32 HD21 LEU 32 -4.472 -3.309 5.350
297 HD22 LEU 32 HD22 LEU 32 -3.932 -4.619 4.285
298 HD23 LEU 32 HD23 LEU 32 -5.334 -3.628 3.866
299 H ASN 33 H ASN 33 -6.436 -8.017 6.924
300 HA ASN 33 HA ASN 33 -8.840 -8.268 5.490
301 HB2 ASN 33 HB2 ASN 33 -6.683 -9.830 5.678
302 HB3 ASN 33 HB3 ASN 33 -7.660 -10.693 6.839
303 HD21 ASN 33 HD21 ASN 33 -9.196 -12.129 6.006
304 HD22 ASN 33 HD22 ASN 33 -9.464 -12.262 4.263
305 H LEU 34 H LEU 34 -8.192 -8.580 8.917
306 HA LEU 34 HA LEU 34 -10.990 -9.440 9.449
307 HB2 LEU 34 HB2 LEU 34 -8.486 -9.577 11.194
308 HB3 LEU 34 HB3 LEU 34 -10.075 -10.177 11.666
309 HG LEU 34 HG LEU 34 -8.501 -11.255 9.282
310 HD11 LEU 34 HD11 LEU 34 -7.927 -13.165 10.676
311 HD12 LEU 34 HD12 LEU 34 -7.278 -11.666 11.369
312 HD13 LEU 34 HD13 LEU 34 -8.726 -12.414 12.079
313 HD21 LEU 34 HD21 LEU 34 -11.180 -11.566 9.701
314 HD22 LEU 34 HD22 LEU 34 -10.153 -12.782 8.945
315 HD23 LEU 34 HD23 LEU 34 -10.574 -12.908 10.666
316 H VAL 35 H VAL 35 -9.824 -6.690 8.846
317 HA VAL 35 HA VAL 35 -11.045 -5.260 11.158
318 HB VAL 35 HB VAL 35 -8.791 -4.312 9.457
319 HG11 VAL 35 HG11 VAL 35 -9.465 -2.894 12.019
320 HG12 VAL 35 HG12 VAL 35 -8.693 -2.304 10.537
321 HG13 VAL 35 HG13 VAL 35 -10.438 -2.539 10.617
322 HG21 VAL 35 HG21 VAL 35 -8.444 -6.126 11.500
323 HG22 VAL 35 HG22 VAL 35 -7.238 -4.951 10.976
324 HG23 VAL 35 HG23 VAL 35 -8.263 -4.628 12.379
325 H THR 36 H THR 36 -10.175 -3.270 8.587
326 HA THR 36 HA THR 36 -12.791 -2.406 8.023
327 HB THR 36 HB THR 36 -11.507 -1.512 5.888
328 HG1 THR 36 HG1 THR 36 -9.683 -2.928 6.245
329 HG21 THR 36 HG21 THR 36 -10.264 0.156 7.532
330 HG22 THR 36 HG22 THR 36 -12.039 0.114 7.500
331 HG23 THR 36 HG23 THR 36 -11.146 -0.717 8.794
332 H ARG 37 H ARG 37 -10.895 -4.920 6.593
333 HA ARG 37 HA ARG 37 -12.571 -5.288 4.242
334 HB2 ARG 37 HB2 ARG 37 -10.018 -6.118 4.984
335 HB3 ARG 37 HB3 ARG 37 -10.949 -7.583 5.231
336 HG2 ARG 37 HG2 ARG 37 -11.621 -6.299 2.668
337 HG3 ARG 37 HG3 ARG 37 -9.883 -6.547 2.812
338 HD2 ARG 37 HD2 ARG 37 -10.062 -8.853 2.891
339 HD3 ARG 37 HD3 ARG 37 -11.712 -8.821 3.548
340 HE ARG 37 HE ARG 37 -11.481 -7.721 0.862
341 HH11 ARG 37 HH22 ARG 37 -11.979 -10.668 2.632
342 HH12 ARG 37 HH21 ARG 37 -12.868 -11.454 1.348
343 HH21 ARG 37 HH12 ARG 37 -12.668 -8.711 -0.772
344 HH22 ARG 37 HH11 ARG 37 -13.214 -10.344 -0.560
345 H GLN 38 H GLN 38 -13.064 -5.913 7.453
346 HA GLN 38 HA GLN 38 -15.308 -7.743 6.860
347 HB2 GLN 38 HB2 GLN 38 -13.072 -8.455 8.306
348 HB3 GLN 38 HB3 GLN 38 -14.074 -7.814 9.584
349 HG2 GLN 38 HG2 GLN 38 -15.144 -9.789 9.677
350 HG3 GLN 38 HG3 GLN 38 -15.861 -9.439 8.114
351 HE21 GLN 38 HE21 GLN 38 -15.913 -11.752 7.540
352 HE22 GLN 38 HE22 GLN 38 -14.342 -12.526 7.231
353 H ARG 39 H ARG 39 -14.938 -4.662 7.287
354 HA ARG 39 HA ARG 39 -16.031 -2.909 8.302
355 HB2 ARG 39 HB2 ARG 39 -18.283 -4.955 8.451
356 HB3 ARG 39 HB3 ARG 39 -18.462 -3.277 8.917
357 HG2 ARG 39 HG2 ARG 39 -19.070 -2.858 6.829
358 HG3 ARG 39 HG3 ARG 39 -17.358 -2.951 6.426
359 HD2 ARG 39 HD2 ARG 39 -18.442 -4.350 4.863
360 HD3 ARG 39 HD3 ARG 39 -17.732 -5.470 6.044
361 HE ARG 39 HE ARG 39 -20.457 -4.697 6.702
362 HH11 ARG 39 HH22 ARG 39 -18.681 -6.961 4.719
363 HH12 ARG 39 HH21 ARG 39 -20.024 -8.047 4.507
364 HH21 ARG 39 HH12 ARG 39 -22.167 -6.105 6.490
365 HH22 ARG 39 HH11 ARG 39 -21.974 -7.546 5.542
366 H TYR 40 H TYR 40 -14.231 -3.846 9.894
367 HA TYR 40 HA TYR 40 -14.489 -4.684 12.367
368 HB2 TYR 40 HB2 TYR 40 -12.543 -3.400 11.143
369 HB3 TYR 40 HB3 TYR 40 -13.037 -2.049 12.088
370 HD1 TYR 40 HD2 TYR 40 -12.575 -5.776 12.692
371 HD2 TYR 40 HD1 TYR 40 -11.584 -1.753 13.921
372 HE1 TYR 40 HE2 TYR 40 -11.077 -6.678 14.427
373 HE2 TYR 40 HE1 TYR 40 -10.108 -2.680 15.706
374 HH TYR 40 HH TYR 40 -10.073 -5.067 17.033
375 HN1 NH2 41 HN1 NH2 41 -16.552 -4.434 13.319
376 HN2 NH2 41 HN2 NH2 41 -16.993 -2.914 14.091
Start of MODEL 5
1 HA TYR 1 HA TYR 1 3.368 16.743 -12.840
2 HB2 TYR 1 HB2 TYR 1 4.954 16.445 -10.903
3 HB3 TYR 1 HB3 TYR 1 4.806 18.083 -11.507
4 HD1 TYR 1 HD1 TYR 1 3.261 15.859 -8.824
5 HD2 TYR 1 HD2 TYR 1 4.597 19.827 -9.939
6 HE1 TYR 1 HE1 TYR 1 2.733 16.680 -6.562
7 HE2 TYR 1 HE2 TYR 1 4.100 20.608 -7.630
8 HH TYR 1 HH TYR 1 3.825 19.716 -5.375
9 H LEU 2 H LEU 2 3.890 14.450 -12.073
10 HA LEU 2 HA LEU 2 2.387 13.285 -9.921
11 HB2 LEU 2 HB2 LEU 2 1.270 13.098 -12.685
12 HB3 LEU 2 HB3 LEU 2 1.420 11.559 -11.872
13 HG LEU 2 HG LEU 2 0.228 13.652 -10.126
14 HD11 LEU 2 HD11 LEU 2 -1.523 12.630 -12.371
15 HD12 LEU 2 HD12 LEU 2 -1.847 13.894 -11.162
16 HD13 LEU 2 HD13 LEU 2 -0.692 14.207 -12.452
17 HD21 LEU 2 HD21 LEU 2 0.317 11.364 -9.410
18 HD22 LEU 2 HD22 LEU 2 -1.375 11.840 -9.667
19 HD23 LEU 2 HD23 LEU 2 -0.547 10.820 -10.867
20 H GLU 3 H GLU 3 3.747 12.188 -13.082
21 HA GLU 3 HA GLU 3 5.001 9.883 -12.309
22 HB2 GLU 3 HB2 GLU 3 6.529 10.447 -14.246
23 HB3 GLU 3 HB3 GLU 3 4.816 10.324 -14.581
24 HG2 GLU 3 HG2 GLU 3 4.728 12.422 -15.405
25 HG3 GLU 3 HG3 GLU 3 5.470 13.115 -13.971
26 H ARG 4 H ARG 4 7.100 12.809 -12.860
27 HA ARG 4 HA ARG 4 9.232 11.895 -11.398
28 HB2 ARG 4 HB2 ARG 4 8.984 14.053 -12.799
29 HB3 ARG 4 HB3 ARG 4 8.394 14.827 -11.335
30 HG2 ARG 4 HG2 ARG 4 10.499 15.006 -10.467
31 HG3 ARG 4 HG3 ARG 4 10.834 13.306 -10.746
32 HD2 ARG 4 HD2 ARG 4 12.400 14.100 -12.148
33 HD3 ARG 4 HD3 ARG 4 11.059 14.094 -13.296
34 HE ARG 4 HE ARG 4 11.256 16.585 -11.801
35 HH11 ARG 4 HH22 ARG 4 12.445 14.952 -14.641
36 HH12 ARG 4 HH21 ARG 4 13.077 16.385 -15.388
37 HH21 ARG 4 HH12 ARG 4 11.970 18.439 -12.760
38 HH22 ARG 4 HH11 ARG 4 12.772 18.390 -14.302
39 H GLU 5 H GLU 5 6.452 13.614 -10.051
40 HA GLU 5 HA GLU 5 7.425 13.918 -7.394
41 HB2 GLU 5 HB2 GLU 5 5.419 15.063 -8.346
42 HB3 GLU 5 HB3 GLU 5 4.525 13.543 -8.244
43 HG2 GLU 5 HG2 GLU 5 4.030 14.898 -6.278
44 HG3 GLU 5 HG3 GLU 5 4.908 13.465 -5.789
45 H LEU 6 H LEU 6 5.358 11.254 -8.763
46 HA LEU 6 HA LEU 6 5.316 9.610 -6.480
47 HB2 LEU 6 HB2 LEU 6 5.295 9.060 -9.460
48 HB3 LEU 6 HB3 LEU 6 5.334 7.713 -8.337
49 HG LEU 6 HG LEU 6 3.207 9.880 -8.165
50 HD11 LEU 6 HD11 LEU 6 1.734 8.405 -9.430
51 HD12 LEU 6 HD12 LEU 6 3.164 8.765 -10.408
52 HD13 LEU 6 HD13 LEU 6 3.019 7.190 -9.598
53 HD21 LEU 6 HD21 LEU 6 3.573 8.391 -6.151
54 HD22 LEU 6 HD22 LEU 6 1.980 8.193 -6.890
55 HD23 LEU 6 HD23 LEU 6 3.251 6.985 -7.181
56 H LYS 7 H LYS 7 7.885 9.959 -8.885
57 HA LYS 7 HA LYS 7 9.598 7.947 -7.722
58 HB2 LYS 7 HB2 LYS 7 9.623 9.345 -10.051
59 HB3 LYS 7 HB3 LYS 7 10.833 10.282 -9.171
60 HG2 LYS 7 HG2 LYS 7 12.254 8.385 -8.899
61 HG3 LYS 7 HG3 LYS 7 10.969 7.242 -9.289
62 HD2 LYS 7 HD2 LYS 7 11.429 9.167 -11.484
63 HD3 LYS 7 HD3 LYS 7 12.880 8.265 -11.090
64 HE2 LYS 7 HE2 LYS 7 10.423 6.586 -11.197
65 HE3 LYS 7 HE3 LYS 7 10.763 7.418 -12.713
66 HZ1 LYS 7 HZ1 LYS 7 12.652 5.654 -11.274
67 HZ2 LYS 7 HZ2 LYS 7 11.856 5.294 -12.660
68 HZ3 LYS 7 HZ3 LYS 7 12.992 6.478 -12.670
69 H LYS 8 H LYS 8 9.446 11.479 -7.230
70 HA LYS 8 HA LYS 8 11.416 11.550 -5.080
71 HB2 LYS 8 HB2 LYS 8 9.441 13.446 -6.318
72 HB3 LYS 8 HB3 LYS 8 9.975 13.813 -4.678
73 HG2 LYS 8 HG2 LYS 8 12.284 13.876 -5.312
74 HG3 LYS 8 HG3 LYS 8 11.950 13.224 -6.919
75 HD2 LYS 8 HD2 LYS 8 11.499 15.255 -7.773
76 HD3 LYS 8 HD3 LYS 8 10.367 15.641 -6.472
77 HE2 LYS 8 HE2 LYS 8 12.398 16.157 -5.008
78 HE3 LYS 8 HE3 LYS 8 13.385 16.038 -6.478
79 HZ1 LYS 8 HZ1 LYS 8 12.759 18.340 -6.170
80 HZ2 LYS 8 HZ2 LYS 8 11.916 17.769 -7.437
81 HZ3 LYS 8 HZ3 LYS 8 11.158 17.926 -5.986
82 H LEU 9 H LEU 9 8.141 10.607 -5.119
83 HA LEU 9 HA LEU 9 7.796 10.733 -2.229
84 HB2 LEU 9 HB2 LEU 9 6.060 10.700 -4.384
85 HB3 LEU 9 HB3 LEU 9 5.986 9.025 -3.912
86 HG LEU 9 HG LEU 9 4.196 10.272 -2.893
87 HD11 LEU 9 HD11 LEU 9 4.957 8.545 -1.457
88 HD12 LEU 9 HD12 LEU 9 6.283 9.542 -0.813
89 HD13 LEU 9 HD13 LEU 9 4.602 9.955 -0.449
90 HD21 LEU 9 HD21 LEU 9 6.330 12.280 -2.212
91 HD22 LEU 9 HD22 LEU 9 4.714 12.492 -2.874
92 HD23 LEU 9 HD23 LEU 9 4.919 12.137 -1.151
93 H GLU 10 H GLU 10 8.087 8.011 -4.611
94 HA GLU 10 HA GLU 10 8.351 6.076 -2.560
95 HB2 GLU 10 HB2 GLU 10 8.175 5.921 -5.335
96 HB3 GLU 10 HB3 GLU 10 9.797 5.295 -4.984
97 HG2 GLU 10 HG2 GLU 10 8.801 3.773 -3.258
98 HG3 GLU 10 HG3 GLU 10 7.204 4.440 -3.611
99 H ARG 11 H ARG 11 10.882 7.977 -4.263
100 HA ARG 11 HA ARG 11 13.129 6.813 -2.908
101 HB2 ARG 11 HB2 ARG 11 12.664 9.567 -4.109
102 HB3 ARG 11 HB3 ARG 11 14.188 9.109 -3.356
103 HG2 ARG 11 HG2 ARG 11 14.393 7.176 -4.941
104 HG3 ARG 11 HG3 ARG 11 12.946 7.754 -5.781
105 HD2 ARG 11 HD2 ARG 11 14.161 10.035 -5.929
106 HD3 ARG 11 HD3 ARG 11 15.627 9.156 -5.444
107 HE ARG 11 HE ARG 11 14.622 7.701 -7.562
108 HH11 ARG 11 HH22 ARG 11 15.665 11.025 -7.200
109 HH12 ARG 11 HH21 ARG 11 15.955 11.272 -8.889
110 HH21 ARG 11 HH12 ARG 11 15.044 8.002 -9.720
111 HH22 ARG 11 HH11 ARG 11 15.556 9.568 -10.310
112 H GLU 12 H GLU 12 10.671 8.909 -1.553
113 HA GLU 12 HA GLU 12 12.363 9.657 0.744
114 HB2 GLU 12 HB2 GLU 12 10.846 11.335 0.262
115 HB3 GLU 12 HB3 GLU 12 9.504 10.259 -0.052
116 HG2 GLU 12 HG2 GLU 12 9.020 9.914 2.187
117 HG3 GLU 12 HG3 GLU 12 10.673 10.215 2.707
118 H LEU 13 H LEU 13 9.230 7.903 0.532
119 HA LEU 13 HA LEU 13 9.528 6.701 3.083
120 HB2 LEU 13 HB2 LEU 13 7.449 6.148 2.797
121 HB3 LEU 13 HB3 LEU 13 7.523 6.956 1.262
122 HG LEU 13 HG LEU 13 6.438 5.010 0.922
123 HD11 LEU 13 HD11 LEU 13 8.952 3.868 -0.184
124 HD12 LEU 13 HD12 LEU 13 7.419 4.258 -0.966
125 HD13 LEU 13 HD13 LEU 13 8.571 5.549 -0.578
126 HD21 LEU 13 HD21 LEU 13 7.458 3.831 3.044
127 HD22 LEU 13 HD22 LEU 13 6.787 2.873 1.710
128 HD23 LEU 13 HD23 LEU 13 8.535 3.066 1.870
129 H LYS 14 H LYS 14 10.895 5.593 0.079
130 HA LYS 14 HA LYS 14 11.724 2.982 0.633
131 HB2 LYS 14 HB2 LYS 14 12.159 3.872 -1.474
132 HB3 LYS 14 HB3 LYS 14 12.869 5.353 -0.843
133 HG2 LYS 14 HG2 LYS 14 14.327 2.726 -0.516
134 HG3 LYS 14 HG3 LYS 14 14.370 3.630 -2.029
135 HD2 LYS 14 HD2 LYS 14 15.153 5.668 -0.851
136 HD3 LYS 14 HD3 LYS 14 15.223 4.786 0.670
137 HE2 LYS 14 HE2 LYS 14 16.854 3.218 -0.240
138 HE3 LYS 14 HE3 LYS 14 16.807 4.066 -1.799
139 HZ1 LYS 14 HZ1 LYS 14 18.642 4.881 -0.441
140 HZ2 LYS 14 HZ2 LYS 14 17.528 6.084 -0.604
141 HZ3 LYS 14 HZ3 LYS 14 17.634 5.247 0.800
142 H LYS 15 H LYS 15 12.689 5.861 2.335
143 HA LYS 15 HA LYS 15 15.077 5.147 3.591
144 HB2 LYS 15 HB2 LYS 15 14.407 6.609 5.371
145 HB3 LYS 15 HB3 LYS 15 13.837 7.283 3.848
146 HG2 LYS 15 HG2 LYS 15 11.599 5.874 4.608
147 HG3 LYS 15 HG3 LYS 15 12.330 6.183 6.180
148 HD2 LYS 15 HD2 LYS 15 12.420 8.682 5.349
149 HD3 LYS 15 HD3 LYS 15 11.244 8.131 4.160
150 HE2 LYS 15 HE2 LYS 15 9.690 8.604 5.675
151 HE3 LYS 15 HE3 LYS 15 10.126 7.047 6.389
152 HZ1 LYS 15 HZ1 LYS 15 11.582 8.178 7.908
153 HZ2 LYS 15 HZ2 LYS 15 11.397 9.615 7.135
154 HZ3 LYS 15 HZ3 LYS 15 10.144 8.975 7.974
155 H LEU 16 H LEU 16 11.911 3.685 4.146
156 HA LEU 16 HA LEU 16 13.098 1.755 6.087
157 HB2 LEU 16 HB2 LEU 16 10.248 2.518 5.310
158 HB3 LEU 16 HB3 LEU 16 10.617 0.940 5.997
159 HG LEU 16 HG LEU 16 11.751 2.122 7.932
160 HD11 LEU 16 HD11 LEU 16 10.793 4.438 8.420
161 HD12 LEU 16 HD12 LEU 16 12.106 4.312 7.251
162 HD13 LEU 16 HD13 LEU 16 10.423 4.531 6.679
163 HD21 LEU 16 HD21 LEU 16 9.691 1.045 8.305
164 HD22 LEU 16 HD22 LEU 16 9.500 2.650 9.013
165 HD23 LEU 16 HD23 LEU 16 8.768 2.293 7.431
166 H SER 17 H SER 17 13.549 -0.238 5.440
167 HA SER 17 HA SER 17 14.150 -1.111 2.996
168 HB2 SER 17 HB2 SER 17 13.273 -2.526 5.453
169 HB3 SER 17 HB3 SER 17 13.411 -3.478 3.955
170 HG SER 17 HG SER 17 15.283 -3.430 5.197
171 HA PRO 18 HA PRO 18 10.075 -1.219 1.012
172 HB2 PRO 18 HB2 PRO 18 10.943 -1.668 -1.588
173 HB3 PRO 18 HB3 PRO 18 10.881 -0.082 -0.774
174 HG2 PRO 18 HG2 PRO 18 13.256 -1.833 -1.285
175 HG3 PRO 18 HG3 PRO 18 13.157 -0.049 -1.214
176 HD2 PRO 18 HD2 PRO 18 14.080 -1.731 0.827
177 HD3 PRO 18 HD3 PRO 18 13.548 -0.040 1.054
178 H GLU 19 H GLU 19 12.316 -3.761 1.308
179 HA GLU 19 HA GLU 19 10.517 -5.873 0.282
180 HB2 GLU 19 HB2 GLU 19 13.087 -5.816 0.029
181 HB3 GLU 19 HB3 GLU 19 13.156 -6.141 1.760
182 HG2 GLU 19 HG2 GLU 19 11.561 -8.186 1.111
183 HG3 GLU 19 HG3 GLU 19 12.128 -7.862 -0.519
184 H GLU 20 H GLU 20 11.359 -4.297 3.350
185 HA GLU 20 HA GLU 20 10.494 -6.522 5.035
186 HB2 GLU 20 HB2 GLU 20 12.071 -4.299 5.399
187 HB3 GLU 20 HB3 GLU 20 10.624 -3.802 6.254
188 HG2 GLU 20 HG2 GLU 20 10.800 -5.649 7.771
189 HG3 GLU 20 HG3 GLU 20 11.938 -6.507 6.730
190 H LEU 21 H LEU 21 9.148 -3.411 3.882
191 HA LEU 21 HA LEU 21 6.720 -3.572 5.330
192 HB2 LEU 21 HB2 LEU 21 7.883 -1.853 3.332
193 HB3 LEU 21 HB3 LEU 21 6.308 -2.332 2.738
194 HG LEU 21 HG LEU 21 6.867 -1.090 5.468
195 HD11 LEU 21 HD11 LEU 21 7.206 0.529 3.701
196 HD12 LEU 21 HD12 LEU 21 5.693 0.056 2.898
197 HD13 LEU 21 HD13 LEU 21 5.652 0.878 4.473
198 HD21 LEU 21 HD21 LEU 21 4.400 -0.791 5.613
199 HD22 LEU 21 HD22 LEU 21 4.200 -1.747 4.127
200 HD23 LEU 21 HD23 LEU 21 4.845 -2.493 5.604
201 H ASN 22 H ASN 22 7.479 -4.749 2.008
202 HA ASN 22 HA ASN 22 4.942 -5.862 1.428
203 HB2 ASN 22 HB2 ASN 22 6.982 -5.529 -0.112
204 HB3 ASN 22 HB3 ASN 22 7.599 -7.050 0.538
205 HD21 ASN 22 HD21 ASN 22 5.489 -5.624 -1.817
206 HD22 ASN 22 HD22 ASN 22 4.708 -7.145 -2.247
207 H ARG 23 H ARG 23 7.747 -7.390 3.072
208 HA ARG 23 HA ARG 23 6.525 -9.921 3.566
209 HB2 ARG 23 HB2 ARG 23 8.977 -9.222 3.767
210 HB3 ARG 23 HB3 ARG 23 8.578 -8.513 5.339
211 HG2 ARG 23 HG2 ARG 23 7.784 -10.745 6.132
212 HG3 ARG 23 HG3 ARG 23 8.091 -11.411 4.522
213 HD2 ARG 23 HD2 ARG 23 10.035 -12.046 5.465
214 HD3 ARG 23 HD3 ARG 23 10.550 -10.425 4.968
215 HE ARG 23 HE ARG 23 9.477 -10.121 7.535
216 HH11 ARG 23 HH22 ARG 23 12.088 -11.948 6.158
217 HH12 ARG 23 HH21 ARG 23 12.999 -12.049 7.644
218 HH21 ARG 23 HH12 ARG 23 10.641 -10.245 9.458
219 HH22 ARG 23 HH11 ARG 23 12.191 -11.037 9.474
220 H TYR 24 H TYR 24 6.558 -6.963 5.551
221 HA TYR 24 HA TYR 24 4.865 -7.994 7.642
222 HB2 TYR 24 HB2 TYR 24 6.344 -5.656 7.183
223 HB3 TYR 24 HB3 TYR 24 4.692 -5.095 7.166
224 HD1 TYR 24 HD2 TYR 24 7.173 -7.126 9.090
225 HD2 TYR 24 HD1 TYR 24 3.538 -4.818 9.258
226 HE1 TYR 24 HE2 TYR 24 7.258 -7.174 11.586
227 HE2 TYR 24 HE1 TYR 24 3.654 -4.813 11.747
228 HH TYR 24 HH TYR 24 5.237 -5.101 13.533
229 H TYR 25 H TYR 25 4.208 -6.753 4.483
230 HA TYR 25 HA TYR 25 1.408 -6.210 4.873
231 HB2 TYR 25 HB2 TYR 25 3.204 -5.525 2.939
232 HB3 TYR 25 HB3 TYR 25 2.473 -6.888 2.131
233 HD1 TYR 25 HD1 TYR 25 1.891 -3.582 3.690
234 HD2 TYR 25 HD2 TYR 25 0.269 -6.661 1.145
235 HE1 TYR 25 HE1 TYR 25 0.121 -2.010 2.936
236 HE2 TYR 25 HE2 TYR 25 -1.500 -5.068 0.362
237 HH TYR 25 HH TYR 25 -1.796 -1.775 1.662
238 H ALA 26 H ALA 26 3.171 -8.994 3.364
239 HA ALA 26 HA ALA 26 0.808 -10.459 2.741
240 HB1 ALA 26 HB1 ALA 26 2.232 -12.089 2.024
241 HB2 ALA 26 HB2 ALA 26 3.457 -10.821 2.215
242 HB3 ALA 26 HB3 ALA 26 3.239 -12.041 3.485
243 H SER 27 H SER 27 2.790 -10.464 5.692
244 HA SER 27 HA SER 27 1.200 -12.381 7.166
245 HB2 SER 27 HB2 SER 27 2.508 -11.397 9.126
246 HB3 SER 27 HB3 SER 27 3.459 -12.173 7.853
247 HG SER 27 HG SER 27 4.210 -10.224 7.186
248 H LEU 28 H LEU 28 0.529 -9.183 6.289
249 HA LEU 28 HA LEU 28 -1.506 -8.922 8.443
250 HB2 LEU 28 HB2 LEU 28 -0.112 -6.953 6.620
251 HB3 LEU 28 HB3 LEU 28 -1.687 -6.567 7.283
252 HG LEU 28 HG LEU 28 0.756 -7.290 8.956
253 HD11 LEU 28 HD11 LEU 28 -0.549 -4.622 8.299
254 HD12 LEU 28 HD12 LEU 28 0.638 -4.860 9.607
255 HD13 LEU 28 HD13 LEU 28 1.108 -5.158 7.931
256 HD21 LEU 28 HD21 LEU 28 -0.957 -7.850 10.396
257 HD22 LEU 28 HD22 LEU 28 -0.910 -6.116 10.720
258 HD23 LEU 28 HD23 LEU 28 -2.137 -6.771 9.622
259 H ARG 29 H ARG 29 -1.184 -8.983 4.880
260 HA ARG 29 HA ARG 29 -3.885 -8.585 4.216
261 HB2 ARG 29 HB2 ARG 29 -1.706 -8.778 2.720
262 HB3 ARG 29 HB3 ARG 29 -2.171 -10.483 2.613
263 HG2 ARG 29 HG2 ARG 29 -4.533 -9.567 1.934
264 HG3 ARG 29 HG3 ARG 29 -3.728 -8.004 1.781
265 HD2 ARG 29 HD2 ARG 29 -3.433 -8.675 -0.380
266 HD3 ARG 29 HD3 ARG 29 -2.017 -9.470 0.286
267 HE ARG 29 HE ARG 29 -3.017 -11.545 -0.078
268 HH11 ARG 29 HH22 ARG 29 -5.544 -9.134 -0.356
269 HH12 ARG 29 HH21 ARG 29 -6.671 -10.251 -1.101
270 HH21 ARG 29 HH12 ARG 29 -4.574 -12.963 -0.935
271 HH22 ARG 29 HH11 ARG 29 -6.107 -12.328 -1.476
272 H HIS 30 H HIS 30 -2.203 -11.607 5.029
273 HA HIS 30 HA HIS 30 -4.618 -13.230 4.760
274 HB2 HIS 30 HB2 HIS 30 -1.976 -13.815 4.825
275 HB3 HIS 30 HB3 HIS 30 -2.355 -14.122 6.513
276 HD1 HIS 30 HD1 HIS 30 -2.030 -15.989 3.518
277 HD2 HIS 30 HD2 HIS 30 -5.062 -15.715 6.435
278 HE1 HIS 30 HE1 HIS 30 -3.439 -18.125 3.343
279 H TYR 31 H TYR 31 -3.306 -11.173 7.250
280 HA TYR 31 HA TYR 31 -4.772 -12.316 9.486
281 HB2 TYR 31 HB2 TYR 31 -2.558 -10.825 9.349
282 HB3 TYR 31 HB3 TYR 31 -3.674 -9.479 9.364
283 HD1 TYR 31 HD2 TYR 31 -3.146 -12.693 11.244
284 HD2 TYR 31 HD1 TYR 31 -3.902 -8.449 11.414
285 HE1 TYR 31 HE2 TYR 31 -3.181 -12.799 13.726
286 HE2 TYR 31 HE1 TYR 31 -3.894 -8.554 13.907
287 HH TYR 31 HH TYR 31 -3.981 -11.578 15.627
288 H LEU 32 H LEU 32 -5.088 -9.181 7.787
289 HA LEU 32 HA LEU 32 -7.641 -8.485 8.726
290 HB2 LEU 32 HB2 LEU 32 -7.701 -6.865 6.910
291 HB3 LEU 32 HB3 LEU 32 -6.148 -6.912 7.722
292 HG LEU 32 HG LEU 32 -5.540 -8.591 5.738
293 HD11 LEU 32 HD11 LEU 32 -8.091 -7.913 4.834
294 HD12 LEU 32 HD12 LEU 32 -7.000 -6.933 3.852
295 HD13 LEU 32 HD13 LEU 32 -6.789 -8.691 3.929
296 HD21 LEU 32 HD21 LEU 32 -4.233 -6.673 6.101
297 HD22 LEU 32 HD22 LEU 32 -4.769 -6.519 4.422
298 HD23 LEU 32 HD23 LEU 32 -5.560 -5.571 5.700
299 H ASN 33 H ASN 33 -6.984 -11.035 6.530
300 HA ASN 33 HA ASN 33 -9.439 -11.341 5.151
301 HB2 ASN 33 HB2 ASN 33 -7.340 -12.771 4.983
302 HB3 ASN 33 HB3 ASN 33 -7.796 -13.505 6.522
303 HD21 ASN 33 HD21 ASN 33 -8.954 -15.405 6.365
304 HD22 ASN 33 HD22 ASN 33 -9.952 -15.777 4.966
305 H LEU 34 H LEU 34 -8.581 -12.463 8.507
306 HA LEU 34 HA LEU 34 -11.517 -12.564 9.091
307 HB2 LEU 34 HB2 LEU 34 -11.342 -14.623 9.851
308 HB3 LEU 34 HB3 LEU 34 -9.735 -14.672 9.178
309 HG LEU 34 HG LEU 34 -8.820 -13.906 11.362
310 HD11 LEU 34 HD11 LEU 34 -10.346 -13.000 12.828
311 HD12 LEU 34 HD12 LEU 34 -11.717 -13.855 12.092
312 HD13 LEU 34 HD13 LEU 34 -10.690 -14.651 13.292
313 HD21 LEU 34 HD21 LEU 34 -10.190 -16.417 12.152
314 HD22 LEU 34 HD22 LEU 34 -9.511 -16.463 10.530
315 HD23 LEU 34 HD23 LEU 34 -8.473 -16.057 11.906
316 H VAL 35 H VAL 35 -8.378 -11.505 10.200
317 HA VAL 35 HA VAL 35 -9.250 -10.293 12.673
318 HB VAL 35 HB VAL 35 -6.779 -9.656 11.124
319 HG11 VAL 35 HG11 VAL 35 -6.278 -9.683 13.947
320 HG12 VAL 35 HG12 VAL 35 -6.351 -8.300 12.843
321 HG13 VAL 35 HG13 VAL 35 -7.786 -8.835 13.729
322 HG21 VAL 35 HG21 VAL 35 -6.006 -11.564 13.067
323 HG22 VAL 35 HG22 VAL 35 -7.480 -12.231 12.410
324 HG23 VAL 35 HG23 VAL 35 -6.129 -11.823 11.349
325 H THR 36 H THR 36 -9.891 -9.479 9.581
326 HA THR 36 HA THR 36 -10.397 -6.694 9.488
327 HB THR 36 HB THR 36 -11.539 -9.155 8.384
328 HG1 THR 36 HG1 THR 36 -10.463 -7.960 7.088
329 HG21 THR 36 HG21 THR 36 -13.641 -8.229 7.537
330 HG22 THR 36 HG22 THR 36 -13.688 -8.531 9.285
331 HG23 THR 36 HG23 THR 36 -13.488 -6.881 8.652
332 H ARG 37 H ARG 37 -11.443 -8.892 11.877
333 HA ARG 37 HA ARG 37 -12.565 -8.558 13.855
334 HB2 ARG 37 HB2 ARG 37 -11.258 -6.157 13.350
335 HB3 ARG 37 HB3 ARG 37 -12.901 -5.601 13.510
336 HG2 ARG 37 HG2 ARG 37 -11.048 -6.802 15.532
337 HG3 ARG 37 HG3 ARG 37 -12.083 -5.382 15.642
338 HD2 ARG 37 HD2 ARG 37 -13.987 -7.348 15.496
339 HD3 ARG 37 HD3 ARG 37 -12.680 -8.265 16.226
340 HE ARG 37 HE ARG 37 -14.415 -6.365 17.434
341 HH11 ARG 37 HH22 ARG 37 -11.143 -7.535 17.730
342 HH12 ARG 37 HH21 ARG 37 -11.061 -7.171 19.434
343 HH21 ARG 37 HH12 ARG 37 -14.190 -5.662 19.490
344 HH22 ARG 37 HH11 ARG 37 -12.702 -5.922 20.365
345 H GLN 38 H GLN 38 -13.964 -9.126 11.478
346 HA GLN 38 HA GLN 38 -15.986 -9.234 10.447
347 HB2 GLN 38 HB2 GLN 38 -16.857 -8.696 13.300
348 HB3 GLN 38 HB3 GLN 38 -18.045 -8.862 12.017
349 HG2 GLN 38 HG2 GLN 38 -17.074 -11.081 11.422
350 HG3 GLN 38 HG3 GLN 38 -15.986 -10.951 12.815
351 HE21 GLN 38 HE21 GLN 38 -17.787 -13.140 12.641
352 HE22 GLN 38 HE22 GLN 38 -19.019 -12.845 13.875
353 H ARG 39 H ARG 39 -14.575 -6.437 10.705
354 HA ARG 39 HA ARG 39 -16.599 -5.008 9.183
355 HB2 ARG 39 HB2 ARG 39 -17.169 -4.809 11.782
356 HB3 ARG 39 HB3 ARG 39 -15.842 -3.689 11.821
357 HG2 ARG 39 HG2 ARG 39 -17.621 -2.266 11.361
358 HG3 ARG 39 HG3 ARG 39 -17.060 -2.573 9.719
359 HD2 ARG 39 HD2 ARG 39 -18.947 -4.665 10.542
360 HD3 ARG 39 HD3 ARG 39 -19.625 -3.075 10.892
361 HE ARG 39 HE ARG 39 -18.536 -3.301 8.189
362 HH11 ARG 39 HH22 ARG 39 -21.408 -3.963 10.118
363 HH12 ARG 39 HH21 ARG 39 -22.471 -3.807 8.728
364 HH21 ARG 39 HH12 ARG 39 -20.004 -3.177 6.447
365 HH22 ARG 39 HH11 ARG 39 -21.720 -3.346 6.762
366 H TYR 40 H TYR 40 -14.537 -5.328 7.895
367 HA TYR 40 HA TYR 40 -12.715 -4.581 6.798
368 HB2 TYR 40 HB2 TYR 40 -14.119 -2.671 6.393
369 HB3 TYR 40 HB3 TYR 40 -13.680 -1.938 7.924
370 HD1 TYR 40 HD2 TYR 40 -12.113 -3.122 4.719
371 HD2 TYR 40 HD1 TYR 40 -11.965 -0.363 8.029
372 HE1 TYR 40 HE2 TYR 40 -10.308 -1.868 3.580
373 HE2 TYR 40 HE1 TYR 40 -10.149 0.911 6.882
374 HH TYR 40 HH TYR 40 -9.110 0.099 3.595
375 HN1 NH2 41 HN1 NH2 41 -12.565 -3.417 10.189
376 HN2 NH2 41 HN2 NH2 41 -10.838 -3.848 10.297
Start of MODEL 6
1 HA TYR 1 HA TYR 1 1.847 13.354 -15.368
2 HB2 TYR 1 HB2 TYR 1 3.944 14.230 -16.169
3 HB3 TYR 1 HB3 TYR 1 2.592 14.935 -17.034
4 HD1 TYR 1 HD2 TYR 1 1.790 17.342 -16.293
5 HD2 TYR 1 HD1 TYR 1 5.630 15.629 -15.300
6 HE1 TYR 1 HE2 TYR 1 2.644 19.588 -15.671
7 HE2 TYR 1 HE1 TYR 1 6.477 17.897 -14.722
8 HH TYR 1 HH TYR 1 5.913 20.286 -15.311
9 H LEU 2 H LEU 2 3.187 16.106 -13.416
10 HA LEU 2 HA LEU 2 4.449 16.170 -11.594
11 HB2 LEU 2 HB2 LEU 2 2.079 14.522 -10.820
12 HB3 LEU 2 HB3 LEU 2 3.419 14.490 -9.711
13 HG LEU 2 HG LEU 2 3.357 17.156 -10.019
14 HD11 LEU 2 HD11 LEU 2 1.078 17.981 -10.136
15 HD12 LEU 2 HD12 LEU 2 1.468 17.118 -11.628
16 HD13 LEU 2 HD13 LEU 2 0.449 16.340 -10.385
17 HD21 LEU 2 HD21 LEU 2 1.961 15.281 -8.137
18 HD22 LEU 2 HD22 LEU 2 3.254 16.459 -7.853
19 HD23 LEU 2 HD23 LEU 2 1.584 17.008 -8.023
20 H GLU 3 H GLU 3 5.778 14.774 -13.440
21 HA GLU 3 HA GLU 3 6.740 12.202 -12.649
22 HB2 GLU 3 HB2 GLU 3 7.425 14.326 -14.645
23 HB3 GLU 3 HB3 GLU 3 8.734 13.250 -14.225
24 HG2 GLU 3 HG2 GLU 3 6.124 11.883 -14.787
25 HG3 GLU 3 HG3 GLU 3 6.850 12.734 -16.147
26 H ARG 4 H ARG 4 8.294 15.409 -12.274
27 HA ARG 4 HA ARG 4 10.633 14.573 -10.944
28 HB2 ARG 4 HB2 ARG 4 9.972 16.963 -11.787
29 HB3 ARG 4 HB3 ARG 4 9.131 17.141 -10.249
30 HG2 ARG 4 HG2 ARG 4 11.186 18.009 -9.629
31 HG3 ARG 4 HG3 ARG 4 11.491 16.311 -9.252
32 HD2 ARG 4 HD2 ARG 4 12.237 16.229 -11.819
33 HD3 ARG 4 HD3 ARG 4 12.445 17.977 -11.582
34 HE ARG 4 HE ARG 4 13.744 16.771 -9.436
35 HH11 ARG 4 HH22 ARG 4 14.124 16.723 -12.902
36 HH12 ARG 4 HH21 ARG 4 15.759 16.111 -12.850
37 HH21 ARG 4 HH12 ARG 4 15.854 15.992 -9.399
38 HH22 ARG 4 HH11 ARG 4 16.756 15.833 -10.886
39 H GLU 5 H GLU 5 7.566 15.613 -9.482
40 HA GLU 5 HA GLU 5 8.232 15.059 -6.807
41 HB2 GLU 5 HB2 GLU 5 5.928 16.009 -8.218
42 HB3 GLU 5 HB3 GLU 5 5.403 14.598 -7.309
43 HG2 GLU 5 HG2 GLU 5 5.098 16.321 -5.786
44 HG3 GLU 5 HG3 GLU 5 6.636 15.632 -5.274
45 H LEU 6 H LEU 6 6.532 12.931 -9.212
46 HA LEU 6 HA LEU 6 6.203 10.672 -7.607
47 HB2 LEU 6 HB2 LEU 6 6.296 11.280 -10.480
48 HB3 LEU 6 HB3 LEU 6 7.011 9.727 -10.171
49 HG LEU 6 HG LEU 6 4.249 10.516 -9.158
50 HD11 LEU 6 HD11 LEU 6 3.810 8.653 -11.113
51 HD12 LEU 6 HD12 LEU 6 3.739 10.404 -11.365
52 HD13 LEU 6 HD13 LEU 6 5.206 9.503 -11.802
53 HD21 LEU 6 HD21 LEU 6 5.186 8.737 -7.816
54 HD22 LEU 6 HD22 LEU 6 4.038 8.001 -8.930
55 HD23 LEU 6 HD23 LEU 6 5.786 7.883 -9.251
56 H LYS 7 H LYS 7 9.098 11.619 -9.446
57 HA LYS 7 HA LYS 7 10.713 9.398 -8.649
58 HB2 LYS 7 HB2 LYS 7 10.997 11.521 -10.366
59 HB3 LYS 7 HB3 LYS 7 12.063 12.054 -9.079
60 HG2 LYS 7 HG2 LYS 7 12.203 9.294 -10.403
61 HG3 LYS 7 HG3 LYS 7 13.064 10.717 -10.987
62 HD2 LYS 7 HD2 LYS 7 14.044 10.879 -8.576
63 HD3 LYS 7 HD3 LYS 7 13.522 9.194 -8.394
64 HE2 LYS 7 HE2 LYS 7 15.081 10.123 -10.827
65 HE3 LYS 7 HE3 LYS 7 15.951 9.795 -9.327
66 HZ1 LYS 7 HZ1 LYS 7 15.564 7.577 -9.526
67 HZ2 LYS 7 HZ2 LYS 7 14.092 7.741 -10.225
68 HZ3 LYS 7 HZ3 LYS 7 15.438 7.930 -11.137
69 H LYS 8 H LYS 8 10.320 12.589 -7.123
70 HA LYS 8 HA LYS 8 11.913 11.952 -4.758
71 HB2 LYS 8 HB2 LYS 8 10.139 14.206 -5.644
72 HB3 LYS 8 HB3 LYS 8 10.393 14.018 -3.907
73 HG2 LYS 8 HG2 LYS 8 12.790 14.166 -4.132
74 HG3 LYS 8 HG3 LYS 8 12.693 14.098 -5.899
75 HD2 LYS 8 HD2 LYS 8 11.526 16.277 -5.933
76 HD3 LYS 8 HD3 LYS 8 11.613 16.377 -4.169
77 HE2 LYS 8 HE2 LYS 8 14.227 15.776 -5.415
78 HE3 LYS 8 HE3 LYS 8 13.536 17.267 -6.055
79 HZ1 LYS 8 HZ1 LYS 8 13.921 18.316 -4.146
80 HZ2 LYS 8 HZ2 LYS 8 13.397 17.091 -3.189
81 HZ3 LYS 8 HZ3 LYS 8 14.946 17.093 -3.763
82 H LEU 9 H LEU 9 8.826 10.936 -5.664
83 HA LEU 9 HA LEU 9 7.937 10.301 -2.953
84 HB2 LEU 9 HB2 LEU 9 6.618 10.852 -5.323
85 HB3 LEU 9 HB3 LEU 9 6.583 9.112 -5.338
86 HG LEU 9 HG LEU 9 5.769 9.540 -2.760
87 HD11 LEU 9 HD11 LEU 9 4.267 11.512 -2.729
88 HD12 LEU 9 HD12 LEU 9 5.956 11.994 -2.964
89 HD13 LEU 9 HD13 LEU 9 4.841 11.983 -4.344
90 HD21 LEU 9 HD21 LEU 9 4.164 9.510 -5.334
91 HD22 LEU 9 HD22 LEU 9 4.474 8.191 -4.182
92 HD23 LEU 9 HD23 LEU 9 3.390 9.516 -3.733
93 H GLU 10 H GLU 10 8.813 8.394 -5.910
94 HA GLU 10 HA GLU 10 8.751 5.822 -4.728
95 HB2 GLU 10 HB2 GLU 10 9.119 6.357 -7.205
96 HB3 GLU 10 HB3 GLU 10 10.800 6.708 -6.792
97 HG2 GLU 10 HG2 GLU 10 10.447 4.193 -5.634
98 HG3 GLU 10 HG3 GLU 10 9.376 4.091 -7.006
99 H ARG 11 H ARG 11 11.326 8.271 -4.721
100 HA ARG 11 HA ARG 11 13.339 6.769 -3.342
101 HB2 ARG 11 HB2 ARG 11 12.686 9.736 -3.352
102 HB3 ARG 11 HB3 ARG 11 14.134 9.058 -2.586
103 HG2 ARG 11 HG2 ARG 11 15.104 8.390 -4.631
104 HG3 ARG 11 HG3 ARG 11 13.576 8.432 -5.494
105 HD2 ARG 11 HD2 ARG 11 14.104 10.452 -6.247
106 HD3 ARG 11 HD3 ARG 11 13.828 11.084 -4.640
107 HE ARG 11 HE ARG 11 16.361 10.748 -6.006
108 HH11 ARG 11 HH22 ARG 11 15.018 10.926 -2.780
109 HH12 ARG 11 HH21 ARG 11 16.549 11.339 -2.048
110 HH21 ARG 11 HH12 ARG 11 18.262 11.453 -5.054
111 HH22 ARG 11 HH11 ARG 11 18.317 11.701 -3.336
112 H GLU 12 H GLU 12 10.669 8.758 -1.966
113 HA GLU 12 HA GLU 12 11.461 8.280 0.773
114 HB2 GLU 12 HB2 GLU 12 9.758 10.034 -0.492
115 HB3 GLU 12 HB3 GLU 12 8.603 8.935 0.237
116 HG2 GLU 12 HG2 GLU 12 10.868 9.996 1.955
117 HG3 GLU 12 HG3 GLU 12 9.631 11.122 1.450
118 H LEU 13 H LEU 13 9.126 6.710 -1.436
119 HA LEU 13 HA LEU 13 8.242 4.767 0.495
120 HB2 LEU 13 HB2 LEU 13 8.105 5.137 -2.482
121 HB3 LEU 13 HB3 LEU 13 7.881 3.491 -1.910
122 HG LEU 13 HG LEU 13 6.253 5.865 -0.903
123 HD11 LEU 13 HD11 LEU 13 6.055 4.366 -3.390
124 HD12 LEU 13 HD12 LEU 13 4.623 4.073 -2.396
125 HD13 LEU 13 HD13 LEU 13 5.091 5.734 -2.801
126 HD21 LEU 13 HD21 LEU 13 6.191 4.180 0.774
127 HD22 LEU 13 HD22 LEU 13 4.718 3.935 -0.145
128 HD23 LEU 13 HD23 LEU 13 6.119 2.863 -0.417
129 H LYS 14 H LYS 14 10.728 4.379 -2.070
130 HA LYS 14 HA LYS 14 11.684 1.821 -1.139
131 HB2 LYS 14 HB2 LYS 14 12.105 2.472 -3.389
132 HB3 LYS 14 HB3 LYS 14 12.848 4.005 -2.914
133 HG2 LYS 14 HG2 LYS 14 14.821 2.918 -2.068
134 HG3 LYS 14 HG3 LYS 14 14.060 1.320 -2.192
135 HD2 LYS 14 HD2 LYS 14 15.495 1.389 -4.020
136 HD3 LYS 14 HD3 LYS 14 13.911 1.763 -4.718
137 HE2 LYS 14 HE2 LYS 14 14.667 4.280 -4.262
138 HE3 LYS 14 HE3 LYS 14 16.285 3.567 -4.196
139 HZ1 LYS 14 HZ1 LYS 14 15.855 4.196 -6.437
140 HZ2 LYS 14 HZ2 LYS 14 15.737 2.571 -6.418
141 HZ3 LYS 14 HZ3 LYS 14 14.347 3.488 -6.467
142 H LYS 15 H LYS 15 12.190 4.996 0.143
143 HA LYS 15 HA LYS 15 14.666 4.848 1.363
144 HB2 LYS 15 HB2 LYS 15 12.784 6.668 1.423
145 HB3 LYS 15 HB3 LYS 15 12.259 5.875 2.905
146 HG2 LYS 15 HG2 LYS 15 14.397 6.347 3.956
147 HG3 LYS 15 HG3 LYS 15 15.082 6.899 2.406
148 HD2 LYS 15 HD2 LYS 15 13.340 8.715 2.327
149 HD3 LYS 15 HD3 LYS 15 12.792 8.215 3.942
150 HE2 LYS 15 HE2 LYS 15 15.098 8.628 4.808
151 HE3 LYS 15 HE3 LYS 15 15.600 9.151 3.195
152 HZ1 LYS 15 HZ1 LYS 15 14.052 10.966 3.331
153 HZ2 LYS 15 HZ2 LYS 15 13.438 10.458 4.779
154 HZ3 LYS 15 HZ3 LYS 15 14.979 11.015 4.691
155 H LEU 16 H LEU 16 11.710 3.219 2.365
156 HA LEU 16 HA LEU 16 13.242 1.786 4.480
157 HB2 LEU 16 HB2 LEU 16 11.377 1.525 5.683
158 HB3 LEU 16 HB3 LEU 16 10.928 2.988 4.856
159 HG LEU 16 HG LEU 16 9.949 1.028 3.113
160 HD11 LEU 16 HD11 LEU 16 8.883 -0.668 4.421
161 HD12 LEU 16 HD12 LEU 16 10.573 -0.685 4.891
162 HD13 LEU 16 HD13 LEU 16 9.381 0.091 5.953
163 HD21 LEU 16 HD21 LEU 16 8.723 2.979 3.660
164 HD22 LEU 16 HD22 LEU 16 7.734 1.591 4.119
165 HD23 LEU 16 HD23 LEU 16 8.587 2.509 5.374
166 H SER 17 H SER 17 13.406 -0.439 4.411
167 HA SER 17 HA SER 17 14.002 -1.624 2.019
168 HB2 SER 17 HB2 SER 17 13.347 -2.711 4.716
169 HB3 SER 17 HB3 SER 17 13.560 -3.843 3.357
170 HG SER 17 HG SER 17 15.429 -2.490 4.715
171 HA PRO 18 HA PRO 18 9.865 -2.094 0.326
172 HB2 PRO 18 HB2 PRO 18 10.569 -3.136 -2.151
173 HB3 PRO 18 HB3 PRO 18 10.605 -1.407 -1.710
174 HG2 PRO 18 HG2 PRO 18 12.890 -3.328 -1.949
175 HG3 PRO 18 HG3 PRO 18 12.851 -1.566 -2.251
176 HD2 PRO 18 HD2 PRO 18 13.833 -2.828 0.055
177 HD3 PRO 18 HD3 PRO 18 13.390 -1.101 -0.068
178 H GLU 19 H GLU 19 12.169 -4.638 0.814
179 HA GLU 19 HA GLU 19 10.190 -6.787 0.465
180 HB2 GLU 19 HB2 GLU 19 12.919 -6.688 0.108
181 HB3 GLU 19 HB3 GLU 19 12.832 -7.375 1.733
182 HG2 GLU 19 HG2 GLU 19 11.256 -9.122 0.869
183 HG3 GLU 19 HG3 GLU 19 11.334 -8.387 -0.733
184 H GLU 20 H GLU 20 11.233 -4.684 3.028
185 HA GLU 20 HA GLU 20 10.571 -6.523 5.215
186 HB2 GLU 20 HB2 GLU 20 12.288 -4.563 5.194
187 HB3 GLU 20 HB3 GLU 20 10.884 -3.517 5.466
188 HG2 GLU 20 HG2 GLU 20 10.386 -4.853 7.539
189 HG3 GLU 20 HG3 GLU 20 11.797 -5.863 7.189
190 H LEU 21 H LEU 21 9.100 -3.636 3.614
191 HA LEU 21 HA LEU 21 6.779 -3.526 5.187
192 HB2 LEU 21 HB2 LEU 21 7.786 -2.226 2.860
193 HB3 LEU 21 HB3 LEU 21 6.221 -2.852 2.390
194 HG LEU 21 HG LEU 21 6.772 -1.101 4.817
195 HD11 LEU 21 HD11 LEU 21 5.398 -0.477 2.162
196 HD12 LEU 21 HD12 LEU 21 5.637 0.656 3.509
197 HD13 LEU 21 HD13 LEU 21 7.035 0.029 2.609
198 HD21 LEU 21 HD21 LEU 21 4.404 -0.852 5.116
199 HD22 LEU 21 HD22 LEU 21 4.046 -1.848 3.689
200 HD23 LEU 21 HD23 LEU 21 4.754 -2.579 5.144
201 H ASN 22 H ASN 22 7.302 -5.367 2.152
202 HA ASN 22 HA ASN 22 4.740 -6.540 1.908
203 HB2 ASN 22 HB2 ASN 22 6.613 -6.639 0.229
204 HB3 ASN 22 HB3 ASN 22 7.448 -7.791 1.271
205 HD21 ASN 22 HD21 ASN 22 4.666 -7.380 -0.937
206 HD22 ASN 22 HD22 ASN 22 4.337 -9.123 -0.940
207 H ARG 23 H ARG 23 7.579 -7.693 3.746
208 HA ARG 23 HA ARG 23 6.342 -10.038 4.830
209 HB2 ARG 23 HB2 ARG 23 8.813 -9.372 4.701
210 HB3 ARG 23 HB3 ARG 23 8.547 -8.373 6.124
211 HG2 ARG 23 HG2 ARG 23 8.627 -10.120 7.515
212 HG3 ARG 23 HG3 ARG 23 7.469 -11.064 6.573
213 HD2 ARG 23 HD2 ARG 23 9.110 -12.113 5.294
214 HD3 ARG 23 HD3 ARG 23 10.255 -10.785 5.468
215 HE ARG 23 HE ARG 23 11.100 -11.670 7.374
216 HH11 ARG 23 HH22 ARG 23 8.092 -13.340 6.818
217 HH12 ARG 23 HH21 ARG 23 8.316 -14.444 8.154
218 HH21 ARG 23 HH12 ARG 23 11.354 -13.029 9.102
219 HH22 ARG 23 HH11 ARG 23 10.179 -14.230 9.481
220 H TYR 24 H TYR 24 6.614 -6.729 6.096
221 HA TYR 24 HA TYR 24 5.087 -7.115 8.488
222 HB2 TYR 24 HB2 TYR 24 6.544 -5.037 7.282
223 HB3 TYR 24 HB3 TYR 24 4.908 -4.441 7.216
224 HD1 TYR 24 HD1 TYR 24 7.460 -5.963 9.502
225 HD2 TYR 24 HD2 TYR 24 4.018 -3.390 9.170
226 HE1 TYR 24 HE1 TYR 24 7.709 -5.319 11.905
227 HE2 TYR 24 HE2 TYR 24 4.273 -2.737 11.552
228 HH TYR 24 HH TYR 24 5.425 -3.099 13.516
229 H TYR 25 H TYR 25 4.117 -6.744 5.199
230 HA TYR 25 HA TYR 25 1.398 -5.956 5.589
231 HB2 TYR 25 HB2 TYR 25 3.105 -6.234 3.418
232 HB3 TYR 25 HB3 TYR 25 2.012 -7.566 3.159
233 HD1 TYR 25 HD1 TYR 25 -0.485 -7.073 2.925
234 HD2 TYR 25 HD2 TYR 25 2.529 -3.998 3.098
235 HE1 TYR 25 HE1 TYR 25 -2.064 -5.470 1.846
236 HE2 TYR 25 HE2 TYR 25 0.949 -2.389 2.022
237 HH TYR 25 HH TYR 25 -2.017 -3.376 0.559
238 H ALA 26 H ALA 26 2.899 -9.200 5.035
239 HA ALA 26 HA ALA 26 0.445 -10.643 4.995
240 HB1 ALA 26 HB1 ALA 26 2.630 -11.587 4.289
241 HB2 ALA 26 HB2 ALA 26 3.204 -11.548 5.972
242 HB3 ALA 26 HB3 ALA 26 1.859 -12.618 5.515
243 H SER 27 H SER 27 2.588 -9.885 7.781
244 HA SER 27 HA SER 27 0.940 -11.016 9.814
245 HB2 SER 27 HB2 SER 27 3.100 -8.907 9.756
246 HB3 SER 27 HB3 SER 27 2.140 -9.138 11.226
247 HG SER 27 HG SER 27 3.672 -10.559 11.520
248 H LEU 28 H LEU 28 0.361 -8.211 7.917
249 HA LEU 28 HA LEU 28 -1.601 -7.068 9.812
250 HB2 LEU 28 HB2 LEU 28 -0.639 -5.239 8.995
251 HB3 LEU 28 HB3 LEU 28 0.139 -6.072 7.682
252 HG LEU 28 HG LEU 28 -1.807 -5.873 6.278
253 HD11 LEU 28 HD11 LEU 28 -3.204 -5.182 8.748
254 HD12 LEU 28 HD12 LEU 28 -3.448 -3.916 7.537
255 HD13 LEU 28 HD13 LEU 28 -3.811 -5.595 7.135
256 HD21 LEU 28 HD21 LEU 28 -0.682 -3.355 7.496
257 HD22 LEU 28 HD22 LEU 28 -0.302 -4.141 5.942
258 HD23 LEU 28 HD23 LEU 28 -1.838 -3.298 6.146
259 H ARG 29 H ARG 29 -1.456 -8.254 6.461
260 HA ARG 29 HA ARG 29 -4.177 -8.164 5.819
261 HB2 ARG 29 HB2 ARG 29 -2.026 -8.862 4.392
262 HB3 ARG 29 HB3 ARG 29 -2.469 -10.494 4.883
263 HG2 ARG 29 HG2 ARG 29 -4.799 -10.080 3.980
264 HG3 ARG 29 HG3 ARG 29 -4.248 -8.495 3.402
265 HD2 ARG 29 HD2 ARG 29 -2.602 -9.542 1.949
266 HD3 ARG 29 HD3 ARG 29 -2.988 -11.150 2.595
267 HE ARG 29 HE ARG 29 -5.414 -10.387 1.702
268 HH11 ARG 29 HH22 ARG 29 -2.329 -10.467 0.086
269 HH12 ARG 29 HH21 ARG 29 -3.013 -10.688 -1.499
270 HH21 ARG 29 HH12 ARG 29 -6.289 -10.708 -0.331
271 HH22 ARG 29 HH11 ARG 29 -5.242 -10.753 -1.721
272 H HIS 30 H HIS 30 -2.402 -10.705 7.510
273 HA HIS 30 HA HIS 30 -4.559 -12.533 7.892
274 HB2 HIS 30 HB2 HIS 30 -1.986 -12.797 8.272
275 HB3 HIS 30 HB3 HIS 30 -2.305 -12.144 9.882
276 HD1 HIS 30 HD1 HIS 30 -3.106 -15.118 7.625
277 HD2 HIS 30 HD2 HIS 30 -3.727 -13.786 11.572
278 HE1 HIS 30 HE1 HIS 30 -4.055 -17.118 8.949
279 H TYR 31 H TYR 31 -3.405 -9.812 9.971
280 HA TYR 31 HA TYR 31 -5.230 -10.050 12.104
281 HB2 TYR 31 HB2 TYR 31 -3.428 -8.023 11.039
282 HB3 TYR 31 HB3 TYR 31 -4.944 -7.277 11.473
283 HD1 TYR 31 HD2 TYR 31 -5.882 -7.950 13.890
284 HD2 TYR 31 HD1 TYR 31 -1.773 -8.246 12.616
285 HE1 TYR 31 HE2 TYR 31 -5.135 -7.884 16.264
286 HE2 TYR 31 HE1 TYR 31 -1.023 -8.175 14.980
287 HH TYR 31 HH TYR 31 -3.289 -8.346 17.665
288 H LEU 32 H LEU 32 -5.630 -8.118 9.080
289 HA LEU 32 HA LEU 32 -8.264 -7.292 9.612
290 HB2 LEU 32 HB2 LEU 32 -7.152 -7.868 6.859
291 HB3 LEU 32 HB3 LEU 32 -8.518 -6.818 7.249
292 HG LEU 32 HG LEU 32 -5.623 -6.386 7.997
293 HD11 LEU 32 HD11 LEU 32 -5.711 -4.513 6.424
294 HD12 LEU 32 HD12 LEU 32 -6.195 -6.007 5.612
295 HD13 LEU 32 HD13 LEU 32 -7.427 -4.822 6.109
296 HD21 LEU 32 HD21 LEU 32 -8.056 -5.068 9.065
297 HD22 LEU 32 HD22 LEU 32 -6.403 -5.146 9.711
298 HD23 LEU 32 HD23 LEU 32 -6.813 -3.954 8.476
299 H ASN 33 H ASN 33 -7.239 -10.340 8.216
300 HA ASN 33 HA ASN 33 -9.760 -11.431 7.423
301 HB2 ASN 33 HB2 ASN 33 -7.234 -12.242 7.160
302 HB3 ASN 33 HB3 ASN 33 -7.573 -13.126 8.645
303 HD21 ASN 33 HD21 ASN 33 -6.901 -14.322 6.144
304 HD22 ASN 33 HD22 ASN 33 -8.340 -15.240 5.673
305 H LEU 34 H LEU 34 -8.309 -11.040 10.590
306 HA LEU 34 HA LEU 34 -10.564 -12.475 11.913
307 HB2 LEU 34 HB2 LEU 34 -7.793 -11.809 12.977
308 HB3 LEU 34 HB3 LEU 34 -9.029 -12.754 13.800
309 HG LEU 34 HG LEU 34 -7.649 -13.623 11.211
310 HD11 LEU 34 HD11 LEU 34 -7.076 -14.241 14.120
311 HD12 LEU 34 HD12 LEU 34 -6.521 -15.269 12.778
312 HD13 LEU 34 HD13 LEU 34 -5.992 -13.590 12.867
313 HD21 LEU 34 HD21 LEU 34 -9.817 -14.833 12.919
314 HD22 LEU 34 HD22 LEU 34 -9.586 -14.857 11.155
315 HD23 LEU 34 HD23 LEU 34 -8.612 -15.907 12.188
316 H VAL 35 H VAL 35 -10.351 -9.617 10.847
317 HA VAL 35 HA VAL 35 -11.183 -8.178 13.352
318 HB VAL 35 HB VAL 35 -9.842 -7.043 10.938
319 HG11 VAL 35 HG11 VAL 35 -10.379 -4.952 11.494
320 HG12 VAL 35 HG12 VAL 35 -11.595 -5.621 12.596
321 HG13 VAL 35 HG13 VAL 35 -10.021 -5.174 13.206
322 HG21 VAL 35 HG21 VAL 35 -7.853 -6.949 12.003
323 HG22 VAL 35 HG22 VAL 35 -8.548 -6.636 13.604
324 HG23 VAL 35 HG23 VAL 35 -8.515 -8.264 12.993
325 H THR 36 H THR 36 -11.645 -6.625 10.337
326 HA THR 36 HA THR 36 -14.415 -6.311 10.737
327 HB THR 36 HB THR 36 -14.384 -5.676 8.235
328 HG1 THR 36 HG1 THR 36 -12.182 -5.193 7.587
329 HG21 THR 36 HG21 THR 36 -12.371 -4.020 9.754
330 HG22 THR 36 HG22 THR 36 -13.753 -3.515 8.751
331 HG23 THR 36 HG23 THR 36 -14.025 -4.142 10.381
332 H ARG 37 H ARG 37 -12.700 -8.676 8.898
333 HA ARG 37 HA ARG 37 -14.985 -9.867 7.615
334 HB2 ARG 37 HB2 ARG 37 -12.393 -10.082 7.143
335 HB3 ARG 37 HB3 ARG 37 -12.469 -11.408 8.288
336 HG2 ARG 37 HG2 ARG 37 -14.514 -11.374 6.087
337 HG3 ARG 37 HG3 ARG 37 -12.849 -11.654 5.600
338 HD2 ARG 37 HD2 ARG 37 -12.712 -13.725 6.584
339 HD3 ARG 37 HD3 ARG 37 -13.784 -13.303 7.908
340 HE ARG 37 HE ARG 37 -15.638 -13.878 6.717
341 HH11 ARG 37 HH22 ARG 37 -12.954 -13.956 4.501
342 HH12 ARG 37 HH21 ARG 37 -13.849 -14.731 3.210
343 HH21 ARG 37 HH12 ARG 37 -16.806 -14.805 5.033
344 HH22 ARG 37 HH11 ARG 37 -16.034 -15.215 3.534
345 H GLN 38 H GLN 38 -14.116 -9.884 10.833
346 HA GLN 38 HA GLN 38 -16.129 -11.967 11.458
347 HB2 GLN 38 HB2 GLN 38 -13.483 -12.525 11.675
348 HB3 GLN 38 HB3 GLN 38 -13.680 -11.674 13.200
349 HG2 GLN 38 HG2 GLN 38 -13.984 -13.962 13.695
350 HG3 GLN 38 HG3 GLN 38 -15.621 -13.306 13.691
351 HE21 GLN 38 HE21 GLN 38 -14.057 -16.092 12.839
352 HE22 GLN 38 HE22 GLN 38 -15.130 -16.422 11.465
353 H ARG 39 H ARG 39 -15.671 -8.860 11.618
354 HA ARG 39 HA ARG 39 -17.431 -8.141 13.778
355 HB2 ARG 39 HB2 ARG 39 -14.495 -8.298 14.391
356 HB3 ARG 39 HB3 ARG 39 -15.264 -6.805 14.866
357 HG2 ARG 39 HG2 ARG 39 -16.993 -8.975 15.697
358 HG3 ARG 39 HG3 ARG 39 -15.341 -9.306 16.228
359 HD2 ARG 39 HD2 ARG 39 -15.208 -7.134 17.323
360 HD3 ARG 39 HD3 ARG 39 -16.790 -6.660 16.662
361 HE ARG 39 HE ARG 39 -17.268 -9.011 18.062
362 HH11 ARG 39 HH22 ARG 39 -16.150 -5.821 18.902
363 HH12 ARG 39 HH21 ARG 39 -16.776 -5.873 20.523
364 HH21 ARG 39 HH12 ARG 39 -18.060 -9.097 20.150
365 HH22 ARG 39 HH11 ARG 39 -17.831 -7.758 21.232
366 H TYR 40 H TYR 40 -18.089 -7.371 11.621
367 HA TYR 40 HA TYR 40 -16.790 -5.012 10.552
368 HB2 TYR 40 HB2 TYR 40 -18.118 -6.667 9.215
369 HB3 TYR 40 HB3 TYR 40 -19.572 -6.124 10.043
370 HD1 TYR 40 HD2 TYR 40 -16.615 -4.462 8.348
371 HD2 TYR 40 HD1 TYR 40 -20.903 -4.759 8.687
372 HE1 TYR 40 HE2 TYR 40 -16.865 -2.634 6.692
373 HE2 TYR 40 HE1 TYR 40 -21.156 -2.952 6.985
374 HH TYR 40 HH TYR 40 -18.463 -0.996 5.991
375 HN1 NH2 41 HN1 NH2 41 -16.857 -3.007 11.572
376 HN2 NH2 41 HN2 NH2 41 -18.249 -2.491 12.515
Start of MODEL 7
1 HA TYR 1 HA TYR 1 5.001 14.011 -15.904
2 HB2 TYR 1 HB2 TYR 1 3.417 15.575 -17.223
3 HB3 TYR 1 HB3 TYR 1 2.270 15.338 -15.909
4 HD1 TYR 1 HD1 TYR 1 5.914 16.196 -16.484
5 HD2 TYR 1 HD2 TYR 1 2.355 16.939 -14.130
6 HE1 TYR 1 HE1 TYR 1 7.114 17.946 -15.189
7 HE2 TYR 1 HE2 TYR 1 3.574 18.664 -12.845
8 HH TYR 1 HH TYR 1 5.697 19.515 -12.359
9 H LEU 2 H LEU 2 4.175 14.919 -13.527
10 HA LEU 2 HA LEU 2 3.388 14.539 -11.454
11 HB2 LEU 2 HB2 LEU 2 1.281 13.872 -13.007
12 HB3 LEU 2 HB3 LEU 2 1.530 12.313 -12.241
13 HG LEU 2 HG LEU 2 1.183 14.944 -10.741
14 HD11 LEU 2 HD11 LEU 2 -1.125 14.423 -10.488
15 HD12 LEU 2 HD12 LEU 2 -0.769 14.289 -12.210
16 HD13 LEU 2 HD13 LEU 2 -0.932 12.815 -11.229
17 HD21 LEU 2 HD21 LEU 2 1.899 13.667 -8.999
18 HD22 LEU 2 HD22 LEU 2 0.294 12.925 -9.069
19 HD23 LEU 2 HD23 LEU 2 1.664 12.137 -9.864
20 H GLU 3 H GLU 3 3.759 11.407 -13.169
21 HA GLU 3 HA GLU 3 4.663 9.677 -11.249
22 HB2 GLU 3 HB2 GLU 3 6.245 8.915 -13.097
23 HB3 GLU 3 HB3 GLU 3 4.524 8.804 -13.385
24 HG2 GLU 3 HG2 GLU 3 4.613 10.198 -15.172
25 HG3 GLU 3 HG3 GLU 3 5.623 11.377 -14.344
26 H ARG 4 H ARG 4 6.930 11.883 -13.022
27 HA ARG 4 HA ARG 4 9.185 11.416 -11.488
28 HB2 ARG 4 HB2 ARG 4 9.114 12.816 -13.500
29 HB3 ARG 4 HB3 ARG 4 8.347 14.128 -12.584
30 HG2 ARG 4 HG2 ARG 4 10.286 14.506 -11.251
31 HG3 ARG 4 HG3 ARG 4 10.966 12.923 -11.627
32 HD2 ARG 4 HD2 ARG 4 12.192 13.817 -13.233
33 HD3 ARG 4 HD3 ARG 4 10.717 14.169 -14.136
34 HE ARG 4 HE ARG 4 11.494 16.151 -12.090
35 HH11 ARG 4 HH22 ARG 4 11.611 15.337 -15.480
36 HH12 ARG 4 HH21 ARG 4 12.072 16.947 -15.975
37 HH21 ARG 4 HH12 ARG 4 12.044 18.238 -12.755
38 HH22 ARG 4 HH11 ARG 4 12.282 18.561 -14.436
39 H GLU 5 H GLU 5 6.587 13.674 -10.581
40 HA GLU 5 HA GLU 5 7.852 14.763 -8.246
41 HB2 GLU 5 HB2 GLU 5 5.763 15.602 -9.583
42 HB3 GLU 5 HB3 GLU 5 4.867 14.449 -8.584
43 HG2 GLU 5 HG2 GLU 5 6.116 15.621 -6.570
44 HG3 GLU 5 HG3 GLU 5 6.429 16.903 -7.738
45 H LEU 6 H LEU 6 5.731 11.915 -8.793
46 HA LEU 6 HA LEU 6 5.799 11.081 -6.010
47 HB2 LEU 6 HB2 LEU 6 3.907 10.383 -7.111
48 HB3 LEU 6 HB3 LEU 6 4.748 10.024 -8.612
49 HG LEU 6 HG LEU 6 5.723 8.027 -7.688
50 HD11 LEU 6 HD11 LEU 6 5.320 9.010 -5.126
51 HD12 LEU 6 HD12 LEU 6 3.993 7.865 -5.259
52 HD13 LEU 6 HD13 LEU 6 5.668 7.329 -5.529
53 HD21 LEU 6 HD21 LEU 6 2.710 8.244 -7.356
54 HD22 LEU 6 HD22 LEU 6 3.610 7.787 -8.818
55 HD23 LEU 6 HD23 LEU 6 3.598 6.704 -7.413
56 H LYS 7 H LYS 7 7.758 10.389 -8.895
57 HA LYS 7 HA LYS 7 9.237 8.218 -7.846
58 HB2 LYS 7 HB2 LYS 7 9.111 9.568 -10.254
59 HB3 LYS 7 HB3 LYS 7 10.719 10.029 -9.721
60 HG2 LYS 7 HG2 LYS 7 11.468 7.768 -9.763
61 HG3 LYS 7 HG3 LYS 7 9.828 7.131 -9.613
62 HD2 LYS 7 HD2 LYS 7 10.486 6.663 -11.817
63 HD3 LYS 7 HD3 LYS 7 9.294 7.960 -11.916
64 HE2 LYS 7 HE2 LYS 7 10.996 9.613 -12.350
65 HE3 LYS 7 HE3 LYS 7 12.293 8.481 -11.933
66 HZ1 LYS 7 HZ1 LYS 7 10.468 8.146 -14.247
67 HZ2 LYS 7 HZ2 LYS 7 11.999 8.731 -14.347
68 HZ3 LYS 7 HZ3 LYS 7 11.747 7.180 -13.877
69 H LYS 8 H LYS 8 9.933 11.684 -7.664
70 HA LYS 8 HA LYS 8 12.234 11.336 -5.889
71 HB2 LYS 8 HB2 LYS 8 12.170 13.743 -5.586
72 HB3 LYS 8 HB3 LYS 8 11.975 13.351 -7.296
73 HG2 LYS 8 HG2 LYS 8 9.595 13.731 -7.180
74 HG3 LYS 8 HG3 LYS 8 9.637 13.999 -5.438
75 HD2 LYS 8 HD2 LYS 8 11.211 15.754 -7.357
76 HD3 LYS 8 HD3 LYS 8 9.484 16.021 -7.045
77 HE2 LYS 8 HE2 LYS 8 9.912 16.146 -4.617
78 HE3 LYS 8 HE3 LYS 8 11.644 15.948 -4.897
79 HZ1 LYS 8 HZ1 LYS 8 10.625 18.026 -6.517
80 HZ2 LYS 8 HZ2 LYS 8 10.170 18.295 -4.965
81 HZ3 LYS 8 HZ3 LYS 8 11.770 18.121 -5.336
82 H LEU 9 H LEU 9 8.968 10.852 -5.298
83 HA LEU 9 HA LEU 9 9.091 11.534 -2.430
84 HB2 LEU 9 HB2 LEU 9 7.086 11.741 -4.313
85 HB3 LEU 9 HB3 LEU 9 6.703 10.187 -3.643
86 HG LEU 9 HG LEU 9 7.234 12.015 -1.449
87 HD11 LEU 9 HD11 LEU 9 4.940 13.067 -3.093
88 HD12 LEU 9 HD12 LEU 9 5.873 13.842 -1.792
89 HD13 LEU 9 HD13 LEU 9 6.577 13.671 -3.404
90 HD21 LEU 9 HD21 LEU 9 5.831 10.136 -1.090
91 HD22 LEU 9 HD22 LEU 9 4.756 11.543 -1.002
92 HD23 LEU 9 HD23 LEU 9 4.775 10.541 -2.459
93 H GLU 10 H GLU 10 8.444 8.690 -4.552
94 HA GLU 10 HA GLU 10 8.381 6.721 -2.540
95 HB2 GLU 10 HB2 GLU 10 8.244 6.651 -5.344
96 HB3 GLU 10 HB3 GLU 10 9.747 5.808 -4.995
97 HG2 GLU 10 HG2 GLU 10 8.182 4.595 -3.136
98 HG3 GLU 10 HG3 GLU 10 6.911 5.125 -4.226
99 H ARG 11 H ARG 11 11.165 8.262 -4.077
100 HA ARG 11 HA ARG 11 13.277 6.704 -3.030
101 HB2 ARG 11 HB2 ARG 11 13.495 8.622 -4.653
102 HB3 ARG 11 HB3 ARG 11 13.187 9.742 -3.313
103 HG2 ARG 11 HG2 ARG 11 15.192 8.768 -2.120
104 HG3 ARG 11 HG3 ARG 11 15.512 7.770 -3.539
105 HD2 ARG 11 HD2 ARG 11 16.566 9.482 -4.579
106 HD3 ARG 11 HD3 ARG 11 15.213 10.576 -4.294
107 HE ARG 11 HE ARG 11 16.349 11.524 -2.550
108 HH11 ARG 11 HH22 ARG 11 17.866 8.422 -3.051
109 HH12 ARG 11 HH21 ARG 11 19.128 8.713 -1.882
110 HH21 ARG 11 HH12 ARG 11 18.001 11.890 -1.094
111 HH22 ARG 11 HH11 ARG 11 19.178 10.644 -0.811
112 H GLU 12 H GLU 12 11.296 9.169 -1.372
113 HA GLU 12 HA GLU 12 12.904 9.107 1.065
114 HB2 GLU 12 HB2 GLU 12 11.090 10.902 -0.056
115 HB3 GLU 12 HB3 GLU 12 10.134 10.166 1.221
116 HG2 GLU 12 HG2 GLU 12 12.927 11.367 1.552
117 HG3 GLU 12 HG3 GLU 12 11.431 12.248 1.841
118 H LEU 13 H LEU 13 9.693 7.766 -0.003
119 HA LEU 13 HA LEU 13 9.298 6.382 2.468
120 HB2 LEU 13 HB2 LEU 13 8.113 6.291 -0.275
121 HB3 LEU 13 HB3 LEU 13 7.905 4.838 0.683
122 HG LEU 13 HG LEU 13 6.026 6.432 0.864
123 HD11 LEU 13 HD11 LEU 13 6.376 4.779 2.609
124 HD12 LEU 13 HD12 LEU 13 7.482 5.859 3.476
125 HD13 LEU 13 HD13 LEU 13 5.774 6.292 3.320
126 HD21 LEU 13 HD21 LEU 13 8.008 8.277 2.254
127 HD22 LEU 13 HD22 LEU 13 7.047 8.592 0.795
128 HD23 LEU 13 HD23 LEU 13 6.254 8.425 2.370
129 H LYS 14 H LYS 14 11.092 5.361 -0.376
130 HA LYS 14 HA LYS 14 11.814 2.721 0.372
131 HB2 LYS 14 HB2 LYS 14 12.271 3.463 -1.809
132 HB3 LYS 14 HB3 LYS 14 13.104 4.905 -1.282
133 HG2 LYS 14 HG2 LYS 14 14.314 2.177 -0.724
134 HG3 LYS 14 HG3 LYS 14 14.441 2.928 -2.307
135 HD2 LYS 14 HD2 LYS 14 15.454 4.963 -1.321
136 HD3 LYS 14 HD3 LYS 14 15.477 4.219 0.270
137 HE2 LYS 14 HE2 LYS 14 17.082 2.644 -0.266
138 HE3 LYS 14 HE3 LYS 14 16.749 2.732 -2.004
139 HZ1 LYS 14 HZ1 LYS 14 17.766 4.882 -2.069
140 HZ2 LYS 14 HZ2 LYS 14 17.973 4.916 -0.435
141 HZ3 LYS 14 HZ3 LYS 14 18.830 3.851 -1.340
142 H LYS 15 H LYS 15 12.675 5.636 2.066
143 HA LYS 15 HA LYS 15 15.174 5.000 3.216
144 HB2 LYS 15 HB2 LYS 15 12.656 6.278 4.359
145 HB3 LYS 15 HB3 LYS 15 14.103 6.112 5.323
146 HG2 LYS 15 HG2 LYS 15 14.178 7.531 2.627
147 HG3 LYS 15 HG3 LYS 15 13.751 8.337 4.147
148 HD2 LYS 15 HD2 LYS 15 16.011 7.338 5.037
149 HD3 LYS 15 HD3 LYS 15 16.362 7.054 3.319
150 HE2 LYS 15 HE2 LYS 15 15.409 9.663 3.301
151 HE3 LYS 15 HE3 LYS 15 16.157 9.585 4.894
152 HZ1 LYS 15 HZ1 LYS 15 18.174 8.681 3.764
153 HZ2 LYS 15 HZ2 LYS 15 17.451 8.995 2.312
154 HZ3 LYS 15 HZ3 LYS 15 17.804 10.241 3.325
155 H LEU 16 H LEU 16 12.004 3.617 3.930
156 HA LEU 16 HA LEU 16 13.248 1.785 5.905
157 HB2 LEU 16 HB2 LEU 16 11.254 1.493 6.864
158 HB3 LEU 16 HB3 LEU 16 11.001 3.091 6.239
159 HG LEU 16 HG LEU 16 10.081 1.478 4.131
160 HD11 LEU 16 HD11 LEU 16 8.540 -0.121 5.310
161 HD12 LEU 16 HD12 LEU 16 10.240 -0.559 5.450
162 HD13 LEU 16 HD13 LEU 16 9.399 0.205 6.818
163 HD21 LEU 16 HD21 LEU 16 8.211 2.415 6.290
164 HD22 LEU 16 HD22 LEU 16 9.049 3.558 5.204
165 HD23 LEU 16 HD23 LEU 16 7.992 2.337 4.522
166 H SER 17 H SER 17 13.412 -0.401 5.518
167 HA SER 17 HA SER 17 14.094 -1.346 3.060
168 HB2 SER 17 HB2 SER 17 13.119 -2.662 5.557
169 HB3 SER 17 HB3 SER 17 13.428 -3.655 4.110
170 HG SER 17 HG SER 17 15.216 -3.237 5.655
171 HA PRO 18 HA PRO 18 10.011 -1.334 1.111
172 HB2 PRO 18 HB2 PRO 18 10.808 -2.043 -1.461
173 HB3 PRO 18 HB3 PRO 18 10.851 -0.396 -0.777
174 HG2 PRO 18 HG2 PRO 18 13.109 -2.312 -1.196
175 HG3 PRO 18 HG3 PRO 18 13.118 -0.524 -1.213
176 HD2 PRO 18 HD2 PRO 18 13.957 -2.174 0.904
177 HD3 PRO 18 HD3 PRO 18 13.575 -0.432 1.036
178 H GLU 19 H GLU 19 12.190 -4.014 1.298
179 HA GLU 19 HA GLU 19 10.200 -6.037 0.530
180 HB2 GLU 19 HB2 GLU 19 12.663 -6.182 0.051
181 HB3 GLU 19 HB3 GLU 19 12.963 -6.383 1.781
182 HG2 GLU 19 HG2 GLU 19 11.861 -8.496 1.831
183 HG3 GLU 19 HG3 GLU 19 11.000 -8.184 0.320
184 H GLU 20 H GLU 20 11.125 -4.335 3.451
185 HA GLU 20 HA GLU 20 10.278 -6.451 5.283
186 HB2 GLU 20 HB2 GLU 20 11.998 -4.502 5.615
187 HB3 GLU 20 HB3 GLU 20 10.593 -3.542 6.080
188 HG2 GLU 20 HG2 GLU 20 10.411 -4.636 8.098
189 HG3 GLU 20 HG3 GLU 20 10.778 -6.212 7.397
190 H LEU 21 H LEU 21 8.957 -3.367 4.001
191 HA LEU 21 HA LEU 21 6.520 -3.428 5.436
192 HB2 LEU 21 HB2 LEU 21 7.718 -1.847 3.372
193 HB3 LEU 21 HB3 LEU 21 6.157 -2.344 2.752
194 HG LEU 21 HG LEU 21 6.578 -1.055 5.480
195 HD11 LEU 21 HD11 LEU 21 5.516 0.222 2.924
196 HD12 LEU 21 HD12 LEU 21 5.835 1.019 4.487
197 HD13 LEU 21 HD13 LEU 21 7.178 0.405 3.506
198 HD21 LEU 21 HD21 LEU 21 4.040 -1.637 3.905
199 HD22 LEU 21 HD22 LEU 21 4.495 -2.277 5.499
200 HD23 LEU 21 HD23 LEU 21 4.121 -0.561 5.315
201 H ASN 22 H ASN 22 7.225 -4.745 2.153
202 HA ASN 22 HA ASN 22 4.695 -5.876 1.639
203 HB2 ASN 22 HB2 ASN 22 6.815 -5.622 0.138
204 HB3 ASN 22 HB3 ASN 22 7.286 -7.198 0.786
205 HD21 ASN 22 HD21 ASN 22 6.969 -7.067 -1.893
206 HD22 ASN 22 HD22 ASN 22 5.381 -7.725 -2.335
207 H ARG 23 H ARG 23 7.515 -7.328 3.324
208 HA ARG 23 HA ARG 23 6.312 -9.846 3.919
209 HB2 ARG 23 HB2 ARG 23 8.752 -9.179 4.095
210 HB3 ARG 23 HB3 ARG 23 8.371 -8.318 5.582
211 HG2 ARG 23 HG2 ARG 23 8.447 -10.207 6.791
212 HG3 ARG 23 HG3 ARG 23 7.266 -11.003 5.745
213 HD2 ARG 23 HD2 ARG 23 9.019 -11.662 4.163
214 HD3 ARG 23 HD3 ARG 23 10.224 -10.740 5.066
215 HE ARG 23 HE ARG 23 10.462 -12.466 6.522
216 HH11 ARG 23 HH22 ARG 23 7.409 -12.995 4.923
217 HH12 ARG 23 HH21 ARG 23 7.142 -14.552 5.657
218 HH21 ARG 23 HH12 ARG 23 10.163 -14.470 7.388
219 HH22 ARG 23 HH11 ARG 23 8.711 -15.375 7.060
220 H TYR 24 H TYR 24 6.420 -6.839 5.849
221 HA TYR 24 HA TYR 24 4.778 -7.765 7.990
222 HB2 TYR 24 HB2 TYR 24 6.212 -5.438 7.369
223 HB3 TYR 24 HB3 TYR 24 4.565 -4.881 7.359
224 HD1 TYR 24 HD1 TYR 24 3.120 -5.616 9.473
225 HD2 TYR 24 HD2 TYR 24 7.431 -5.569 9.342
226 HE1 TYR 24 HE1 TYR 24 3.206 -5.502 11.968
227 HE2 TYR 24 HE2 TYR 24 7.515 -5.427 11.820
228 HH TYR 24 HH TYR 24 6.270 -5.433 13.768
229 H TYR 25 H TYR 25 4.003 -6.538 4.851
230 HA TYR 25 HA TYR 25 1.283 -5.884 5.142
231 HB2 TYR 25 HB2 TYR 25 3.123 -5.736 3.112
232 HB3 TYR 25 HB3 TYR 25 2.112 -7.015 2.506
233 HD1 TYR 25 HD2 TYR 25 -0.557 -6.444 2.735
234 HD2 TYR 25 HD1 TYR 25 2.670 -3.594 2.507
235 HE1 TYR 25 HE2 TYR 25 -2.123 -4.745 1.808
236 HE2 TYR 25 HE1 TYR 25 1.097 -1.888 1.583
237 HH TYR 25 HH TYR 25 -2.027 -2.739 0.425
238 H ALA 26 H ALA 26 2.749 -9.002 4.009
239 HA ALA 26 HA ALA 26 0.275 -10.328 3.549
240 HB1 ALA 26 HB1 ALA 26 2.446 -11.196 2.781
241 HB2 ALA 26 HB2 ALA 26 2.954 -11.481 4.463
242 HB3 ALA 26 HB3 ALA 26 1.609 -12.414 3.765
243 H SER 27 H SER 27 2.239 -10.173 6.555
244 HA SER 27 HA SER 27 0.466 -11.598 8.254
245 HB2 SER 27 HB2 SER 27 1.697 -10.044 10.022
246 HB3 SER 27 HB3 SER 27 2.541 -11.356 9.197
247 HG SER 27 HG SER 27 2.586 -8.639 8.272
248 H LEU 28 H LEU 28 0.002 -8.502 6.846
249 HA LEU 28 HA LEU 28 -2.008 -7.677 8.853
250 HB2 LEU 28 HB2 LEU 28 -0.833 -5.807 8.492
251 HB3 LEU 28 HB3 LEU 28 -0.133 -6.361 6.997
252 HG LEU 28 HG LEU 28 -2.239 -5.799 5.806
253 HD11 LEU 28 HD11 LEU 28 -3.742 -4.099 6.936
254 HD12 LEU 28 HD12 LEU 28 -3.888 -5.695 7.641
255 HD13 LEU 28 HD13 LEU 28 -2.931 -4.465 8.475
256 HD21 LEU 28 HD21 LEU 28 -0.446 -3.786 7.117
257 HD22 LEU 28 HD22 LEU 28 -0.597 -4.266 5.413
258 HD23 LEU 28 HD23 LEU 28 -1.810 -3.211 6.140
259 H ARG 29 H ARG 29 -1.628 -8.241 5.357
260 HA ARG 29 HA ARG 29 -4.301 -7.915 4.555
261 HB2 ARG 29 HB2 ARG 29 -2.060 -8.387 3.159
262 HB3 ARG 29 HB3 ARG 29 -2.622 -10.056 3.251
263 HG2 ARG 29 HG2 ARG 29 -4.949 -8.997 2.470
264 HG3 ARG 29 HG3 ARG 29 -3.931 -7.641 1.970
265 HD2 ARG 29 HD2 ARG 29 -2.521 -9.367 0.689
266 HD3 ARG 29 HD3 ARG 29 -3.793 -10.544 1.032
267 HE ARG 29 HE ARG 29 -3.810 -8.411 -0.922
268 HH11 ARG 29 HH22 ARG 29 -6.013 -10.317 1.011
269 HH12 ARG 29 HH21 ARG 29 -7.388 -10.003 -0.025
270 HH21 ARG 29 HH12 ARG 29 -5.569 -8.107 -2.280
271 HH22 ARG 29 HH11 ARG 29 -7.108 -8.792 -1.878
272 H HIS 30 H HIS 30 -2.698 -10.791 5.842
273 HA HIS 30 HA HIS 30 -5.066 -12.472 5.734
274 HB2 HIS 30 HB2 HIS 30 -2.470 -13.052 6.008
275 HB3 HIS 30 HB3 HIS 30 -2.869 -12.967 7.725
276 HD1 HIS 30 HD1 HIS 30 -3.253 -15.096 4.682
277 HD2 HIS 30 HD2 HIS 30 -4.985 -14.763 8.493
278 HE1 HIS 30 HE1 HIS 30 -4.505 -17.283 5.097
279 H TYR 31 H TYR 31 -3.732 -10.154 8.078
280 HA TYR 31 HA TYR 31 -5.408 -10.833 10.296
281 HB2 TYR 31 HB2 TYR 31 -3.245 -9.269 10.033
282 HB3 TYR 31 HB3 TYR 31 -4.429 -8.009 9.792
283 HD1 TYR 31 HD2 TYR 31 -4.132 -10.956 12.116
284 HD2 TYR 31 HD1 TYR 31 -4.562 -6.682 11.699
285 HE1 TYR 31 HE2 TYR 31 -4.190 -10.716 14.592
286 HE2 TYR 31 HE1 TYR 31 -4.595 -6.444 14.169
287 HH TYR 31 HH TYR 31 -4.797 -7.639 16.171
288 H LEU 32 H LEU 32 -5.679 -8.008 8.077
289 HA LEU 32 HA LEU 32 -8.311 -7.321 8.824
290 HB2 LEU 32 HB2 LEU 32 -8.413 -5.953 6.819
291 HB3 LEU 32 HB3 LEU 32 -6.926 -5.795 7.729
292 HG LEU 32 HG LEU 32 -5.915 -7.464 6.008
293 HD11 LEU 32 HD11 LEU 32 -6.965 -7.087 3.682
294 HD12 LEU 32 HD12 LEU 32 -7.685 -8.295 4.730
295 HD13 LEU 32 HD13 LEU 32 -8.455 -6.699 4.574
296 HD21 LEU 32 HD21 LEU 32 -5.951 -4.676 6.131
297 HD22 LEU 32 HD22 LEU 32 -4.868 -5.692 5.176
298 HD23 LEU 32 HD23 LEU 32 -6.339 -5.019 4.450
299 H ASN 33 H ASN 33 -7.364 -9.915 6.736
300 HA ASN 33 HA ASN 33 -9.760 -10.529 5.378
301 HB2 ASN 33 HB2 ASN 33 -7.198 -11.704 5.806
302 HB3 ASN 33 HB3 ASN 33 -8.337 -12.912 6.335
303 HD21 ASN 33 HD21 ASN 33 -6.980 -11.194 3.673
304 HD22 ASN 33 HD22 ASN 33 -7.885 -12.135 2.435
305 H LEU 34 H LEU 34 -8.914 -11.011 8.758
306 HA LEU 34 HA LEU 34 -11.735 -11.741 9.305
307 HB2 LEU 34 HB2 LEU 34 -11.192 -13.565 10.705
308 HB3 LEU 34 HB3 LEU 34 -10.494 -13.858 9.129
309 HG LEU 34 HG LEU 34 -8.664 -12.522 11.087
310 HD11 LEU 34 HD11 LEU 34 -8.217 -14.404 12.442
311 HD12 LEU 34 HD12 LEU 34 -9.978 -14.233 12.458
312 HD13 LEU 34 HD13 LEU 34 -9.226 -15.483 11.449
313 HD21 LEU 34 HD21 LEU 34 -6.989 -13.652 9.991
314 HD22 LEU 34 HD22 LEU 34 -7.994 -15.059 9.593
315 HD23 LEU 34 HD23 LEU 34 -8.171 -13.559 8.685
316 H VAL 35 H VAL 35 -9.435 -9.562 9.864
317 HA VAL 35 HA VAL 35 -10.160 -8.983 12.665
318 HB VAL 35 HB VAL 35 -7.997 -8.041 10.826
319 HG11 VAL 35 HG11 VAL 35 -8.578 -6.632 13.387
320 HG12 VAL 35 HG12 VAL 35 -7.092 -6.499 12.442
321 HG13 VAL 35 HG13 VAL 35 -8.612 -5.951 11.747
322 HG21 VAL 35 HG21 VAL 35 -6.806 -8.674 13.174
323 HG22 VAL 35 HG22 VAL 35 -8.235 -9.682 13.328
324 HG23 VAL 35 HG23 VAL 35 -7.164 -9.882 11.945
325 H THR 36 H THR 36 -11.046 -7.886 9.531
326 HA THR 36 HA THR 36 -12.467 -5.571 10.832
327 HB THR 36 HB THR 36 -12.753 -4.759 8.511
328 HG1 THR 36 HG1 THR 36 -10.678 -6.601 7.920
329 HG21 THR 36 HG21 THR 36 -10.968 -3.377 8.787
330 HG22 THR 36 HG22 THR 36 -10.798 -4.200 10.339
331 HG23 THR 36 HG23 THR 36 -9.799 -4.703 8.962
332 H ARG 37 H ARG 37 -12.956 -8.296 8.783
333 HA ARG 37 HA ARG 37 -15.772 -8.156 8.371
334 HB2 ARG 37 HB2 ARG 37 -13.802 -10.452 8.604
335 HB3 ARG 37 HB3 ARG 37 -15.528 -10.780 8.407
336 HG2 ARG 37 HG2 ARG 37 -15.656 -9.629 6.328
337 HG3 ARG 37 HG3 ARG 37 -14.028 -8.946 6.497
338 HD2 ARG 37 HD2 ARG 37 -12.986 -10.832 5.837
339 HD3 ARG 37 HD3 ARG 37 -14.122 -11.904 6.678
340 HE ARG 37 HE ARG 37 -15.326 -10.661 4.365
341 HH11 ARG 37 HH22 ARG 37 -13.202 -13.285 5.293
342 HH12 ARG 37 HH21 ARG 37 -13.702 -14.322 3.980
343 HH21 ARG 37 HH12 ARG 37 -15.846 -11.968 2.590
344 HH22 ARG 37 HH11 ARG 37 -15.203 -13.581 2.493
345 H GLN 38 H GLN 38 -14.127 -8.726 11.240
346 HA GLN 38 HA GLN 38 -16.598 -9.539 12.680
347 HB2 GLN 38 HB2 GLN 38 -13.799 -10.338 12.935
348 HB3 GLN 38 HB3 GLN 38 -14.317 -9.625 14.433
349 HG2 GLN 38 HG2 GLN 38 -16.483 -11.310 13.789
350 HG3 GLN 38 HG3 GLN 38 -15.086 -12.198 13.195
351 HE21 GLN 38 HE21 GLN 38 -16.042 -10.225 16.092
352 HE22 GLN 38 HE22 GLN 38 -15.370 -11.412 17.236
353 H ARG 39 H ARG 39 -15.633 -6.702 11.809
354 HA ARG 39 HA ARG 39 -15.822 -4.553 12.575
355 HB2 ARG 39 HB2 ARG 39 -17.516 -5.845 14.737
356 HB3 ARG 39 HB3 ARG 39 -17.386 -4.115 14.496
357 HG2 ARG 39 HG2 ARG 39 -18.718 -4.065 12.673
358 HG3 ARG 39 HG3 ARG 39 -18.123 -5.579 12.020
359 HD2 ARG 39 HD2 ARG 39 -19.594 -6.196 14.436
360 HD3 ARG 39 HD3 ARG 39 -20.556 -5.063 13.480
361 HE ARG 39 HE ARG 39 -19.458 -7.197 11.868
362 HH11 ARG 39 HH22 ARG 39 -22.155 -6.599 14.059
363 HH12 ARG 39 HH21 ARG 39 -23.061 -7.976 13.483
364 HH21 ARG 39 HH12 ARG 39 -20.758 -8.780 11.010
365 HH22 ARG 39 HH11 ARG 39 -22.351 -9.040 11.675
366 H TYR 40 H TYR 40 -13.486 -5.744 13.089
367 HA TYR 40 HA TYR 40 -12.582 -4.430 15.586
368 HB2 TYR 40 HB2 TYR 40 -12.518 -6.682 16.153
369 HB3 TYR 40 HB3 TYR 40 -12.058 -7.221 14.583
370 HD1 TYR 40 HD1 TYR 40 -10.369 -4.552 16.628
371 HD2 TYR 40 HD2 TYR 40 -10.149 -8.564 15.038
372 HE1 TYR 40 HE1 TYR 40 -7.950 -4.571 17.035
373 HE2 TYR 40 HE2 TYR 40 -7.699 -8.601 15.514
374 HH TYR 40 HH TYR 40 -6.020 -5.649 16.640
375 HN1 NH2 41 HN1 NH2 41 -9.754 -5.287 14.163
376 HN2 NH2 41 HN2 NH2 41 -9.588 -3.860 13.124
Start of MODEL 8
1 HA TYR 1 HA TYR 1 -4.795 10.549 -6.745
2 HB2 TYR 1 HB2 TYR 1 -4.690 12.871 -7.675
3 HB3 TYR 1 HB3 TYR 1 -6.214 12.487 -6.906
4 HD1 TYR 1 HD1 TYR 1 -3.051 14.400 -6.531
5 HD2 TYR 1 HD2 TYR 1 -7.027 13.770 -4.981
6 HE1 TYR 1 HE1 TYR 1 -2.799 16.402 -5.083
7 HE2 TYR 1 HE2 TYR 1 -6.762 15.786 -3.538
8 HH TYR 1 HH TYR 1 -5.183 18.043 -3.682
9 H LEU 2 H LEU 2 -2.819 11.829 -7.975
10 HA LEU 2 HA LEU 2 -0.640 12.212 -8.212
11 HB2 LEU 2 HB2 LEU 2 -1.231 13.416 -5.713
12 HB3 LEU 2 HB3 LEU 2 0.260 12.576 -5.461
13 HG LEU 2 HG LEU 2 1.301 13.775 -7.334
14 HD11 LEU 2 HD11 LEU 2 -0.089 14.436 -8.989
15 HD12 LEU 2 HD12 LEU 2 -1.468 14.704 -7.918
16 HD13 LEU 2 HD13 LEU 2 -0.192 15.922 -8.037
17 HD21 LEU 2 HD21 LEU 2 1.317 15.985 -6.227
18 HD22 LEU 2 HD22 LEU 2 -0.186 15.581 -5.368
19 HD23 LEU 2 HD23 LEU 2 1.313 14.689 -5.027
20 H GLU 3 H GLU 3 -0.811 9.889 -8.844
21 HA GLU 3 HA GLU 3 0.519 7.925 -7.151
22 HB2 GLU 3 HB2 GLU 3 -0.771 8.043 -9.849
23 HB3 GLU 3 HB3 GLU 3 0.504 6.864 -9.690
24 HG2 GLU 3 HG2 GLU 3 -1.285 6.774 -7.343
25 HG3 GLU 3 HG3 GLU 3 -2.201 6.670 -8.827
26 H ARG 4 H ARG 4 1.589 10.098 -9.742
27 HA ARG 4 HA ARG 4 4.217 8.809 -9.868
28 HB2 ARG 4 HB2 ARG 4 2.766 10.127 -11.754
29 HB3 ARG 4 HB3 ARG 4 3.744 11.469 -11.173
30 HG2 ARG 4 HG2 ARG 4 5.669 9.472 -11.485
31 HG3 ARG 4 HG3 ARG 4 4.482 9.008 -12.705
32 HD2 ARG 4 HD2 ARG 4 4.647 11.661 -13.247
33 HD3 ARG 4 HD3 ARG 4 6.243 11.432 -12.519
34 HE ARG 4 HE ARG 4 6.071 9.385 -14.369
35 HH11 ARG 4 HH22 ARG 4 5.635 12.844 -14.691
36 HH12 ARG 4 HH21 ARG 4 6.109 12.858 -16.374
37 HH21 ARG 4 HH12 ARG 4 6.593 9.449 -16.585
38 HH22 ARG 4 HH11 ARG 4 6.647 10.961 -17.432
39 H GLU 5 H GLU 5 3.203 10.332 -7.449
40 HA GLU 5 HA GLU 5 5.651 11.980 -6.905
41 HB2 GLU 5 HB2 GLU 5 2.761 12.435 -6.245
42 HB3 GLU 5 HB3 GLU 5 3.937 12.926 -5.041
43 HG2 GLU 5 HG2 GLU 5 4.015 13.822 -7.955
44 HG3 GLU 5 HG3 GLU 5 3.296 14.745 -6.647
45 H LEU 6 H LEU 6 3.181 9.892 -5.250
46 HA LEU 6 HA LEU 6 4.780 9.390 -2.970
47 HB2 LEU 6 HB2 LEU 6 2.670 7.697 -4.340
48 HB3 LEU 6 HB3 LEU 6 3.411 7.242 -2.806
49 HG LEU 6 HG LEU 6 1.958 9.891 -3.205
50 HD11 LEU 6 HD11 LEU 6 0.880 7.332 -1.950
51 HD12 LEU 6 HD12 LEU 6 0.034 8.888 -2.122
52 HD13 LEU 6 HD13 LEU 6 0.437 7.942 -3.562
53 HD21 LEU 6 HD21 LEU 6 3.552 9.794 -1.258
54 HD22 LEU 6 HD22 LEU 6 1.869 9.930 -0.752
55 HD23 LEU 6 HD23 LEU 6 2.693 8.362 -0.659
56 H LYS 7 H LYS 7 5.167 8.143 -6.201
57 HA LYS 7 HA LYS 7 6.905 5.959 -5.559
58 HB2 LYS 7 HB2 LYS 7 5.892 7.204 -7.944
59 HB3 LYS 7 HB3 LYS 7 7.625 7.324 -8.063
60 HG2 LYS 7 HG2 LYS 7 7.622 5.216 -8.836
61 HG3 LYS 7 HG3 LYS 7 7.351 4.691 -7.191
62 HD2 LYS 7 HD2 LYS 7 4.753 5.375 -8.179
63 HD3 LYS 7 HD3 LYS 7 5.587 4.596 -9.529
64 HE2 LYS 7 HE2 LYS 7 6.129 2.677 -7.976
65 HE3 LYS 7 HE3 LYS 7 5.178 3.476 -6.718
66 HZ1 LYS 7 HZ1 LYS 7 3.234 3.358 -8.154
67 HZ2 LYS 7 HZ2 LYS 7 4.080 2.644 -9.352
68 HZ3 LYS 7 HZ3 LYS 7 3.836 1.858 -7.918
69 H LYS 8 H LYS 8 7.610 9.418 -6.036
70 HA LYS 8 HA LYS 8 10.505 9.032 -5.601
71 HB2 LYS 8 HB2 LYS 8 8.733 11.439 -6.148
72 HB3 LYS 8 HB3 LYS 8 10.299 11.659 -5.401
73 HG2 LYS 8 HG2 LYS 8 11.020 11.857 -7.495
74 HG3 LYS 8 HG3 LYS 8 11.189 10.123 -7.389
75 HD2 LYS 8 HD2 LYS 8 9.715 9.801 -9.086
76 HD3 LYS 8 HD3 LYS 8 8.482 10.771 -8.280
77 HE2 LYS 8 HE2 LYS 8 10.250 12.732 -9.111
78 HE3 LYS 8 HE3 LYS 8 10.440 11.547 -10.401
79 HZ1 LYS 8 HZ1 LYS 8 8.585 13.309 -10.627
80 HZ2 LYS 8 HZ2 LYS 8 8.113 11.725 -10.867
81 HZ3 LYS 8 HZ3 LYS 8 7.786 12.506 -9.467
82 H LEU 9 H LEU 9 7.787 9.137 -3.644
83 HA LEU 9 HA LEU 9 9.219 10.131 -1.281
84 HB2 LEU 9 HB2 LEU 9 6.593 10.262 -2.080
85 HB3 LEU 9 HB3 LEU 9 6.521 8.854 -1.046
86 HG LEU 9 HG LEU 9 5.940 10.769 0.246
87 HD11 LEU 9 HD11 LEU 9 7.435 9.155 1.412
88 HD12 LEU 9 HD12 LEU 9 8.832 10.176 0.998
89 HD13 LEU 9 HD13 LEU 9 7.555 10.807 2.047
90 HD21 LEU 9 HD21 LEU 9 8.506 12.102 -0.724
91 HD22 LEU 9 HD22 LEU 9 6.842 12.522 -1.175
92 HD23 LEU 9 HD23 LEU 9 7.391 12.757 0.492
93 H GLU 10 H GLU 10 7.709 7.029 -2.363
94 HA GLU 10 HA GLU 10 8.537 5.417 -0.247
95 HB2 GLU 10 HB2 GLU 10 7.104 4.732 -2.230
96 HB3 GLU 10 HB3 GLU 10 8.622 4.469 -3.106
97 HG2 GLU 10 HG2 GLU 10 9.214 3.017 -0.905
98 HG3 GLU 10 HG3 GLU 10 7.475 2.996 -0.712
99 H ARG 11 H ARG 11 10.479 6.552 -2.947
100 HA ARG 11 HA ARG 11 12.928 5.189 -2.614
101 HB2 ARG 11 HB2 ARG 11 12.047 7.881 -3.600
102 HB3 ARG 11 HB3 ARG 11 13.740 7.767 -3.178
103 HG2 ARG 11 HG2 ARG 11 12.636 5.522 -4.849
104 HG3 ARG 11 HG3 ARG 11 12.751 7.100 -5.623
105 HD2 ARG 11 HD2 ARG 11 15.002 7.080 -5.729
106 HD3 ARG 11 HD3 ARG 11 15.191 6.429 -4.094
107 HE ARG 11 HE ARG 11 14.245 4.365 -5.810
108 HH11 ARG 11 HH22 ARG 11 17.168 6.188 -5.265
109 HH12 ARG 11 HH21 ARG 11 18.233 4.876 -5.705
110 HH21 ARG 11 HH12 ARG 11 15.634 2.700 -6.457
111 HH22 ARG 11 HH11 ARG 11 17.349 2.973 -6.443
112 H GLU 12 H GLU 12 11.739 7.936 -0.629
113 HA GLU 12 HA GLU 12 14.219 7.888 0.951
114 HB2 GLU 12 HB2 GLU 12 12.149 9.833 0.485
115 HB3 GLU 12 HB3 GLU 12 12.078 9.396 2.196
116 HG2 GLU 12 HG2 GLU 12 14.601 9.700 2.283
117 HG3 GLU 12 HG3 GLU 12 14.538 10.292 0.625
118 H LEU 13 H LEU 13 10.770 6.944 1.365
119 HA LEU 13 HA LEU 13 10.981 5.927 4.019
120 HB2 LEU 13 HB2 LEU 13 8.813 6.137 3.306
121 HB3 LEU 13 HB3 LEU 13 9.204 5.684 1.667
122 HG LEU 13 HG LEU 13 9.381 3.312 2.376
123 HD11 LEU 13 HD11 LEU 13 7.756 3.292 4.726
124 HD12 LEU 13 HD12 LEU 13 9.462 2.856 4.591
125 HD13 LEU 13 HD13 LEU 13 8.988 4.506 5.029
126 HD21 LEU 13 HD21 LEU 13 7.218 2.952 1.839
127 HD22 LEU 13 HD22 LEU 13 6.577 4.126 3.012
128 HD23 LEU 13 HD23 LEU 13 7.252 4.657 1.466
129 H LYS 14 H LYS 14 12.139 4.497 0.969
130 HA LYS 14 HA LYS 14 12.745 1.936 1.927
131 HB2 LYS 14 HB2 LYS 14 13.188 3.520 -0.432
132 HB3 LYS 14 HB3 LYS 14 14.757 3.033 0.090
133 HG2 LYS 14 HG2 LYS 14 14.385 1.044 -0.922
134 HG3 LYS 14 HG3 LYS 14 13.277 0.669 0.370
135 HD2 LYS 14 HD2 LYS 14 11.627 0.504 -1.170
136 HD3 LYS 14 HD3 LYS 14 11.695 2.251 -1.364
137 HE2 LYS 14 HE2 LYS 14 13.620 1.870 -3.017
138 HE3 LYS 14 HE3 LYS 14 13.261 0.143 -2.914
139 HZ1 LYS 14 HZ1 LYS 14 10.840 1.459 -3.420
140 HZ2 LYS 14 HZ2 LYS 14 11.924 2.105 -4.445
141 HZ3 LYS 14 HZ3 LYS 14 11.662 0.475 -4.431
142 H LYS 15 H LYS 15 14.122 4.799 3.113
143 HA LYS 15 HA LYS 15 16.746 4.128 3.889
144 HB2 LYS 15 HB2 LYS 15 14.516 5.815 4.994
145 HB3 LYS 15 HB3 LYS 15 15.764 5.383 6.137
146 HG2 LYS 15 HG2 LYS 15 17.410 6.573 5.124
147 HG3 LYS 15 HG3 LYS 15 16.776 6.343 3.488
148 HD2 LYS 15 HD2 LYS 15 15.035 8.018 3.873
149 HD3 LYS 15 HD3 LYS 15 15.532 8.206 5.553
150 HE2 LYS 15 HE2 LYS 15 17.867 8.517 3.899
151 HE3 LYS 15 HE3 LYS 15 16.572 9.416 3.104
152 HZ1 LYS 15 HZ1 LYS 15 16.170 10.573 5.189
153 HZ2 LYS 15 HZ2 LYS 15 17.387 9.741 5.927
154 HZ3 LYS 15 HZ3 LYS 15 17.727 10.794 4.701
155 H LEU 16 H LEU 16 13.713 3.034 5.360
156 HA LEU 16 HA LEU 16 15.185 1.322 7.272
157 HB2 LEU 16 HB2 LEU 16 12.849 0.654 8.013
158 HB3 LEU 16 HB3 LEU 16 13.364 2.280 8.358
159 HG LEU 16 HG LEU 16 11.909 1.892 5.783
160 HD11 LEU 16 HD11 LEU 16 9.716 1.819 6.695
161 HD12 LEU 16 HD12 LEU 16 10.612 0.471 7.405
162 HD13 LEU 16 HD13 LEU 16 10.316 1.942 8.363
163 HD21 LEU 16 HD21 LEU 16 11.550 3.940 8.041
164 HD22 LEU 16 HD22 LEU 16 12.702 4.153 6.721
165 HD23 LEU 16 HD23 LEU 16 10.976 4.087 6.365
166 H SER 17 H SER 17 15.722 0.784 4.632
167 HA SER 17 HA SER 17 15.967 -0.748 3.072
168 HB2 SER 17 HB2 SER 17 15.690 -2.375 5.467
169 HB3 SER 17 HB3 SER 17 15.115 -3.247 4.047
170 HG SER 17 HG SER 17 17.566 -1.843 4.149
171 HA PRO 18 HA PRO 18 12.144 -1.237 0.906
172 HB2 PRO 18 HB2 PRO 18 12.981 -2.978 -1.145
173 HB3 PRO 18 HB3 PRO 18 13.163 -1.222 -1.154
174 HG2 PRO 18 HG2 PRO 18 15.236 -3.277 -0.726
175 HG3 PRO 18 HG3 PRO 18 15.416 -1.568 -1.214
176 HD2 PRO 18 HD2 PRO 18 15.885 -2.693 1.364
177 HD3 PRO 18 HD3 PRO 18 15.877 -0.961 0.929
178 H GLU 19 H GLU 19 14.018 -4.192 1.559
179 HA GLU 19 HA GLU 19 11.748 -5.968 1.256
180 HB2 GLU 19 HB2 GLU 19 14.259 -6.495 0.978
181 HB3 GLU 19 HB3 GLU 19 14.335 -6.535 2.741
182 HG2 GLU 19 HG2 GLU 19 12.157 -8.202 2.182
183 HG3 GLU 19 HG3 GLU 19 13.171 -8.463 0.779
184 H GLU 20 H GLU 20 13.035 -4.089 3.925
185 HA GLU 20 HA GLU 20 11.879 -5.544 6.129
186 HB2 GLU 20 HB2 GLU 20 13.507 -3.258 5.688
187 HB3 GLU 20 HB3 GLU 20 12.100 -2.668 6.555
188 HG2 GLU 20 HG2 GLU 20 13.500 -5.120 7.608
189 HG3 GLU 20 HG3 GLU 20 14.341 -3.581 7.713
190 H LEU 21 H LEU 21 10.764 -2.790 4.100
191 HA LEU 21 HA LEU 21 8.311 -2.496 5.519
192 HB2 LEU 21 HB2 LEU 21 9.620 -1.299 3.191
193 HB3 LEU 21 HB3 LEU 21 7.992 -1.763 2.763
194 HG LEU 21 HG LEU 21 8.878 0.183 4.912
195 HD11 LEU 21 HD11 LEU 21 7.153 0.248 2.404
196 HD12 LEU 21 HD12 LEU 21 7.135 1.532 3.601
197 HD13 LEU 21 HD13 LEU 21 8.655 1.124 2.770
198 HD21 LEU 21 HD21 LEU 21 7.202 -0.697 6.218
199 HD22 LEU 21 HD22 LEU 21 6.238 0.408 5.257
200 HD23 LEU 21 HD23 LEU 21 6.261 -1.315 4.841
201 H ASN 22 H ASN 22 9.080 -4.203 2.447
202 HA ASN 22 HA ASN 22 6.533 -5.288 1.960
203 HB2 ASN 22 HB2 ASN 22 8.702 -5.360 0.539
204 HB3 ASN 22 HB3 ASN 22 9.048 -6.865 1.396
205 HD21 ASN 22 HD21 ASN 22 7.290 -8.631 1.227
206 HD22 ASN 22 HD22 ASN 22 6.337 -8.573 -0.258
207 H ARG 23 H ARG 23 9.069 -6.444 4.156
208 HA ARG 23 HA ARG 23 7.900 -8.876 5.001
209 HB2 ARG 23 HB2 ARG 23 10.210 -7.758 5.537
210 HB3 ARG 23 HB3 ARG 23 9.388 -7.022 6.905
211 HG2 ARG 23 HG2 ARG 23 9.374 -10.012 6.373
212 HG3 ARG 23 HG3 ARG 23 10.653 -9.187 7.281
213 HD2 ARG 23 HD2 ARG 23 8.948 -8.284 8.850
214 HD3 ARG 23 HD3 ARG 23 7.701 -9.253 8.031
215 HE ARG 23 HE ARG 23 9.532 -11.140 8.568
216 HH11 ARG 23 HH22 ARG 23 8.155 -8.737 10.694
217 HH12 ARG 23 HH21 ARG 23 8.396 -9.681 12.138
218 HH21 ARG 23 HH12 ARG 23 9.797 -12.359 10.382
219 HH22 ARG 23 HH11 ARG 23 9.324 -11.751 11.943
220 H TYR 24 H TYR 24 7.527 -5.648 6.548
221 HA TYR 24 HA TYR 24 5.438 -6.462 8.364
222 HB2 TYR 24 HB2 TYR 24 6.595 -3.858 7.381
223 HB3 TYR 24 HB3 TYR 24 5.029 -3.832 8.165
224 HD1 TYR 24 HD1 TYR 24 8.268 -5.699 8.845
225 HD2 TYR 24 HD2 TYR 24 5.189 -3.075 10.353
226 HE1 TYR 24 HE1 TYR 24 9.310 -5.765 11.099
227 HE2 TYR 24 HE2 TYR 24 6.269 -3.121 12.602
228 HH TYR 24 HH TYR 24 7.905 -5.057 13.812
229 H TYR 25 H TYR 25 5.417 -5.417 5.059
230 HA TYR 25 HA TYR 25 2.639 -4.951 4.708
231 HB2 TYR 25 HB2 TYR 25 4.882 -4.758 3.151
232 HB3 TYR 25 HB3 TYR 25 4.124 -6.149 2.410
233 HD1 TYR 25 HD1 TYR 25 1.835 -5.875 1.375
234 HD2 TYR 25 HD2 TYR 25 4.089 -2.565 2.971
235 HE1 TYR 25 HE1 TYR 25 0.458 -4.294 0.032
236 HE2 TYR 25 HE2 TYR 25 2.716 -0.977 1.620
237 HH TYR 25 HH TYR 25 0.149 -2.109 -0.573
238 H ALA 26 H ALA 26 4.505 -8.028 4.271
239 HA ALA 26 HA ALA 26 2.287 -9.597 3.400
240 HB1 ALA 26 HB1 ALA 26 3.665 -11.530 4.229
241 HB2 ALA 26 HB2 ALA 26 4.563 -10.398 3.195
242 HB3 ALA 26 HB3 ALA 26 4.792 -10.366 4.961
243 H SER 27 H SER 27 3.513 -9.071 6.728
244 HA SER 27 HA SER 27 1.348 -10.415 8.076
245 HB2 SER 27 HB2 SER 27 3.414 -8.356 8.958
246 HB3 SER 27 HB3 SER 27 2.216 -9.046 10.061
247 HG SER 27 HG SER 27 3.052 -11.074 9.700
248 H LEU 28 H LEU 28 1.271 -7.504 6.356
249 HA LEU 28 HA LEU 28 -1.131 -6.608 7.852
250 HB2 LEU 28 HB2 LEU 28 0.832 -5.209 6.041
251 HB3 LEU 28 HB3 LEU 28 -0.793 -4.573 6.221
252 HG LEU 28 HG LEU 28 0.990 -5.173 8.607
253 HD11 LEU 28 HD11 LEU 28 0.650 -2.536 7.119
254 HD12 LEU 28 HD12 LEU 28 1.482 -2.745 8.680
255 HD13 LEU 28 HD13 LEU 28 2.130 -3.512 7.219
256 HD21 LEU 28 HD21 LEU 28 -1.222 -3.102 8.524
257 HD22 LEU 28 HD22 LEU 28 -1.645 -4.794 8.776
258 HD23 LEU 28 HD23 LEU 28 -0.552 -3.992 9.908
259 H ARG 29 H ARG 29 -0.039 -7.831 4.716
260 HA ARG 29 HA ARG 29 -2.467 -7.405 3.294
261 HB2 ARG 29 HB2 ARG 29 -0.143 -8.086 2.360
262 HB3 ARG 29 HB3 ARG 29 -0.550 -9.731 2.852
263 HG2 ARG 29 HG2 ARG 29 -2.791 -9.287 1.501
264 HG3 ARG 29 HG3 ARG 29 -1.896 -7.958 0.780
265 HD2 ARG 29 HD2 ARG 29 -0.743 -9.351 -0.579
266 HD3 ARG 29 HD3 ARG 29 -0.303 -10.433 0.731
267 HE ARG 29 HE ARG 29 -2.549 -10.701 -1.121
268 HH11 ARG 29 HH22 ARG 29 -1.308 -11.829 1.938
269 HH12 ARG 29 HH21 ARG 29 -2.342 -13.236 1.984
270 HH21 ARG 29 HH12 ARG 29 -3.827 -12.569 -1.078
271 HH22 ARG 29 HH11 ARG 29 -3.670 -13.677 0.233
272 H HIS 30 H HIS 30 -1.288 -10.377 4.943
273 HA HIS 30 HA HIS 30 -3.794 -11.786 4.577
274 HB2 HIS 30 HB2 HIS 30 -1.216 -12.470 5.462
275 HB3 HIS 30 HB3 HIS 30 -2.209 -12.662 6.898
276 HD1 HIS 30 HD1 HIS 30 -1.111 -14.606 4.060
277 HD2 HIS 30 HD2 HIS 30 -4.660 -14.205 6.285
278 HE1 HIS 30 HE1 HIS 30 -2.546 -16.672 3.538
279 H TYR 31 H TYR 31 -2.669 -9.469 6.920
280 HA TYR 31 HA TYR 31 -4.684 -9.928 8.937
281 HB2 TYR 31 HB2 TYR 31 -2.420 -8.866 9.213
282 HB3 TYR 31 HB3 TYR 31 -3.027 -7.442 8.381
283 HD1 TYR 31 HD1 TYR 31 -3.838 -9.699 11.272
284 HD2 TYR 31 HD2 TYR 31 -3.835 -5.676 9.701
285 HE1 TYR 31 HE1 TYR 31 -4.647 -8.840 13.466
286 HE2 TYR 31 HE2 TYR 31 -4.582 -4.818 11.930
287 HH TYR 31 HH TYR 31 -6.053 -6.565 14.152
288 H LEU 32 H LEU 32 -4.278 -7.181 6.584
289 HA LEU 32 HA LEU 32 -6.785 -6.039 6.980
290 HB2 LEU 32 HB2 LEU 32 -6.087 -4.524 5.430
291 HB3 LEU 32 HB3 LEU 32 -4.596 -5.289 5.709
292 HG LEU 32 HG LEU 32 -5.300 -6.829 3.658
293 HD11 LEU 32 HD11 LEU 32 -7.078 -6.190 2.387
294 HD12 LEU 32 HD12 LEU 32 -7.604 -5.230 3.773
295 HD13 LEU 32 HD13 LEU 32 -6.668 -4.468 2.494
296 HD21 LEU 32 HD21 LEU 32 -4.175 -5.333 2.148
297 HD22 LEU 32 HD22 LEU 32 -4.519 -3.929 3.186
298 HD23 LEU 32 HD23 LEU 32 -3.407 -5.196 3.739
299 H ASN 33 H ASN 33 -5.954 -8.787 4.951
300 HA ASN 33 HA ASN 33 -8.294 -9.195 3.484
301 HB2 ASN 33 HB2 ASN 33 -5.968 -10.572 3.877
302 HB3 ASN 33 HB3 ASN 33 -7.053 -11.600 4.785
303 HD21 ASN 33 HD21 ASN 33 -5.548 -11.997 2.234
304 HD22 ASN 33 HD22 ASN 33 -6.826 -12.452 1.092
305 H LEU 34 H LEU 34 -7.871 -9.650 6.954
306 HA LEU 34 HA LEU 34 -10.774 -10.298 7.170
307 HB2 LEU 34 HB2 LEU 34 -10.409 -11.910 8.840
308 HB3 LEU 34 HB3 LEU 34 -9.429 -12.322 7.456
309 HG LEU 34 HG LEU 34 -7.743 -10.742 9.177
310 HD11 LEU 34 HD11 LEU 34 -9.058 -11.118 11.103
311 HD12 LEU 34 HD12 LEU 34 -9.404 -12.803 10.657
312 HD13 LEU 34 HD13 LEU 34 -7.777 -12.339 11.189
313 HD21 LEU 34 HD21 LEU 34 -6.362 -12.689 9.230
314 HD22 LEU 34 HD22 LEU 34 -7.726 -13.759 8.822
315 HD23 LEU 34 HD23 LEU 34 -7.097 -12.607 7.627
316 H VAL 35 H VAL 35 -8.446 -8.088 7.923
317 HA VAL 35 HA VAL 35 -9.818 -7.036 10.334
318 HB VAL 35 HB VAL 35 -7.168 -6.628 9.020
319 HG11 VAL 35 HG11 VAL 35 -7.731 -4.343 9.369
320 HG12 VAL 35 HG12 VAL 35 -8.228 -4.675 11.049
321 HG13 VAL 35 HG13 VAL 35 -6.533 -4.851 10.545
322 HG21 VAL 35 HG21 VAL 35 -6.443 -7.844 10.731
323 HG22 VAL 35 HG22 VAL 35 -7.290 -6.846 11.937
324 HG23 VAL 35 HG23 VAL 35 -8.101 -8.205 11.141
325 H THR 36 H THR 36 -9.502 -6.355 6.987
326 HA THR 36 HA THR 36 -10.999 -3.792 7.323
327 HB THR 36 HB THR 36 -9.717 -4.431 4.713
328 HG1 THR 36 HG1 THR 36 -8.317 -3.897 7.102
329 HG21 THR 36 HG21 THR 36 -10.015 -2.190 4.509
330 HG22 THR 36 HG22 THR 36 -10.365 -1.998 6.239
331 HG23 THR 36 HG23 THR 36 -8.703 -1.981 5.669
332 H ARG 37 H ARG 37 -11.266 -6.968 6.109
333 HA ARG 37 HA ARG 37 -13.464 -6.679 4.312
334 HB2 ARG 37 HB2 ARG 37 -11.892 -8.778 5.179
335 HB3 ARG 37 HB3 ARG 37 -13.376 -9.148 6.025
336 HG2 ARG 37 HG2 ARG 37 -14.378 -9.893 4.122
337 HG3 ARG 37 HG3 ARG 37 -13.971 -8.423 3.243
338 HD2 ARG 37 HD2 ARG 37 -11.564 -9.408 3.079
339 HD3 ARG 37 HD3 ARG 37 -12.324 -10.941 3.547
340 HE ARG 37 HE ARG 37 -13.579 -9.510 1.306
341 HH11 ARG 37 HH22 ARG 37 -11.038 -11.825 2.044
342 HH12 ARG 37 HH21 ARG 37 -11.213 -12.652 0.523
343 HH21 ARG 37 HH12 ARG 37 -13.569 -10.435 -0.726
344 HH22 ARG 37 HH11 ARG 37 -12.574 -11.819 -1.057
345 H GLN 38 H GLN 38 -13.348 -6.204 7.571
346 HA GLN 38 HA GLN 38 -16.285 -5.797 7.779
347 HB2 GLN 38 HB2 GLN 38 -14.510 -7.551 9.459
348 HB3 GLN 38 HB3 GLN 38 -15.670 -6.599 10.337
349 HG2 GLN 38 HG2 GLN 38 -16.993 -7.823 8.016
350 HG3 GLN 38 HG3 GLN 38 -16.088 -9.038 8.901
351 HE21 GLN 38 HE21 GLN 38 -18.302 -9.980 9.322
352 HE22 GLN 38 HE22 GLN 38 -19.112 -9.275 10.744
353 H ARG 39 H ARG 39 -13.612 -4.130 7.568
354 HA ARG 39 HA ARG 39 -14.644 -1.946 9.189
355 HB2 ARG 39 HB2 ARG 39 -13.253 -3.508 10.772
356 HB3 ARG 39 HB3 ARG 39 -11.847 -2.775 10.005
357 HG2 ARG 39 HG2 ARG 39 -12.577 -0.545 10.671
358 HG3 ARG 39 HG3 ARG 39 -14.109 -1.182 11.290
359 HD2 ARG 39 HD2 ARG 39 -11.455 -2.195 12.360
360 HD3 ARG 39 HD3 ARG 39 -12.153 -0.703 12.972
361 HE ARG 39 HE ARG 39 -13.259 -3.445 13.309
362 HH11 ARG 39 HH22 ARG 39 -13.785 -0.053 13.855
363 HH12 ARG 39 HH21 ARG 39 -15.205 -0.312 14.833
364 HH21 ARG 39 HH12 ARG 39 -14.872 -3.774 14.882
365 HH22 ARG 39 HH11 ARG 39 -15.688 -2.383 15.508
366 H TYR 40 H TYR 40 -14.686 -1.575 6.790
367 HA TYR 40 HA TYR 40 -12.308 -0.949 5.359
368 HB2 TYR 40 HB2 TYR 40 -14.894 -1.414 4.680
369 HB3 TYR 40 HB3 TYR 40 -14.865 0.324 4.502
370 HD1 TYR 40 HD1 TYR 40 -13.252 1.374 2.854
371 HD2 TYR 40 HD2 TYR 40 -13.696 -2.898 3.227
372 HE1 TYR 40 HE1 TYR 40 -12.230 1.074 0.604
373 HE2 TYR 40 HE2 TYR 40 -12.675 -3.197 0.964
374 HH TYR 40 HH TYR 40 -11.796 -0.426 -1.081
375 HN1 NH2 41 HN1 NH2 41 -10.966 0.532 6.478
376 HN2 NH2 41 HN2 NH2 41 -11.449 2.242 6.546
Start of MODEL 9
1 HA TYR 1 HA TYR 1 -1.086 13.274 -12.967
2 HB2 TYR 1 HB2 TYR 1 -0.295 13.650 -15.271
3 HB3 TYR 1 HB3 TYR 1 -1.832 14.417 -14.940
4 HD1 TYR 1 HD2 TYR 1 -2.018 16.930 -14.714
5 HD2 TYR 1 HD1 TYR 1 1.682 14.983 -15.856
6 HE1 TYR 1 HE2 TYR 1 -1.089 19.100 -15.457
7 HE2 TYR 1 HE1 TYR 1 2.561 17.154 -16.660
8 HH TYR 1 HH TYR 1 1.899 19.337 -17.276
9 H LEU 2 H LEU 2 0.579 14.405 -10.831
10 HA LEU 2 HA LEU 2 3.323 14.392 -11.901
11 HB2 LEU 2 HB2 LEU 2 1.910 15.355 -9.440
12 HB3 LEU 2 HB3 LEU 2 3.506 14.729 -9.198
13 HG LEU 2 HG LEU 2 3.633 16.485 -11.500
14 HD11 LEU 2 HD11 LEU 2 3.084 18.619 -10.384
15 HD12 LEU 2 HD12 LEU 2 1.660 17.615 -10.678
16 HD13 LEU 2 HD13 LEU 2 2.349 17.717 -9.037
17 HD21 LEU 2 HD21 LEU 2 5.576 16.013 -10.201
18 HD22 LEU 2 HD22 LEU 2 5.211 17.726 -9.950
19 HD23 LEU 2 HD23 LEU 2 4.797 16.545 -8.692
20 H GLU 3 H GLU 3 2.984 12.138 -12.655
21 HA GLU 3 HA GLU 3 2.802 9.957 -10.793
22 HB2 GLU 3 HB2 GLU 3 3.479 10.355 -13.655
23 HB3 GLU 3 HB3 GLU 3 4.359 9.038 -12.940
24 HG2 GLU 3 HG2 GLU 3 1.496 8.974 -12.163
25 HG3 GLU 3 HG3 GLU 3 1.703 9.038 -13.900
26 H ARG 4 H ARG 4 5.696 11.594 -12.110
27 HA ARG 4 HA ARG 4 7.684 10.065 -10.861
28 HB2 ARG 4 HB2 ARG 4 7.908 12.096 -12.477
29 HB3 ARG 4 HB3 ARG 4 7.775 13.095 -11.023
30 HG2 ARG 4 HG2 ARG 4 9.750 11.333 -10.240
31 HG3 ARG 4 HG3 ARG 4 9.990 11.300 -11.972
32 HD2 ARG 4 HD2 ARG 4 11.226 13.182 -11.739
33 HD3 ARG 4 HD3 ARG 4 9.739 14.051 -11.404
34 HE ARG 4 HE ARG 4 10.287 14.153 -9.162
35 HH11 ARG 4 HH22 ARG 4 12.408 11.813 -10.646
36 HH12 ARG 4 HH21 ARG 4 13.408 11.619 -9.224
37 HH21 ARG 4 HH12 ARG 4 11.611 13.920 -7.386
38 HH22 ARG 4 HH11 ARG 4 12.959 12.818 -7.395
39 H GLU 5 H GLU 5 5.534 12.418 -9.361
40 HA GLU 5 HA GLU 5 6.967 12.833 -6.923
41 HB2 GLU 5 HB2 GLU 5 5.052 14.180 -7.782
42 HB3 GLU 5 HB3 GLU 5 3.952 12.874 -7.281
43 HG2 GLU 5 HG2 GLU 5 4.393 13.207 -4.997
44 HG3 GLU 5 HG3 GLU 5 5.905 14.068 -5.308
45 H LEU 6 H LEU 6 4.536 10.328 -7.853
46 HA LEU 6 HA LEU 6 4.439 9.007 -5.328
47 HB2 LEU 6 HB2 LEU 6 3.832 8.264 -8.172
48 HB3 LEU 6 HB3 LEU 6 4.161 6.922 -7.095
49 HG LEU 6 HG LEU 6 2.101 9.070 -6.493
50 HD11 LEU 6 HD11 LEU 6 1.817 6.332 -7.810
51 HD12 LEU 6 HD12 LEU 6 0.452 7.270 -7.168
52 HD13 LEU 6 HD13 LEU 6 1.415 7.907 -8.516
53 HD21 LEU 6 HD21 LEU 6 1.433 7.771 -4.678
54 HD22 LEU 6 HD22 LEU 6 2.094 6.264 -5.362
55 HD23 LEU 6 HD23 LEU 6 3.171 7.452 -4.633
56 H LYS 7 H LYS 7 6.722 8.746 -8.000
57 HA LYS 7 HA LYS 7 8.286 6.612 -6.865
58 HB2 LYS 7 HB2 LYS 7 8.299 7.975 -9.294
59 HB3 LYS 7 HB3 LYS 7 9.736 8.641 -8.514
60 HG2 LYS 7 HG2 LYS 7 10.239 6.078 -7.995
61 HG3 LYS 7 HG3 LYS 7 9.091 5.797 -9.304
62 HD2 LYS 7 HD2 LYS 7 10.517 7.502 -10.663
63 HD3 LYS 7 HD3 LYS 7 11.752 7.283 -9.408
64 HE2 LYS 7 HE2 LYS 7 12.000 4.955 -9.919
65 HE3 LYS 7 HE3 LYS 7 10.507 4.921 -10.862
66 HZ1 LYS 7 HZ1 LYS 7 11.529 6.184 -12.577
67 HZ2 LYS 7 HZ2 LYS 7 12.854 6.535 -11.685
68 HZ3 LYS 7 HZ3 LYS 7 12.592 5.001 -12.220
69 H LYS 8 H LYS 8 8.528 10.143 -6.576
70 HA LYS 8 HA LYS 8 10.791 10.072 -4.717
71 HB2 LYS 8 HB2 LYS 8 10.289 11.969 -6.256
72 HB3 LYS 8 HB3 LYS 8 8.861 12.351 -5.292
73 HG2 LYS 8 HG2 LYS 8 10.191 12.913 -3.373
74 HG3 LYS 8 HG3 LYS 8 11.666 12.245 -4.088
75 HD2 LYS 8 HD2 LYS 8 12.056 14.108 -5.379
76 HD3 LYS 8 HD3 LYS 8 10.322 14.427 -5.628
77 HE2 LYS 8 HE2 LYS 8 10.360 15.011 -3.067
78 HE3 LYS 8 HE3 LYS 8 12.104 15.203 -3.303
79 HZ1 LYS 8 HZ1 LYS 8 10.118 16.568 -5.021
80 HZ2 LYS 8 HZ2 LYS 8 10.636 17.240 -3.625
81 HZ3 LYS 8 HZ3 LYS 8 11.709 16.956 -4.830
82 H LEU 9 H LEU 9 7.499 9.424 -4.342
83 HA LEU 9 HA LEU 9 7.379 9.983 -1.475
84 HB2 LEU 9 HB2 LEU 9 5.493 9.860 -3.501
85 HB3 LEU 9 HB3 LEU 9 5.323 8.278 -2.802
86 HG LEU 9 HG LEU 9 5.315 9.818 -0.520
87 HD11 LEU 9 HD11 LEU 9 4.253 11.580 -2.767
88 HD12 LEU 9 HD12 LEU 9 3.849 11.825 -1.058
89 HD13 LEU 9 HD13 LEU 9 5.533 11.944 -1.593
90 HD21 LEU 9 HD21 LEU 9 2.621 9.909 -1.291
91 HD22 LEU 9 HD22 LEU 9 3.265 8.510 -2.157
92 HD23 LEU 9 HD23 LEU 9 3.452 8.626 -0.403
93 H GLU 10 H GLU 10 7.240 7.006 -3.557
94 HA GLU 10 HA GLU 10 7.321 5.117 -1.465
95 HB2 GLU 10 HB2 GLU 10 6.993 4.699 -3.988
96 HB3 GLU 10 HB3 GLU 10 8.756 4.747 -4.113
97 HG2 GLU 10 HG2 GLU 10 8.646 2.931 -2.169
98 HG3 GLU 10 HG3 GLU 10 6.977 2.746 -2.675
99 H ARG 11 H ARG 11 9.984 6.924 -2.940
100 HA ARG 11 HA ARG 11 12.214 5.696 -1.632
101 HB2 ARG 11 HB2 ARG 11 11.615 8.415 -2.772
102 HB3 ARG 11 HB3 ARG 11 13.018 8.286 -1.718
103 HG2 ARG 11 HG2 ARG 11 14.259 7.082 -3.152
104 HG3 ARG 11 HG3 ARG 11 12.911 6.090 -3.683
105 HD2 ARG 11 HD2 ARG 11 12.505 8.788 -4.669
106 HD3 ARG 11 HD3 ARG 11 14.141 8.291 -5.065
107 HE ARG 11 HE ARG 11 11.581 7.083 -5.902
108 HH11 ARG 11 HH22 ARG 11 15.056 6.663 -5.879
109 HH12 ARG 11 HH21 ARG 11 15.057 5.343 -7.013
110 HH21 ARG 11 HH12 ARG 11 11.612 5.318 -7.315
111 HH22 ARG 11 HH11 ARG 11 13.119 4.607 -7.830
112 H GLU 12 H GLU 12 9.865 8.037 -0.342
113 HA GLU 12 HA GLU 12 11.436 8.479 2.048
114 HB2 GLU 12 HB2 GLU 12 9.090 9.646 0.908
115 HB3 GLU 12 HB3 GLU 12 8.564 8.923 2.421
116 HG2 GLU 12 HG2 GLU 12 11.025 10.220 3.046
117 HG3 GLU 12 HG3 GLU 12 10.247 11.292 1.905
118 H LEU 13 H LEU 13 8.717 6.322 1.155
119 HA LEU 13 HA LEU 13 8.654 5.095 3.791
120 HB2 LEU 13 HB2 LEU 13 7.438 4.462 1.085
121 HB3 LEU 13 HB3 LEU 13 7.327 3.322 2.402
122 HG LEU 13 HG LEU 13 5.315 4.636 2.260
123 HD11 LEU 13 HD11 LEU 13 6.775 5.493 4.786
124 HD12 LEU 13 HD12 LEU 13 5.041 5.234 4.559
125 HD13 LEU 13 HD13 LEU 13 6.150 3.854 4.505
126 HD21 LEU 13 HD21 LEU 13 5.194 7.016 2.783
127 HD22 LEU 13 HD22 LEU 13 6.950 7.122 2.899
128 HD23 LEU 13 HD23 LEU 13 6.182 6.749 1.336
129 H LYS 14 H LYS 14 10.426 4.373 0.856
130 HA LYS 14 HA LYS 14 11.662 1.928 1.592
131 HB2 LYS 14 HB2 LYS 14 11.690 2.903 -0.662
132 HB3 LYS 14 HB3 LYS 14 12.710 4.222 -0.111
133 HG2 LYS 14 HG2 LYS 14 13.808 1.529 0.440
134 HG3 LYS 14 HG3 LYS 14 13.591 1.864 -1.264
135 HD2 LYS 14 HD2 LYS 14 15.076 3.672 -1.277
136 HD3 LYS 14 HD3 LYS 14 15.003 3.908 0.478
137 HE2 LYS 14 HE2 LYS 14 16.396 2.132 0.966
138 HE3 LYS 14 HE3 LYS 14 16.043 1.274 -0.535
139 HZ1 LYS 14 HZ1 LYS 14 18.285 2.283 -0.475
140 HZ2 LYS 14 HZ2 LYS 14 17.408 2.787 -1.750
141 HZ3 LYS 14 HZ3 LYS 14 17.610 3.785 -0.457
142 H LYS 15 H LYS 15 12.081 4.995 3.152
143 HA LYS 15 HA LYS 15 14.715 4.757 4.225
144 HB2 LYS 15 HB2 LYS 15 12.114 5.777 5.398
145 HB3 LYS 15 HB3 LYS 15 13.619 5.845 6.305
146 HG2 LYS 15 HG2 LYS 15 14.656 7.372 4.852
147 HG3 LYS 15 HG3 LYS 15 13.600 6.963 3.505
148 HD2 LYS 15 HD2 LYS 15 12.502 8.814 3.929
149 HD3 LYS 15 HD3 LYS 15 11.754 7.977 5.287
150 HE2 LYS 15 HE2 LYS 15 13.405 8.905 6.809
151 HE3 LYS 15 HE3 LYS 15 14.231 9.710 5.465
152 HZ1 LYS 15 HZ1 LYS 15 11.364 10.248 5.610
153 HZ2 LYS 15 HZ2 LYS 15 12.210 10.835 6.892
154 HZ3 LYS 15 HZ3 LYS 15 12.613 11.275 5.348
155 H LEU 16 H LEU 16 11.743 2.988 5.109
156 HA LEU 16 HA LEU 16 13.309 1.529 7.140
157 HB2 LEU 16 HB2 LEU 16 11.403 0.936 8.220
158 HB3 LEU 16 HB3 LEU 16 10.967 2.496 7.582
159 HG LEU 16 HG LEU 16 10.142 0.682 5.576
160 HD11 LEU 16 HD11 LEU 16 9.007 -0.391 8.194
161 HD12 LEU 16 HD12 LEU 16 8.996 -1.122 6.569
162 HD13 LEU 16 HD13 LEU 16 10.473 -1.079 7.540
163 HD21 LEU 16 HD21 LEU 16 7.929 1.397 6.098
164 HD22 LEU 16 HD22 LEU 16 8.335 1.730 7.790
165 HD23 LEU 16 HD23 LEU 16 8.971 2.760 6.484
166 H SER 17 H SER 17 13.843 1.206 4.345
167 HA SER 17 HA SER 17 14.473 -0.343 2.843
168 HB2 SER 17 HB2 SER 17 14.076 -2.165 5.153
169 HB3 SER 17 HB3 SER 17 13.978 -2.913 3.567
170 HG SER 17 HG SER 17 16.084 -2.608 4.718
171 HA PRO 18 HA PRO 18 10.635 -0.887 0.701
172 HB2 PRO 18 HB2 PRO 18 11.500 -2.174 -1.598
173 HB3 PRO 18 HB3 PRO 18 11.669 -0.428 -1.278
174 HG2 PRO 18 HG2 PRO 18 13.761 -2.551 -1.197
175 HG3 PRO 18 HG3 PRO 18 13.928 -0.798 -1.489
176 HD2 PRO 18 HD2 PRO 18 14.429 -2.212 0.944
177 HD3 PRO 18 HD3 PRO 18 14.417 -0.453 0.719
178 H GLU 19 H GLU 19 12.770 -3.734 1.016
179 HA GLU 19 HA GLU 19 10.623 -5.637 0.595
180 HB2 GLU 19 HB2 GLU 19 13.140 -5.908 0.118
181 HB3 GLU 19 HB3 GLU 19 13.331 -6.256 1.834
182 HG2 GLU 19 HG2 GLU 19 12.206 -8.292 1.672
183 HG3 GLU 19 HG3 GLU 19 11.167 -7.751 0.363
184 H GLU 20 H GLU 20 11.660 -3.809 3.311
185 HA GLU 20 HA GLU 20 10.712 -5.579 5.421
186 HB2 GLU 20 HB2 GLU 20 12.112 -3.070 5.154
187 HB3 GLU 20 HB3 GLU 20 10.741 -2.838 6.215
188 HG2 GLU 20 HG2 GLU 20 12.350 -3.363 7.734
189 HG3 GLU 20 HG3 GLU 20 11.635 -4.950 7.477
190 H LEU 21 H LEU 21 9.401 -2.751 3.583
191 HA LEU 21 HA LEU 21 6.976 -2.631 5.106
192 HB2 LEU 21 HB2 LEU 21 8.149 -1.227 2.864
193 HB3 LEU 21 HB3 LEU 21 6.545 -1.754 2.385
194 HG LEU 21 HG LEU 21 7.183 -0.234 4.936
195 HD11 LEU 21 HD11 LEU 21 5.949 1.639 3.652
196 HD12 LEU 21 HD12 LEU 21 7.607 1.237 3.161
197 HD13 LEU 21 HD13 LEU 21 6.230 0.660 2.197
198 HD21 LEU 21 HD21 LEU 21 5.114 -1.496 5.244
199 HD22 LEU 21 HD22 LEU 21 4.752 0.217 5.064
200 HD23 LEU 21 HD23 LEU 21 4.481 -0.891 3.697
201 H ASN 22 H ASN 22 7.775 -4.163 1.950
202 HA ASN 22 HA ASN 22 5.297 -5.410 1.497
203 HB2 ASN 22 HB2 ASN 22 7.384 -5.249 -0.014
204 HB3 ASN 22 HB3 ASN 22 7.929 -6.722 0.799
205 HD21 ASN 22 HD21 ASN 22 7.586 -8.315 -0.810
206 HD22 ASN 22 HD22 ASN 22 5.998 -8.510 -1.569
207 H ARG 23 H ARG 23 8.033 -6.547 3.495
208 HA ARG 23 HA ARG 23 6.985 -9.056 4.295
209 HB2 ARG 23 HB2 ARG 23 9.294 -8.253 4.709
210 HB3 ARG 23 HB3 ARG 23 8.713 -7.127 5.925
211 HG2 ARG 23 HG2 ARG 23 8.026 -10.050 6.180
212 HG3 ARG 23 HG3 ARG 23 9.657 -9.504 6.582
213 HD2 ARG 23 HD2 ARG 23 8.917 -8.068 8.313
214 HD3 ARG 23 HD3 ARG 23 7.221 -8.190 7.842
215 HE ARG 23 HE ARG 23 7.785 -10.778 8.337
216 HH11 ARG 23 HH22 ARG 23 8.195 -7.929 10.322
217 HH12 ARG 23 HH21 ARG 23 8.085 -8.810 11.821
218 HH21 ARG 23 HH12 ARG 23 7.603 -11.885 10.245
219 HH22 ARG 23 HH11 ARG 23 7.745 -11.051 11.764
220 H TYR 24 H TYR 24 6.568 -5.879 5.911
221 HA TYR 24 HA TYR 24 4.671 -6.857 7.876
222 HB2 TYR 24 HB2 TYR 24 5.703 -4.182 6.970
223 HB3 TYR 24 HB3 TYR 24 4.210 -4.238 7.880
224 HD1 TYR 24 HD2 TYR 24 7.726 -5.608 8.056
225 HD2 TYR 24 HD1 TYR 24 4.286 -4.131 10.202
226 HE1 TYR 24 HE2 TYR 24 8.996 -5.746 10.202
227 HE2 TYR 24 HE1 TYR 24 5.549 -4.283 12.335
228 HH TYR 24 HH TYR 24 8.218 -4.236 12.920
229 H TYR 25 H TYR 25 4.385 -5.894 4.588
230 HA TYR 25 HA TYR 25 1.553 -5.374 4.574
231 HB2 TYR 25 HB2 TYR 25 3.698 -5.098 2.796
232 HB3 TYR 25 HB3 TYR 25 2.762 -6.350 2.036
233 HD1 TYR 25 HD1 TYR 25 0.142 -5.811 1.883
234 HD2 TYR 25 HD2 TYR 25 3.269 -2.894 2.415
235 HE1 TYR 25 HE1 TYR 25 -1.314 -4.040 0.878
236 HE2 TYR 25 HE2 TYR 25 1.838 -1.150 1.371
237 HH TYR 25 HH TYR 25 -0.043 -0.981 -0.114
238 H ALA 26 H ALA 26 3.501 -8.290 3.640
239 HA ALA 26 HA ALA 26 1.245 -9.890 2.923
240 HB1 ALA 26 HB1 ALA 26 4.045 -10.547 3.936
241 HB2 ALA 26 HB2 ALA 26 2.877 -11.812 3.499
242 HB3 ALA 26 HB3 ALA 26 3.412 -10.640 2.276
243 H SER 27 H SER 27 2.825 -9.467 6.141
244 HA SER 27 HA SER 27 1.044 -11.236 7.540
245 HB2 SER 27 HB2 SER 27 1.937 -9.965 9.559
246 HB3 SER 27 HB3 SER 27 3.148 -10.764 8.537
247 HG SER 27 HG SER 27 3.906 -8.733 8.826
248 H LEU 28 H LEU 28 0.458 -8.169 6.179
249 HA LEU 28 HA LEU 28 -1.893 -7.746 7.924
250 HB2 LEU 28 HB2 LEU 28 -0.337 -5.960 6.055
251 HB3 LEU 28 HB3 LEU 28 -1.986 -5.551 6.495
252 HG LEU 28 HG LEU 28 0.185 -6.119 8.540
253 HD11 LEU 28 HD11 LEU 28 0.483 -3.742 8.809
254 HD12 LEU 28 HD12 LEU 28 0.723 -4.131 7.100
255 HD13 LEU 28 HD13 LEU 28 -0.797 -3.382 7.624
256 HD21 LEU 28 HD21 LEU 28 -2.308 -4.444 9.016
257 HD22 LEU 28 HD22 LEU 28 -2.400 -6.195 9.174
258 HD23 LEU 28 HD23 LEU 28 -1.277 -5.291 10.187
259 H ARG 29 H ARG 29 -1.069 -8.073 4.453
260 HA ARG 29 HA ARG 29 -3.684 -7.980 3.423
261 HB2 ARG 29 HB2 ARG 29 -1.235 -8.166 2.335
262 HB3 ARG 29 HB3 ARG 29 -1.621 -9.869 2.251
263 HG2 ARG 29 HG2 ARG 29 -3.043 -9.591 0.520
264 HG3 ARG 29 HG3 ARG 29 -3.857 -8.215 1.245
265 HD2 ARG 29 HD2 ARG 29 -1.100 -7.612 0.267
266 HD3 ARG 29 HD3 ARG 29 -2.232 -8.136 -0.977
267 HE ARG 29 HE ARG 29 -3.319 -6.084 0.793
268 HH11 ARG 29 HH22 ARG 29 -1.441 -6.517 -2.120
269 HH12 ARG 29 HH21 ARG 29 -1.899 -4.980 -2.799
270 HH21 ARG 29 HH12 ARG 29 -3.955 -4.126 -0.138
271 HH22 ARG 29 HH11 ARG 29 -3.337 -3.675 -1.703
272 H HIS 30 H HIS 30 -1.932 -10.733 4.802
273 HA HIS 30 HA HIS 30 -4.054 -12.657 4.407
274 HB2 HIS 30 HB2 HIS 30 -1.381 -12.709 5.316
275 HB3 HIS 30 HB3 HIS 30 -2.311 -13.152 6.736
276 HD1 HIS 30 HD1 HIS 30 -0.937 -14.558 3.659
277 HD2 HIS 30 HD2 HIS 30 -4.255 -15.262 6.140
278 HE1 HIS 30 HE1 HIS 30 -1.739 -16.957 3.160
279 H TYR 31 H TYR 31 -3.386 -10.249 6.938
280 HA TYR 31 HA TYR 31 -5.286 -11.281 8.872
281 HB2 TYR 31 HB2 TYR 31 -3.562 -8.851 8.537
282 HB3 TYR 31 HB3 TYR 31 -5.037 -8.617 9.402
283 HD1 TYR 31 HD1 TYR 31 -2.676 -11.553 9.304
284 HD2 TYR 31 HD2 TYR 31 -4.365 -8.343 11.636
285 HE1 TYR 31 HE1 TYR 31 -1.482 -12.392 11.288
286 HE2 TYR 31 HE2 TYR 31 -3.151 -9.191 13.651
287 HH TYR 31 HH TYR 31 -0.977 -12.001 13.474
288 H LEU 32 H LEU 32 -5.306 -8.517 6.558
289 HA LEU 32 HA LEU 32 -7.941 -7.714 7.036
290 HB2 LEU 32 HB2 LEU 32 -6.650 -7.525 4.307
291 HB3 LEU 32 HB3 LEU 32 -7.918 -6.524 4.990
292 HG LEU 32 HG LEU 32 -4.985 -6.528 5.546
293 HD11 LEU 32 HD11 LEU 32 -5.985 -3.896 5.442
294 HD12 LEU 32 HD12 LEU 32 -5.013 -4.770 4.252
295 HD13 LEU 32 HD13 LEU 32 -6.778 -4.790 4.136
296 HD21 LEU 32 HD21 LEU 32 -5.751 -6.524 7.815
297 HD22 LEU 32 HD22 LEU 32 -5.326 -4.873 7.412
298 HD23 LEU 32 HD23 LEU 32 -7.041 -5.356 7.443
299 H ASN 33 H ASN 33 -6.888 -10.373 5.069
300 HA ASN 33 HA ASN 33 -9.142 -11.206 3.673
301 HB2 ASN 33 HB2 ASN 33 -6.750 -12.288 4.122
302 HB3 ASN 33 HB3 ASN 33 -7.602 -13.166 5.391
303 HD21 ASN 33 HD21 ASN 33 -8.347 -15.183 4.681
304 HD22 ASN 33 HD22 ASN 33 -8.741 -15.448 2.975
305 H LEU 34 H LEU 34 -8.709 -11.323 7.189
306 HA LEU 34 HA LEU 34 -11.624 -11.646 7.474
307 HB2 LEU 34 HB2 LEU 34 -11.604 -13.410 8.954
308 HB3 LEU 34 HB3 LEU 34 -10.610 -13.937 7.623
309 HG LEU 34 HG LEU 34 -9.141 -12.685 9.953
310 HD11 LEU 34 HD11 LEU 34 -10.338 -15.455 10.210
311 HD12 LEU 34 HD12 LEU 34 -9.344 -14.561 11.393
312 HD13 LEU 34 HD13 LEU 34 -10.972 -13.995 11.014
313 HD21 LEU 34 HD21 LEU 34 -8.638 -14.908 7.978
314 HD22 LEU 34 HD22 LEU 34 -7.612 -13.540 8.454
315 HD23 LEU 34 HD23 LEU 34 -7.806 -14.928 9.537
316 H VAL 35 H VAL 35 -9.155 -9.740 8.141
317 HA VAL 35 HA VAL 35 -9.991 -8.971 10.874
318 HB VAL 35 HB VAL 35 -7.639 -8.275 9.159
319 HG11 VAL 35 HG11 VAL 35 -8.046 -6.155 10.083
320 HG12 VAL 35 HG12 VAL 35 -8.348 -6.851 11.701
321 HG13 VAL 35 HG13 VAL 35 -6.720 -6.888 10.983
322 HG21 VAL 35 HG21 VAL 35 -6.626 -9.876 10.417
323 HG22 VAL 35 HG22 VAL 35 -7.056 -9.046 11.910
324 HG23 VAL 35 HG23 VAL 35 -8.151 -10.232 11.186
325 H THR 36 H THR 36 -10.500 -7.954 7.593
326 HA THR 36 HA THR 36 -11.272 -5.263 8.241
327 HB THR 36 HB THR 36 -12.609 -5.467 6.048
328 HG1 THR 36 HG1 THR 36 -12.809 -7.423 5.364
329 HG21 THR 36 HG21 THR 36 -10.588 -4.363 5.790
330 HG22 THR 36 HG22 THR 36 -9.621 -5.716 6.392
331 HG23 THR 36 HG23 THR 36 -10.305 -5.777 4.754
332 H ARG 37 H ARG 37 -13.061 -8.243 8.065
333 HA ARG 37 HA ARG 37 -15.691 -7.197 8.552
334 HB2 ARG 37 HB2 ARG 37 -16.356 -9.428 9.192
335 HB3 ARG 37 HB3 ARG 37 -15.310 -9.522 7.777
336 HG2 ARG 37 HG2 ARG 37 -13.490 -10.385 9.004
337 HG3 ARG 37 HG3 ARG 37 -14.107 -9.827 10.551
338 HD2 ARG 37 HD2 ARG 37 -14.818 -11.857 10.935
339 HD3 ARG 37 HD3 ARG 37 -16.123 -11.545 9.785
340 HE ARG 37 HE ARG 37 -13.992 -12.395 8.220
341 HH11 ARG 37 HH22 ARG 37 -15.712 -13.807 10.923
342 HH12 ARG 37 HH21 ARG 37 -15.444 -15.446 10.415
343 HH21 ARG 37 HH12 ARG 37 -13.512 -14.504 7.656
344 HH22 ARG 37 HH11 ARG 37 -14.137 -15.824 8.605
345 H GLN 38 H GLN 38 -13.116 -7.158 10.628
346 HA GLN 38 HA GLN 38 -14.803 -6.352 12.907
347 HB2 GLN 38 HB2 GLN 38 -13.229 -8.818 12.747
348 HB3 GLN 38 HB3 GLN 38 -12.594 -7.812 14.034
349 HG2 GLN 38 HG2 GLN 38 -15.534 -8.567 13.694
350 HG3 GLN 38 HG3 GLN 38 -14.397 -9.373 14.777
351 HE21 GLN 38 HE21 GLN 38 -16.622 -6.691 14.514
352 HE22 GLN 38 HE22 GLN 38 -16.115 -5.962 16.044
353 H ARG 39 H ARG 39 -12.746 -5.202 10.844
354 HA ARG 39 HA ARG 39 -11.666 -3.070 12.439
355 HB2 ARG 39 HB2 ARG 39 -10.231 -5.340 12.904
356 HB3 ARG 39 HB3 ARG 39 -9.387 -4.793 11.484
357 HG2 ARG 39 HG2 ARG 39 -8.841 -2.675 12.497
358 HG3 ARG 39 HG3 ARG 39 -9.929 -2.979 13.864
359 HD2 ARG 39 HD2 ARG 39 -7.534 -4.744 13.216
360 HD3 ARG 39 HD3 ARG 39 -7.445 -3.374 14.318
361 HE ARG 39 HE ARG 39 -8.746 -5.966 14.802
362 HH11 ARG 39 HH22 ARG 39 -8.666 -2.665 15.889
363 HH12 ARG 39 HH21 ARG 39 -9.335 -3.042 17.459
364 HH21 ARG 39 HH12 ARG 39 -9.605 -6.434 16.830
365 HH22 ARG 39 HH11 ARG 39 -9.895 -5.159 17.953
366 H TYR 40 H TYR 40 -12.989 -2.392 10.540
367 HA TYR 40 HA TYR 40 -11.186 -1.588 8.327
368 HB2 TYR 40 HB2 TYR 40 -12.278 -3.551 7.488
369 HB3 TYR 40 HB3 TYR 40 -13.856 -3.000 8.039
370 HD1 TYR 40 HD1 TYR 40 -11.078 -1.494 5.975
371 HD2 TYR 40 HD2 TYR 40 -15.255 -2.589 6.220
372 HE1 TYR 40 HE1 TYR 40 -11.478 -0.458 3.764
373 HE2 TYR 40 HE2 TYR 40 -15.653 -1.545 4.005
374 HH TYR 40 HH TYR 40 -13.004 0.052 2.206
375 HN1 NH2 41 HN1 NH2 41 -14.645 -1.018 8.066
376 HN2 NH2 41 HN2 NH2 41 -14.539 0.665 8.584
Start of MODEL 10
1 HA TYR 1 HA TYR 1 -4.693 12.537 -6.665
2 HB2 TYR 1 HB2 TYR 1 -5.189 13.724 -8.656
3 HB3 TYR 1 HB3 TYR 1 -5.975 14.592 -7.349
4 HD1 TYR 1 HD2 TYR 1 -4.904 16.780 -6.472
5 HD2 TYR 1 HD1 TYR 1 -3.496 14.745 -10.026
6 HE1 TYR 1 HE2 TYR 1 -3.649 18.809 -7.155
7 HE2 TYR 1 HE1 TYR 1 -2.306 16.807 -10.725
8 HH TYR 1 HH TYR 1 -2.140 19.101 -10.330
9 H LEU 2 H LEU 2 -1.816 14.311 -5.854
10 HA LEU 2 HA LEU 2 -0.263 13.708 -8.175
11 HB2 LEU 2 HB2 LEU 2 0.375 14.509 -5.308
12 HB3 LEU 2 HB3 LEU 2 1.582 14.240 -6.547
13 HG LEU 2 HG LEU 2 -0.221 16.034 -7.776
14 HD11 LEU 2 HD11 LEU 2 0.074 17.986 -6.090
15 HD12 LEU 2 HD12 LEU 2 -1.251 16.848 -5.825
16 HD13 LEU 2 HD13 LEU 2 0.244 16.731 -4.857
17 HD21 LEU 2 HD21 LEU 2 2.189 15.901 -8.137
18 HD22 LEU 2 HD22 LEU 2 1.726 17.551 -7.693
19 HD23 LEU 2 HD23 LEU 2 2.503 16.490 -6.495
20 H GLU 3 H GLU 3 -1.233 11.422 -8.232
21 HA GLU 3 HA GLU 3 -0.299 9.390 -6.472
22 HB2 GLU 3 HB2 GLU 3 -1.549 9.544 -9.172
23 HB3 GLU 3 HB3 GLU 3 -0.455 8.189 -8.986
24 HG2 GLU 3 HG2 GLU 3 -1.820 7.932 -6.641
25 HG3 GLU 3 HG3 GLU 3 -3.062 8.719 -7.619
26 H ARG 4 H ARG 4 1.271 10.855 -9.278
27 HA ARG 4 HA ARG 4 3.548 9.171 -9.447
28 HB2 ARG 4 HB2 ARG 4 3.125 10.889 -11.085
29 HB3 ARG 4 HB3 ARG 4 3.296 12.185 -9.884
30 HG2 ARG 4 HG2 ARG 4 5.619 11.955 -9.736
31 HG3 ARG 4 HG3 ARG 4 5.572 10.240 -10.155
32 HD2 ARG 4 HD2 ARG 4 4.743 11.207 -12.504
33 HD3 ARG 4 HD3 ARG 4 5.706 12.600 -11.963
34 HE ARG 4 HE ARG 4 7.374 10.529 -11.432
35 HH11 ARG 4 HH22 ARG 4 5.579 11.172 -14.350
36 HH12 ARG 4 HH21 ARG 4 6.704 10.343 -15.384
37 HH21 ARG 4 HH12 ARG 4 8.803 9.427 -12.770
38 HH22 ARG 4 HH11 ARG 4 8.502 9.371 -14.481
39 H GLU 5 H GLU 5 2.807 11.701 -7.048
40 HA GLU 5 HA GLU 5 5.396 11.936 -5.944
41 HB2 GLU 5 HB2 GLU 5 2.976 13.123 -5.419
42 HB3 GLU 5 HB3 GLU 5 3.102 12.055 -4.039
43 HG2 GLU 5 HG2 GLU 5 4.270 13.779 -3.151
44 HG3 GLU 5 HG3 GLU 5 5.632 13.098 -4.037
45 H LEU 6 H LEU 6 2.753 9.617 -5.230
46 HA LEU 6 HA LEU 6 3.987 8.276 -3.040
47 HB2 LEU 6 HB2 LEU 6 1.937 7.450 -5.113
48 HB3 LEU 6 HB3 LEU 6 2.586 6.253 -4.019
49 HG LEU 6 HG LEU 6 1.314 8.827 -3.028
50 HD11 LEU 6 HD11 LEU 6 -0.480 7.794 -4.150
51 HD12 LEU 6 HD12 LEU 6 0.093 6.158 -3.790
52 HD13 LEU 6 HD13 LEU 6 -0.636 7.145 -2.508
53 HD21 LEU 6 HD21 LEU 6 1.377 6.257 -1.467
54 HD22 LEU 6 HD22 LEU 6 2.893 7.149 -1.593
55 HD23 LEU 6 HD23 LEU 6 1.471 7.946 -0.911
56 H LYS 7 H LYS 7 4.395 7.855 -6.530
57 HA LYS 7 HA LYS 7 6.155 5.571 -6.334
58 HB2 LYS 7 HB2 LYS 7 4.888 6.860 -8.409
59 HB3 LYS 7 HB3 LYS 7 6.520 7.479 -8.641
60 HG2 LYS 7 HG2 LYS 7 5.834 4.529 -8.299
61 HG3 LYS 7 HG3 LYS 7 5.874 5.314 -9.876
62 HD2 LYS 7 HD2 LYS 7 8.221 5.643 -9.820
63 HD3 LYS 7 HD3 LYS 7 8.304 5.433 -8.073
64 HE2 LYS 7 HE2 LYS 7 7.297 3.037 -8.608
65 HE3 LYS 7 HE3 LYS 7 8.038 3.314 -10.188
66 HZ1 LYS 7 HZ1 LYS 7 9.504 3.605 -7.637
67 HZ2 LYS 7 HZ2 LYS 7 9.398 2.167 -8.444
68 HZ3 LYS 7 HZ3 LYS 7 10.148 3.452 -9.152
69 H LYS 8 H LYS 8 6.741 9.067 -6.425
70 HA LYS 8 HA LYS 8 9.619 8.778 -5.993
71 HB2 LYS 8 HB2 LYS 8 7.758 10.974 -6.525
72 HB3 LYS 8 HB3 LYS 8 8.813 11.406 -5.189
73 HG2 LYS 8 HG2 LYS 8 9.744 10.310 -7.874
74 HG3 LYS 8 HG3 LYS 8 9.704 12.017 -7.467
75 HD2 LYS 8 HD2 LYS 8 11.273 10.295 -5.551
76 HD3 LYS 8 HD3 LYS 8 11.885 10.375 -7.192
77 HE2 LYS 8 HE2 LYS 8 12.989 12.158 -6.222
78 HE3 LYS 8 HE3 LYS 8 11.606 12.944 -6.991
79 HZ1 LYS 8 HZ1 LYS 8 10.556 12.521 -4.637
80 HZ2 LYS 8 HZ2 LYS 8 12.115 12.482 -4.145
81 HZ3 LYS 8 HZ3 LYS 8 11.529 13.826 -4.890
82 H LEU 9 H LEU 9 7.049 8.302 -3.922
83 HA LEU 9 HA LEU 9 8.522 8.974 -1.475
84 HB2 LEU 9 HB2 LEU 9 5.842 9.067 -2.117
85 HB3 LEU 9 HB3 LEU 9 5.930 7.480 -1.384
86 HG LEU 9 HG LEU 9 7.286 8.771 0.507
87 HD11 LEU 9 HD11 LEU 9 6.885 10.929 -1.191
88 HD12 LEU 9 HD12 LEU 9 5.526 11.107 -0.079
89 HD13 LEU 9 HD13 LEU 9 7.191 11.054 0.545
90 HD21 LEU 9 HD21 LEU 9 4.276 9.087 0.186
91 HD22 LEU 9 HD22 LEU 9 5.113 7.650 0.812
92 HD23 LEU 9 HD23 LEU 9 5.194 9.176 1.709
93 H GLU 10 H GLU 10 7.104 6.030 -3.022
94 HA GLU 10 HA GLU 10 8.073 4.100 -1.222
95 HB2 GLU 10 HB2 GLU 10 6.484 3.794 -3.185
96 HB3 GLU 10 HB3 GLU 10 7.919 3.713 -4.219
97 HG2 GLU 10 HG2 GLU 10 8.739 1.796 -2.770
98 HG3 GLU 10 HG3 GLU 10 7.211 1.858 -1.895
99 H ARG 11 H ARG 11 9.747 5.777 -3.815
100 HA ARG 11 HA ARG 11 12.214 4.338 -3.807
101 HB2 ARG 11 HB2 ARG 11 11.218 6.818 -4.972
102 HB3 ARG 11 HB3 ARG 11 12.730 7.170 -4.148
103 HG2 ARG 11 HG2 ARG 11 13.546 4.930 -5.400
104 HG3 ARG 11 HG3 ARG 11 12.201 5.348 -6.472
105 HD2 ARG 11 HD2 ARG 11 13.533 7.790 -6.136
106 HD3 ARG 11 HD3 ARG 11 14.860 6.637 -6.067
107 HE ARG 11 HE ARG 11 13.284 7.410 -8.367
108 HH11 ARG 11 HH22 ARG 11 15.129 4.669 -7.157
109 HH12 ARG 11 HH21 ARG 11 15.378 3.998 -8.736
110 HH21 ARG 11 HH12 ARG 11 13.693 6.548 -10.408
111 HH22 ARG 11 HH11 ARG 11 14.589 5.066 -10.521
112 H GLU 12 H GLU 12 11.195 7.120 -1.790
113 HA GLU 12 HA GLU 12 13.782 7.160 -0.430
114 HB2 GLU 12 HB2 GLU 12 11.868 9.100 -0.754
115 HB3 GLU 12 HB3 GLU 12 11.425 8.493 0.837
116 HG2 GLU 12 HG2 GLU 12 14.251 8.700 0.962
117 HG3 GLU 12 HG3 GLU 12 13.779 10.060 -0.041
118 H LEU 13 H LEU 13 10.514 5.909 0.243
119 HA LEU 13 HA LEU 13 10.894 4.978 2.883
120 HB2 LEU 13 HB2 LEU 13 9.256 4.086 0.513
121 HB3 LEU 13 HB3 LEU 13 9.256 3.114 1.951
122 HG LEU 13 HG LEU 13 8.467 6.055 1.941
123 HD11 LEU 13 HD11 LEU 13 6.132 4.841 2.348
124 HD12 LEU 13 HD12 LEU 13 6.747 5.127 0.715
125 HD13 LEU 13 HD13 LEU 13 6.903 3.519 1.454
126 HD21 LEU 13 HD21 LEU 13 9.170 5.409 4.149
127 HD22 LEU 13 HD22 LEU 13 7.410 5.376 4.152
128 HD23 LEU 13 HD23 LEU 13 8.316 3.858 4.049
129 H LYS 14 H LYS 14 12.207 3.661 -0.082
130 HA LYS 14 HA LYS 14 13.215 1.177 0.864
131 HB2 LYS 14 HB2 LYS 14 13.225 2.193 -1.520
132 HB3 LYS 14 HB3 LYS 14 14.691 3.043 -1.020
133 HG2 LYS 14 HG2 LYS 14 14.968 0.252 -0.323
134 HG3 LYS 14 HG3 LYS 14 14.340 0.339 -1.949
135 HD2 LYS 14 HD2 LYS 14 16.563 0.317 -2.395
136 HD3 LYS 14 HD3 LYS 14 16.309 2.060 -2.357
137 HE2 LYS 14 HE2 LYS 14 17.424 2.314 -0.303
138 HE3 LYS 14 HE3 LYS 14 17.087 0.665 0.209
139 HZ1 LYS 14 HZ1 LYS 14 18.915 1.256 -2.035
140 HZ2 LYS 14 HZ2 LYS 14 19.472 1.091 -0.502
141 HZ3 LYS 14 HZ3 LYS 14 18.727 -0.168 -1.258
142 H LYS 15 H LYS 15 14.101 4.347 1.937
143 HA LYS 15 HA LYS 15 16.735 4.077 2.863
144 HB2 LYS 15 HB2 LYS 15 16.126 5.651 4.609
145 HB3 LYS 15 HB3 LYS 15 15.363 6.118 3.095
146 HG2 LYS 15 HG2 LYS 15 13.225 4.957 3.957
147 HG3 LYS 15 HG3 LYS 15 14.033 4.746 5.492
148 HD2 LYS 15 HD2 LYS 15 14.189 7.536 4.547
149 HD3 LYS 15 HD3 LYS 15 12.535 6.968 4.630
150 HE2 LYS 15 HE2 LYS 15 14.071 6.123 7.005
151 HE3 LYS 15 HE3 LYS 15 14.192 7.864 6.759
152 HZ1 LYS 15 HZ1 LYS 15 11.730 6.277 7.134
153 HZ2 LYS 15 HZ2 LYS 15 12.280 7.520 8.053
154 HZ3 LYS 15 HZ3 LYS 15 11.694 7.807 6.539
155 H LEU 16 H LEU 16 13.791 2.585 4.162
156 HA LEU 16 HA LEU 16 15.427 1.300 6.260
157 HB2 LEU 16 HB2 LEU 16 13.593 1.059 7.579
158 HB3 LEU 16 HB3 LEU 16 13.231 2.550 6.763
159 HG LEU 16 HG LEU 16 12.055 0.587 5.119
160 HD11 LEU 16 HD11 LEU 16 12.473 -0.925 7.272
161 HD12 LEU 16 HD12 LEU 16 11.102 -0.080 7.937
162 HD13 LEU 16 HD13 LEU 16 10.927 -1.005 6.425
163 HD21 LEU 16 HD21 LEU 16 11.174 2.905 6.063
164 HD22 LEU 16 HD22 LEU 16 10.063 1.665 5.534
165 HD23 LEU 16 HD23 LEU 16 10.365 1.875 7.263
166 H SER 17 H SER 17 15.682 0.609 3.512
167 HA SER 17 HA SER 17 16.011 -1.136 2.146
168 HB2 SER 17 HB2 SER 17 15.736 -2.599 4.704
169 HB3 SER 17 HB3 SER 17 15.496 -3.557 3.248
170 HG SER 17 HG SER 17 17.688 -3.136 4.219
171 HA PRO 18 HA PRO 18 11.977 -1.748 0.462
172 HB2 PRO 18 HB2 PRO 18 12.540 -3.373 -1.706
173 HB3 PRO 18 HB3 PRO 18 12.866 -1.622 -1.634
174 HG2 PRO 18 HG2 PRO 18 14.795 -3.891 -1.436
175 HG3 PRO 18 HG3 PRO 18 15.066 -2.209 -1.973
176 HD2 PRO 18 HD2 PRO 18 15.666 -3.343 0.586
177 HD3 PRO 18 HD3 PRO 18 15.785 -1.637 0.116
178 H GLU 19 H GLU 19 13.942 -4.682 1.033
179 HA GLU 19 HA GLU 19 11.638 -6.463 1.117
180 HB2 GLU 19 HB2 GLU 19 14.221 -6.953 0.593
181 HB3 GLU 19 HB3 GLU 19 14.285 -7.229 2.335
182 HG2 GLU 19 HG2 GLU 19 12.175 -8.765 1.893
183 HG3 GLU 19 HG3 GLU 19 12.633 -8.641 0.207
184 H GLU 20 H GLU 20 12.875 -4.195 3.326
185 HA GLU 20 HA GLU 20 12.096 -5.643 5.778
186 HB2 GLU 20 HB2 GLU 20 13.720 -3.369 5.042
187 HB3 GLU 20 HB3 GLU 20 12.522 -2.871 6.222
188 HG2 GLU 20 HG2 GLU 20 14.114 -3.427 7.689
189 HG3 GLU 20 HG3 GLU 20 13.416 -5.035 7.526
190 H LEU 21 H LEU 21 10.831 -3.036 3.655
191 HA LEU 21 HA LEU 21 8.641 -2.366 5.410
192 HB2 LEU 21 HB2 LEU 21 9.708 -1.478 2.864
193 HB3 LEU 21 HB3 LEU 21 8.000 -1.820 2.648
194 HG LEU 21 HG LEU 21 9.089 -0.129 4.918
195 HD11 LEU 21 HD11 LEU 21 8.070 1.744 3.400
196 HD12 LEU 21 HD12 LEU 21 9.686 1.099 3.042
197 HD13 LEU 21 HD13 LEU 21 8.278 0.572 2.089
198 HD21 LEU 21 HD21 LEU 21 6.851 -0.961 5.419
199 HD22 LEU 21 HD22 LEU 21 6.781 0.763 5.055
200 HD23 LEU 21 HD23 LEU 21 6.261 -0.417 3.831
201 H ASN 22 H ASN 22 8.889 -4.404 2.470
202 HA ASN 22 HA ASN 22 6.263 -5.343 2.365
203 HB2 ASN 22 HB2 ASN 22 8.445 -5.817 0.872
204 HB3 ASN 22 HB3 ASN 22 8.476 -7.302 1.821
205 HD21 ASN 22 HD21 ASN 22 6.781 -5.482 -0.678
206 HD22 ASN 22 HD22 ASN 22 5.654 -6.784 -1.046
207 H ARG 23 H ARG 23 8.880 -6.442 4.484
208 HA ARG 23 HA ARG 23 7.656 -8.693 5.690
209 HB2 ARG 23 HB2 ARG 23 10.070 -7.773 5.966
210 HB3 ARG 23 HB3 ARG 23 9.373 -6.633 7.120
211 HG2 ARG 23 HG2 ARG 23 8.339 -8.731 8.271
212 HG3 ARG 23 HG3 ARG 23 9.506 -9.653 7.321
213 HD2 ARG 23 HD2 ARG 23 10.514 -7.256 8.865
214 HD3 ARG 23 HD3 ARG 23 9.968 -8.659 9.792
215 HE ARG 23 HE ARG 23 11.763 -9.447 7.671
216 HH11 ARG 23 HH22 ARG 23 11.827 -7.907 10.777
217 HH12 ARG 23 HH21 ARG 23 13.375 -8.574 11.235
218 HH21 ARG 23 HH12 ARG 23 13.781 -10.293 8.242
219 HH22 ARG 23 HH11 ARG 23 14.460 -9.948 9.791
220 H TYR 24 H TYR 24 7.600 -5.288 6.858
221 HA TYR 24 HA TYR 24 5.574 -5.757 8.861
222 HB2 TYR 24 HB2 TYR 24 6.887 -3.344 7.593
223 HB3 TYR 24 HB3 TYR 24 5.426 -3.118 8.529
224 HD1 TYR 24 HD1 TYR 24 5.459 -4.630 10.850
225 HD2 TYR 24 HD2 TYR 24 8.839 -2.842 8.847
226 HE1 TYR 24 HE1 TYR 24 6.745 -4.673 12.981
227 HE2 TYR 24 HE2 TYR 24 10.102 -2.841 10.983
228 HH TYR 24 HH TYR 24 10.141 -3.578 13.146
229 H TYR 25 H TYR 25 5.450 -5.143 5.468
230 HA TYR 25 HA TYR 25 2.703 -4.319 5.324
231 HB2 TYR 25 HB2 TYR 25 4.714 -4.205 3.592
232 HB3 TYR 25 HB3 TYR 25 4.114 -5.774 3.081
233 HD1 TYR 25 HD1 TYR 25 2.782 -2.367 3.936
234 HD2 TYR 25 HD2 TYR 25 2.711 -5.727 1.235
235 HE1 TYR 25 HE1 TYR 25 1.213 -1.129 2.439
236 HE2 TYR 25 HE2 TYR 25 1.201 -4.464 -0.297
237 HH TYR 25 HH TYR 25 0.521 -2.152 -0.777
238 H ALA 26 H ALA 26 4.289 -7.535 4.931
239 HA ALA 26 HA ALA 26 1.929 -8.971 4.303
240 HB1 ALA 26 HB1 ALA 26 3.930 -10.422 5.985
241 HB2 ALA 26 HB2 ALA 26 3.290 -10.804 4.376
242 HB3 ALA 26 HB3 ALA 26 4.599 -9.623 4.553
243 H SER 27 H SER 27 3.399 -8.352 7.485
244 HA SER 27 HA SER 27 1.301 -9.539 9.075
245 HB2 SER 27 HB2 SER 27 3.711 -9.001 9.777
246 HB3 SER 27 HB3 SER 27 3.176 -7.316 9.946
247 HG SER 27 HG SER 27 2.771 -9.457 11.591
248 H LEU 28 H LEU 28 1.288 -6.669 7.250
249 HA LEU 28 HA LEU 28 -1.020 -5.576 8.782
250 HB2 LEU 28 HB2 LEU 28 0.976 -4.395 6.842
251 HB3 LEU 28 HB3 LEU 28 -0.607 -3.661 7.011
252 HG LEU 28 HG LEU 28 1.322 -4.138 9.326
253 HD11 LEU 28 HD11 LEU 28 0.802 -1.717 7.580
254 HD12 LEU 28 HD12 LEU 28 1.433 -1.559 9.235
255 HD13 LEU 28 HD13 LEU 28 2.344 -2.478 8.039
256 HD21 LEU 28 HD21 LEU 28 -0.516 -2.186 10.103
257 HD22 LEU 28 HD22 LEU 28 -1.522 -3.324 9.202
258 HD23 LEU 28 HD23 LEU 28 -0.540 -3.891 10.566
259 H ARG 29 H ARG 29 -0.181 -7.158 5.781
260 HA ARG 29 HA ARG 29 -2.750 -6.648 4.507
261 HB2 ARG 29 HB2 ARG 29 -0.328 -7.074 3.431
262 HB3 ARG 29 HB3 ARG 29 -0.836 -8.760 3.522
263 HG2 ARG 29 HG2 ARG 29 -3.039 -7.973 2.376
264 HG3 ARG 29 HG3 ARG 29 -2.199 -6.440 2.098
265 HD2 ARG 29 HD2 ARG 29 -0.393 -7.730 0.886
266 HD3 ARG 29 HD3 ARG 29 -1.330 -9.203 1.141
267 HE ARG 29 HE ARG 29 -2.822 -8.583 -0.514
268 HH11 ARG 29 HH22 ARG 29 -0.873 -5.777 0.219
269 HH12 ARG 29 HH21 ARG 29 -1.484 -4.841 -1.119
270 HH21 ARG 29 HH12 ARG 29 -3.613 -7.368 -2.214
271 HH22 ARG 29 HH11 ARG 29 -3.051 -5.740 -2.460
272 H HIS 30 H HIS 30 -1.165 -9.490 5.983
273 HA HIS 30 HA HIS 30 -3.150 -11.433 5.435
274 HB2 HIS 30 HB2 HIS 30 -0.760 -11.548 6.587
275 HB3 HIS 30 HB3 HIS 30 -1.682 -11.388 8.078
276 HD1 HIS 30 HD1 HIS 30 -0.279 -13.935 6.011
277 HD2 HIS 30 HD2 HIS 30 -3.962 -13.417 7.977
278 HE1 HIS 30 HE1 HIS 30 -1.344 -16.269 6.229
279 H TYR 31 H TYR 31 -3.051 -8.862 7.880
280 HA TYR 31 HA TYR 31 -5.418 -9.570 9.304
281 HB2 TYR 31 HB2 TYR 31 -3.719 -7.118 8.830
282 HB3 TYR 31 HB3 TYR 31 -5.317 -6.863 9.448
283 HD1 TYR 31 HD2 TYR 31 -5.780 -9.065 11.370
284 HD2 TYR 31 HD1 TYR 31 -2.231 -6.759 10.565
285 HE1 TYR 31 HE2 TYR 31 -4.881 -9.649 13.614
286 HE2 TYR 31 HE1 TYR 31 -1.313 -7.374 12.775
287 HH TYR 31 HH TYR 31 -1.605 -8.855 14.596
288 H LEU 32 H LEU 32 -4.938 -7.228 6.613
289 HA LEU 32 HA LEU 32 -7.540 -6.376 6.343
290 HB2 LEU 32 HB2 LEU 32 -5.631 -6.818 4.026
291 HB3 LEU 32 HB3 LEU 32 -6.997 -5.746 4.056
292 HG LEU 32 HG LEU 32 -4.336 -5.514 5.309
293 HD11 LEU 32 HD11 LEU 32 -4.137 -4.106 3.624
294 HD12 LEU 32 HD12 LEU 32 -5.889 -3.969 3.373
295 HD13 LEU 32 HD13 LEU 32 -5.078 -2.957 4.574
296 HD21 LEU 32 HD21 LEU 32 -6.724 -4.180 6.585
297 HD22 LEU 32 HD22 LEU 32 -5.402 -5.097 7.347
298 HD23 LEU 32 HD23 LEU 32 -5.086 -3.505 6.711
299 H ASN 33 H ASN 33 -6.255 -9.344 5.191
300 HA ASN 33 HA ASN 33 -8.160 -10.474 3.528
301 HB2 ASN 33 HB2 ASN 33 -5.938 -11.384 4.720
302 HB3 ASN 33 HB3 ASN 33 -7.087 -12.062 5.870
303 HD21 ASN 33 HD21 ASN 33 -5.862 -14.055 4.934
304 HD22 ASN 33 HD22 ASN 33 -6.620 -14.730 3.487
305 H LEU 34 H LEU 34 -8.473 -9.997 7.033
306 HA LEU 34 HA LEU 34 -11.408 -10.317 6.732
307 HB2 LEU 34 HB2 LEU 34 -11.697 -11.740 8.515
308 HB3 LEU 34 HB3 LEU 34 -10.414 -12.463 7.574
309 HG LEU 34 HG LEU 34 -9.343 -10.682 9.698
310 HD11 LEU 34 HD11 LEU 34 -11.269 -11.266 10.963
311 HD12 LEU 34 HD12 LEU 34 -11.206 -12.963 10.445
312 HD13 LEU 34 HD13 LEU 34 -9.969 -12.321 11.547
313 HD21 LEU 34 HD21 LEU 34 -8.895 -13.658 9.467
314 HD22 LEU 34 HD22 LEU 34 -8.131 -12.516 8.338
315 HD23 LEU 34 HD23 LEU 34 -7.812 -12.381 10.069
316 H VAL 35 H VAL 35 -9.093 -8.240 7.472
317 HA VAL 35 HA VAL 35 -10.477 -6.861 9.702
318 HB VAL 35 HB VAL 35 -7.768 -6.687 8.456
319 HG11 VAL 35 HG11 VAL 35 -7.141 -4.836 9.881
320 HG12 VAL 35 HG12 VAL 35 -8.260 -4.376 8.597
321 HG13 VAL 35 HG13 VAL 35 -8.869 -4.600 10.256
322 HG21 VAL 35 HG21 VAL 35 -8.164 -8.285 10.325
323 HG22 VAL 35 HG22 VAL 35 -7.041 -7.000 10.804
324 HG23 VAL 35 HG23 VAL 35 -8.720 -6.930 11.338
325 H THR 36 H THR 36 -10.161 -6.647 6.290
326 HA THR 36 HA THR 36 -11.530 -3.964 6.362
327 HB THR 36 HB THR 36 -10.526 -4.796 3.736
328 HG1 THR 36 HG1 THR 36 -8.807 -4.395 5.933
329 HG21 THR 36 HG21 THR 36 -9.636 -2.573 3.683
330 HG22 THR 36 HG22 THR 36 -11.203 -2.412 4.510
331 HG23 THR 36 HG23 THR 36 -9.689 -2.411 5.445
332 H ARG 37 H ARG 37 -12.009 -7.229 5.592
333 HA ARG 37 HA ARG 37 -14.194 -7.082 3.780
334 HB2 ARG 37 HB2 ARG 37 -12.653 -9.082 4.946
335 HB3 ARG 37 HB3 ARG 37 -14.211 -9.355 5.726
336 HG2 ARG 37 HG2 ARG 37 -15.305 -9.744 3.631
337 HG3 ARG 37 HG3 ARG 37 -14.026 -8.916 2.729
338 HD2 ARG 37 HD2 ARG 37 -12.490 -10.855 3.682
339 HD3 ARG 37 HD3 ARG 37 -14.041 -11.709 3.820
340 HE ARG 37 HE ARG 37 -13.638 -10.376 1.251
341 HH11 ARG 37 HH22 ARG 37 -12.937 -13.320 2.963
342 HH12 ARG 37 HH21 ARG 37 -12.595 -14.240 1.522
343 HH21 ARG 37 HH12 ARG 37 -13.233 -11.520 -0.582
344 HH22 ARG 37 HH11 ARG 37 -12.757 -13.203 -0.475
345 H GLN 38 H GLN 38 -14.038 -6.261 6.966
346 HA GLN 38 HA GLN 38 -16.963 -5.723 7.153
347 HB2 GLN 38 HB2 GLN 38 -15.134 -6.991 9.224
348 HB3 GLN 38 HB3 GLN 38 -16.609 -6.135 9.691
349 HG2 GLN 38 HG2 GLN 38 -17.882 -7.595 8.050
350 HG3 GLN 38 HG3 GLN 38 -16.428 -8.599 7.927
351 HE21 GLN 38 HE21 GLN 38 -18.831 -9.744 8.839
352 HE22 GLN 38 HE22 GLN 38 -18.695 -9.896 10.605
353 H ARG 39 H ARG 39 -14.451 -4.088 6.414
354 HA ARG 39 HA ARG 39 -13.833 -1.875 6.601
355 HB2 ARG 39 HB2 ARG 39 -16.592 -1.669 7.909
356 HB3 ARG 39 HB3 ARG 39 -15.559 -0.289 7.650
357 HG2 ARG 39 HG2 ARG 39 -16.926 -0.218 5.828
358 HG3 ARG 39 HG3 ARG 39 -15.433 -0.917 5.202
359 HD2 ARG 39 HD2 ARG 39 -16.595 -3.227 5.514
360 HD3 ARG 39 HD3 ARG 39 -18.064 -2.320 5.848
361 HE ARG 39 HE ARG 39 -18.225 -1.756 3.599
362 HH11 ARG 39 HH22 ARG 39 -15.051 -3.330 4.073
363 HH12 ARG 39 HH21 ARG 39 -14.724 -3.302 2.382
364 HH21 ARG 39 HH12 ARG 39 -17.718 -1.858 1.434
365 HH22 ARG 39 HH11 ARG 39 -16.206 -2.482 0.887
366 H TYR 40 H TYR 40 -12.923 -3.727 8.728
367 HA TYR 40 HA TYR 40 -11.843 -3.837 10.644
368 HB2 TYR 40 HB2 TYR 40 -10.914 -1.722 9.294
369 HB3 TYR 40 HB3 TYR 40 -11.447 -0.875 10.724
370 HD1 TYR 40 HD1 TYR 40 -10.610 -3.051 12.820
371 HD2 TYR 40 HD2 TYR 40 -8.617 -1.435 9.340
372 HE1 TYR 40 HE1 TYR 40 -8.414 -3.729 13.748
373 HE2 TYR 40 HE2 TYR 40 -6.431 -2.087 10.292
374 HH TYR 40 HH TYR 40 -5.384 -3.358 11.941
375 HN1 NH2 41 HN1 NH2 41 -14.276 -1.217 10.817
376 HN2 NH2 41 HN2 NH2 41 -14.751 -1.653 12.489
Start of MODEL 11
1 HA TYR 1 HA TYR 1 -2.748 7.589 -12.076
2 HB2 TYR 1 HB2 TYR 1 -4.065 9.469 -12.828
3 HB3 TYR 1 HB3 TYR 1 -4.953 8.504 -11.665
4 HD1 TYR 1 HD2 TYR 1 -5.190 9.365 -9.233
5 HD2 TYR 1 HD1 TYR 1 -3.735 11.820 -12.493
6 HE1 TYR 1 HE2 TYR 1 -5.549 11.401 -7.872
7 HE2 TYR 1 HE1 TYR 1 -4.111 13.847 -11.111
8 HH TYR 1 HH TYR 1 -5.640 13.706 -7.901
9 H LEU 2 H LEU 2 -2.095 10.673 -10.271
10 HA LEU 2 HA LEU 2 0.012 11.461 -12.054
11 HB2 LEU 2 HB2 LEU 2 -1.613 12.949 -10.823
12 HB3 LEU 2 HB3 LEU 2 -0.866 12.459 -9.320
13 HG LEU 2 HG LEU 2 1.364 13.361 -10.610
14 HD11 LEU 2 HD11 LEU 2 0.503 15.587 -11.745
15 HD12 LEU 2 HD12 LEU 2 0.632 14.088 -12.658
16 HD13 LEU 2 HD13 LEU 2 -0.949 14.634 -12.067
17 HD21 LEU 2 HD21 LEU 2 1.136 14.348 -8.618
18 HD22 LEU 2 HD22 LEU 2 0.539 15.721 -9.553
19 HD23 LEU 2 HD23 LEU 2 -0.609 14.625 -8.771
20 H GLU 3 H GLU 3 1.203 9.304 -11.762
21 HA GLU 3 HA GLU 3 2.488 8.576 -9.378
22 HB2 GLU 3 HB2 GLU 3 3.755 8.217 -12.111
23 HB3 GLU 3 HB3 GLU 3 3.788 7.169 -10.696
24 HG2 GLU 3 HG2 GLU 3 1.237 6.869 -11.095
25 HG3 GLU 3 HG3 GLU 3 1.552 7.585 -12.688
26 H ARG 4 H ARG 4 3.446 10.886 -11.814
27 HA ARG 4 HA ARG 4 6.148 11.419 -11.033
28 HB2 ARG 4 HB2 ARG 4 4.677 12.379 -13.066
29 HB3 ARG 4 HB3 ARG 4 4.242 13.622 -11.895
30 HG2 ARG 4 HG2 ARG 4 6.125 14.617 -12.833
31 HG3 ARG 4 HG3 ARG 4 6.903 13.731 -11.522
32 HD2 ARG 4 HD2 ARG 4 7.037 11.772 -13.310
33 HD3 ARG 4 HD3 ARG 4 6.771 13.087 -14.468
34 HE ARG 4 HE ARG 4 8.910 13.629 -12.562
35 HH11 ARG 4 HH22 ARG 4 8.246 12.147 -15.664
36 HH12 ARG 4 HH21 ARG 4 9.894 12.222 -16.194
37 HH21 ARG 4 HH12 ARG 4 11.047 13.691 -13.255
38 HH22 ARG 4 HH11 ARG 4 11.444 13.088 -14.834
39 H GLU 5 H GLU 5 6.953 12.865 -9.536
40 HA GLU 5 HA GLU 5 7.093 14.276 -7.730
41 HB2 GLU 5 HB2 GLU 5 4.800 15.175 -8.580
42 HB3 GLU 5 HB3 GLU 5 4.114 14.249 -7.246
43 HG2 GLU 5 HG2 GLU 5 4.697 15.766 -5.726
44 HG3 GLU 5 HG3 GLU 5 6.366 15.797 -6.278
45 H LEU 6 H LEU 6 4.851 11.505 -7.546
46 HA LEU 6 HA LEU 6 5.538 10.943 -4.748
47 HB2 LEU 6 HB2 LEU 6 4.199 9.209 -6.850
48 HB3 LEU 6 HB3 LEU 6 4.328 8.806 -5.145
49 HG LEU 6 HG LEU 6 2.981 11.396 -6.025
50 HD11 LEU 6 HD11 LEU 6 1.755 8.622 -5.800
51 HD12 LEU 6 HD12 LEU 6 0.833 10.153 -5.879
52 HD13 LEU 6 HD13 LEU 6 1.856 9.656 -7.233
53 HD21 LEU 6 HD21 LEU 6 3.600 11.067 -3.598
54 HD22 LEU 6 HD22 LEU 6 1.866 11.247 -3.892
55 HD23 LEU 6 HD23 LEU 6 2.549 9.633 -3.579
56 H LYS 7 H LYS 7 6.745 9.902 -7.895
57 HA LYS 7 HA LYS 7 8.458 7.833 -6.975
58 HB2 LYS 7 HB2 LYS 7 7.903 9.024 -9.446
59 HB3 LYS 7 HB3 LYS 7 9.600 9.430 -9.221
60 HG2 LYS 7 HG2 LYS 7 8.444 6.622 -8.905
61 HG3 LYS 7 HG3 LYS 7 9.079 7.240 -10.429
62 HD2 LYS 7 HD2 LYS 7 11.314 7.447 -9.539
63 HD3 LYS 7 HD3 LYS 7 10.766 7.092 -7.896
64 HE2 LYS 7 HE2 LYS 7 10.903 4.902 -8.171
65 HE3 LYS 7 HE3 LYS 7 9.844 4.964 -9.576
66 HZ1 LYS 7 HZ1 LYS 7 11.850 5.561 -10.904
67 HZ2 LYS 7 HZ2 LYS 7 12.787 5.269 -9.591
68 HZ3 LYS 7 HZ3 LYS 7 11.906 4.055 -10.272
69 H LYS 8 H LYS 8 9.101 11.313 -7.094
70 HA LYS 8 HA LYS 8 11.814 11.041 -6.017
71 HB2 LYS 8 HB2 LYS 8 11.958 13.369 -6.080
72 HB3 LYS 8 HB3 LYS 8 10.986 12.970 -7.482
73 HG2 LYS 8 HG2 LYS 8 9.252 14.239 -6.748
74 HG3 LYS 8 HG3 LYS 8 9.223 13.403 -5.215
75 HD2 LYS 8 HD2 LYS 8 9.644 15.383 -4.339
76 HD3 LYS 8 HD3 LYS 8 11.324 14.979 -4.657
77 HE2 LYS 8 HE2 LYS 8 9.463 16.569 -6.493
78 HE3 LYS 8 HE3 LYS 8 10.634 17.285 -5.380
79 HZ1 LYS 8 HZ1 LYS 8 12.401 16.152 -6.615
80 HZ2 LYS 8 HZ2 LYS 8 11.314 15.524 -7.669
81 HZ3 LYS 8 HZ3 LYS 8 11.544 17.146 -7.605
82 H LEU 9 H LEU 9 8.784 10.687 -4.648
83 HA LEU 9 HA LEU 9 9.519 11.589 -1.950
84 HB2 LEU 9 HB2 LEU 9 7.131 11.649 -3.324
85 HB3 LEU 9 HB3 LEU 9 6.958 10.123 -2.487
86 HG LEU 9 HG LEU 9 7.882 11.748 -0.442
87 HD11 LEU 9 HD11 LEU 9 7.726 13.693 -2.117
88 HD12 LEU 9 HD12 LEU 9 5.967 13.485 -2.055
89 HD13 LEU 9 HD13 LEU 9 6.872 13.911 -0.581
90 HD21 LEU 9 HD21 LEU 9 4.983 11.355 -1.285
91 HD22 LEU 9 HD22 LEU 9 5.954 10.242 -0.302
92 HD23 LEU 9 HD23 LEU 9 5.552 11.846 0.330
93 H GLU 10 H GLU 10 8.361 8.560 -3.567
94 HA GLU 10 HA GLU 10 8.860 6.780 -1.470
95 HB2 GLU 10 HB2 GLU 10 7.728 6.363 -3.776
96 HB3 GLU 10 HB3 GLU 10 9.365 5.996 -4.334
97 HG2 GLU 10 HG2 GLU 10 9.320 4.442 -2.084
98 HG3 GLU 10 HG3 GLU 10 7.596 4.533 -2.370
99 H ARG 11 H ARG 11 11.133 8.201 -3.704
100 HA ARG 11 HA ARG 11 13.408 6.642 -3.267
101 HB2 ARG 11 HB2 ARG 11 12.973 8.866 -4.725
102 HB3 ARG 11 HB3 ARG 11 13.633 9.664 -3.306
103 HG2 ARG 11 HG2 ARG 11 15.458 9.310 -4.768
104 HG3 ARG 11 HG3 ARG 11 15.672 8.105 -3.499
105 HD2 ARG 11 HD2 ARG 11 14.109 7.364 -5.986
106 HD3 ARG 11 HD3 ARG 11 15.869 7.521 -6.109
107 HE ARG 11 HE ARG 11 15.286 5.873 -3.877
108 HH11 ARG 11 HH22 ARG 11 15.246 5.741 -7.356
109 HH12 ARG 11 HH21 ARG 11 15.396 4.003 -7.434
110 HH21 ARG 11 HH12 ARG 11 15.337 3.614 -4.000
111 HH22 ARG 11 HH11 ARG 11 15.497 2.832 -5.549
112 H GLU 12 H GLU 12 11.997 9.063 -1.111
113 HA GLU 12 HA GLU 12 14.194 8.786 0.834
114 HB2 GLU 12 HB2 GLU 12 12.448 10.868 0.270
115 HB3 GLU 12 HB3 GLU 12 11.678 10.150 1.668
116 HG2 GLU 12 HG2 GLU 12 14.632 10.496 1.964
117 HG3 GLU 12 HG3 GLU 12 13.799 11.991 1.628
118 H LEU 13 H LEU 13 10.820 7.634 0.388
119 HA LEU 13 HA LEU 13 10.531 6.433 2.967
120 HB2 LEU 13 HB2 LEU 13 9.332 5.711 0.268
121 HB3 LEU 13 HB3 LEU 13 9.084 4.724 1.679
122 HG LEU 13 HG LEU 13 8.435 7.101 2.792
123 HD11 LEU 13 HD11 LEU 13 7.339 7.398 -0.033
124 HD12 LEU 13 HD12 LEU 13 7.155 8.505 1.335
125 HD13 LEU 13 HD13 LEU 13 8.739 8.299 0.591
126 HD21 LEU 13 HD21 LEU 13 6.332 5.676 1.144
127 HD22 LEU 13 HD22 LEU 13 7.077 4.907 2.561
128 HD23 LEU 13 HD23 LEU 13 6.206 6.433 2.748
129 H LYS 14 H LYS 14 12.305 5.274 0.155
130 HA LYS 14 HA LYS 14 13.074 2.697 1.079
131 HB2 LYS 14 HB2 LYS 14 13.592 3.350 -1.152
132 HB3 LYS 14 HB3 LYS 14 14.522 4.757 -0.620
133 HG2 LYS 14 HG2 LYS 14 16.323 3.462 0.166
134 HG3 LYS 14 HG3 LYS 14 15.374 1.956 0.163
135 HD2 LYS 14 HD2 LYS 14 15.374 1.926 -2.270
136 HD3 LYS 14 HD3 LYS 14 16.301 3.460 -2.286
137 HE2 LYS 14 HE2 LYS 14 17.717 1.823 -0.497
138 HE3 LYS 14 HE3 LYS 14 17.179 0.675 -1.724
139 HZ1 LYS 14 HZ1 LYS 14 18.814 3.108 -2.127
140 HZ2 LYS 14 HZ2 LYS 14 19.278 1.565 -2.389
141 HZ3 LYS 14 HZ3 LYS 14 18.170 2.253 -3.384
142 H LYS 15 H LYS 15 13.889 5.698 2.619
143 HA LYS 15 HA LYS 15 16.280 5.136 3.997
144 HB2 LYS 15 HB2 LYS 15 13.674 6.517 4.705
145 HB3 LYS 15 HB3 LYS 15 14.807 6.221 5.986
146 HG2 LYS 15 HG2 LYS 15 15.708 7.607 3.424
147 HG3 LYS 15 HG3 LYS 15 14.966 8.464 4.783
148 HD2 LYS 15 HD2 LYS 15 16.808 7.114 6.203
149 HD3 LYS 15 HD3 LYS 15 17.631 7.056 4.647
150 HE2 LYS 15 HE2 LYS 15 18.391 9.125 5.023
151 HE3 LYS 15 HE3 LYS 15 16.733 9.730 4.873
152 HZ1 LYS 15 HZ1 LYS 15 16.529 9.905 7.111
153 HZ2 LYS 15 HZ2 LYS 15 17.469 8.598 7.453
154 HZ3 LYS 15 HZ3 LYS 15 18.166 10.034 7.069
155 H LEU 16 H LEU 16 13.049 3.780 4.576
156 HA LEU 16 HA LEU 16 14.213 2.017 6.661
157 HB2 LEU 16 HB2 LEU 16 12.202 1.796 7.582
158 HB3 LEU 16 HB3 LEU 16 11.942 3.336 6.832
159 HG LEU 16 HG LEU 16 11.108 1.520 4.836
160 HD11 LEU 16 HD11 LEU 16 9.705 0.557 7.301
161 HD12 LEU 16 HD12 LEU 16 9.990 -0.253 5.740
162 HD13 LEU 16 HD13 LEU 16 11.284 -0.152 6.926
163 HD21 LEU 16 HD21 LEU 16 9.557 3.098 6.892
164 HD22 LEU 16 HD22 LEU 16 9.989 3.551 5.225
165 HD23 LEU 16 HD23 LEU 16 8.816 2.260 5.510
166 H SER 17 H SER 17 14.433 -0.157 6.358
167 HA SER 17 HA SER 17 15.180 -1.251 4.007
168 HB2 SER 17 HB2 SER 17 14.260 -3.450 5.328
169 HB3 SER 17 HB3 SER 17 15.800 -2.643 5.611
170 HG SER 17 HG SER 17 13.383 -2.112 6.999
171 HA PRO 18 HA PRO 18 11.166 -1.382 1.920
172 HB2 PRO 18 HB2 PRO 18 12.072 -2.149 -0.588
173 HB3 PRO 18 HB3 PRO 18 12.092 -0.483 0.049
174 HG2 PRO 18 HG2 PRO 18 14.362 -2.411 -0.227
175 HG3 PRO 18 HG3 PRO 18 14.372 -0.624 -0.298
176 HD2 PRO 18 HD2 PRO 18 15.112 -2.222 1.902
177 HD3 PRO 18 HD3 PRO 18 14.765 -0.470 1.954
178 H GLU 19 H GLU 19 13.271 -3.998 2.537
179 HA GLU 19 HA GLU 19 11.359 -6.081 1.661
180 HB2 GLU 19 HB2 GLU 19 13.940 -6.193 1.454
181 HB3 GLU 19 HB3 GLU 19 13.951 -6.458 3.196
182 HG2 GLU 19 HG2 GLU 19 12.115 -8.348 2.447
183 HG3 GLU 19 HG3 GLU 19 13.000 -8.211 0.940
184 H GLU 20 H GLU 20 12.141 -4.224 4.548
185 HA GLU 20 HA GLU 20 11.144 -6.208 6.450
186 HB2 GLU 20 HB2 GLU 20 12.874 -4.252 6.794
187 HB3 GLU 20 HB3 GLU 20 11.446 -3.255 7.044
188 HG2 GLU 20 HG2 GLU 20 11.770 -3.886 9.207
189 HG3 GLU 20 HG3 GLU 20 10.848 -5.309 8.729
190 H LEU 21 H LEU 21 9.913 -3.284 4.786
191 HA LEU 21 HA LEU 21 7.419 -3.200 6.183
192 HB2 LEU 21 HB2 LEU 21 8.722 -1.746 4.046
193 HB3 LEU 21 HB3 LEU 21 7.136 -2.223 3.477
194 HG LEU 21 HG LEU 21 7.689 -0.728 6.077
195 HD11 LEU 21 HD11 LEU 21 6.662 1.186 4.852
196 HD12 LEU 21 HD12 LEU 21 8.162 0.613 4.091
197 HD13 LEU 21 HD13 LEU 21 6.596 0.184 3.383
198 HD21 LEU 21 HD21 LEU 21 5.065 -1.546 4.760
199 HD22 LEU 21 HD22 LEU 21 5.630 -1.945 6.394
200 HD23 LEU 21 HD23 LEU 21 5.187 -0.286 6.004
201 H ASN 22 H ASN 22 8.301 -4.645 3.008
202 HA ASN 22 HA ASN 22 5.847 -5.754 2.307
203 HB2 ASN 22 HB2 ASN 22 8.099 -5.727 1.031
204 HB3 ASN 22 HB3 ASN 22 8.479 -7.215 1.910
205 HD21 ASN 22 HD21 ASN 22 8.159 -8.947 0.450
206 HD22 ASN 22 HD22 ASN 22 6.725 -8.985 -0.584
207 H ARG 23 H ARG 23 8.264 -7.109 4.549
208 HA ARG 23 HA ARG 23 6.966 -9.582 5.134
209 HB2 ARG 23 HB2 ARG 23 9.287 -8.926 5.858
210 HB3 ARG 23 HB3 ARG 23 8.588 -7.815 7.026
211 HG2 ARG 23 HG2 ARG 23 8.340 -9.457 8.527
212 HG3 ARG 23 HG3 ARG 23 7.248 -10.316 7.438
213 HD2 ARG 23 HD2 ARG 23 9.321 -11.210 6.246
214 HD3 ARG 23 HD3 ARG 23 10.250 -10.562 7.617
215 HE ARG 23 HE ARG 23 7.946 -12.308 8.252
216 HH11 ARG 23 HH22 ARG 23 11.403 -12.183 7.870
217 HH12 ARG 23 HH21 ARG 23 11.676 -13.648 8.790
218 HH21 ARG 23 HH12 ARG 23 8.302 -14.247 9.331
219 HH22 ARG 23 HH11 ARG 23 9.918 -14.843 9.496
220 H TYR 24 H TYR 24 6.776 -6.522 6.973
221 HA TYR 24 HA TYR 24 4.584 -7.248 8.658
222 HB2 TYR 24 HB2 TYR 24 5.958 -4.699 7.838
223 HB3 TYR 24 HB3 TYR 24 4.385 -4.586 8.595
224 HD1 TYR 24 HD2 TYR 24 3.979 -5.253 10.893
225 HD2 TYR 24 HD1 TYR 24 7.923 -5.508 9.165
226 HE1 TYR 24 HE2 TYR 24 4.964 -5.551 13.170
227 HE2 TYR 24 HE1 TYR 24 8.899 -5.810 11.428
228 HH TYR 24 HH TYR 24 8.188 -6.634 13.625
229 H TYR 25 H TYR 25 4.668 -6.187 5.373
230 HA TYR 25 HA TYR 25 1.894 -5.466 5.132
231 HB2 TYR 25 HB2 TYR 25 4.090 -5.020 3.624
232 HB3 TYR 25 HB3 TYR 25 3.497 -6.417 2.757
233 HD1 TYR 25 HD1 TYR 25 0.912 -6.300 2.091
234 HD2 TYR 25 HD2 TYR 25 3.409 -2.917 3.054
235 HE1 TYR 25 HE1 TYR 25 -0.558 -4.809 0.747
236 HE2 TYR 25 HE2 TYR 25 1.960 -1.441 1.681
237 HH TYR 25 HH TYR 25 0.238 -1.423 0.069
238 H ALA 26 H ALA 26 3.707 -8.454 4.136
239 HA ALA 26 HA ALA 26 1.387 -9.806 3.162
240 HB1 ALA 26 HB1 ALA 26 2.883 -11.381 2.587
241 HB2 ALA 26 HB2 ALA 26 4.138 -10.318 3.237
242 HB3 ALA 26 HB3 ALA 26 3.454 -11.599 4.253
243 H SER 27 H SER 27 2.886 -9.775 6.437
244 HA SER 27 HA SER 27 0.928 -11.520 7.653
245 HB2 SER 27 HB2 SER 27 1.853 -10.473 9.789
246 HB3 SER 27 HB3 SER 27 3.003 -11.363 8.780
247 HG SER 27 HG SER 27 3.990 -9.475 9.235
248 H LEU 28 H LEU 28 0.585 -8.368 6.467
249 HA LEU 28 HA LEU 28 -1.756 -7.892 8.237
250 HB2 LEU 28 HB2 LEU 28 -0.047 -6.090 6.519
251 HB3 LEU 28 HB3 LEU 28 -1.694 -5.629 6.909
252 HG LEU 28 HG LEU 28 0.379 -6.369 9.002
253 HD11 LEU 28 HD11 LEU 28 0.826 -4.082 9.367
254 HD12 LEU 28 HD12 LEU 28 0.906 -4.284 7.618
255 HD13 LEU 28 HD13 LEU 28 -0.534 -3.547 8.338
256 HD21 LEU 28 HD21 LEU 28 -1.333 -6.346 10.451
257 HD22 LEU 28 HD22 LEU 28 -1.669 -4.651 10.046
258 HD23 LEU 28 HD23 LEU 28 -2.486 -5.942 9.169
259 H ARG 29 H ARG 29 -0.826 -8.209 4.776
260 HA ARG 29 HA ARG 29 -3.369 -7.854 3.658
261 HB2 ARG 29 HB2 ARG 29 -1.060 -8.131 2.525
262 HB3 ARG 29 HB3 ARG 29 -1.387 -9.858 2.574
263 HG2 ARG 29 HG2 ARG 29 -2.592 -9.680 0.700
264 HG3 ARG 29 HG3 ARG 29 -3.786 -8.700 1.526
265 HD2 ARG 29 HD2 ARG 29 -1.289 -7.311 0.558
266 HD3 ARG 29 HD3 ARG 29 -2.425 -7.899 -0.657
267 HE ARG 29 HE ARG 29 -3.867 -6.440 1.335
268 HH11 ARG 29 HH22 ARG 29 -1.680 -5.864 -1.328
269 HH12 ARG 29 HH21 ARG 29 -2.294 -4.269 -1.659
270 HH21 ARG 29 HH12 ARG 29 -4.691 -4.387 0.854
271 HH22 ARG 29 HH11 ARG 29 -4.008 -3.488 -0.469
272 H HIS 30 H HIS 30 -1.905 -10.906 4.784
273 HA HIS 30 HA HIS 30 -4.278 -12.481 4.238
274 HB2 HIS 30 HB2 HIS 30 -1.656 -13.063 4.819
275 HB3 HIS 30 HB3 HIS 30 -2.406 -13.399 6.375
276 HD1 HIS 30 HD1 HIS 30 -2.737 -14.379 2.657
277 HD2 HIS 30 HD2 HIS 30 -3.761 -15.719 6.514
278 HE1 HIS 30 HE1 HIS 30 -3.706 -16.725 2.378
279 H TYR 31 H TYR 31 -3.392 -10.357 6.816
280 HA TYR 31 HA TYR 31 -5.263 -11.371 8.805
281 HB2 TYR 31 HB2 TYR 31 -2.961 -10.064 9.047
282 HB3 TYR 31 HB3 TYR 31 -3.934 -8.633 8.810
283 HD1 TYR 31 HD1 TYR 31 -4.302 -11.783 10.848
284 HD2 TYR 31 HD2 TYR 31 -4.193 -7.471 10.779
285 HE1 TYR 31 HE1 TYR 31 -4.887 -11.733 13.261
286 HE2 TYR 31 HE2 TYR 31 -4.738 -7.422 13.209
287 HH TYR 31 HH TYR 31 -5.893 -10.209 14.885
288 H LEU 32 H LEU 32 -5.043 -8.253 7.049
289 HA LEU 32 HA LEU 32 -7.589 -7.299 7.584
290 HB2 LEU 32 HB2 LEU 32 -7.245 -5.753 5.675
291 HB3 LEU 32 HB3 LEU 32 -5.886 -5.880 6.765
292 HG LEU 32 HG LEU 32 -5.121 -7.646 4.897
293 HD11 LEU 32 HD11 LEU 32 -7.358 -7.093 3.603
294 HD12 LEU 32 HD12 LEU 32 -6.420 -5.708 3.032
295 HD13 LEU 32 HD13 LEU 32 -5.835 -7.373 2.761
296 HD21 LEU 32 HD21 LEU 32 -4.943 -4.611 4.720
297 HD22 LEU 32 HD22 LEU 32 -3.845 -5.688 5.589
298 HD23 LEU 32 HD23 LEU 32 -3.881 -5.719 3.820
299 H ASN 33 H ASN 33 -6.727 -9.715 5.255
300 HA ASN 33 HA ASN 33 -8.917 -10.008 3.597
301 HB2 ASN 33 HB2 ASN 33 -6.687 -11.427 3.986
302 HB3 ASN 33 HB3 ASN 33 -7.712 -12.400 5.027
303 HD21 ASN 33 HD21 ASN 33 -8.074 -14.293 3.772
304 HD22 ASN 33 HD22 ASN 33 -8.640 -14.149 2.101
305 H LEU 34 H LEU 34 -8.693 -10.848 7.054
306 HA LEU 34 HA LEU 34 -11.655 -10.931 7.158
307 HB2 LEU 34 HB2 LEU 34 -11.799 -12.938 8.327
308 HB3 LEU 34 HB3 LEU 34 -10.880 -13.254 6.877
309 HG LEU 34 HG LEU 34 -9.094 -12.605 9.149
310 HD11 LEU 34 HD11 LEU 34 -11.237 -14.685 9.547
311 HD12 LEU 34 HD12 LEU 34 -9.600 -15.045 10.109
312 HD13 LEU 34 HD13 LEU 34 -10.446 -13.606 10.708
313 HD21 LEU 34 HD21 LEU 34 -8.361 -13.641 7.028
314 HD22 LEU 34 HD22 LEU 34 -7.941 -14.605 8.444
315 HD23 LEU 34 HD23 LEU 34 -9.315 -15.093 7.421
316 H VAL 35 H VAL 35 -9.085 -9.384 8.283
317 HA VAL 35 HA VAL 35 -10.061 -8.987 11.059
318 HB VAL 35 HB VAL 35 -7.601 -8.268 9.524
319 HG11 VAL 35 HG11 VAL 35 -7.991 -6.209 10.705
320 HG12 VAL 35 HG12 VAL 35 -8.162 -7.098 12.240
321 HG13 VAL 35 HG13 VAL 35 -6.619 -7.070 11.360
322 HG21 VAL 35 HG21 VAL 35 -8.397 -10.373 11.302
323 HG22 VAL 35 HG22 VAL 35 -6.842 -10.108 10.553
324 HG23 VAL 35 HG23 VAL 35 -7.190 -9.404 12.145
325 H THR 36 H THR 36 -10.170 -7.460 8.037
326 HA THR 36 HA THR 36 -11.295 -4.957 9.219
327 HB THR 36 HB THR 36 -10.913 -4.769 6.344
328 HG1 THR 36 HG1 THR 36 -9.288 -6.247 6.537
329 HG21 THR 36 HG21 THR 36 -10.974 -2.831 7.806
330 HG22 THR 36 HG22 THR 36 -9.561 -3.416 8.719
331 HG23 THR 36 HG23 THR 36 -9.387 -2.917 7.022
332 H ARG 37 H ARG 37 -12.174 -7.732 7.459
333 HA ARG 37 HA ARG 37 -14.531 -6.769 6.162
334 HB2 ARG 37 HB2 ARG 37 -13.131 -9.022 5.940
335 HB3 ARG 37 HB3 ARG 37 -14.273 -9.630 7.138
336 HG2 ARG 37 HG2 ARG 37 -16.061 -9.562 5.669
337 HG3 ARG 37 HG3 ARG 37 -15.456 -8.169 4.779
338 HD2 ARG 37 HD2 ARG 37 -13.870 -10.717 4.567
339 HD3 ARG 37 HD3 ARG 37 -15.435 -10.630 3.740
340 HE ARG 37 HE ARG 37 -13.932 -8.263 3.175
341 HH11 ARG 37 HH22 ARG 37 -14.003 -11.634 2.260
342 HH12 ARG 37 HH21 ARG 37 -13.297 -11.357 0.679
343 HH21 ARG 37 HH12 ARG 37 -13.091 -7.913 1.131
344 HH22 ARG 37 HH11 ARG 37 -12.826 -9.268 0.071
345 H GLN 38 H GLN 38 -13.873 -7.287 9.373
346 HA GLN 38 HA GLN 38 -16.684 -6.757 10.140
347 HB2 GLN 38 HB2 GLN 38 -15.506 -9.207 10.486
348 HB3 GLN 38 HB3 GLN 38 -15.051 -8.461 12.009
349 HG2 GLN 38 HG2 GLN 38 -17.212 -8.487 12.801
350 HG3 GLN 38 HG3 GLN 38 -17.911 -8.061 11.241
351 HE21 GLN 38 HE21 GLN 38 -19.402 -9.626 10.723
352 HE22 GLN 38 HE22 GLN 38 -18.994 -11.350 10.820
353 H ARG 39 H ARG 39 -13.955 -5.238 9.993
354 HA ARG 39 HA ARG 39 -14.401 -3.426 12.197
355 HB2 ARG 39 HB2 ARG 39 -12.563 -5.674 12.647
356 HB3 ARG 39 HB3 ARG 39 -11.726 -4.144 12.838
357 HG2 ARG 39 HG2 ARG 39 -13.130 -3.373 14.534
358 HG3 ARG 39 HG3 ARG 39 -14.378 -4.591 14.236
359 HD2 ARG 39 HD2 ARG 39 -13.175 -6.319 15.194
360 HD3 ARG 39 HD3 ARG 39 -11.607 -5.537 14.913
361 HE ARG 39 HE ARG 39 -13.223 -4.015 16.754
362 HH11 ARG 39 HH22 ARG 39 -11.204 -6.847 16.644
363 HH12 ARG 39 HH21 ARG 39 -10.835 -6.820 18.348
364 HH21 ARG 39 HH12 ARG 39 -12.617 -3.876 18.919
365 HH22 ARG 39 HH11 ARG 39 -11.619 -5.109 19.605
366 H TYR 40 H TYR 40 -14.616 -2.310 10.132
367 HA TYR 40 HA TYR 40 -12.018 -1.444 8.971
368 HB2 TYR 40 HB2 TYR 40 -13.168 -0.815 7.033
369 HB3 TYR 40 HB3 TYR 40 -13.787 -2.391 7.461
370 HD1 TYR 40 HD1 TYR 40 -16.147 -2.652 8.302
371 HD2 TYR 40 HD2 TYR 40 -14.526 1.190 7.179
372 HE1 TYR 40 HE1 TYR 40 -18.438 -1.648 8.365
373 HE2 TYR 40 HE2 TYR 40 -16.788 2.189 7.300
374 HH TYR 40 HH TYR 40 -18.999 1.804 7.694
375 HN1 NH2 41 HN1 NH2 41 -15.122 0.241 9.898
376 HN2 NH2 41 HN2 NH2 41 -14.211 1.622 10.521
Start of MODEL 12
1 HA TYR 1 HA TYR 1 -2.420 5.417 -10.433
2 HB2 TYR 1 HB2 TYR 1 -3.242 5.622 -12.636
3 HB3 TYR 1 HB3 TYR 1 -3.421 7.363 -12.512
4 HD1 TYR 1 HD1 TYR 1 -0.659 4.761 -12.369
5 HD2 TYR 1 HD2 TYR 1 -1.864 8.733 -13.575
6 HE1 TYR 1 HE1 TYR 1 1.566 5.139 -13.436
7 HE2 TYR 1 HE2 TYR 1 0.346 9.082 -14.642
8 HH TYR 1 HH TYR 1 2.242 7.827 -15.495
9 H LEU 2 H LEU 2 -1.281 6.118 -8.572
10 HA LEU 2 HA LEU 2 0.060 8.752 -8.860
11 HB2 LEU 2 HB2 LEU 2 -1.523 7.661 -6.582
12 HB3 LEU 2 HB3 LEU 2 0.001 8.364 -6.122
13 HG LEU 2 HG LEU 2 -1.793 9.946 -5.930
14 HD11 LEU 2 HD11 LEU 2 -0.741 11.827 -7.331
15 HD12 LEU 2 HD12 LEU 2 0.270 10.972 -6.171
16 HD13 LEU 2 HD13 LEU 2 0.411 10.611 -7.904
17 HD21 LEU 2 HD21 LEU 2 -2.130 10.506 -8.813
18 HD22 LEU 2 HD22 LEU 2 -2.906 9.023 -8.220
19 HD23 LEU 2 HD23 LEU 2 -3.286 10.566 -7.467
20 H GLU 3 H GLU 3 1.147 6.517 -10.013
21 HA GLU 3 HA GLU 3 3.016 5.056 -8.418
22 HB2 GLU 3 HB2 GLU 3 2.500 5.607 -11.306
23 HB3 GLU 3 HB3 GLU 3 4.136 5.141 -10.923
24 HG2 GLU 3 HG2 GLU 3 2.075 3.420 -9.617
25 HG3 GLU 3 HG3 GLU 3 2.025 3.405 -11.373
26 H ARG 4 H ARG 4 3.444 8.082 -10.285
27 HA ARG 4 HA ARG 4 6.212 8.424 -9.809
28 HB2 ARG 4 HB2 ARG 4 4.629 9.779 -11.379
29 HB3 ARG 4 HB3 ARG 4 4.202 10.714 -9.957
30 HG2 ARG 4 HG2 ARG 4 5.899 12.009 -10.806
31 HG3 ARG 4 HG3 ARG 4 6.834 11.022 -9.679
32 HD2 ARG 4 HD2 ARG 4 7.673 9.625 -11.433
33 HD3 ARG 4 HD3 ARG 4 6.443 10.201 -12.579
34 HE ARG 4 HE ARG 4 7.953 12.433 -11.743
35 HH11 ARG 4 HH22 ARG 4 8.382 9.611 -13.762
36 HH12 ARG 4 HH21 ARG 4 9.540 10.402 -14.805
37 HH21 ARG 4 HH12 ARG 4 9.437 13.411 -13.107
38 HH22 ARG 4 HH11 ARG 4 10.047 12.541 -14.479
39 H GLU 5 H GLU 5 3.514 9.902 -8.003
40 HA GLU 5 HA GLU 5 5.114 11.048 -5.951
41 HB2 GLU 5 HB2 GLU 5 2.558 11.396 -6.594
42 HB3 GLU 5 HB3 GLU 5 2.311 10.134 -5.375
43 HG2 GLU 5 HG2 GLU 5 3.939 11.705 -3.931
44 HG3 GLU 5 HG3 GLU 5 3.434 12.932 -5.087
45 H LEU 6 H LEU 6 3.417 7.828 -6.086
46 HA LEU 6 HA LEU 6 4.175 6.852 -3.575
47 HB2 LEU 6 HB2 LEU 6 3.668 5.592 -6.263
48 HB3 LEU 6 HB3 LEU 6 4.398 4.593 -5.028
49 HG LEU 6 HG LEU 6 1.792 6.107 -4.577
50 HD11 LEU 6 HD11 LEU 6 1.499 4.494 -6.405
51 HD12 LEU 6 HD12 LEU 6 2.267 3.219 -5.437
52 HD13 LEU 6 HD13 LEU 6 0.703 3.900 -4.936
53 HD21 LEU 6 HD21 LEU 6 1.548 4.423 -2.735
54 HD22 LEU 6 HD22 LEU 6 3.182 3.819 -3.097
55 HD23 LEU 6 HD23 LEU 6 2.951 5.469 -2.495
56 H LYS 7 H LYS 7 6.147 6.846 -6.568
57 HA LYS 7 HA LYS 7 8.435 5.639 -5.352
58 HB2 LYS 7 HB2 LYS 7 7.714 6.558 -7.912
59 HB3 LYS 7 HB3 LYS 7 9.031 7.644 -7.473
60 HG2 LYS 7 HG2 LYS 7 10.530 5.782 -7.091
61 HG3 LYS 7 HG3 LYS 7 9.205 4.609 -7.223
62 HD2 LYS 7 HD2 LYS 7 8.927 4.942 -9.537
63 HD3 LYS 7 HD3 LYS 7 9.877 6.433 -9.560
64 HE2 LYS 7 HE2 LYS 7 11.298 4.043 -8.488
65 HE3 LYS 7 HE3 LYS 7 10.829 3.883 -10.180
66 HZ1 LYS 7 HZ1 LYS 7 12.129 6.364 -9.372
67 HZ2 LYS 7 HZ2 LYS 7 13.079 5.020 -9.517
68 HZ3 LYS 7 HZ3 LYS 7 12.220 5.559 -10.800
69 H LYS 8 H LYS 8 7.440 9.026 -5.431
70 HA LYS 8 HA LYS 8 9.830 9.953 -3.985
71 HB2 LYS 8 HB2 LYS 8 7.780 11.228 -5.500
72 HB3 LYS 8 HB3 LYS 8 7.486 11.715 -3.851
73 HG2 LYS 8 HG2 LYS 8 8.912 13.374 -4.473
74 HG3 LYS 8 HG3 LYS 8 10.098 12.260 -3.810
75 HD2 LYS 8 HD2 LYS 8 9.403 12.095 -6.761
76 HD3 LYS 8 HD3 LYS 8 10.357 13.459 -6.208
77 HE2 LYS 8 HE2 LYS 8 12.230 12.287 -5.945
78 HE3 LYS 8 HE3 LYS 8 11.409 10.954 -5.122
79 HZ1 LYS 8 HZ1 LYS 8 12.370 10.306 -7.278
80 HZ2 LYS 8 HZ2 LYS 8 10.732 10.093 -7.242
81 HZ3 LYS 8 HZ3 LYS 8 11.383 11.370 -8.051
82 H LEU 9 H LEU 9 6.967 8.402 -3.090
83 HA LEU 9 HA LEU 9 6.934 9.306 -0.313
84 HB2 LEU 9 HB2 LEU 9 4.993 8.346 -2.036
85 HB3 LEU 9 HB3 LEU 9 5.393 6.883 -1.183
86 HG LEU 9 HG LEU 9 5.153 8.701 0.916
87 HD11 LEU 9 HD11 LEU 9 3.061 9.434 -1.182
88 HD12 LEU 9 HD12 LEU 9 3.178 10.070 0.476
89 HD13 LEU 9 HD13 LEU 9 4.435 10.450 -0.714
90 HD21 LEU 9 HD21 LEU 9 3.187 6.794 -0.368
91 HD22 LEU 9 HD22 LEU 9 4.115 6.628 1.139
92 HD23 LEU 9 HD23 LEU 9 2.744 7.749 1.061
93 H GLU 10 H GLU 10 7.495 6.158 -2.026
94 HA GLU 10 HA GLU 10 8.363 4.693 0.223
95 HB2 GLU 10 HB2 GLU 10 8.582 4.365 -2.708
96 HB3 GLU 10 HB3 GLU 10 10.030 3.830 -1.885
97 HG2 GLU 10 HG2 GLU 10 8.902 1.878 -1.760
98 HG3 GLU 10 HG3 GLU 10 8.361 2.578 -0.247
99 H ARG 11 H ARG 11 10.185 6.972 -1.792
100 HA ARG 11 HA ARG 11 12.783 6.677 -0.742
101 HB2 ARG 11 HB2 ARG 11 11.224 8.798 -2.090
102 HB3 ARG 11 HB3 ARG 11 12.451 9.444 -0.999
103 HG2 ARG 11 HG2 ARG 11 14.221 8.269 -2.059
104 HG3 ARG 11 HG3 ARG 11 13.108 7.269 -3.021
105 HD2 ARG 11 HD2 ARG 11 12.419 9.086 -4.359
106 HD3 ARG 11 HD3 ARG 11 13.090 10.294 -3.262
107 HE ARG 11 HE ARG 11 14.570 8.653 -5.228
108 HH11 ARG 11 HH22 ARG 11 14.921 10.802 -2.487
109 HH12 ARG 11 HH21 ARG 11 16.544 11.272 -2.919
110 HH21 ARG 11 HH12 ARG 11 16.693 9.199 -5.692
111 HH22 ARG 11 HH11 ARG 11 17.536 10.317 -4.673
112 H GLU 12 H GLU 12 10.065 8.423 0.806
113 HA GLU 12 HA GLU 12 11.725 9.577 2.872
114 HB2 GLU 12 HB2 GLU 12 9.195 10.062 2.048
115 HB3 GLU 12 HB3 GLU 12 8.813 8.941 3.346
116 HG2 GLU 12 HG2 GLU 12 10.730 10.741 4.462
117 HG3 GLU 12 HG3 GLU 12 9.723 11.735 3.421
118 H LEU 13 H LEU 13 9.914 6.589 2.526
119 HA LEU 13 HA LEU 13 10.732 5.620 5.212
120 HB2 LEU 13 HB2 LEU 13 8.782 4.381 3.270
121 HB3 LEU 13 HB3 LEU 13 8.986 4.090 5.011
122 HG LEU 13 HG LEU 13 8.084 6.827 4.145
123 HD11 LEU 13 HD11 LEU 13 5.742 6.098 4.208
124 HD12 LEU 13 HD12 LEU 13 6.634 5.407 2.845
125 HD13 LEU 13 HD13 LEU 13 6.271 4.400 4.264
126 HD21 LEU 13 HD21 LEU 13 6.881 5.353 6.444
127 HD22 LEU 13 HD22 LEU 13 8.590 5.801 6.609
128 HD23 LEU 13 HD23 LEU 13 7.384 7.051 6.285
129 H LYS 14 H LYS 14 12.264 5.709 2.443
130 HA LYS 14 HA LYS 14 13.011 2.948 1.961
131 HB2 LYS 14 HB2 LYS 14 12.999 4.671 0.207
132 HB3 LYS 14 HB3 LYS 14 14.281 5.561 1.027
133 HG2 LYS 14 HG2 LYS 14 14.862 2.712 0.366
134 HG3 LYS 14 HG3 LYS 14 14.604 3.773 -1.016
135 HD2 LYS 14 HD2 LYS 14 16.326 5.325 -0.214
136 HD3 LYS 14 HD3 LYS 14 16.645 4.307 1.198
137 HE2 LYS 14 HE2 LYS 14 17.426 2.479 -0.168
138 HE3 LYS 14 HE3 LYS 14 16.813 3.242 -1.642
139 HZ1 LYS 14 HZ1 LYS 14 18.990 3.810 -1.744
140 HZ2 LYS 14 HZ2 LYS 14 18.448 5.119 -0.910
141 HZ3 LYS 14 HZ3 LYS 14 19.222 3.894 -0.107
142 H LYS 15 H LYS 15 13.958 5.199 4.287
143 HA LYS 15 HA LYS 15 16.638 4.593 4.901
144 HB2 LYS 15 HB2 LYS 15 15.298 6.291 6.040
145 HB3 LYS 15 HB3 LYS 15 14.290 5.062 6.802
146 HG2 LYS 15 HG2 LYS 15 17.303 5.034 7.197
147 HG3 LYS 15 HG3 LYS 15 16.308 6.185 8.089
148 HD2 LYS 15 HD2 LYS 15 14.938 4.280 8.999
149 HD3 LYS 15 HD3 LYS 15 16.026 3.142 8.213
150 HE2 LYS 15 HE2 LYS 15 17.144 3.176 10.145
151 HE3 LYS 15 HE3 LYS 15 17.892 4.612 9.437
152 HZ1 LYS 15 HZ1 LYS 15 16.057 5.888 10.551
153 HZ2 LYS 15 HZ2 LYS 15 15.627 4.517 11.341
154 HZ3 LYS 15 HZ3 LYS 15 17.116 5.180 11.602
155 H LEU 16 H LEU 16 13.758 2.664 5.459
156 HA LEU 16 HA LEU 16 15.400 0.337 6.359
157 HB2 LEU 16 HB2 LEU 16 13.160 -0.531 7.208
158 HB3 LEU 16 HB3 LEU 16 13.928 0.722 8.126
159 HG LEU 16 HG LEU 16 12.043 1.673 6.010
160 HD11 LEU 16 HD11 LEU 16 10.576 0.039 6.511
161 HD12 LEU 16 HD12 LEU 16 11.077 -0.103 8.208
162 HD13 LEU 16 HD13 LEU 16 10.072 1.270 7.673
163 HD21 LEU 16 HD21 LEU 16 13.213 2.743 8.393
164 HD22 LEU 16 HD22 LEU 16 12.162 3.541 7.216
165 HD23 LEU 16 HD23 LEU 16 11.469 2.732 8.632
166 H SER 17 H SER 17 15.457 0.944 3.714
167 HA SER 17 HA SER 17 15.304 0.139 1.668
168 HB2 SER 17 HB2 SER 17 15.177 -2.264 3.304
169 HB3 SER 17 HB3 SER 17 14.338 -2.486 1.770
170 HG SER 17 HG SER 17 16.339 -2.867 1.184
171 HA PRO 18 HA PRO 18 11.151 0.794 0.329
172 HB2 PRO 18 HB2 PRO 18 11.368 0.276 -2.384
173 HB3 PRO 18 HB3 PRO 18 11.909 1.777 -1.582
174 HG2 PRO 18 HG2 PRO 18 13.564 -0.478 -2.624
175 HG3 PRO 18 HG3 PRO 18 13.996 1.240 -2.392
176 HD2 PRO 18 HD2 PRO 18 14.631 -0.962 -0.686
177 HD3 PRO 18 HD3 PRO 18 14.911 0.756 -0.355
178 H GLU 19 H GLU 19 12.769 -2.225 -0.661
179 HA GLU 19 HA GLU 19 10.249 -3.609 -1.117
180 HB2 GLU 19 HB2 GLU 19 12.768 -4.008 -2.058
181 HB3 GLU 19 HB3 GLU 19 12.808 -5.126 -0.701
182 HG2 GLU 19 HG2 GLU 19 12.091 -6.344 -2.637
183 HG3 GLU 19 HG3 GLU 19 10.680 -6.178 -1.596
184 H GLU 20 H GLU 20 12.115 -2.937 1.717
185 HA GLU 20 HA GLU 20 11.289 -5.261 3.294
186 HB2 GLU 20 HB2 GLU 20 13.054 -3.030 3.628
187 HB3 GLU 20 HB3 GLU 20 11.833 -2.931 4.904
188 HG2 GLU 20 HG2 GLU 20 12.396 -5.445 5.309
189 HG3 GLU 20 HG3 GLU 20 13.860 -5.095 4.374
190 H LEU 21 H LEU 21 10.152 -1.886 2.804
191 HA LEU 21 HA LEU 21 8.023 -2.074 4.696
192 HB2 LEU 21 HB2 LEU 21 9.082 -0.134 2.830
193 HB3 LEU 21 HB3 LEU 21 7.355 -0.272 2.531
194 HG LEU 21 HG LEU 21 8.523 0.061 5.326
195 HD11 LEU 21 HD11 LEU 21 7.594 2.463 4.891
196 HD12 LEU 21 HD12 LEU 21 9.212 1.980 4.313
197 HD13 LEU 21 HD13 LEU 21 7.850 2.059 3.177
198 HD21 LEU 21 HD21 LEU 21 6.111 -0.785 5.118
199 HD22 LEU 21 HD22 LEU 21 6.354 0.709 6.032
200 HD23 LEU 21 HD23 LEU 21 5.729 0.784 4.369
201 H ASN 22 H ASN 22 8.058 -2.467 1.132
202 HA ASN 22 HA ASN 22 5.395 -3.206 0.749
203 HB2 ASN 22 HB2 ASN 22 7.363 -2.837 -0.934
204 HB3 ASN 22 HB3 ASN 22 7.627 -4.575 -0.760
205 HD21 ASN 22 HD21 ASN 22 7.195 -4.281 -3.172
206 HD22 ASN 22 HD22 ASN 22 5.472 -4.359 -3.637
207 H ARG 23 H ARG 23 8.119 -5.291 1.771
208 HA ARG 23 HA ARG 23 6.761 -7.759 1.877
209 HB2 ARG 23 HB2 ARG 23 9.282 -7.252 2.228
210 HB3 ARG 23 HB3 ARG 23 8.871 -6.844 3.884
211 HG2 ARG 23 HG2 ARG 23 9.612 -9.057 3.958
212 HG3 ARG 23 HG3 ARG 23 7.861 -9.180 4.131
213 HD2 ARG 23 HD2 ARG 23 9.146 -9.333 1.388
214 HD3 ARG 23 HD3 ARG 23 9.219 -10.741 2.453
215 HE ARG 23 HE ARG 23 6.585 -10.249 2.556
216 HH11 ARG 23 HH22 ARG 23 8.639 -10.322 -0.286
217 HH12 ARG 23 HH21 ARG 23 7.357 -10.853 -1.339
218 HH21 ARG 23 HH12 ARG 23 5.032 -11.134 1.233
219 HH22 ARG 23 HH11 ARG 23 5.354 -11.347 -0.461
220 H TYR 24 H TYR 24 7.245 -5.454 4.575
221 HA TYR 24 HA TYR 24 5.464 -6.731 6.414
222 HB2 TYR 24 HB2 TYR 24 6.747 -4.011 6.144
223 HB3 TYR 24 HB3 TYR 24 5.445 -4.213 7.296
224 HD1 TYR 24 HD1 TYR 24 5.605 -6.327 8.882
225 HD2 TYR 24 HD2 TYR 24 8.966 -4.435 6.939
226 HE1 TYR 24 HE1 TYR 24 7.147 -7.271 10.611
227 HE2 TYR 24 HE2 TYR 24 10.483 -5.341 8.665
228 HH TYR 24 HH TYR 24 10.551 -6.375 10.751
229 H TYR 25 H TYR 25 4.860 -4.572 3.759
230 HA TYR 25 HA TYR 25 2.165 -3.853 4.395
231 HB2 TYR 25 HB2 TYR 25 4.107 -3.285 2.397
232 HB3 TYR 25 HB3 TYR 25 2.771 -3.945 1.525
233 HD1 TYR 25 HD1 TYR 25 3.681 -1.471 4.175
234 HD2 TYR 25 HD2 TYR 25 1.097 -2.426 0.873
235 HE1 TYR 25 HE1 TYR 25 2.746 0.841 4.252
236 HE2 TYR 25 HE2 TYR 25 0.130 -0.100 0.965
237 HH TYR 25 HH TYR 25 1.647 2.417 2.679
238 H ALA 26 H ALA 26 3.483 -6.409 2.185
239 HA ALA 26 HA ALA 26 0.911 -7.426 1.436
240 HB1 ALA 26 HB1 ALA 26 2.626 -9.625 1.313
241 HB2 ALA 26 HB2 ALA 26 2.388 -8.414 0.041
242 HB3 ALA 26 HB3 ALA 26 3.744 -8.254 1.174
243 H SER 27 H SER 27 3.075 -8.397 4.138
244 HA SER 27 HA SER 27 1.261 -10.322 5.266
245 HB2 SER 27 HB2 SER 27 3.592 -8.733 6.408
246 HB3 SER 27 HB3 SER 27 2.736 -9.993 7.315
247 HG SER 27 HG SER 27 3.463 -11.516 5.932
248 H LEU 28 H LEU 28 0.925 -6.966 5.139
249 HA LEU 28 HA LEU 28 -0.940 -6.934 7.461
250 HB2 LEU 28 HB2 LEU 28 0.554 -4.802 5.926
251 HB3 LEU 28 HB3 LEU 28 -0.907 -4.385 6.807
252 HG LEU 28 HG LEU 28 1.447 -5.822 8.078
253 HD11 LEU 28 HD11 LEU 28 2.410 -3.858 8.745
254 HD12 LEU 28 HD12 LEU 28 1.827 -3.385 7.150
255 HD13 LEU 28 HD13 LEU 28 0.917 -2.897 8.590
256 HD21 LEU 28 HD21 LEU 28 -0.059 -4.339 10.003
257 HD22 LEU 28 HD22 LEU 28 -1.238 -5.208 9.016
258 HD23 LEU 28 HD23 LEU 28 0.065 -6.092 9.825
259 H ARG 29 H ARG 29 -0.786 -6.238 3.935
260 HA ARG 29 HA ARG 29 -3.455 -5.465 3.581
261 HB2 ARG 29 HB2 ARG 29 -1.460 -5.519 1.917
262 HB3 ARG 29 HB3 ARG 29 -1.922 -7.178 1.568
263 HG2 ARG 29 HG2 ARG 29 -3.993 -6.565 0.625
264 HG3 ARG 29 HG3 ARG 29 -4.047 -5.016 1.465
265 HD2 ARG 29 HD2 ARG 29 -1.699 -5.160 -0.309
266 HD3 ARG 29 HD3 ARG 29 -3.186 -5.496 -1.181
267 HE ARG 29 HE ARG 29 -3.864 -3.317 -0.937
268 HH11 ARG 29 HH22 ARG 29 -1.226 -3.740 1.315
269 HH12 ARG 29 HH21 ARG 29 -1.129 -2.049 1.714
270 HH21 ARG 29 HH12 ARG 29 -3.720 -1.157 -0.438
271 HH22 ARG 29 HH11 ARG 29 -2.594 -0.619 0.773
272 H HIS 30 H HIS 30 -2.110 -8.769 3.516
273 HA HIS 30 HA HIS 30 -4.670 -10.056 3.149
274 HB2 HIS 30 HB2 HIS 30 -2.081 -10.902 3.011
275 HB3 HIS 30 HB3 HIS 30 -2.508 -11.525 4.601
276 HD1 HIS 30 HD1 HIS 30 -2.494 -12.607 1.187
277 HD2 HIS 30 HD2 HIS 30 -5.251 -12.845 4.359
278 HE1 HIS 30 HE1 HIS 30 -4.151 -14.485 0.598
279 H TYR 31 H TYR 31 -2.990 -8.808 5.993
280 HA TYR 31 HA TYR 31 -4.596 -10.095 8.009
281 HB2 TYR 31 HB2 TYR 31 -2.282 -8.739 8.052
282 HB3 TYR 31 HB3 TYR 31 -3.337 -7.387 8.425
283 HD1 TYR 31 HD2 TYR 31 -5.396 -8.709 10.225
284 HD2 TYR 31 HD1 TYR 31 -1.091 -9.025 9.991
285 HE1 TYR 31 HE2 TYR 31 -5.311 -9.345 12.613
286 HE2 TYR 31 HE1 TYR 31 -1.011 -9.624 12.399
287 HH TYR 31 HH TYR 31 -2.267 -10.125 14.288
288 H LEU 32 H LEU 32 -4.675 -6.788 6.558
289 HA LEU 32 HA LEU 32 -6.978 -5.932 7.914
290 HB2 LEU 32 HB2 LEU 32 -6.245 -5.027 5.123
291 HB3 LEU 32 HB3 LEU 32 -7.208 -4.160 6.320
292 HG LEU 32 HG LEU 32 -4.244 -4.673 6.321
293 HD11 LEU 32 HD11 LEU 32 -5.046 -2.816 4.980
294 HD12 LEU 32 HD12 LEU 32 -5.839 -2.110 6.411
295 HD13 LEU 32 HD13 LEU 32 -4.066 -2.262 6.343
296 HD21 LEU 32 HD21 LEU 32 -4.309 -3.228 8.504
297 HD22 LEU 32 HD22 LEU 32 -5.967 -3.848 8.659
298 HD23 LEU 32 HD23 LEU 32 -4.587 -4.968 8.608
299 H ASN 33 H ASN 33 -6.782 -7.999 5.219
300 HA ASN 33 HA ASN 33 -9.374 -8.099 4.135
301 HB2 ASN 33 HB2 ASN 33 -7.151 -9.482 3.689
302 HB3 ASN 33 HB3 ASN 33 -7.896 -10.634 4.798
303 HD21 ASN 33 HD21 ASN 33 -8.793 -12.280 3.584
304 HD22 ASN 33 HD22 ASN 33 -9.745 -11.982 2.143
305 H LEU 34 H LEU 34 -8.277 -9.233 7.287
306 HA LEU 34 HA LEU 34 -11.079 -9.854 8.058
307 HB2 LEU 34 HB2 LEU 34 -10.132 -11.461 9.708
308 HB3 LEU 34 HB3 LEU 34 -9.974 -11.961 8.043
309 HG LEU 34 HG LEU 34 -7.693 -10.511 9.373
310 HD11 LEU 34 HD11 LEU 34 -6.801 -12.333 10.474
311 HD12 LEU 34 HD12 LEU 34 -8.506 -12.367 10.941
312 HD13 LEU 34 HD13 LEU 34 -7.909 -13.502 9.716
313 HD21 LEU 34 HD21 LEU 34 -6.434 -11.362 7.671
314 HD22 LEU 34 HD22 LEU 34 -7.204 -12.949 7.698
315 HD23 LEU 34 HD23 LEU 34 -7.973 -11.621 6.849
316 H VAL 35 H VAL 35 -10.103 -7.267 8.076
317 HA VAL 35 HA VAL 35 -10.301 -6.664 11.002
318 HB VAL 35 HB VAL 35 -8.550 -5.210 9.053
319 HG11 VAL 35 HG11 VAL 35 -9.681 -4.284 11.527
320 HG12 VAL 35 HG12 VAL 35 -7.944 -4.482 11.753
321 HG13 VAL 35 HG13 VAL 35 -8.546 -3.468 10.438
322 HG21 VAL 35 HG21 VAL 35 -7.797 -6.926 11.458
323 HG22 VAL 35 HG22 VAL 35 -7.567 -7.368 9.768
324 HG23 VAL 35 HG23 VAL 35 -6.661 -6.010 10.427
325 H THR 36 H THR 36 -10.075 -3.992 8.881
326 HA THR 36 HA THR 36 -12.554 -2.876 9.625
327 HB THR 36 HB THR 36 -12.041 -1.464 7.463
328 HG1 THR 36 HG1 THR 36 -9.733 -1.632 7.066
329 HG21 THR 36 HG21 THR 36 -9.925 -0.493 8.829
330 HG22 THR 36 HG22 THR 36 -11.585 -0.283 9.396
331 HG23 THR 36 HG23 THR 36 -10.565 -1.557 10.093
332 H ARG 37 H ARG 37 -11.730 -4.829 6.896
333 HA ARG 37 HA ARG 37 -14.249 -4.759 5.475
334 HB2 ARG 37 HB2 ARG 37 -11.923 -6.704 5.586
335 HB3 ARG 37 HB3 ARG 37 -13.350 -7.070 4.611
336 HG2 ARG 37 HG2 ARG 37 -13.050 -5.207 3.184
337 HG3 ARG 37 HG3 ARG 37 -11.932 -4.403 4.305
338 HD2 ARG 37 HD2 ARG 37 -10.313 -6.256 3.977
339 HD3 ARG 37 HD3 ARG 37 -11.377 -6.944 2.721
340 HE ARG 37 HE ARG 37 -10.849 -4.194 2.163
341 HH11 ARG 37 HH22 ARG 37 -9.167 -7.288 2.019
342 HH12 ARG 37 HH21 ARG 37 -7.873 -6.658 1.057
343 HH21 ARG 37 HH12 ARG 37 -9.289 -3.481 0.757
344 HH22 ARG 37 HH11 ARG 37 -7.998 -4.541 0.280
345 H GLN 38 H GLN 38 -13.557 -6.126 8.449
346 HA GLN 38 HA GLN 38 -16.197 -7.488 8.478
347 HB2 GLN 38 HB2 GLN 38 -15.381 -9.302 9.779
348 HB3 GLN 38 HB3 GLN 38 -14.359 -9.186 8.350
349 HG2 GLN 38 HG2 GLN 38 -12.519 -8.413 9.567
350 HG3 GLN 38 HG3 GLN 38 -13.469 -7.833 10.925
351 HE21 GLN 38 HE21 GLN 38 -12.134 -10.838 9.472
352 HE22 GLN 38 HE22 GLN 38 -12.329 -11.678 11.014
353 H ARG 39 H ARG 39 -15.008 -4.771 9.488
354 HA ARG 39 HA ARG 39 -15.324 -3.353 11.268
355 HB2 ARG 39 HB2 ARG 39 -17.521 -5.357 11.788
356 HB3 ARG 39 HB3 ARG 39 -17.157 -4.179 13.029
357 HG2 ARG 39 HG2 ARG 39 -17.459 -2.340 11.449
358 HG3 ARG 39 HG3 ARG 39 -17.821 -3.497 10.152
359 HD2 ARG 39 HD2 ARG 39 -19.410 -4.047 12.581
360 HD3 ARG 39 HD3 ARG 39 -19.629 -2.384 12.067
361 HE ARG 39 HE ARG 39 -20.471 -4.828 10.676
362 HH11 ARG 39 HH22 ARG 39 -19.961 -1.400 10.329
363 HH12 ARG 39 HH21 ARG 39 -20.906 -1.254 8.872
364 HH21 ARG 39 HH12 ARG 39 -21.667 -4.654 8.787
365 HH22 ARG 39 HH11 ARG 39 -21.852 -3.098 8.012
366 H TYR 40 H TYR 40 -13.265 -5.446 11.464
367 HA TYR 40 HA TYR 40 -11.621 -6.112 12.829
368 HB2 TYR 40 HB2 TYR 40 -11.844 -3.519 13.103
369 HB3 TYR 40 HB3 TYR 40 -12.328 -3.873 14.735
370 HD1 TYR 40 HD1 TYR 40 -10.294 -6.335 15.100
371 HD2 TYR 40 HD2 TYR 40 -9.926 -2.294 13.600
372 HE1 TYR 40 HE1 TYR 40 -7.872 -6.351 15.617
373 HE2 TYR 40 HE2 TYR 40 -7.511 -2.325 14.108
374 HH TYR 40 HH TYR 40 -5.761 -3.666 14.659
375 HN1 NH2 41 HN1 NH2 41 -13.829 -5.081 15.478
376 HN2 NH2 41 HN2 NH2 41 -13.877 -6.705 16.190
Start of MODEL 13
1 HA TYR 1 HA TYR 1 1.049 13.403 -15.761
2 HB2 TYR 1 HB2 TYR 1 2.863 12.070 -16.553
3 HB3 TYR 1 HB3 TYR 1 2.016 12.721 -17.943
4 HD1 TYR 1 HD1 TYR 1 3.068 14.702 -19.250
5 HD2 TYR 1 HD2 TYR 1 5.200 12.468 -16.212
6 HE1 TYR 1 HE1 TYR 1 5.177 15.795 -19.918
7 HE2 TYR 1 HE2 TYR 1 7.326 13.538 -16.944
8 HH TYR 1 HH TYR 1 7.367 16.272 -19.129
9 H LEU 2 H LEU 2 1.668 13.468 -13.615
10 HA LEU 2 HA LEU 2 4.206 14.861 -12.882
11 HB2 LEU 2 HB2 LEU 2 1.441 15.181 -11.728
12 HB3 LEU 2 HB3 LEU 2 2.829 15.368 -10.691
13 HG LEU 2 HG LEU 2 3.265 16.917 -13.136
14 HD11 LEU 2 HD11 LEU 2 1.485 18.684 -12.455
15 HD12 LEU 2 HD12 LEU 2 1.025 17.329 -13.484
16 HD13 LEU 2 HD13 LEU 2 0.617 17.313 -11.749
17 HD21 LEU 2 HD21 LEU 2 3.451 18.780 -11.389
18 HD22 LEU 2 HD22 LEU 2 3.173 17.531 -10.166
19 HD23 LEU 2 HD23 LEU 2 4.572 17.423 -11.251
20 H GLU 3 H GLU 3 3.533 11.997 -13.429
21 HA GLU 3 HA GLU 3 3.599 10.420 -11.046
22 HB2 GLU 3 HB2 GLU 3 4.195 10.110 -13.982
23 HB3 GLU 3 HB3 GLU 3 4.882 8.909 -12.913
24 HG2 GLU 3 HG2 GLU 3 1.987 9.518 -12.431
25 HG3 GLU 3 HG3 GLU 3 2.372 8.756 -13.975
26 H ARG 4 H ARG 4 6.200 12.054 -12.828
27 HA ARG 4 HA ARG 4 8.397 10.714 -11.598
28 HB2 ARG 4 HB2 ARG 4 8.486 12.224 -13.603
29 HB3 ARG 4 HB3 ARG 4 8.282 13.618 -12.532
30 HG2 ARG 4 HG2 ARG 4 10.425 13.512 -11.738
31 HG3 ARG 4 HG3 ARG 4 10.468 11.743 -11.726
32 HD2 ARG 4 HD2 ARG 4 10.858 11.630 -14.103
33 HD3 ARG 4 HD3 ARG 4 10.577 13.362 -14.290
34 HE ARG 4 HE ARG 4 12.689 13.846 -13.480
35 HH11 ARG 4 HH22 ARG 4 12.106 10.487 -12.836
36 HH12 ARG 4 HH21 ARG 4 13.786 10.134 -12.483
37 HH21 ARG 4 HH12 ARG 4 14.813 13.415 -12.920
38 HH22 ARG 4 HH11 ARG 4 15.275 11.822 -12.418
39 H GLU 5 H GLU 5 6.375 13.380 -10.430
40 HA GLU 5 HA GLU 5 8.031 14.147 -8.231
41 HB2 GLU 5 HB2 GLU 5 5.967 15.331 -9.325
42 HB3 GLU 5 HB3 GLU 5 5.009 14.345 -8.206
43 HG2 GLU 5 HG2 GLU 5 6.226 15.302 -6.292
44 HG3 GLU 5 HG3 GLU 5 7.331 16.144 -7.380
45 H LEU 6 H LEU 6 5.340 11.782 -8.472
46 HA LEU 6 HA LEU 6 5.367 10.797 -5.801
47 HB2 LEU 6 HB2 LEU 6 4.600 9.672 -8.494
48 HB3 LEU 6 HB3 LEU 6 4.699 8.575 -7.146
49 HG LEU 6 HG LEU 6 3.210 11.049 -6.479
50 HD11 LEU 6 HD11 LEU 6 1.168 10.355 -7.779
51 HD12 LEU 6 HD12 LEU 6 2.491 11.011 -8.761
52 HD13 LEU 6 HD13 LEU 6 2.207 9.257 -8.721
53 HD21 LEU 6 HD21 LEU 6 3.365 8.605 -5.341
54 HD22 LEU 6 HD22 LEU 6 1.944 9.651 -5.197
55 HD23 LEU 6 HD23 LEU 6 1.963 8.326 -6.385
56 H LYS 7 H LYS 7 7.458 9.940 -8.550
57 HA LYS 7 HA LYS 7 8.883 7.844 -7.171
58 HB2 LYS 7 HB2 LYS 7 8.732 8.606 -9.728
59 HB3 LYS 7 HB3 LYS 7 10.167 9.534 -9.340
60 HG2 LYS 7 HG2 LYS 7 10.130 6.613 -8.530
61 HG3 LYS 7 HG3 LYS 7 10.117 6.989 -10.244
62 HD2 LYS 7 HD2 LYS 7 12.158 8.574 -9.649
63 HD3 LYS 7 HD3 LYS 7 12.308 7.534 -8.227
64 HE2 LYS 7 HE2 LYS 7 11.891 6.268 -10.943
65 HE3 LYS 7 HE3 LYS 7 13.466 7.000 -10.648
66 HZ1 LYS 7 HZ1 LYS 7 12.928 4.522 -10.013
67 HZ2 LYS 7 HZ2 LYS 7 14.001 5.422 -9.161
68 HZ3 LYS 7 HZ3 LYS 7 12.461 5.213 -8.593
69 H LYS 8 H LYS 8 9.434 11.336 -7.410
70 HA LYS 8 HA LYS 8 11.833 11.281 -5.736
71 HB2 LYS 8 HB2 LYS 8 10.935 13.079 -7.541
72 HB3 LYS 8 HB3 LYS 8 10.209 13.781 -6.087
73 HG2 LYS 8 HG2 LYS 8 12.486 13.752 -5.013
74 HG3 LYS 8 HG3 LYS 8 13.174 13.134 -6.522
75 HD2 LYS 8 HD2 LYS 8 12.882 15.159 -7.654
76 HD3 LYS 8 HD3 LYS 8 11.512 15.645 -6.641
77 HE2 LYS 8 HE2 LYS 8 13.385 15.633 -4.718
78 HE3 LYS 8 HE3 LYS 8 14.465 15.882 -6.099
79 HZ1 LYS 8 HZ1 LYS 8 12.794 17.745 -6.665
80 HZ2 LYS 8 HZ2 LYS 8 12.285 17.583 -5.099
81 HZ3 LYS 8 HZ3 LYS 8 13.832 18.008 -5.410
82 H LEU 9 H LEU 9 8.525 11.100 -5.087
83 HA LEU 9 HA LEU 9 8.659 12.009 -2.307
84 HB2 LEU 9 HB2 LEU 9 6.636 11.933 -4.168
85 HB3 LEU 9 HB3 LEU 9 6.331 10.420 -3.342
86 HG LEU 9 HG LEU 9 6.293 11.725 -1.158
87 HD11 LEU 9 HD11 LEU 9 5.746 14.266 -1.625
88 HD12 LEU 9 HD12 LEU 9 7.440 13.758 -1.569
89 HD13 LEU 9 HD13 LEU 9 6.641 14.013 -3.132
90 HD21 LEU 9 HD21 LEU 9 4.256 11.087 -2.602
91 HD22 LEU 9 HD22 LEU 9 4.040 12.392 -1.428
92 HD23 LEU 9 HD23 LEU 9 4.255 12.779 -3.150
93 H GLU 10 H GLU 10 8.053 8.847 -3.966
94 HA GLU 10 HA GLU 10 8.097 7.251 -1.652
95 HB2 GLU 10 HB2 GLU 10 7.628 6.612 -4.177
96 HB3 GLU 10 HB3 GLU 10 9.355 6.243 -4.197
97 HG2 GLU 10 HG2 GLU 10 8.385 5.041 -1.805
98 HG3 GLU 10 HG3 GLU 10 7.072 4.816 -2.934
99 H ARG 11 H ARG 11 10.810 8.666 -3.360
100 HA ARG 11 HA ARG 11 13.001 7.308 -2.140
101 HB2 ARG 11 HB2 ARG 11 12.519 9.886 -3.523
102 HB3 ARG 11 HB3 ARG 11 13.836 9.972 -2.353
103 HG2 ARG 11 HG2 ARG 11 15.042 8.177 -3.399
104 HG3 ARG 11 HG3 ARG 11 13.648 7.732 -4.392
105 HD2 ARG 11 HD2 ARG 11 14.691 8.920 -6.005
106 HD3 ARG 11 HD3 ARG 11 13.922 10.290 -5.231
107 HE ARG 11 HE ARG 11 15.988 10.984 -4.344
108 HH11 ARG 11 HH22 ARG 11 16.456 7.900 -5.949
109 HH12 ARG 11 HH21 ARG 11 18.196 8.062 -5.956
110 HH21 ARG 11 HH12 ARG 11 18.247 11.073 -4.307
111 HH22 ARG 11 HH11 ARG 11 19.163 9.787 -5.034
112 H GLU 12 H GLU 12 10.786 9.599 -0.662
113 HA GLU 12 HA GLU 12 12.481 9.948 1.726
114 HB2 GLU 12 HB2 GLU 12 10.370 11.382 0.521
115 HB3 GLU 12 HB3 GLU 12 9.634 10.715 1.965
116 HG2 GLU 12 HG2 GLU 12 12.345 12.078 2.161
117 HG3 GLU 12 HG3 GLU 12 10.928 13.063 1.874
118 H LEU 13 H LEU 13 9.552 8.103 0.767
119 HA LEU 13 HA LEU 13 9.342 6.840 3.390
120 HB2 LEU 13 HB2 LEU 13 8.085 6.064 0.733
121 HB3 LEU 13 HB3 LEU 13 7.772 5.290 2.280
122 HG LEU 13 HG LEU 13 7.381 8.021 2.863
123 HD11 LEU 13 HD11 LEU 13 6.127 7.378 0.163
124 HD12 LEU 13 HD12 LEU 13 5.779 8.802 1.170
125 HD13 LEU 13 HD13 LEU 13 7.389 8.594 0.482
126 HD21 LEU 13 HD21 LEU 13 5.993 6.389 3.843
127 HD22 LEU 13 HD22 LEU 13 4.916 7.362 2.834
128 HD23 LEU 13 HD23 LEU 13 5.443 5.763 2.274
129 H LYS 14 H LYS 14 11.088 6.041 0.439
130 HA LYS 14 HA LYS 14 11.931 3.414 0.889
131 HB2 LYS 14 HB2 LYS 14 12.435 4.528 -1.164
132 HB3 LYS 14 HB3 LYS 14 13.304 5.830 -0.345
133 HG2 LYS 14 HG2 LYS 14 15.111 4.267 0.284
134 HG3 LYS 14 HG3 LYS 14 14.222 2.943 -0.495
135 HD2 LYS 14 HD2 LYS 14 14.471 4.492 -2.642
136 HD3 LYS 14 HD3 LYS 14 15.700 5.315 -1.657
137 HE2 LYS 14 HE2 LYS 14 17.140 3.684 -2.380
138 HE3 LYS 14 HE3 LYS 14 16.336 2.698 -1.159
139 HZ1 LYS 14 HZ1 LYS 14 14.674 2.276 -3.103
140 HZ2 LYS 14 HZ2 LYS 14 15.951 2.677 -4.059
141 HZ3 LYS 14 HZ3 LYS 14 16.064 1.405 -3.023
142 H LYS 15 H LYS 15 12.698 6.096 2.878
143 HA LYS 15 HA LYS 15 15.199 5.464 3.960
144 HB2 LYS 15 HB2 LYS 15 13.479 7.407 4.368
145 HB3 LYS 15 HB3 LYS 15 12.907 6.411 5.712
146 HG2 LYS 15 HG2 LYS 15 15.113 6.511 6.755
147 HG3 LYS 15 HG3 LYS 15 15.824 7.206 5.279
148 HD2 LYS 15 HD2 LYS 15 14.261 9.187 5.536
149 HD3 LYS 15 HD3 LYS 15 13.777 8.523 7.111
150 HE2 LYS 15 HE2 LYS 15 16.308 8.536 7.682
151 HE3 LYS 15 HE3 LYS 15 16.522 9.475 6.200
152 HZ1 LYS 15 HZ1 LYS 15 15.139 10.234 8.692
153 HZ2 LYS 15 HZ2 LYS 15 16.196 11.129 7.788
154 HZ3 LYS 15 HZ3 LYS 15 14.649 10.916 7.275
155 H LEU 16 H LEU 16 12.064 3.978 4.723
156 HA LEU 16 HA LEU 16 13.483 1.976 6.412
157 HB2 LEU 16 HB2 LEU 16 11.629 1.454 7.484
158 HB3 LEU 16 HB3 LEU 16 11.216 3.113 7.121
159 HG LEU 16 HG LEU 16 10.221 0.655 5.597
160 HD11 LEU 16 HD11 LEU 16 8.671 2.465 7.480
161 HD12 LEU 16 HD12 LEU 16 8.156 0.930 6.749
162 HD13 LEU 16 HD13 LEU 16 9.419 0.927 7.983
163 HD21 LEU 16 HD21 LEU 16 9.685 3.625 5.301
164 HD22 LEU 16 HD22 LEU 16 10.004 2.407 4.041
165 HD23 LEU 16 HD23 LEU 16 8.450 2.462 4.844
166 H SER 17 H SER 17 13.499 -0.188 5.845
167 HA SER 17 HA SER 17 14.054 -0.846 3.245
168 HB2 SER 17 HB2 SER 17 13.266 -2.446 5.650
169 HB3 SER 17 HB3 SER 17 13.509 -3.269 4.092
170 HG SER 17 HG SER 17 15.576 -2.815 4.157
171 HA PRO 18 HA PRO 18 9.866 -0.686 1.571
172 HB2 PRO 18 HB2 PRO 18 10.486 -1.109 -1.101
173 HB3 PRO 18 HB3 PRO 18 10.622 0.453 -0.249
174 HG2 PRO 18 HG2 PRO 18 12.794 -1.476 -0.988
175 HG3 PRO 18 HG3 PRO 18 12.848 0.310 -0.883
176 HD2 PRO 18 HD2 PRO 18 13.799 -1.477 1.051
177 HD3 PRO 18 HD3 PRO 18 13.411 0.243 1.349
178 H GLU 19 H GLU 19 12.037 -3.372 1.416
179 HA GLU 19 HA GLU 19 9.966 -5.281 0.564
180 HB2 GLU 19 HB2 GLU 19 12.749 -5.191 0.309
181 HB3 GLU 19 HB3 GLU 19 12.525 -6.351 1.619
182 HG2 GLU 19 HG2 GLU 19 10.964 -7.651 0.194
183 HG3 GLU 19 HG3 GLU 19 11.078 -6.427 -1.071
184 H GLU 20 H GLU 20 11.068 -3.903 3.567
185 HA GLU 20 HA GLU 20 10.313 -6.194 5.245
186 HB2 GLU 20 HB2 GLU 20 12.067 -4.268 5.711
187 HB3 GLU 20 HB3 GLU 20 10.657 -3.358 6.234
188 HG2 GLU 20 HG2 GLU 20 11.361 -4.275 8.229
189 HG3 GLU 20 HG3 GLU 20 10.177 -5.475 7.735
190 H LEU 21 H LEU 21 8.928 -3.022 4.221
191 HA LEU 21 HA LEU 21 6.597 -3.223 5.812
192 HB2 LEU 21 HB2 LEU 21 7.650 -1.386 3.872
193 HB3 LEU 21 HB3 LEU 21 6.046 -1.828 3.319
194 HG LEU 21 HG LEU 21 6.765 -0.761 6.071
195 HD11 LEU 21 HD11 LEU 21 5.709 0.494 3.537
196 HD12 LEU 21 HD12 LEU 21 5.157 1.149 5.093
197 HD13 LEU 21 HD13 LEU 21 6.878 1.096 4.710
198 HD21 LEU 21 HD21 LEU 21 3.928 -1.043 5.034
199 HD22 LEU 21 HD22 LEU 21 4.681 -2.281 6.058
200 HD23 LEU 21 HD23 LEU 21 4.496 -0.641 6.671
201 H ASN 22 H ASN 22 7.033 -4.073 2.331
202 HA ASN 22 HA ASN 22 4.505 -5.132 1.809
203 HB2 ASN 22 HB2 ASN 22 6.422 -4.800 0.197
204 HB3 ASN 22 HB3 ASN 22 7.129 -6.298 0.804
205 HD21 ASN 22 HD21 ASN 22 6.671 -8.025 -0.597
206 HD22 ASN 22 HD22 ASN 22 5.089 -8.180 -1.366
207 H ARG 23 H ARG 23 7.238 -6.713 3.410
208 HA ARG 23 HA ARG 23 6.111 -9.308 3.749
209 HB2 ARG 23 HB2 ARG 23 8.539 -8.133 4.414
210 HB3 ARG 23 HB3 ARG 23 7.802 -8.239 5.996
211 HG2 ARG 23 HG2 ARG 23 8.613 -10.343 6.011
212 HG3 ARG 23 HG3 ARG 23 7.201 -10.742 5.029
213 HD2 ARG 23 HD2 ARG 23 8.691 -10.040 2.991
214 HD3 ARG 23 HD3 ARG 23 10.050 -10.163 4.110
215 HE ARG 23 HE ARG 23 8.655 -12.290 2.809
216 HH11 ARG 23 HH22 ARG 23 10.184 -11.659 5.873
217 HH12 ARG 23 HH21 ARG 23 10.463 -13.333 6.257
218 HH21 ARG 23 HH12 ARG 23 8.890 -14.424 3.318
219 HH22 ARG 23 HH11 ARG 23 9.725 -14.902 4.767
220 H TYR 24 H TYR 24 6.181 -6.596 6.076
221 HA TYR 24 HA TYR 24 4.413 -7.729 7.990
222 HB2 TYR 24 HB2 TYR 24 5.480 -4.999 7.385
223 HB3 TYR 24 HB3 TYR 24 4.065 -5.107 8.408
224 HD1 TYR 24 HD2 TYR 24 7.615 -6.286 8.104
225 HD2 TYR 24 HD1 TYR 24 4.197 -5.775 10.692
226 HE1 TYR 24 HE2 TYR 24 9.022 -6.850 10.054
227 HE2 TYR 24 HE1 TYR 24 5.620 -6.338 12.658
228 HH TYR 24 HH TYR 24 9.073 -7.181 12.334
229 H TYR 25 H TYR 25 3.795 -6.034 5.035
230 HA TYR 25 HA TYR 25 1.038 -5.459 5.277
231 HB2 TYR 25 HB2 TYR 25 2.992 -5.016 3.393
232 HB3 TYR 25 HB3 TYR 25 2.058 -6.228 2.564
233 HD1 TYR 25 HD2 TYR 25 -0.652 -5.729 2.735
234 HD2 TYR 25 HD1 TYR 25 2.559 -2.849 2.900
235 HE1 TYR 25 HE2 TYR 25 -2.192 -3.935 1.896
236 HE2 TYR 25 HE1 TYR 25 1.041 -1.091 2.044
237 HH TYR 25 HH TYR 25 -1.042 -0.701 1.078
238 H ALA 26 H ALA 26 2.613 -8.367 3.757
239 HA ALA 26 HA ALA 26 0.133 -9.646 3.120
240 HB1 ALA 26 HB1 ALA 26 2.869 -10.867 3.695
241 HB2 ALA 26 HB2 ALA 26 1.506 -11.692 2.901
242 HB3 ALA 26 HB3 ALA 26 2.275 -10.298 2.117
243 H SER 27 H SER 27 2.164 -9.854 6.085
244 HA SER 27 HA SER 27 0.385 -11.624 7.509
245 HB2 SER 27 HB2 SER 27 1.689 -10.779 9.516
246 HB3 SER 27 HB3 SER 27 2.621 -11.580 8.249
247 HG SER 27 HG SER 27 2.360 -8.736 8.380
248 H LEU 28 H LEU 28 -0.129 -8.425 6.592
249 HA LEU 28 HA LEU 28 -2.098 -8.013 8.795
250 HB2 LEU 28 HB2 LEU 28 -0.597 -6.156 6.937
251 HB3 LEU 28 HB3 LEU 28 -2.157 -5.673 7.576
252 HG LEU 28 HG LEU 28 0.205 -6.515 9.308
253 HD11 LEU 28 HD11 LEU 28 -0.697 -3.838 8.251
254 HD12 LEU 28 HD12 LEU 28 0.082 -3.942 9.843
255 HD13 LEU 28 HD13 LEU 28 0.936 -4.527 8.414
256 HD21 LEU 28 HD21 LEU 28 -1.382 -5.137 10.990
257 HD22 LEU 28 HD22 LEU 28 -2.640 -5.718 9.886
258 HD23 LEU 28 HD23 LEU 28 -1.573 -6.869 10.720
259 H ARG 29 H ARG 29 -1.765 -8.116 5.235
260 HA ARG 29 HA ARG 29 -4.507 -7.746 4.614
261 HB2 ARG 29 HB2 ARG 29 -2.353 -7.907 3.051
262 HB3 ARG 29 HB3 ARG 29 -2.734 -9.616 3.011
263 HG2 ARG 29 HG2 ARG 29 -3.982 -9.001 1.217
264 HG3 ARG 29 HG3 ARG 29 -5.213 -8.697 2.432
265 HD2 ARG 29 HD2 ARG 29 -5.238 -6.462 1.984
266 HD3 ARG 29 HD3 ARG 29 -3.493 -6.336 2.102
267 HE ARG 29 HE ARG 29 -3.262 -6.551 -0.182
268 HH11 ARG 29 HH22 ARG 29 -6.595 -7.280 0.576
269 HH12 ARG 29 HH21 ARG 29 -7.062 -7.477 -1.087
270 HH21 ARG 29 HH12 ARG 29 -3.900 -6.707 -2.321
271 HH22 ARG 29 HH11 ARG 29 -5.530 -7.167 -2.706
272 H HIS 30 H HIS 30 -2.713 -10.850 4.977
273 HA HIS 30 HA HIS 30 -5.029 -12.509 4.710
274 HB2 HIS 30 HB2 HIS 30 -2.467 -13.064 4.581
275 HB3 HIS 30 HB3 HIS 30 -2.597 -13.320 6.320
276 HD1 HIS 30 HD1 HIS 30 -3.458 -14.873 3.004
277 HD2 HIS 30 HD2 HIS 30 -4.391 -15.395 7.074
278 HE1 HIS 30 HE1 HIS 30 -4.496 -17.213 3.227
279 H TYR 31 H TYR 31 -3.599 -10.906 7.491
280 HA TYR 31 HA TYR 31 -5.192 -12.159 9.537
281 HB2 TYR 31 HB2 TYR 31 -2.986 -10.875 9.733
282 HB3 TYR 31 HB3 TYR 31 -3.893 -9.389 9.531
283 HD1 TYR 31 HD1 TYR 31 -4.069 -12.546 11.582
284 HD2 TYR 31 HD2 TYR 31 -4.211 -8.231 11.551
285 HE1 TYR 31 HE1 TYR 31 -4.439 -12.545 14.030
286 HE2 TYR 31 HE2 TYR 31 -4.502 -8.238 14.036
287 HH TYR 31 HH TYR 31 -5.265 -11.127 15.815
288 H LEU 32 H LEU 32 -5.464 -8.826 8.143
289 HA LEU 32 HA LEU 32 -7.950 -8.288 9.260
290 HB2 LEU 32 HB2 LEU 32 -7.654 -6.275 8.347
291 HB3 LEU 32 HB3 LEU 32 -6.126 -6.870 7.874
292 HG LEU 32 HG LEU 32 -7.376 -7.611 5.635
293 HD11 LEU 32 HD11 LEU 32 -9.087 -5.622 5.177
294 HD12 LEU 32 HD12 LEU 32 -9.658 -7.098 5.950
295 HD13 LEU 32 HD13 LEU 32 -9.307 -5.657 6.925
296 HD21 LEU 32 HD21 LEU 32 -5.575 -5.870 5.931
297 HD22 LEU 32 HD22 LEU 32 -6.716 -5.597 4.605
298 HD23 LEU 32 HD23 LEU 32 -6.872 -4.667 6.117
299 H ASN 33 H ASN 33 -7.263 -10.090 6.342
300 HA ASN 33 HA ASN 33 -9.643 -10.401 5.012
301 HB2 ASN 33 HB2 ASN 33 -7.204 -11.573 4.857
302 HB3 ASN 33 HB3 ASN 33 -8.040 -12.883 5.644
303 HD21 ASN 33 HD21 ASN 33 -9.897 -13.865 4.434
304 HD22 ASN 33 HD22 ASN 33 -9.808 -13.696 2.672
305 H LEU 34 H LEU 34 -8.818 -11.788 8.161
306 HA LEU 34 HA LEU 34 -11.654 -12.591 8.536
307 HB2 LEU 34 HB2 LEU 34 -10.953 -14.796 9.435
308 HB3 LEU 34 HB3 LEU 34 -10.701 -14.544 7.728
309 HG LEU 34 HG LEU 34 -8.203 -13.840 8.624
310 HD11 LEU 34 HD11 LEU 34 -9.261 -14.847 10.980
311 HD12 LEU 34 HD12 LEU 34 -8.441 -16.259 10.280
312 HD13 LEU 34 HD13 LEU 34 -7.549 -14.748 10.549
313 HD21 LEU 34 HD21 LEU 34 -9.250 -16.601 7.927
314 HD22 LEU 34 HD22 LEU 34 -8.639 -15.355 6.812
315 HD23 LEU 34 HD23 LEU 34 -7.532 -16.132 7.949
316 H VAL 35 H VAL 35 -9.249 -10.760 9.721
317 HA VAL 35 HA VAL 35 -10.082 -10.954 12.559
318 HB VAL 35 HB VAL 35 -7.888 -9.569 11.063
319 HG11 VAL 35 HG11 VAL 35 -6.941 -8.687 13.088
320 HG12 VAL 35 HG12 VAL 35 -8.479 -7.930 12.732
321 HG13 VAL 35 HG13 VAL 35 -8.381 -9.173 14.010
322 HG21 VAL 35 HG21 VAL 35 -7.103 -11.179 13.356
323 HG22 VAL 35 HG22 VAL 35 -8.166 -12.124 12.313
324 HG23 VAL 35 HG23 VAL 35 -6.724 -11.399 11.637
325 H THR 36 H THR 36 -10.664 -9.036 9.816
326 HA THR 36 HA THR 36 -11.988 -6.912 11.454
327 HB THR 36 HB THR 36 -11.816 -6.288 8.601
328 HG1 THR 36 HG1 THR 36 -9.983 -7.515 8.602
329 HG21 THR 36 HG21 THR 36 -12.087 -4.455 10.104
330 HG22 THR 36 HG22 THR 36 -10.785 -5.029 11.174
331 HG23 THR 36 HG23 THR 36 -10.393 -4.371 9.581
332 H ARG 37 H ARG 37 -12.650 -9.396 9.228
333 HA ARG 37 HA ARG 37 -15.300 -8.751 8.356
334 HB2 ARG 37 HB2 ARG 37 -13.422 -10.910 8.074
335 HB3 ARG 37 HB3 ARG 37 -14.891 -11.614 8.748
336 HG2 ARG 37 HG2 ARG 37 -16.219 -10.586 6.894
337 HG3 ARG 37 HG3 ARG 37 -14.730 -9.869 6.259
338 HD2 ARG 37 HD2 ARG 37 -14.963 -11.770 4.949
339 HD3 ARG 37 HD3 ARG 37 -13.801 -12.300 6.155
340 HE ARG 37 HE ARG 37 -16.627 -13.112 5.829
341 HH11 ARG 37 HH22 ARG 37 -13.833 -13.512 7.925
342 HH12 ARG 37 HH21 ARG 37 -14.538 -14.892 8.751
343 HH21 ARG 37 HH12 ARG 37 -17.455 -14.903 6.936
344 HH22 ARG 37 HH11 ARG 37 -16.465 -15.645 8.155
345 H GLN 38 H GLN 38 -14.250 -9.396 11.400
346 HA GLN 38 HA GLN 38 -17.012 -9.644 12.437
347 HB2 GLN 38 HB2 GLN 38 -16.391 -11.386 14.000
348 HB3 GLN 38 HB3 GLN 38 -15.972 -11.893 12.365
349 HG2 GLN 38 HG2 GLN 38 -13.564 -11.067 12.887
350 HG3 GLN 38 HG3 GLN 38 -14.094 -10.949 14.570
351 HE21 GLN 38 HE21 GLN 38 -11.990 -12.618 14.236
352 HE22 GLN 38 HE22 GLN 38 -12.604 -14.275 14.300
353 H ARG 39 H ARG 39 -14.591 -7.622 12.263
354 HA ARG 39 HA ARG 39 -15.116 -6.308 14.751
355 HB2 ARG 39 HB2 ARG 39 -13.437 -8.226 15.352
356 HB3 ARG 39 HB3 ARG 39 -12.220 -7.236 14.579
357 HG2 ARG 39 HG2 ARG 39 -13.935 -5.705 16.457
358 HG3 ARG 39 HG3 ARG 39 -13.142 -7.070 17.234
359 HD2 ARG 39 HD2 ARG 39 -11.012 -6.226 16.912
360 HD3 ARG 39 HD3 ARG 39 -11.474 -5.303 15.469
361 HE ARG 39 HE ARG 39 -12.742 -4.381 17.934
362 HH11 ARG 39 HH22 ARG 39 -10.005 -3.942 15.827
363 HH12 ARG 39 HH21 ARG 39 -9.657 -2.327 16.394
364 HH21 ARG 39 HH12 ARG 39 -12.342 -2.307 18.601
365 HH22 ARG 39 HH11 ARG 39 -10.964 -1.430 17.981
366 H TYR 40 H TYR 40 -15.712 -4.923 13.019
367 HA TYR 40 HA TYR 40 -14.077 -3.625 11.157
368 HB2 TYR 40 HB2 TYR 40 -16.635 -3.004 12.597
369 HB3 TYR 40 HB3 TYR 40 -15.836 -1.657 11.834
370 HD1 TYR 40 HD1 TYR 40 -17.127 -5.111 11.060
371 HD2 TYR 40 HD2 TYR 40 -16.115 -1.185 9.571
372 HE1 TYR 40 HE1 TYR 40 -18.193 -5.652 8.870
373 HE2 TYR 40 HE2 TYR 40 -17.163 -1.735 7.394
374 HH TYR 40 HH TYR 40 -18.264 -3.336 6.165
375 HN1 NH2 41 HN1 NH2 41 -13.351 -1.253 11.122
376 HN2 NH2 41 HN2 NH2 41 -12.565 -0.711 12.591
Start of MODEL 14
1 HA TYR 1 HA TYR 1 -2.549 11.716 -7.588
2 HB2 TYR 1 HB2 TYR 1 -4.233 13.797 -7.096
3 HB3 TYR 1 HB3 TYR 1 -2.791 14.703 -7.503
4 HD1 TYR 1 HD2 TYR 1 -5.036 11.926 -8.665
5 HD2 TYR 1 HD1 TYR 1 -2.282 15.039 -9.855
6 HE1 TYR 1 HE2 TYR 1 -5.599 11.538 -11.060
7 HE2 TYR 1 HE1 TYR 1 -2.832 14.625 -12.225
8 HH TYR 1 HH TYR 1 -4.332 13.572 -13.669
9 H LEU 2 H LEU 2 -0.993 13.560 -8.949
10 HA LEU 2 HA LEU 2 1.157 14.047 -9.399
11 HB2 LEU 2 HB2 LEU 2 0.873 15.104 -6.598
12 HB3 LEU 2 HB3 LEU 2 2.468 15.075 -7.300
13 HG LEU 2 HG LEU 2 1.296 17.236 -7.507
14 HD11 LEU 2 HD11 LEU 2 3.139 16.979 -8.936
15 HD12 LEU 2 HD12 LEU 2 2.318 15.807 -9.985
16 HD13 LEU 2 HD13 LEU 2 1.842 17.513 -10.014
17 HD21 LEU 2 HD21 LEU 2 -0.468 17.648 -8.980
18 HD22 LEU 2 HD22 LEU 2 -0.330 16.059 -9.755
19 HD23 LEU 2 HD23 LEU 2 -0.974 16.210 -8.090
20 H GLU 3 H GLU 3 1.105 11.587 -9.623
21 HA GLU 3 HA GLU 3 2.551 9.951 -7.841
22 HB2 GLU 3 HB2 GLU 3 1.699 9.815 -10.700
23 HB3 GLU 3 HB3 GLU 3 3.152 8.924 -10.318
24 HG2 GLU 3 HG2 GLU 3 1.616 8.096 -8.221
25 HG3 GLU 3 HG3 GLU 3 0.342 8.485 -9.366
26 H ARG 4 H ARG 4 3.746 12.317 -10.119
27 HA ARG 4 HA ARG 4 6.461 11.464 -10.275
28 HB2 ARG 4 HB2 ARG 4 5.382 13.190 -11.713
29 HB3 ARG 4 HB3 ARG 4 5.394 14.331 -10.359
30 HG2 ARG 4 HG2 ARG 4 7.753 14.521 -10.365
31 HG3 ARG 4 HG3 ARG 4 7.969 12.941 -11.133
32 HD2 ARG 4 HD2 ARG 4 6.786 13.996 -13.186
33 HD3 ARG 4 HD3 ARG 4 7.175 15.554 -12.434
34 HE ARG 4 HE ARG 4 9.588 14.441 -12.357
35 HH11 ARG 4 HH22 ARG 4 7.342 14.367 -15.091
36 HH12 ARG 4 HH21 ARG 4 8.675 14.259 -16.237
37 HH21 ARG 4 HH12 ARG 4 11.205 14.246 -13.985
38 HH22 ARG 4 HH11 ARG 4 10.639 14.265 -15.646
39 H GLU 5 H GLU 5 4.952 13.765 -7.988
40 HA GLU 5 HA GLU 5 7.322 14.208 -6.418
41 HB2 GLU 5 HB2 GLU 5 5.275 15.687 -6.412
42 HB3 GLU 5 HB3 GLU 5 4.424 14.427 -5.505
43 HG2 GLU 5 HG2 GLU 5 6.309 14.587 -3.768
44 HG3 GLU 5 HG3 GLU 5 6.919 15.976 -4.657
45 H LEU 6 H LEU 6 4.597 11.845 -6.129
46 HA LEU 6 HA LEU 6 5.528 10.539 -3.790
47 HB2 LEU 6 HB2 LEU 6 3.369 10.016 -4.300
48 HB3 LEU 6 HB3 LEU 6 3.653 9.944 -6.028
49 HG LEU 6 HG LEU 6 4.625 7.785 -5.914
50 HD11 LEU 6 HD11 LEU 6 5.639 6.959 -4.108
51 HD12 LEU 6 HD12 LEU 6 5.064 8.289 -3.093
52 HD13 LEU 6 HD13 LEU 6 4.104 6.816 -3.256
53 HD21 LEU 6 HD21 LEU 6 2.287 7.693 -6.158
54 HD22 LEU 6 HD22 LEU 6 2.650 6.480 -4.933
55 HD23 LEU 6 HD23 LEU 6 1.992 8.056 -4.441
56 H LYS 7 H LYS 7 6.282 9.814 -7.255
57 HA LYS 7 HA LYS 7 7.973 7.619 -6.678
58 HB2 LYS 7 HB2 LYS 7 7.155 8.831 -9.023
59 HB3 LYS 7 HB3 LYS 7 8.822 9.400 -8.941
60 HG2 LYS 7 HG2 LYS 7 9.297 6.824 -8.369
61 HG3 LYS 7 HG3 LYS 7 7.727 6.579 -9.117
62 HD2 LYS 7 HD2 LYS 7 9.609 8.259 -10.741
63 HD3 LYS 7 HD3 LYS 7 10.203 6.648 -10.367
64 HE2 LYS 7 HE2 LYS 7 9.099 6.232 -12.346
65 HE3 LYS 7 HE3 LYS 7 7.889 5.783 -11.137
66 HZ1 LYS 7 HZ1 LYS 7 6.735 7.133 -12.611
67 HZ2 LYS 7 HZ2 LYS 7 7.126 8.208 -11.433
68 HZ3 LYS 7 HZ3 LYS 7 7.981 8.173 -12.847
69 H LYS 8 H LYS 8 8.739 11.069 -6.758
70 HA LYS 8 HA LYS 8 11.538 10.704 -6.043
71 HB2 LYS 8 HB2 LYS 8 9.992 12.844 -7.014
72 HB3 LYS 8 HB3 LYS 8 10.288 13.303 -5.342
73 HG2 LYS 8 HG2 LYS 8 12.819 12.553 -6.022
74 HG3 LYS 8 HG3 LYS 8 12.194 12.902 -7.638
75 HD2 LYS 8 HD2 LYS 8 11.364 15.162 -6.354
76 HD3 LYS 8 HD3 LYS 8 12.724 14.716 -5.303
77 HE2 LYS 8 HE2 LYS 8 14.176 14.576 -7.361
78 HE3 LYS 8 HE3 LYS 8 12.810 15.163 -8.326
79 HZ1 LYS 8 HZ1 LYS 8 12.886 17.223 -7.255
80 HZ2 LYS 8 HZ2 LYS 8 13.821 16.675 -6.013
81 HZ3 LYS 8 HZ3 LYS 8 14.473 16.861 -7.509
82 H LEU 9 H LEU 9 8.772 10.287 -4.223
83 HA LEU 9 HA LEU 9 9.992 10.974 -1.627
84 HB2 LEU 9 HB2 LEU 9 7.418 11.254 -2.569
85 HB3 LEU 9 HB3 LEU 9 7.290 9.675 -1.841
86 HG LEU 9 HG LEU 9 8.627 11.104 0.140
87 HD11 LEU 9 HD11 LEU 9 8.276 13.185 -1.288
88 HD12 LEU 9 HD12 LEU 9 6.534 12.983 -1.044
89 HD13 LEU 9 HD13 LEU 9 7.595 13.280 0.349
90 HD21 LEU 9 HD21 LEU 9 6.665 9.605 0.428
91 HD22 LEU 9 HD22 LEU 9 6.519 11.117 1.339
92 HD23 LEU 9 HD23 LEU 9 5.606 10.900 -0.173
93 H GLU 10 H GLU 10 8.454 8.122 -3.250
94 HA GLU 10 HA GLU 10 9.248 6.206 -1.297
95 HB2 GLU 10 HB2 GLU 10 7.534 5.936 -3.183
96 HB3 GLU 10 HB3 GLU 10 8.911 5.621 -4.253
97 HG2 GLU 10 HG2 GLU 10 9.593 3.773 -2.601
98 HG3 GLU 10 HG3 GLU 10 8.065 4.051 -1.772
99 H ARG 11 H ARG 11 10.967 7.567 -4.088
100 HA ARG 11 HA ARG 11 13.269 5.947 -4.161
101 HB2 ARG 11 HB2 ARG 11 12.771 7.868 -5.699
102 HB3 ARG 11 HB3 ARG 11 13.167 8.994 -4.383
103 HG2 ARG 11 HG2 ARG 11 15.488 8.013 -4.299
104 HG3 ARG 11 HG3 ARG 11 15.027 6.898 -5.591
105 HD2 ARG 11 HD2 ARG 11 14.386 9.376 -6.675
106 HD3 ARG 11 HD3 ARG 11 15.779 9.764 -5.644
107 HE ARG 11 HE ARG 11 16.209 7.392 -7.262
108 HH11 ARG 11 HH22 ARG 11 16.300 10.851 -7.462
109 HH12 ARG 11 HH21 ARG 11 17.296 10.885 -8.891
110 HH21 ARG 11 HH12 ARG 11 17.557 7.406 -9.038
111 HH22 ARG 11 HH11 ARG 11 17.918 8.904 -9.831
112 H GLU 12 H GLU 12 12.364 8.367 -1.704
113 HA GLU 12 HA GLU 12 15.001 8.132 -0.442
114 HB2 GLU 12 HB2 GLU 12 12.971 10.105 -0.291
115 HB3 GLU 12 HB3 GLU 12 12.927 9.278 1.272
116 HG2 GLU 12 HG2 GLU 12 15.579 9.489 1.129
117 HG3 GLU 12 HG3 GLU 12 15.237 10.698 -0.105
118 H LEU 13 H LEU 13 11.636 7.103 0.329
119 HA LEU 13 HA LEU 13 12.158 5.631 2.690
120 HB2 LEU 13 HB2 LEU 13 10.139 5.279 0.473
121 HB3 LEU 13 HB3 LEU 13 10.125 4.246 1.889
122 HG LEU 13 HG LEU 13 10.057 7.259 2.246
123 HD11 LEU 13 HD11 LEU 13 8.111 7.347 1.138
124 HD12 LEU 13 HD12 LEU 13 7.930 5.584 1.058
125 HD13 LEU 13 HD13 LEU 13 7.404 6.460 2.496
126 HD21 LEU 13 HD21 LEU 13 8.836 6.617 4.321
127 HD22 LEU 13 HD22 LEU 13 9.048 4.906 3.901
128 HD23 LEU 13 HD23 LEU 13 10.464 5.926 4.252
129 H LYS 14 H LYS 14 12.848 4.631 -0.596
130 HA LYS 14 HA LYS 14 13.647 1.937 -0.196
131 HB2 LYS 14 HB2 LYS 14 13.635 2.592 -2.388
132 HB3 LYS 14 HB3 LYS 14 14.332 4.173 -2.073
133 HG2 LYS 14 HG2 LYS 14 16.570 3.200 -1.775
134 HG3 LYS 14 HG3 LYS 14 15.872 1.576 -1.963
135 HD2 LYS 14 HD2 LYS 14 15.052 2.648 -4.289
136 HD3 LYS 14 HD3 LYS 14 16.487 3.667 -4.016
137 HE2 LYS 14 HE2 LYS 14 17.948 1.792 -3.937
138 HE3 LYS 14 HE3 LYS 14 16.629 0.665 -3.606
139 HZ1 LYS 14 HZ1 LYS 14 16.916 2.088 -6.167
140 HZ2 LYS 14 HZ2 LYS 14 17.429 0.542 -5.915
141 HZ3 LYS 14 HZ3 LYS 14 15.827 0.905 -5.807
142 H LYS 15 H LYS 15 15.146 4.711 1.230
143 HA LYS 15 HA LYS 15 17.766 3.976 1.739
144 HB2 LYS 15 HB2 LYS 15 17.553 5.253 3.840
145 HB3 LYS 15 HB3 LYS 15 16.825 6.068 2.465
146 HG2 LYS 15 HG2 LYS 15 14.647 4.700 3.512
147 HG3 LYS 15 HG3 LYS 15 15.597 4.989 4.956
148 HD2 LYS 15 HD2 LYS 15 15.439 7.492 3.516
149 HD3 LYS 15 HD3 LYS 15 13.858 6.746 3.455
150 HE2 LYS 15 HE2 LYS 15 13.499 7.779 5.365
151 HE3 LYS 15 HE3 LYS 15 14.274 6.343 6.050
152 HZ1 LYS 15 HZ1 LYS 15 16.379 7.610 5.989
153 HZ2 LYS 15 HZ2 LYS 15 15.587 8.922 5.387
154 HZ3 LYS 15 HZ3 LYS 15 15.259 8.403 6.904
155 H LEU 16 H LEU 16 14.931 2.468 3.127
156 HA LEU 16 HA LEU 16 16.674 0.399 4.401
157 HB2 LEU 16 HB2 LEU 16 14.538 -0.304 5.588
158 HB3 LEU 16 HB3 LEU 16 15.345 1.131 6.184
159 HG LEU 16 HG LEU 16 13.237 1.548 4.097
160 HD11 LEU 16 HD11 LEU 16 11.405 1.459 5.709
161 HD12 LEU 16 HD12 LEU 16 12.149 -0.132 5.461
162 HD13 LEU 16 HD13 LEU 16 12.506 0.799 6.941
163 HD21 LEU 16 HD21 LEU 16 14.651 3.226 5.828
164 HD22 LEU 16 HD22 LEU 16 13.166 3.654 4.943
165 HD23 LEU 16 HD23 LEU 16 13.090 3.098 6.626
166 H SER 17 H SER 17 16.010 -1.788 4.153
167 HA SER 17 HA SER 17 15.834 -2.667 1.574
168 HB2 SER 17 HB2 SER 17 15.346 -3.896 4.233
169 HB3 SER 17 HB3 SER 17 14.854 -4.825 2.794
170 HG SER 17 HG SER 17 16.982 -5.202 3.516
171 HA PRO 18 HA PRO 18 11.489 -1.752 0.718
172 HB2 PRO 18 HB2 PRO 18 11.448 -2.529 -1.946
173 HB3 PRO 18 HB3 PRO 18 12.043 -0.962 -1.334
174 HG2 PRO 18 HG2 PRO 18 13.620 -3.337 -2.248
175 HG3 PRO 18 HG3 PRO 18 14.031 -1.598 -2.329
176 HD2 PRO 18 HD2 PRO 18 14.970 -3.449 -0.429
177 HD3 PRO 18 HD3 PRO 18 15.047 -1.669 -0.272
178 H GLU 19 H GLU 19 12.961 -4.821 0.731
179 HA GLU 19 HA GLU 19 10.413 -6.327 0.470
180 HB2 GLU 19 HB2 GLU 19 12.607 -6.996 -0.653
181 HB3 GLU 19 HB3 GLU 19 13.239 -7.338 0.946
182 HG2 GLU 19 HG2 GLU 19 12.433 -9.421 0.747
183 HG3 GLU 19 HG3 GLU 19 10.804 -8.775 0.847
184 H GLU 20 H GLU 20 12.383 -4.869 2.962
185 HA GLU 20 HA GLU 20 11.588 -6.787 5.061
186 HB2 GLU 20 HB2 GLU 20 13.745 -5.143 4.685
187 HB3 GLU 20 HB3 GLU 20 12.839 -4.202 5.857
188 HG2 GLU 20 HG2 GLU 20 13.000 -5.953 7.480
189 HG3 GLU 20 HG3 GLU 20 13.418 -7.167 6.263
190 H LEU 21 H LEU 21 10.579 -3.659 3.787
191 HA LEU 21 HA LEU 21 8.804 -3.073 5.992
192 HB2 LEU 21 HB2 LEU 21 9.705 -1.769 3.546
193 HB3 LEU 21 HB3 LEU 21 7.955 -1.742 3.590
194 HG LEU 21 HG LEU 21 9.820 -0.758 5.780
195 HD11 LEU 21 HD11 LEU 21 8.137 0.665 3.682
196 HD12 LEU 21 HD12 LEU 21 8.796 1.492 5.109
197 HD13 LEU 21 HD13 LEU 21 9.892 0.753 3.923
198 HD21 LEU 21 HD21 LEU 21 6.995 0.120 5.932
199 HD22 LEU 21 HD22 LEU 21 7.212 -1.597 6.259
200 HD23 LEU 21 HD23 LEU 21 8.118 -0.409 7.199
201 H ASN 22 H ASN 22 8.263 -4.315 2.650
202 HA ASN 22 HA ASN 22 5.508 -4.777 2.814
203 HB2 ASN 22 HB2 ASN 22 7.176 -5.081 0.850
204 HB3 ASN 22 HB3 ASN 22 7.347 -6.735 1.428
205 HD21 ASN 22 HD21 ASN 22 6.101 -5.527 -1.093
206 HD22 ASN 22 HD22 ASN 22 4.521 -6.333 -1.089
207 H ARG 23 H ARG 23 8.147 -6.719 4.146
208 HA ARG 23 HA ARG 23 6.754 -9.015 4.984
209 HB2 ARG 23 HB2 ARG 23 9.240 -8.526 5.147
210 HB3 ARG 23 HB3 ARG 23 8.916 -7.587 6.605
211 HG2 ARG 23 HG2 ARG 23 7.827 -10.391 6.432
212 HG3 ARG 23 HG3 ARG 23 9.559 -10.172 6.680
213 HD2 ARG 23 HD2 ARG 23 9.237 -8.980 8.747
214 HD3 ARG 23 HD3 ARG 23 7.513 -8.788 8.466
215 HE ARG 23 HE ARG 23 7.101 -10.872 9.281
216 HH11 ARG 23 HH22 ARG 23 10.513 -10.735 8.599
217 HH12 ARG 23 HH21 ARG 23 10.841 -12.333 9.222
218 HH21 ARG 23 HH12 ARG 23 7.540 -12.894 10.146
219 HH22 ARG 23 HH11 ARG 23 9.165 -13.515 10.089
220 H TYR 24 H TYR 24 7.186 -6.009 6.905
221 HA TYR 24 HA TYR 24 5.374 -6.785 9.009
222 HB2 TYR 24 HB2 TYR 24 6.713 -4.228 8.100
223 HB3 TYR 24 HB3 TYR 24 5.381 -4.127 9.227
224 HD1 TYR 24 HD2 TYR 24 5.531 -6.042 11.197
225 HD2 TYR 24 HD1 TYR 24 8.833 -4.137 9.167
226 HE1 TYR 24 HE2 TYR 24 6.972 -6.456 13.170
227 HE2 TYR 24 HE1 TYR 24 10.269 -4.526 11.176
228 HH TYR 24 HH TYR 24 8.958 -5.893 14.172
229 H TYR 25 H TYR 25 4.894 -5.496 5.849
230 HA TYR 25 HA TYR 25 2.202 -4.510 6.260
231 HB2 TYR 25 HB2 TYR 25 4.152 -4.195 4.354
232 HB3 TYR 25 HB3 TYR 25 3.093 -5.317 3.517
233 HD1 TYR 25 HD2 TYR 25 0.469 -4.618 3.696
234 HD2 TYR 25 HD1 TYR 25 3.851 -1.962 4.053
235 HE1 TYR 25 HE2 TYR 25 -0.982 -2.667 3.091
236 HE2 TYR 25 HE1 TYR 25 2.407 -0.032 3.394
237 HH TYR 25 HH TYR 25 -0.900 -0.141 3.539
238 H ALA 26 H ALA 26 3.525 -7.503 4.715
239 HA ALA 26 HA ALA 26 1.030 -8.707 4.127
240 HB1 ALA 26 HB1 ALA 26 3.013 -10.728 4.758
241 HB2 ALA 26 HB2 ALA 26 2.412 -10.194 3.179
242 HB3 ALA 26 HB3 ALA 26 3.807 -9.389 3.913
243 H SER 27 H SER 27 3.085 -9.031 7.040
244 HA SER 27 HA SER 27 1.178 -10.639 8.538
245 HB2 SER 27 HB2 SER 27 3.697 -9.111 9.211
246 HB3 SER 27 HB3 SER 27 2.666 -9.742 10.506
247 HG SER 27 HG SER 27 3.172 -11.500 8.443
248 H LEU 28 H LEU 28 0.939 -7.382 7.643
249 HA LEU 28 HA LEU 28 -1.016 -6.910 9.839
250 HB2 LEU 28 HB2 LEU 28 0.533 -5.081 7.984
251 HB3 LEU 28 HB3 LEU 28 -0.955 -4.525 8.729
252 HG LEU 28 HG LEU 28 1.401 -5.640 10.284
253 HD11 LEU 28 HD11 LEU 28 2.185 -3.486 10.736
254 HD12 LEU 28 HD12 LEU 28 1.833 -3.440 9.007
255 HD13 LEU 28 HD13 LEU 28 0.704 -2.690 10.148
256 HD21 LEU 28 HD21 LEU 28 0.169 -5.450 12.154
257 HD22 LEU 28 HD22 LEU 28 -0.388 -3.817 11.745
258 HD23 LEU 28 HD23 LEU 28 -1.257 -5.218 11.134
259 H ARG 29 H ARG 29 -0.685 -7.344 6.355
260 HA ARG 29 HA ARG 29 -3.404 -6.672 5.742
261 HB2 ARG 29 HB2 ARG 29 -1.227 -6.913 4.171
262 HB3 ARG 29 HB3 ARG 29 -1.837 -8.549 3.973
263 HG2 ARG 29 HG2 ARG 29 -3.148 -7.647 2.325
264 HG3 ARG 29 HG3 ARG 29 -4.168 -7.080 3.643
265 HD2 ARG 29 HD2 ARG 29 -2.493 -5.022 3.684
266 HD3 ARG 29 HD3 ARG 29 -2.049 -5.604 2.071
267 HE ARG 29 HE ARG 29 -4.924 -5.137 2.651
268 HH11 ARG 29 HH22 ARG 29 -2.067 -3.861 1.088
269 HH12 ARG 29 HH21 ARG 29 -2.941 -2.671 0.170
270 HH21 ARG 29 HH12 ARG 29 -6.035 -3.567 1.503
271 HH22 ARG 29 HH11 ARG 29 -5.159 -2.511 0.434
272 H HIS 30 H HIS 30 -1.761 -9.838 6.199
273 HA HIS 30 HA HIS 30 -3.945 -11.505 5.610
274 HB2 HIS 30 HB2 HIS 30 -1.473 -12.042 6.159
275 HB3 HIS 30 HB3 HIS 30 -1.987 -12.115 7.833
276 HD1 HIS 30 HD1 HIS 30 -0.830 -14.653 6.352
277 HD2 HIS 30 HD2 HIS 30 -4.930 -13.737 6.616
278 HE1 HIS 30 HE1 HIS 30 -2.120 -16.849 6.101
279 H TYR 31 H TYR 31 -3.313 -9.678 8.593
280 HA TYR 31 HA TYR 31 -5.435 -10.761 10.189
281 HB2 TYR 31 HB2 TYR 31 -3.717 -8.277 10.131
282 HB3 TYR 31 HB3 TYR 31 -5.209 -8.184 11.019
283 HD1 TYR 31 HD1 TYR 31 -1.935 -9.864 10.839
284 HD2 TYR 31 HD2 TYR 31 -5.541 -9.316 13.126
285 HE1 TYR 31 HE1 TYR 31 -0.815 -10.838 12.819
286 HE2 TYR 31 HE2 TYR 31 -4.456 -10.369 15.096
287 HH TYR 31 HH TYR 31 -1.003 -11.169 15.063
288 H LEU 32 H LEU 32 -5.519 -7.478 8.792
289 HA LEU 32 HA LEU 32 -8.305 -7.247 8.795
290 HB2 LEU 32 HB2 LEU 32 -7.961 -5.347 7.235
291 HB3 LEU 32 HB3 LEU 32 -6.986 -5.332 8.689
292 HG LEU 32 HG LEU 32 -5.209 -6.547 7.027
293 HD11 LEU 32 HD11 LEU 32 -6.869 -4.786 5.201
294 HD12 LEU 32 HD12 LEU 32 -5.221 -5.349 4.859
295 HD13 LEU 32 HD13 LEU 32 -6.534 -6.527 5.016
296 HD21 LEU 32 HD21 LEU 32 -4.801 -4.589 8.403
297 HD22 LEU 32 HD22 LEU 32 -4.106 -4.425 6.793
298 HD23 LEU 32 HD23 LEU 32 -5.614 -3.558 7.194
299 H ASN 33 H ASN 33 -6.475 -9.103 6.472
300 HA ASN 33 HA ASN 33 -8.326 -9.407 4.402
301 HB2 ASN 33 HB2 ASN 33 -5.991 -10.576 5.011
302 HB3 ASN 33 HB3 ASN 33 -7.029 -11.832 5.669
303 HD21 ASN 33 HD21 ASN 33 -6.663 -13.465 4.117
304 HD22 ASN 33 HD22 ASN 33 -6.952 -13.130 2.402
305 H LEU 34 H LEU 34 -8.377 -11.025 7.614
306 HA LEU 34 HA LEU 34 -11.230 -11.819 7.084
307 HB2 LEU 34 HB2 LEU 34 -10.809 -13.904 7.701
308 HB3 LEU 34 HB3 LEU 34 -9.135 -13.501 7.490
309 HG LEU 34 HG LEU 34 -9.188 -12.830 10.025
310 HD11 LEU 34 HD11 LEU 34 -11.803 -14.307 9.683
311 HD12 LEU 34 HD12 LEU 34 -10.865 -14.605 11.152
312 HD13 LEU 34 HD13 LEU 34 -11.399 -12.971 10.771
313 HD21 LEU 34 HD21 LEU 34 -9.429 -15.799 9.767
314 HD22 LEU 34 HD22 LEU 34 -8.183 -14.985 8.799
315 HD23 LEU 34 HD23 LEU 34 -8.201 -14.785 10.548
316 H VAL 35 H VAL 35 -9.055 -10.232 9.244
317 HA VAL 35 HA VAL 35 -10.911 -9.756 11.420
318 HB VAL 35 HB VAL 35 -8.296 -8.388 10.819
319 HG11 VAL 35 HG11 VAL 35 -9.400 -7.189 12.593
320 HG12 VAL 35 HG12 VAL 35 -9.800 -8.707 13.432
321 HG13 VAL 35 HG13 VAL 35 -8.115 -8.143 13.313
322 HG21 VAL 35 HG21 VAL 35 -8.353 -10.604 12.854
323 HG22 VAL 35 HG22 VAL 35 -8.304 -11.083 11.158
324 HG23 VAL 35 HG23 VAL 35 -7.057 -10.043 11.785
325 H THR 36 H THR 36 -10.624 -8.420 8.367
326 HA THR 36 HA THR 36 -11.405 -5.734 8.476
327 HB THR 36 HB THR 36 -11.697 -7.979 6.629
328 HG1 THR 36 HG1 THR 36 -10.314 -6.549 6.163
329 HG21 THR 36 HG21 THR 36 -14.057 -7.614 6.618
330 HG22 THR 36 HG22 THR 36 -13.806 -5.845 6.401
331 HG23 THR 36 HG23 THR 36 -13.311 -6.966 5.146
332 H ARG 37 H ARG 37 -13.138 -8.345 9.749
333 HA ARG 37 HA ARG 37 -14.892 -8.386 11.196
334 HB2 ARG 37 HB2 ARG 37 -13.947 -5.828 11.497
335 HB3 ARG 37 HB3 ARG 37 -15.557 -5.454 10.921
336 HG2 ARG 37 HG2 ARG 37 -15.514 -5.488 13.326
337 HG3 ARG 37 HG3 ARG 37 -16.481 -6.883 12.794
338 HD2 ARG 37 HD2 ARG 37 -14.783 -8.427 13.346
339 HD3 ARG 37 HD3 ARG 37 -13.497 -7.212 13.213
340 HE ARG 37 HE ARG 37 -15.235 -6.528 15.364
341 HH11 ARG 37 HH22 ARG 37 -12.704 -8.775 14.559
342 HH12 ARG 37 HH21 ARG 37 -12.261 -9.148 16.187
343 HH21 ARG 37 HH12 ARG 37 -14.584 -6.808 17.484
344 HH22 ARG 37 HH11 ARG 37 -13.272 -7.890 17.846
345 H GLN 38 H GLN 38 -15.203 -9.050 8.620
346 HA GLN 38 HA GLN 38 -16.646 -9.452 6.915
347 HB2 GLN 38 HB2 GLN 38 -18.633 -8.945 9.130
348 HB3 GLN 38 HB3 GLN 38 -19.179 -9.343 7.528
349 HG2 GLN 38 HG2 GLN 38 -17.090 -11.117 8.830
350 HG3 GLN 38 HG3 GLN 38 -18.749 -11.198 9.407
351 HE21 GLN 38 HE21 GLN 38 -17.249 -13.432 8.030
352 HE22 GLN 38 HE22 GLN 38 -18.151 -13.654 6.545
353 H ARG 39 H ARG 39 -15.718 -6.540 7.540
354 HA ARG 39 HA ARG 39 -17.692 -5.003 6.022
355 HB2 ARG 39 HB2 ARG 39 -16.071 -4.409 8.162
356 HB3 ARG 39 HB3 ARG 39 -15.064 -3.798 6.860
357 HG2 ARG 39 HG2 ARG 39 -16.484 -2.062 7.820
358 HG3 ARG 39 HG3 ARG 39 -16.970 -2.336 6.136
359 HD2 ARG 39 HD2 ARG 39 -18.937 -3.458 6.748
360 HD3 ARG 39 HD3 ARG 39 -18.337 -3.882 8.362
361 HE ARG 39 HE ARG 39 -18.453 -1.228 8.604
362 HH11 ARG 39 HH22 ARG 39 -20.836 -3.433 7.362
363 HH12 ARG 39 HH21 ARG 39 -22.198 -2.482 7.877
364 HH21 ARG 39 HH12 ARG 39 -20.215 0.067 9.212
365 HH22 ARG 39 HH11 ARG 39 -21.804 -0.421 8.806
366 H TYR 40 H TYR 40 -16.292 -7.128 4.667
367 HA TYR 40 HA TYR 40 -14.393 -5.953 2.771
368 HB2 TYR 40 HB2 TYR 40 -14.342 -8.281 1.841
369 HB3 TYR 40 HB3 TYR 40 -13.925 -8.175 3.511
370 HD1 TYR 40 HD1 TYR 40 -16.867 -9.016 1.275
371 HD2 TYR 40 HD2 TYR 40 -14.921 -9.576 5.093
372 HE1 TYR 40 HE1 TYR 40 -18.543 -10.719 1.875
373 HE2 TYR 40 HE2 TYR 40 -16.579 -11.343 5.645
374 HH TYR 40 HH TYR 40 -18.948 -11.887 5.065
375 HN1 NH2 41 HN1 NH2 41 -15.313 -7.505 0.338
376 HN2 NH2 41 HN2 NH2 41 -16.723 -6.599 -0.147
Start of MODEL 15
1 HA TYR 1 HA TYR 1 -3.219 11.777 -8.337
2 HB2 TYR 1 HB2 TYR 1 -2.072 10.980 -10.330
3 HB3 TYR 1 HB3 TYR 1 -3.629 11.674 -10.743
4 HD1 TYR 1 HD1 TYR 1 -3.636 14.175 -11.673
5 HD2 TYR 1 HD2 TYR 1 -0.158 11.615 -11.531
6 HE1 TYR 1 HE1 TYR 1 -2.428 15.716 -13.191
7 HE2 TYR 1 HE2 TYR 1 1.024 13.163 -13.094
8 HH TYR 1 HH TYR 1 0.486 16.109 -13.555
9 H LEU 2 H LEU 2 -0.824 14.119 -9.714
10 HA LEU 2 HA LEU 2 1.287 14.569 -9.161
11 HB2 LEU 2 HB2 LEU 2 -0.163 14.597 -6.522
12 HB3 LEU 2 HB3 LEU 2 1.570 14.806 -6.514
13 HG LEU 2 HG LEU 2 0.540 16.940 -6.455
14 HD11 LEU 2 HD11 LEU 2 2.666 16.636 -7.750
15 HD12 LEU 2 HD12 LEU 2 1.698 16.658 -9.251
16 HD13 LEU 2 HD13 LEU 2 1.721 18.066 -8.179
17 HD21 LEU 2 HD21 LEU 2 -0.736 17.884 -8.383
18 HD22 LEU 2 HD22 LEU 2 -0.893 16.259 -9.050
19 HD23 LEU 2 HD23 LEU 2 -1.607 16.651 -7.462
20 H GLU 3 H GLU 3 1.075 12.000 -9.957
21 HA GLU 3 HA GLU 3 2.361 10.113 -8.232
22 HB2 GLU 3 HB2 GLU 3 1.563 10.275 -11.116
23 HB3 GLU 3 HB3 GLU 3 2.818 9.135 -10.727
24 HG2 GLU 3 HG2 GLU 3 0.624 8.930 -8.776
25 HG3 GLU 3 HG3 GLU 3 0.023 8.786 -10.418
26 H ARG 4 H ARG 4 3.638 12.397 -10.603
27 HA ARG 4 HA ARG 4 6.292 11.451 -10.815
28 HB2 ARG 4 HB2 ARG 4 5.131 13.425 -12.069
29 HB3 ARG 4 HB3 ARG 4 5.538 14.397 -10.665
30 HG2 ARG 4 HG2 ARG 4 7.450 14.849 -11.746
31 HG3 ARG 4 HG3 ARG 4 8.011 13.278 -11.198
32 HD2 ARG 4 HD2 ARG 4 6.484 13.587 -13.814
33 HD3 ARG 4 HD3 ARG 4 8.209 13.948 -13.708
34 HE ARG 4 HE ARG 4 7.722 11.352 -12.605
35 HH11 ARG 4 HH22 ARG 4 7.842 12.961 -15.719
36 HH12 ARG 4 HH21 ARG 4 8.490 11.581 -16.550
37 HH21 ARG 4 HH12 ARG 4 8.408 9.512 -13.744
38 HH22 ARG 4 HH11 ARG 4 8.788 9.654 -15.428
39 H GLU 5 H GLU 5 4.885 13.641 -8.395
40 HA GLU 5 HA GLU 5 7.298 13.995 -6.873
41 HB2 GLU 5 HB2 GLU 5 4.609 15.005 -6.787
42 HB3 GLU 5 HB3 GLU 5 4.923 14.232 -5.228
43 HG2 GLU 5 HG2 GLU 5 7.164 15.506 -5.198
44 HG3 GLU 5 HG3 GLU 5 6.547 16.421 -6.578
45 H LEU 6 H LEU 6 4.502 11.730 -6.531
46 HA LEU 6 HA LEU 6 5.374 10.380 -4.233
47 HB2 LEU 6 HB2 LEU 6 3.653 9.735 -6.590
48 HB3 LEU 6 HB3 LEU 6 4.281 8.350 -5.740
49 HG LEU 6 HG LEU 6 2.052 8.976 -5.001
50 HD11 LEU 6 HD11 LEU 6 2.453 8.874 -2.590
51 HD12 LEU 6 HD12 LEU 6 3.535 7.792 -3.479
52 HD13 LEU 6 HD13 LEU 6 4.151 9.326 -2.824
53 HD21 LEU 6 HD21 LEU 6 3.269 11.656 -4.317
54 HD22 LEU 6 HD22 LEU 6 1.758 11.260 -5.154
55 HD23 LEU 6 HD23 LEU 6 1.894 11.025 -3.407
56 H LYS 7 H LYS 7 6.421 9.884 -7.594
57 HA LYS 7 HA LYS 7 8.221 7.755 -6.983
58 HB2 LYS 7 HB2 LYS 7 7.441 9.151 -9.327
59 HB3 LYS 7 HB3 LYS 7 9.153 9.516 -9.171
60 HG2 LYS 7 HG2 LYS 7 9.076 6.784 -8.597
61 HG3 LYS 7 HG3 LYS 7 7.771 6.939 -9.767
62 HD2 LYS 7 HD2 LYS 7 9.252 7.739 -11.457
63 HD3 LYS 7 HD3 LYS 7 10.535 8.113 -10.297
64 HE2 LYS 7 HE2 LYS 7 9.555 5.304 -10.975
65 HE3 LYS 7 HE3 LYS 7 11.010 6.075 -11.626
66 HZ1 LYS 7 HZ1 LYS 7 11.767 4.811 -9.845
67 HZ2 LYS 7 HZ2 LYS 7 11.693 6.317 -9.206
68 HZ3 LYS 7 HZ3 LYS 7 10.516 5.231 -8.851
69 H LYS 8 H LYS 8 8.720 11.229 -6.803
70 HA LYS 8 HA LYS 8 11.550 11.025 -5.989
71 HB2 LYS 8 HB2 LYS 8 9.544 13.296 -6.231
72 HB3 LYS 8 HB3 LYS 8 11.118 13.539 -5.472
73 HG2 LYS 8 HG2 LYS 8 12.286 12.855 -7.510
74 HG3 LYS 8 HG3 LYS 8 10.753 12.443 -8.290
75 HD2 LYS 8 HD2 LYS 8 10.319 15.081 -7.515
76 HD3 LYS 8 HD3 LYS 8 12.038 15.106 -7.900
77 HE2 LYS 8 HE2 LYS 8 9.940 13.908 -9.755
78 HE3 LYS 8 HE3 LYS 8 10.303 15.634 -9.752
79 HZ1 LYS 8 HZ1 LYS 8 12.130 13.437 -10.476
80 HZ2 LYS 8 HZ2 LYS 8 11.657 14.700 -11.401
81 HZ3 LYS 8 HZ3 LYS 8 12.713 14.944 -10.164
82 H LEU 9 H LEU 9 8.638 10.454 -4.446
83 HA LEU 9 HA LEU 9 9.630 11.092 -1.749
84 HB2 LEU 9 HB2 LEU 9 7.129 11.218 -2.905
85 HB3 LEU 9 HB3 LEU 9 7.044 9.634 -2.180
86 HG LEU 9 HG LEU 9 6.114 11.222 -0.690
87 HD11 LEU 9 HD11 LEU 9 7.662 9.445 0.289
88 HD12 LEU 9 HD12 LEU 9 8.866 10.724 0.507
89 HD13 LEU 9 HD13 LEU 9 7.295 10.828 1.331
90 HD21 LEU 9 HD21 LEU 9 7.035 13.264 -0.011
91 HD22 LEU 9 HD22 LEU 9 8.683 12.825 -0.516
92 HD23 LEU 9 HD23 LEU 9 7.444 13.189 -1.729
93 H GLU 10 H GLU 10 8.451 8.191 -3.564
94 HA GLU 10 HA GLU 10 9.163 6.281 -1.653
95 HB2 GLU 10 HB2 GLU 10 7.932 6.065 -4.013
96 HB3 GLU 10 HB3 GLU 10 9.544 5.547 -4.530
97 HG2 GLU 10 HG2 GLU 10 9.440 3.961 -2.430
98 HG3 GLU 10 HG3 GLU 10 7.721 4.326 -2.418
99 H ARG 11 H ARG 11 11.225 7.961 -3.896
100 HA ARG 11 HA ARG 11 13.677 6.550 -3.725
101 HB2 ARG 11 HB2 ARG 11 12.829 9.381 -4.226
102 HB3 ARG 11 HB3 ARG 11 14.469 9.200 -3.609
103 HG2 ARG 11 HG2 ARG 11 14.926 7.513 -5.434
104 HG3 ARG 11 HG3 ARG 11 13.324 7.906 -6.102
105 HD2 ARG 11 HD2 ARG 11 14.258 10.411 -5.849
106 HD3 ARG 11 HD3 ARG 11 15.828 9.590 -5.913
107 HE ARG 11 HE ARG 11 14.504 8.512 -8.039
108 HH11 ARG 11 HH22 ARG 11 15.175 11.822 -7.150
109 HH12 ARG 11 HH21 ARG 11 15.108 12.423 -8.782
110 HH21 ARG 11 HH12 ARG 11 14.308 9.312 -10.113
111 HH22 ARG 11 HH11 ARG 11 14.638 10.995 -10.444
112 H GLU 12 H GLU 12 12.191 8.659 -1.269
113 HA GLU 12 HA GLU 12 14.553 8.298 0.501
114 HB2 GLU 12 HB2 GLU 12 12.504 10.317 0.185
115 HB3 GLU 12 HB3 GLU 12 12.376 9.653 1.800
116 HG2 GLU 12 HG2 GLU 12 15.056 10.519 0.617
117 HG3 GLU 12 HG3 GLU 12 13.938 11.680 1.324
118 H LEU 13 H LEU 13 11.076 7.350 0.262
119 HA LEU 13 HA LEU 13 10.993 5.925 2.731
120 HB2 LEU 13 HB2 LEU 13 9.615 5.332 0.102
121 HB3 LEU 13 HB3 LEU 13 9.201 4.546 1.605
122 HG LEU 13 HG LEU 13 9.067 7.586 1.340
123 HD11 LEU 13 HD11 LEU 13 7.184 5.499 0.320
124 HD12 LEU 13 HD12 LEU 13 6.468 6.873 1.182
125 HD13 LEU 13 HD13 LEU 13 7.488 7.153 -0.232
126 HD21 LEU 13 HD21 LEU 13 7.381 7.223 3.219
127 HD22 LEU 13 HD22 LEU 13 7.962 5.548 3.308
128 HD23 LEU 13 HD23 LEU 13 9.069 6.904 3.621
129 H LYS 14 H LYS 14 12.420 4.901 -0.336
130 HA LYS 14 HA LYS 14 13.155 2.231 0.326
131 HB2 LYS 14 HB2 LYS 14 13.355 2.997 -1.917
132 HB3 LYS 14 HB3 LYS 14 14.398 4.351 -1.465
133 HG2 LYS 14 HG2 LYS 14 16.265 2.994 -1.087
134 HG3 LYS 14 HG3 LYS 14 15.300 1.505 -0.950
135 HD2 LYS 14 HD2 LYS 14 14.902 1.413 -3.292
136 HD3 LYS 14 HD3 LYS 14 15.669 2.998 -3.549
137 HE2 LYS 14 HE2 LYS 14 17.689 2.020 -3.705
138 HE3 LYS 14 HE3 LYS 14 17.542 1.508 -2.031
139 HZ1 LYS 14 HZ1 LYS 14 16.075 -0.270 -3.646
140 HZ2 LYS 14 HZ2 LYS 14 17.584 -0.112 -4.282
141 HZ3 LYS 14 HZ3 LYS 14 17.397 -0.591 -2.734
142 H LYS 15 H LYS 15 14.312 5.094 1.908
143 HA LYS 15 HA LYS 15 16.870 4.390 2.799
144 HB2 LYS 15 HB2 LYS 15 16.434 5.734 4.736
145 HB3 LYS 15 HB3 LYS 15 15.632 6.495 3.372
146 HG2 LYS 15 HG2 LYS 15 13.456 5.319 4.180
147 HG3 LYS 15 HG3 LYS 15 14.372 4.829 5.607
148 HD2 LYS 15 HD2 LYS 15 14.901 7.373 5.874
149 HD3 LYS 15 HD3 LYS 15 13.541 7.597 4.748
150 HE2 LYS 15 HE2 LYS 15 12.201 6.060 6.333
151 HE3 LYS 15 HE3 LYS 15 13.557 6.208 7.458
152 HZ1 LYS 15 HZ1 LYS 15 12.405 8.016 8.151
153 HZ2 LYS 15 HZ2 LYS 15 13.071 8.781 6.872
154 HZ3 LYS 15 HZ3 LYS 15 11.554 8.171 6.746
155 H LEU 16 H LEU 16 13.796 2.972 3.709
156 HA LEU 16 HA LEU 16 15.155 1.105 5.577
157 HB2 LEU 16 HB2 LEU 16 13.266 0.930 6.754
158 HB3 LEU 16 HB3 LEU 16 13.008 2.525 6.124
159 HG LEU 16 HG LEU 16 11.791 0.961 4.157
160 HD11 LEU 16 HD11 LEU 16 11.926 -1.121 5.311
161 HD12 LEU 16 HD12 LEU 16 11.503 -0.392 6.873
162 HD13 LEU 16 HD13 LEU 16 10.291 -0.539 5.600
163 HD21 LEU 16 HD21 LEU 16 10.291 1.984 6.563
164 HD22 LEU 16 HD22 LEU 16 10.941 3.042 5.277
165 HD23 LEU 16 HD23 LEU 16 9.755 1.813 4.874
166 H SER 17 H SER 17 15.160 -1.079 5.166
167 HA SER 17 HA SER 17 15.522 -2.038 2.632
168 HB2 SER 17 HB2 SER 17 16.226 -3.394 4.392
169 HB3 SER 17 HB3 SER 17 14.612 -3.429 5.124
170 HG SER 17 HG SER 17 14.733 -5.324 4.058
171 HA PRO 18 HA PRO 18 11.265 -1.850 1.095
172 HB2 PRO 18 HB2 PRO 18 11.797 -2.577 -1.533
173 HB3 PRO 18 HB3 PRO 18 11.953 -0.932 -0.859
174 HG2 PRO 18 HG2 PRO 18 14.108 -2.893 -1.517
175 HG3 PRO 18 HG3 PRO 18 14.160 -1.105 -1.493
176 HD2 PRO 18 HD2 PRO 18 15.121 -2.861 0.508
177 HD3 PRO 18 HD3 PRO 18 14.886 -1.096 0.678
178 H GLU 19 H GLU 19 13.288 -4.535 1.500
179 HA GLU 19 HA GLU 19 11.216 -6.516 0.766
180 HB2 GLU 19 HB2 GLU 19 13.963 -6.451 0.403
181 HB3 GLU 19 HB3 GLU 19 13.843 -7.417 1.865
182 HG2 GLU 19 HG2 GLU 19 12.599 -9.115 0.773
183 HG3 GLU 19 HG3 GLU 19 12.078 -8.044 -0.526
184 H GLU 20 H GLU 20 12.310 -4.763 3.531
185 HA GLU 20 HA GLU 20 11.542 -6.844 5.481
186 HB2 GLU 20 HB2 GLU 20 13.392 -5.041 5.725
187 HB3 GLU 20 HB3 GLU 20 12.085 -3.924 6.109
188 HG2 GLU 20 HG2 GLU 20 12.102 -4.682 8.239
189 HG3 GLU 20 HG3 GLU 20 11.670 -6.298 7.690
190 H LEU 21 H LEU 21 10.254 -3.811 4.103
191 HA LEU 21 HA LEU 21 7.947 -3.638 5.769
192 HB2 LEU 21 HB2 LEU 21 9.093 -2.192 3.561
193 HB3 LEU 21 HB3 LEU 21 7.440 -2.565 3.117
194 HG LEU 21 HG LEU 21 8.296 -1.225 5.713
195 HD11 LEU 21 HD11 LEU 21 6.905 -0.014 3.295
196 HD12 LEU 21 HD12 LEU 21 7.499 0.831 4.747
197 HD13 LEU 21 HD13 LEU 21 8.647 0.107 3.609
198 HD21 LEU 21 HD21 LEU 21 6.296 -1.925 6.452
199 HD22 LEU 21 HD22 LEU 21 5.654 -0.610 5.465
200 HD23 LEU 21 HD23 LEU 21 5.665 -2.268 4.831
201 H ASN 22 H ASN 22 8.320 -5.039 2.463
202 HA ASN 22 HA ASN 22 5.755 -6.057 2.080
203 HB2 ASN 22 HB2 ASN 22 7.661 -6.122 0.462
204 HB3 ASN 22 HB3 ASN 22 8.346 -7.478 1.353
205 HD21 ASN 22 HD21 ASN 22 7.250 -9.593 1.244
206 HD22 ASN 22 HD22 ASN 22 5.977 -9.786 0.054
207 H ARG 23 H ARG 23 8.376 -7.453 3.988
208 HA ARG 23 HA ARG 23 7.148 -9.934 4.648
209 HB2 ARG 23 HB2 ARG 23 9.609 -8.891 5.013
210 HB3 ARG 23 HB3 ARG 23 8.991 -8.552 6.615
211 HG2 ARG 23 HG2 ARG 23 8.471 -11.343 5.630
212 HG3 ARG 23 HG3 ARG 23 10.161 -10.889 5.743
213 HD2 ARG 23 HD2 ARG 23 9.888 -11.713 7.822
214 HD3 ARG 23 HD3 ARG 23 9.520 -10.019 8.156
215 HE ARG 23 HE ARG 23 7.048 -11.200 7.555
216 HH11 ARG 23 HH22 ARG 23 9.515 -11.586 9.981
217 HH12 ARG 23 HH21 ARG 23 8.488 -12.387 11.137
218 HH21 ARG 23 HH12 ARG 23 5.702 -12.330 9.020
219 HH22 ARG 23 HH11 ARG 23 6.335 -12.774 10.582
220 H TYR 24 H TYR 24 7.231 -6.891 6.513
221 HA TYR 24 HA TYR 24 5.349 -7.715 8.546
222 HB2 TYR 24 HB2 TYR 24 6.571 -5.126 7.596
223 HB3 TYR 24 HB3 TYR 24 5.142 -5.050 8.603
224 HD1 TYR 24 HD1 TYR 24 5.106 -6.169 10.865
225 HD2 TYR 24 HD2 TYR 24 8.737 -5.607 8.602
226 HE1 TYR 24 HE1 TYR 24 6.453 -6.503 12.938
227 HE2 TYR 24 HE2 TYR 24 10.075 -5.926 10.663
228 HH TYR 24 HH TYR 24 10.007 -6.220 12.889
229 H TYR 25 H TYR 25 4.974 -6.510 5.323
230 HA TYR 25 HA TYR 25 2.276 -5.662 5.395
231 HB2 TYR 25 HB2 TYR 25 4.268 -5.674 3.539
232 HB3 TYR 25 HB3 TYR 25 3.296 -6.977 2.896
233 HD1 TYR 25 HD1 TYR 25 0.973 -6.520 2.119
234 HD2 TYR 25 HD2 TYR 25 3.645 -3.416 3.459
235 HE1 TYR 25 HE1 TYR 25 -0.406 -4.803 0.919
236 HE2 TYR 25 HE2 TYR 25 2.295 -1.715 2.250
237 HH TYR 25 HH TYR 25 0.712 -1.641 0.325
238 H ALA 26 H ALA 26 3.615 -8.906 4.498
239 HA ALA 26 HA ALA 26 1.080 -10.108 3.971
240 HB1 ALA 26 HB1 ALA 26 3.393 -11.011 3.404
241 HB2 ALA 26 HB2 ALA 26 3.518 -11.542 5.098
242 HB3 ALA 26 HB3 ALA 26 2.240 -12.196 4.048
243 H SER 27 H SER 27 2.946 -9.863 6.995
244 HA SER 27 HA SER 27 1.075 -11.174 8.718
245 HB2 SER 27 HB2 SER 27 3.231 -9.092 9.268
246 HB3 SER 27 HB3 SER 27 2.399 -10.038 10.512
247 HG SER 27 HG SER 27 4.423 -10.875 9.897
248 H LEU 28 H LEU 28 0.832 -8.155 7.182
249 HA LEU 28 HA LEU 28 -1.184 -7.151 9.119
250 HB2 LEU 28 HB2 LEU 28 0.540 -5.855 7.002
251 HB3 LEU 28 HB3 LEU 28 -0.958 -5.084 7.492
252 HG LEU 28 HG LEU 28 1.185 -5.907 9.490
253 HD11 LEU 28 HD11 LEU 28 2.271 -4.328 8.066
254 HD12 LEU 28 HD12 LEU 28 0.830 -3.291 7.977
255 HD13 LEU 28 HD13 LEU 28 1.748 -3.423 9.495
256 HD21 LEU 28 HD21 LEU 28 0.063 -4.450 11.025
257 HD22 LEU 28 HD22 LEU 28 -0.962 -3.757 9.747
258 HD23 LEU 28 HD23 LEU 28 -1.221 -5.416 10.306
259 H ARG 29 H ARG 29 -0.777 -8.107 5.703
260 HA ARG 29 HA ARG 29 -3.377 -7.493 4.820
261 HB2 ARG 29 HB2 ARG 29 -1.312 -8.325 3.502
262 HB3 ARG 29 HB3 ARG 29 -1.836 -9.967 3.907
263 HG2 ARG 29 HG2 ARG 29 -3.987 -9.602 2.764
264 HG3 ARG 29 HG3 ARG 29 -3.635 -7.879 2.599
265 HD2 ARG 29 HD2 ARG 29 -3.141 -8.581 0.499
266 HD3 ARG 29 HD3 ARG 29 -1.536 -8.646 1.239
267 HE ARG 29 HE ARG 29 -2.517 -11.191 1.628
268 HH11 ARG 29 HH22 ARG 29 -2.192 -9.238 -1.253
269 HH12 ARG 29 HH21 ARG 29 -2.135 -10.608 -2.330
270 HH21 ARG 29 HH12 ARG 29 -2.343 -12.952 0.218
271 HH22 ARG 29 HH11 ARG 29 -2.144 -12.654 -1.483
272 H HIS 30 H HIS 30 -2.221 -10.479 6.378
273 HA HIS 30 HA HIS 30 -4.833 -11.728 6.445
274 HB2 HIS 30 HB2 HIS 30 -2.252 -12.576 6.930
275 HB3 HIS 30 HB3 HIS 30 -2.910 -12.512 8.561
276 HD1 HIS 30 HD1 HIS 30 -2.580 -14.799 5.855
277 HD2 HIS 30 HD2 HIS 30 -5.693 -13.789 8.485
278 HE1 HIS 30 HE1 HIS 30 -4.234 -16.784 5.838
279 H TYR 31 H TYR 31 -3.218 -9.394 8.523
280 HA TYR 31 HA TYR 31 -4.866 -9.640 10.848
281 HB2 TYR 31 HB2 TYR 31 -2.595 -8.347 10.341
282 HB3 TYR 31 HB3 TYR 31 -3.659 -7.018 9.914
283 HD1 TYR 31 HD1 TYR 31 -3.033 -9.495 12.633
284 HD2 TYR 31 HD2 TYR 31 -4.238 -5.494 11.580
285 HE1 TYR 31 HE1 TYR 31 -3.093 -8.895 15.040
286 HE2 TYR 31 HE2 TYR 31 -4.273 -4.873 14.002
287 HH TYR 31 HH TYR 31 -3.570 -7.254 16.559
288 H LEU 32 H LEU 32 -5.000 -7.325 8.113
289 HA LEU 32 HA LEU 32 -7.504 -6.170 8.816
290 HB2 LEU 32 HB2 LEU 32 -6.391 -6.442 6.010
291 HB3 LEU 32 HB3 LEU 32 -7.556 -5.243 6.578
292 HG LEU 32 HG LEU 32 -4.653 -5.440 7.427
293 HD11 LEU 32 HD11 LEU 32 -5.325 -2.993 6.049
294 HD12 LEU 32 HD12 LEU 32 -4.104 -4.224 5.683
295 HD13 LEU 32 HD13 LEU 32 -5.742 -4.398 5.048
296 HD21 LEU 32 HD21 LEU 32 -6.858 -3.622 8.358
297 HD22 LEU 32 HD22 LEU 32 -5.605 -4.475 9.286
298 HD23 LEU 32 HD23 LEU 32 -5.168 -3.059 8.328
299 H ASN 33 H ASN 33 -6.804 -9.137 7.163
300 HA ASN 33 HA ASN 33 -9.253 -9.762 5.925
301 HB2 ASN 33 HB2 ASN 33 -6.930 -11.085 6.234
302 HB3 ASN 33 HB3 ASN 33 -7.854 -11.905 7.497
303 HD21 ASN 33 HD21 ASN 33 -7.273 -11.646 4.098
304 HD22 ASN 33 HD22 ASN 33 -8.525 -12.842 3.694
305 H LEU 34 H LEU 34 -8.424 -9.766 9.374
306 HA LEU 34 HA LEU 34 -11.188 -10.633 10.057
307 HB2 LEU 34 HB2 LEU 34 -8.669 -10.499 11.767
308 HB3 LEU 34 HB3 LEU 34 -10.225 -11.152 12.280
309 HG LEU 34 HG LEU 34 -8.518 -12.324 10.032
310 HD11 LEU 34 HD11 LEU 34 -8.028 -14.126 11.652
311 HD12 LEU 34 HD12 LEU 34 -7.368 -12.554 12.140
312 HD13 LEU 34 HD13 LEU 34 -8.837 -13.180 12.928
313 HD21 LEU 34 HD21 LEU 34 -10.454 -14.130 11.292
314 HD22 LEU 34 HD22 LEU 34 -11.252 -12.735 10.569
315 HD23 LEU 34 HD23 LEU 34 -10.193 -13.747 9.579
316 H VAL 35 H VAL 35 -10.550 -8.020 9.045
317 HA VAL 35 HA VAL 35 -11.628 -6.358 11.281
318 HB VAL 35 HB VAL 35 -9.497 -5.481 9.354
319 HG11 VAL 35 HG11 VAL 35 -11.331 -3.845 10.703
320 HG12 VAL 35 HG12 VAL 35 -9.894 -3.780 11.713
321 HG13 VAL 35 HG13 VAL 35 -9.786 -3.357 9.997
322 HG21 VAL 35 HG21 VAL 35 -9.279 -6.022 12.339
323 HG22 VAL 35 HG22 VAL 35 -8.559 -6.992 11.057
324 HG23 VAL 35 HG23 VAL 35 -7.993 -5.342 11.297
325 H THR 36 H THR 36 -10.975 -4.709 8.398
326 HA THR 36 HA THR 36 -13.642 -3.966 7.889
327 HB THR 36 HB THR 36 -12.568 -3.348 5.576
328 HG1 THR 36 HG1 THR 36 -10.144 -3.208 6.651
329 HG21 THR 36 HG21 THR 36 -11.526 -2.176 8.205
330 HG22 THR 36 HG22 THR 36 -11.392 -1.401 6.606
331 HG23 THR 36 HG23 THR 36 -12.985 -1.675 7.322
332 H ARG 37 H ARG 37 -11.790 -6.599 6.604
333 HA ARG 37 HA ARG 37 -13.673 -7.477 4.575
334 HB2 ARG 37 HB2 ARG 37 -11.135 -8.385 5.741
335 HB3 ARG 37 HB3 ARG 37 -12.228 -9.750 5.496
336 HG2 ARG 37 HG2 ARG 37 -12.459 -9.329 3.183
337 HG3 ARG 37 HG3 ARG 37 -11.785 -7.694 3.319
338 HD2 ARG 37 HD2 ARG 37 -9.564 -8.587 3.825
339 HD3 ARG 37 HD3 ARG 37 -10.207 -10.234 3.881
340 HE ARG 37 HE ARG 37 -10.067 -10.362 1.611
341 HH11 ARG 37 HH22 ARG 37 -10.087 -6.946 2.345
342 HH12 ARG 37 HH21 ARG 37 -9.950 -6.453 0.687
343 HH21 ARG 37 HH12 ARG 37 -9.896 -9.736 -0.518
344 HH22 ARG 37 HH11 ARG 37 -9.845 -8.067 -0.952
345 H GLN 38 H GLN 38 -13.852 -7.580 7.890
346 HA GLN 38 HA GLN 38 -16.250 -9.316 7.847
347 HB2 GLN 38 HB2 GLN 38 -13.729 -9.865 9.145
348 HB3 GLN 38 HB3 GLN 38 -14.891 -9.491 10.411
349 HG2 GLN 38 HG2 GLN 38 -16.503 -11.122 9.333
350 HG3 GLN 38 HG3 GLN 38 -15.219 -11.553 8.190
351 HE21 GLN 38 HE21 GLN 38 -13.276 -12.688 9.040
352 HE22 GLN 38 HE22 GLN 38 -13.448 -13.467 10.620
353 H ARG 39 H ARG 39 -15.706 -6.274 7.829
354 HA ARG 39 HA ARG 39 -16.678 -4.392 8.720
355 HB2 ARG 39 HB2 ARG 39 -18.745 -6.258 9.978
356 HB3 ARG 39 HB3 ARG 39 -18.885 -4.527 9.742
357 HG2 ARG 39 HG2 ARG 39 -20.059 -5.174 7.926
358 HG3 ARG 39 HG3 ARG 39 -18.449 -5.104 7.204
359 HD2 ARG 39 HD2 ARG 39 -18.522 -7.719 8.136
360 HD3 ARG 39 HD3 ARG 39 -20.226 -7.430 7.818
361 HE ARG 39 HE ARG 39 -18.556 -6.537 5.635
362 HH11 ARG 39 HH22 ARG 39 -19.866 -9.482 6.982
363 HH12 ARG 39 HH21 ARG 39 -19.800 -10.345 5.475
364 HH21 ARG 39 HH12 ARG 39 -18.609 -7.594 3.686
365 HH22 ARG 39 HH11 ARG 39 -19.131 -9.247 3.607
366 H TYR 40 H TYR 40 -14.644 -5.855 10.305
367 HA TYR 40 HA TYR 40 -13.610 -5.955 12.242
368 HB2 TYR 40 HB2 TYR 40 -13.002 -3.893 13.092
369 HB3 TYR 40 HB3 TYR 40 -13.411 -3.601 11.418
370 HD1 TYR 40 HD1 TYR 40 -14.408 -2.974 14.913
371 HD2 TYR 40 HD2 TYR 40 -15.376 -2.274 10.772
372 HE1 TYR 40 HE1 TYR 40 -16.171 -1.348 15.595
373 HE2 TYR 40 HE2 TYR 40 -17.163 -0.705 11.443
374 HH TYR 40 HH TYR 40 -18.315 0.118 13.143
375 HN1 NH2 41 HN1 NH2 41 -16.766 -6.500 12.515
376 HN2 NH2 41 HN2 NH2 41 -16.861 -6.576 14.282
Start of MODEL 16
1 HA TYR 1 HA TYR 1 1.656 12.241 -15.539
2 HB2 TYR 1 HB2 TYR 1 -0.130 13.988 -16.033
3 HB3 TYR 1 HB3 TYR 1 0.061 14.538 -14.373
4 HD1 TYR 1 HD1 TYR 1 2.012 13.825 -17.510
5 HD2 TYR 1 HD2 TYR 1 1.763 16.169 -13.894
6 HE1 TYR 1 HE1 TYR 1 3.934 15.227 -18.275
7 HE2 TYR 1 HE2 TYR 1 3.659 17.585 -14.694
8 HH TYR 1 HH TYR 1 4.641 18.089 -17.366
9 H LEU 2 H LEU 2 0.020 12.827 -12.362
10 HA LEU 2 HA LEU 2 2.451 13.314 -10.936
11 HB2 LEU 2 HB2 LEU 2 -0.476 12.871 -10.326
12 HB3 LEU 2 HB3 LEU 2 0.667 12.704 -9.034
13 HG LEU 2 HG LEU 2 -0.221 14.893 -8.945
14 HD11 LEU 2 HD11 LEU 2 1.693 16.206 -8.737
15 HD12 LEU 2 HD12 LEU 2 2.299 14.572 -8.548
16 HD13 LEU 2 HD13 LEU 2 2.538 15.417 -10.089
17 HD21 LEU 2 HD21 LEU 2 0.698 15.298 -11.814
18 HD22 LEU 2 HD22 LEU 2 -0.971 15.312 -11.192
19 HD23 LEU 2 HD23 LEU 2 0.165 16.591 -10.733
20 H GLU 3 H GLU 3 3.496 11.511 -12.068
21 HA GLU 3 HA GLU 3 3.353 8.907 -10.601
22 HB2 GLU 3 HB2 GLU 3 4.035 9.768 -13.347
23 HB3 GLU 3 HB3 GLU 3 5.222 8.677 -12.685
24 HG2 GLU 3 HG2 GLU 3 2.300 7.957 -12.354
25 HG3 GLU 3 HG3 GLU 3 3.007 7.844 -13.956
26 H ARG 4 H ARG 4 5.827 11.307 -11.671
27 HA ARG 4 HA ARG 4 7.975 10.267 -10.180
28 HB2 ARG 4 HB2 ARG 4 8.013 12.217 -11.867
29 HB3 ARG 4 HB3 ARG 4 7.459 13.242 -10.546
30 HG2 ARG 4 HG2 ARG 4 9.658 13.539 -10.039
31 HG3 ARG 4 HG3 ARG 4 9.614 11.930 -9.350
32 HD2 ARG 4 HD2 ARG 4 10.021 11.363 -12.034
33 HD3 ARG 4 HD3 ARG 4 10.881 12.899 -11.825
34 HE ARG 4 HE ARG 4 11.408 10.834 -9.795
35 HH11 ARG 4 HH22 ARG 4 12.476 12.097 -12.900
36 HH12 ARG 4 HH21 ARG 4 14.020 11.298 -12.817
37 HH21 ARG 4 HH12 ARG 4 13.434 9.817 -9.738
38 HH22 ARG 4 HH11 ARG 4 14.571 10.131 -11.013
39 H GLU 5 H GLU 5 5.319 12.293 -9.034
40 HA GLU 5 HA GLU 5 6.268 12.964 -6.456
41 HB2 GLU 5 HB2 GLU 5 3.981 13.210 -5.765
42 HB3 GLU 5 HB3 GLU 5 4.209 13.902 -7.366
43 HG2 GLU 5 HG2 GLU 5 2.868 12.367 -8.400
44 HG3 GLU 5 HG3 GLU 5 3.231 11.072 -7.308
45 H LEU 6 H LEU 6 5.071 9.847 -7.654
46 HA LEU 6 HA LEU 6 4.818 8.577 -5.067
47 HB2 LEU 6 HB2 LEU 6 5.162 7.367 -7.841
48 HB3 LEU 6 HB3 LEU 6 4.644 6.507 -6.415
49 HG LEU 6 HG LEU 6 3.054 8.847 -7.551
50 HD11 LEU 6 HD11 LEU 6 1.769 6.337 -8.105
51 HD12 LEU 6 HD12 LEU 6 2.267 7.623 -9.200
52 HD13 LEU 6 HD13 LEU 6 3.394 6.317 -8.820
53 HD21 LEU 6 HD21 LEU 6 1.206 7.721 -6.277
54 HD22 LEU 6 HD22 LEU 6 2.414 6.611 -5.587
55 HD23 LEU 6 HD23 LEU 6 2.497 8.361 -5.255
56 H LYS 7 H LYS 7 7.381 8.894 -7.502
57 HA LYS 7 HA LYS 7 9.229 7.029 -6.219
58 HB2 LYS 7 HB2 LYS 7 9.205 8.479 -8.656
59 HB3 LYS 7 HB3 LYS 7 10.470 9.256 -7.732
60 HG2 LYS 7 HG2 LYS 7 11.809 7.632 -8.530
61 HG3 LYS 7 HG3 LYS 7 11.115 6.598 -7.289
62 HD2 LYS 7 HD2 LYS 7 10.077 6.896 -10.151
63 HD3 LYS 7 HD3 LYS 7 11.119 5.587 -9.596
64 HE2 LYS 7 HE2 LYS 7 9.443 4.451 -8.578
65 HE3 LYS 7 HE3 LYS 7 8.706 5.906 -7.920
66 HZ1 LYS 7 HZ1 LYS 7 7.719 6.325 -10.131
67 HZ2 LYS 7 HZ2 LYS 7 8.348 4.917 -10.695
68 HZ3 LYS 7 HZ3 LYS 7 7.221 4.903 -9.510
69 H LYS 8 H LYS 8 8.663 10.508 -5.985
70 HA LYS 8 HA LYS 8 10.681 10.873 -3.886
71 HB2 LYS 8 HB2 LYS 8 8.931 12.629 -5.468
72 HB3 LYS 8 HB3 LYS 8 8.816 13.017 -3.759
73 HG2 LYS 8 HG2 LYS 8 10.614 14.338 -4.503
74 HG3 LYS 8 HG3 LYS 8 11.371 12.988 -3.674
75 HD2 LYS 8 HD2 LYS 8 11.183 12.083 -6.339
76 HD3 LYS 8 HD3 LYS 8 11.501 13.815 -6.520
77 HE2 LYS 8 HE2 LYS 8 13.477 13.597 -5.039
78 HE3 LYS 8 HE3 LYS 8 13.130 11.859 -4.853
79 HZ1 LYS 8 HZ1 LYS 8 14.788 12.068 -6.520
80 HZ2 LYS 8 HZ2 LYS 8 13.399 11.748 -7.329
81 HZ3 LYS 8 HZ3 LYS 8 14.005 13.279 -7.301
82 H LEU 9 H LEU 9 7.702 9.380 -3.809
83 HA LEU 9 HA LEU 9 7.227 9.926 -0.954
84 HB2 LEU 9 HB2 LEU 9 5.499 9.622 -3.076
85 HB3 LEU 9 HB3 LEU 9 5.537 7.983 -2.506
86 HG LEU 9 HG LEU 9 3.672 9.221 -1.613
87 HD11 LEU 9 HD11 LEU 9 3.870 8.701 0.717
88 HD12 LEU 9 HD12 LEU 9 4.808 7.495 -0.181
89 HD13 LEU 9 HD13 LEU 9 5.644 8.817 0.665
90 HD21 LEU 9 HD21 LEU 9 5.570 11.096 -0.151
91 HD22 LEU 9 HD22 LEU 9 4.834 11.484 -1.722
92 HD23 LEU 9 HD23 LEU 9 3.805 11.198 -0.308
93 H GLU 10 H GLU 10 7.646 7.058 -3.131
94 HA GLU 10 HA GLU 10 8.018 5.148 -1.117
95 HB2 GLU 10 HB2 GLU 10 7.832 4.848 -3.717
96 HB3 GLU 10 HB3 GLU 10 9.599 4.962 -3.670
97 HG2 GLU 10 HG2 GLU 10 9.485 3.121 -1.837
98 HG3 GLU 10 HG3 GLU 10 7.790 2.946 -2.259
99 H ARG 11 H ARG 11 10.280 7.567 -2.336
100 HA ARG 11 HA ARG 11 12.696 6.635 -1.239
101 HB2 ARG 11 HB2 ARG 11 12.230 8.795 -2.641
102 HB3 ARG 11 HB3 ARG 11 11.858 9.554 -1.093
103 HG2 ARG 11 HG2 ARG 11 14.307 8.184 -0.636
104 HG3 ARG 11 HG3 ARG 11 14.468 8.794 -2.273
105 HD2 ARG 11 HD2 ARG 11 13.644 10.481 0.130
106 HD3 ARG 11 HD3 ARG 11 15.321 10.284 -0.403
107 HE ARG 11 HE ARG 11 14.219 11.110 -2.689
108 HH11 ARG 11 HH22 ARG 11 13.800 12.483 0.494
109 HH12 ARG 11 HH21 ARG 11 13.647 14.123 -0.093
110 HH21 ARG 11 HH12 ARG 11 14.258 13.241 -3.362
111 HH22 ARG 11 HH11 ARG 11 13.798 14.512 -2.268
112 H GLU 12 H GLU 12 10.079 8.406 0.487
113 HA GLU 12 HA GLU 12 11.650 8.455 2.963
114 HB2 GLU 12 HB2 GLU 12 9.454 9.928 2.087
115 HB3 GLU 12 HB3 GLU 12 8.710 8.772 3.200
116 HG2 GLU 12 HG2 GLU 12 10.813 9.454 4.732
117 HG3 GLU 12 HG3 GLU 12 10.808 10.890 3.714
118 H LEU 13 H LEU 13 9.069 6.486 1.534
119 HA LEU 13 HA LEU 13 8.706 4.777 3.830
120 HB2 LEU 13 HB2 LEU 13 7.910 4.795 0.923
121 HB3 LEU 13 HB3 LEU 13 7.742 3.309 1.781
122 HG LEU 13 HG LEU 13 5.655 4.545 1.733
123 HD11 LEU 13 HD11 LEU 13 6.881 3.693 4.255
124 HD12 LEU 13 HD12 LEU 13 5.670 4.949 4.511
125 HD13 LEU 13 HD13 LEU 13 5.237 3.474 3.641
126 HD21 LEU 13 HD21 LEU 13 5.311 6.657 2.887
127 HD22 LEU 13 HD22 LEU 13 7.030 6.742 3.314
128 HD23 LEU 13 HD23 LEU 13 6.528 6.817 1.611
129 H LYS 14 H LYS 14 11.031 4.691 1.236
130 HA LYS 14 HA LYS 14 12.185 2.154 1.597
131 HB2 LYS 14 HB2 LYS 14 12.676 3.975 -0.167
132 HB3 LYS 14 HB3 LYS 14 13.709 4.720 1.046
133 HG2 LYS 14 HG2 LYS 14 14.577 2.021 0.925
134 HG3 LYS 14 HG3 LYS 14 14.169 2.434 -0.732
135 HD2 LYS 14 HD2 LYS 14 15.600 4.505 -0.506
136 HD3 LYS 14 HD3 LYS 14 16.104 3.944 1.097
137 HE2 LYS 14 HE2 LYS 14 16.339 2.206 -1.385
138 HE3 LYS 14 HE3 LYS 14 17.595 3.381 -0.985
139 HZ1 LYS 14 HZ1 LYS 14 16.815 1.653 1.200
140 HZ2 LYS 14 HZ2 LYS 14 17.574 0.881 -0.036
141 HZ3 LYS 14 HZ3 LYS 14 18.313 2.125 0.724
142 H LYS 15 H LYS 15 12.033 4.616 3.977
143 HA LYS 15 HA LYS 15 14.354 4.309 5.536
144 HB2 LYS 15 HB2 LYS 15 11.538 5.076 6.034
145 HB3 LYS 15 HB3 LYS 15 12.175 4.146 7.360
146 HG2 LYS 15 HG2 LYS 15 12.651 6.356 7.926
147 HG3 LYS 15 HG3 LYS 15 14.196 5.658 7.424
148 HD2 LYS 15 HD2 LYS 15 13.933 6.743 5.182
149 HD3 LYS 15 HD3 LYS 15 12.380 7.424 5.725
150 HE2 LYS 15 HE2 LYS 15 13.451 8.653 7.510
151 HE3 LYS 15 HE3 LYS 15 15.032 7.966 7.113
152 HZ1 LYS 15 HZ1 LYS 15 14.267 10.282 6.174
153 HZ2 LYS 15 HZ2 LYS 15 15.191 9.282 5.247
154 HZ3 LYS 15 HZ3 LYS 15 13.563 9.363 5.012
155 H LEU 16 H LEU 16 11.641 2.098 5.242
156 HA LEU 16 HA LEU 16 13.189 -0.006 6.692
157 HB2 LEU 16 HB2 LEU 16 10.941 -1.094 7.056
158 HB3 LEU 16 HB3 LEU 16 11.332 0.283 8.040
159 HG LEU 16 HG LEU 16 9.827 0.861 5.504
160 HD11 LEU 16 HD11 LEU 16 8.599 -1.069 6.104
161 HD12 LEU 16 HD12 LEU 16 8.617 -0.663 7.834
162 HD13 LEU 16 HD13 LEU 16 7.649 0.300 6.696
163 HD21 LEU 16 HD21 LEU 16 10.212 2.764 6.880
164 HD22 LEU 16 HD22 LEU 16 8.544 2.330 7.225
165 HD23 LEU 16 HD23 LEU 16 9.815 1.887 8.373
166 H SER 17 H SER 17 13.786 0.617 4.119
167 HA SER 17 HA SER 17 14.136 -0.121 2.087
168 HB2 SER 17 HB2 SER 17 14.225 -2.483 3.738
169 HB3 SER 17 HB3 SER 17 13.643 -2.917 2.127
170 HG SER 17 HG SER 17 16.094 -2.088 2.928
171 HA PRO 18 HA PRO 18 10.401 -0.336 -0.201
172 HB2 PRO 18 HB2 PRO 18 11.253 -1.094 -2.715
173 HB3 PRO 18 HB3 PRO 18 11.466 0.532 -2.012
174 HG2 PRO 18 HG2 PRO 18 13.507 -1.618 -2.381
175 HG3 PRO 18 HG3 PRO 18 13.716 0.157 -2.320
176 HD2 PRO 18 HD2 PRO 18 14.187 -1.711 -0.220
177 HD3 PRO 18 HD3 PRO 18 14.173 0.064 -0.083
178 H GLU 19 H GLU 19 12.517 -3.212 -0.471
179 HA GLU 19 HA GLU 19 10.343 -4.996 -1.209
180 HB2 GLU 19 HB2 GLU 19 12.865 -5.337 -1.673
181 HB3 GLU 19 HB3 GLU 19 12.996 -5.835 0.019
182 HG2 GLU 19 HG2 GLU 19 10.952 -7.439 -0.625
183 HG3 GLU 19 HG3 GLU 19 11.457 -7.107 -2.271
184 H GLU 20 H GLU 20 11.963 -4.169 1.887
185 HA GLU 20 HA GLU 20 10.613 -6.095 3.495
186 HB2 GLU 20 HB2 GLU 20 12.260 -3.701 3.934
187 HB3 GLU 20 HB3 GLU 20 10.995 -3.901 5.151
188 HG2 GLU 20 HG2 GLU 20 12.485 -5.095 6.246
189 HG3 GLU 20 HG3 GLU 20 12.019 -6.411 5.173
190 H LEU 21 H LEU 21 9.529 -2.898 2.286
191 HA LEU 21 HA LEU 21 7.235 -2.763 3.963
192 HB2 LEU 21 HB2 LEU 21 8.426 -1.243 1.784
193 HB3 LEU 21 HB3 LEU 21 6.724 -1.465 1.442
194 HG LEU 21 HG LEU 21 7.907 -0.334 4.002
195 HD11 LEU 21 HD11 LEU 21 6.836 1.736 3.175
196 HD12 LEU 21 HD12 LEU 21 8.133 1.141 2.118
197 HD13 LEU 21 HD13 LEU 21 6.426 0.914 1.655
198 HD21 LEU 21 HD21 LEU 21 5.820 -0.051 4.936
199 HD22 LEU 21 HD22 LEU 21 4.973 -0.025 3.379
200 HD23 LEU 21 HD23 LEU 21 5.482 -1.558 4.084
201 H ASN 22 H ASN 22 7.564 -3.813 0.540
202 HA ASN 22 HA ASN 22 4.876 -4.717 0.259
203 HB2 ASN 22 HB2 ASN 22 6.806 -4.399 -1.512
204 HB3 ASN 22 HB3 ASN 22 7.206 -6.074 -1.123
205 HD21 ASN 22 HD21 ASN 22 6.679 -6.562 -3.391
206 HD22 ASN 22 HD22 ASN 22 4.971 -6.711 -3.836
207 H ARG 23 H ARG 23 7.765 -6.321 1.582
208 HA ARG 23 HA ARG 23 6.543 -8.868 2.101
209 HB2 ARG 23 HB2 ARG 23 9.058 -8.129 2.191
210 HB3 ARG 23 HB3 ARG 23 8.704 -7.610 3.832
211 HG2 ARG 23 HG2 ARG 23 8.969 -9.725 4.557
212 HG3 ARG 23 HG3 ARG 23 7.571 -10.216 3.624
213 HD2 ARG 23 HD2 ARG 23 8.888 -11.537 2.440
214 HD3 ARG 23 HD3 ARG 23 9.570 -10.108 1.664
215 HE ARG 23 HE ARG 23 11.051 -10.257 3.941
216 HH11 ARG 23 HH22 ARG 23 10.399 -12.619 1.462
217 HH12 ARG 23 HH21 ARG 23 11.849 -13.548 1.779
218 HH21 ARG 23 HH12 ARG 23 12.899 -11.486 4.355
219 HH22 ARG 23 HH11 ARG 23 13.210 -12.912 3.392
220 H TYR 24 H TYR 24 6.629 -5.864 4.005
221 HA TYR 24 HA TYR 24 5.316 -6.905 6.323
222 HB2 TYR 24 HB2 TYR 24 6.455 -4.437 5.527
223 HB3 TYR 24 HB3 TYR 24 4.770 -4.062 5.740
224 HD1 TYR 24 HD1 TYR 24 7.398 -6.158 7.439
225 HD2 TYR 24 HD2 TYR 24 4.322 -3.176 7.886
226 HE1 TYR 24 HE1 TYR 24 7.791 -6.116 9.914
227 HE2 TYR 24 HE2 TYR 24 4.732 -3.105 10.332
228 HH TYR 24 HH TYR 24 5.739 -4.242 12.105
229 H TYR 25 H TYR 25 4.170 -5.849 3.247
230 HA TYR 25 HA TYR 25 1.440 -5.370 3.843
231 HB2 TYR 25 HB2 TYR 25 3.040 -5.098 1.619
232 HB3 TYR 25 HB3 TYR 25 2.062 -6.474 1.142
233 HD1 TYR 25 HD2 TYR 25 1.818 -3.062 2.648
234 HD2 TYR 25 HD1 TYR 25 -0.039 -6.008 0.108
235 HE1 TYR 25 HE2 TYR 25 0.065 -1.417 2.046
236 HE2 TYR 25 HE1 TYR 25 -1.802 -4.335 -0.520
237 HH TYR 25 HH TYR 25 -1.775 -1.029 0.782
238 H ALA 26 H ALA 26 3.033 -8.424 2.757
239 HA ALA 26 HA ALA 26 0.618 -9.924 2.497
240 HB1 ALA 26 HB1 ALA 26 2.012 -11.633 1.973
241 HB2 ALA 26 HB2 ALA 26 3.300 -10.414 2.021
242 HB3 ALA 26 HB3 ALA 26 3.000 -11.441 3.433
243 H SER 27 H SER 27 2.847 -9.605 5.310
244 HA SER 27 HA SER 27 1.295 -11.043 7.204
245 HB2 SER 27 HB2 SER 27 2.589 -9.194 8.740
246 HB3 SER 27 HB3 SER 27 3.355 -10.654 8.118
247 HG SER 27 HG SER 27 3.416 -8.055 6.898
248 H LEU 28 H LEU 28 0.660 -8.013 5.744
249 HA LEU 28 HA LEU 28 -1.224 -7.215 7.876
250 HB2 LEU 28 HB2 LEU 28 -0.560 -5.226 7.330
251 HB3 LEU 28 HB3 LEU 28 0.353 -5.779 5.951
252 HG LEU 28 HG LEU 28 -1.633 -5.583 4.525
253 HD11 LEU 28 HD11 LEU 28 -3.081 -5.249 7.049
254 HD12 LEU 28 HD12 LEU 28 -3.440 -3.925 5.936
255 HD13 LEU 28 HD13 LEU 28 -3.655 -5.580 5.398
256 HD21 LEU 28 HD21 LEU 28 -0.334 -3.327 5.929
257 HD22 LEU 28 HD22 LEU 28 -0.491 -3.707 4.202
258 HD23 LEU 28 HD23 LEU 28 -1.808 -2.902 5.048
259 H ARG 29 H ARG 29 -1.237 -7.953 4.388
260 HA ARG 29 HA ARG 29 -3.939 -7.760 3.919
261 HB2 ARG 29 HB2 ARG 29 -1.960 -8.330 2.289
262 HB3 ARG 29 HB3 ARG 29 -2.346 -10.006 2.632
263 HG2 ARG 29 HG2 ARG 29 -4.049 -9.960 1.149
264 HG3 ARG 29 HG3 ARG 29 -4.854 -8.710 2.073
265 HD2 ARG 29 HD2 ARG 29 -4.599 -7.352 0.335
266 HD3 ARG 29 HD3 ARG 29 -2.884 -7.250 0.727
267 HE ARG 29 HE ARG 29 -3.157 -9.582 -0.789
268 HH11 ARG 29 HH22 ARG 29 -3.713 -6.178 -1.346
269 HH12 ARG 29 HH21 ARG 29 -3.488 -6.286 -3.068
270 HH21 ARG 29 HH12 ARG 29 -2.801 -9.705 -2.995
271 HH22 ARG 29 HH11 ARG 29 -2.921 -8.277 -3.975
272 H HIS 30 H HIS 30 -2.228 -10.579 5.127
273 HA HIS 30 HA HIS 30 -4.611 -12.193 5.505
274 HB2 HIS 30 HB2 HIS 30 -1.895 -12.695 5.459
275 HB3 HIS 30 HB3 HIS 30 -2.231 -12.787 7.184
276 HD1 HIS 30 HD1 HIS 30 -2.282 -14.867 4.187
277 HD2 HIS 30 HD2 HIS 30 -4.693 -14.442 7.615
278 HE1 HIS 30 HE1 HIS 30 -3.644 -17.026 4.400
279 H TYR 31 H TYR 31 -2.706 -10.011 7.657
280 HA TYR 31 HA TYR 31 -4.105 -10.576 10.081
281 HB2 TYR 31 HB2 TYR 31 -1.929 -9.489 9.982
282 HB3 TYR 31 HB3 TYR 31 -2.639 -8.081 9.185
283 HD1 TYR 31 HD1 TYR 31 -3.290 -10.174 12.233
284 HD2 TYR 31 HD2 TYR 31 -2.861 -6.211 10.579
285 HE1 TYR 31 HE1 TYR 31 -3.606 -9.208 14.490
286 HE2 TYR 31 HE2 TYR 31 -3.165 -5.238 12.857
287 HH TYR 31 HH TYR 31 -3.885 -7.288 15.682
288 H LEU 32 H LEU 32 -4.558 -7.883 7.749
289 HA LEU 32 HA LEU 32 -6.667 -6.528 8.899
290 HB2 LEU 32 HB2 LEU 32 -6.472 -5.287 7.084
291 HB3 LEU 32 HB3 LEU 32 -5.269 -6.415 6.540
292 HG LEU 32 HG LEU 32 -7.318 -7.686 5.433
293 HD11 LEU 32 HD11 LEU 32 -9.178 -6.368 4.886
294 HD12 LEU 32 HD12 LEU 32 -8.908 -5.944 6.594
295 HD13 LEU 32 HD13 LEU 32 -8.377 -4.845 5.320
296 HD21 LEU 32 HD21 LEU 32 -7.159 -5.857 3.493
297 HD22 LEU 32 HD22 LEU 32 -5.774 -5.318 4.454
298 HD23 LEU 32 HD23 LEU 32 -5.869 -6.992 3.847
299 H ASN 33 H ASN 33 -6.780 -9.523 7.053
300 HA ASN 33 HA ASN 33 -9.493 -9.931 6.681
301 HB2 ASN 33 HB2 ASN 33 -7.416 -11.306 5.930
302 HB3 ASN 33 HB3 ASN 33 -7.660 -12.186 7.442
303 HD21 ASN 33 HD21 ASN 33 -8.792 -14.059 7.122
304 HD22 ASN 33 HD22 ASN 33 -10.107 -14.184 5.950
305 H LEU 34 H LEU 34 -7.644 -10.303 9.639
306 HA LEU 34 HA LEU 34 -10.134 -11.064 11.099
307 HB2 LEU 34 HB2 LEU 34 -8.816 -12.202 12.749
308 HB3 LEU 34 HB3 LEU 34 -8.573 -12.903 11.172
309 HG LEU 34 HG LEU 34 -6.561 -10.818 11.910
310 HD11 LEU 34 HD11 LEU 34 -5.356 -11.930 13.529
311 HD12 LEU 34 HD12 LEU 34 -7.019 -11.965 14.114
312 HD13 LEU 34 HD13 LEU 34 -6.302 -13.427 13.386
313 HD21 LEU 34 HD21 LEU 34 -5.058 -12.947 11.272
314 HD22 LEU 34 HD22 LEU 34 -6.570 -13.510 10.540
315 HD23 LEU 34 HD23 LEU 34 -5.878 -11.963 10.063
316 H VAL 35 H VAL 35 -9.261 -8.415 10.339
317 HA VAL 35 HA VAL 35 -9.405 -7.099 13.009
318 HB VAL 35 HB VAL 35 -7.438 -6.428 10.833
319 HG11 VAL 35 HG11 VAL 35 -8.522 -4.663 12.795
320 HG12 VAL 35 HG12 VAL 35 -6.843 -4.969 13.237
321 HG13 VAL 35 HG13 VAL 35 -7.227 -4.358 11.630
322 HG21 VAL 35 HG21 VAL 35 -6.931 -7.397 13.665
323 HG22 VAL 35 HG22 VAL 35 -6.634 -8.310 12.183
324 HG23 VAL 35 HG23 VAL 35 -5.707 -6.861 12.486
325 H THR 36 H THR 36 -8.825 -4.977 10.453
326 HA THR 36 HA THR 36 -11.359 -3.801 10.632
327 HB THR 36 HB THR 36 -9.917 -3.018 8.215
328 HG1 THR 36 HG1 THR 36 -7.976 -3.259 8.942
329 HG21 THR 36 HG21 THR 36 -10.362 -1.603 10.881
330 HG22 THR 36 HG22 THR 36 -9.831 -0.838 9.369
331 HG23 THR 36 HG23 THR 36 -11.458 -1.540 9.478
332 H ARG 37 H ARG 37 -10.326 -6.376 8.594
333 HA ARG 37 HA ARG 37 -12.223 -6.158 6.446
334 HB2 ARG 37 HB2 ARG 37 -10.267 -7.679 6.461
335 HB3 ARG 37 HB3 ARG 37 -10.982 -8.581 7.793
336 HG2 ARG 37 HG2 ARG 37 -12.631 -8.351 5.319
337 HG3 ARG 37 HG3 ARG 37 -11.127 -9.252 5.152
338 HD2 ARG 37 HD2 ARG 37 -11.740 -10.921 6.657
339 HD3 ARG 37 HD3 ARG 37 -12.859 -9.889 7.537
340 HE ARG 37 HE ARG 37 -14.526 -10.531 6.152
341 HH11 ARG 37 HH22 ARG 37 -11.523 -11.456 4.497
342 HH12 ARG 37 HH21 ARG 37 -12.371 -11.966 3.069
343 HH21 ARG 37 HH12 ARG 37 -15.530 -11.407 4.362
344 HH22 ARG 37 HH11 ARG 37 -14.576 -11.978 3.008
345 H GLN 38 H GLN 38 -12.602 -6.892 9.721
346 HA GLN 38 HA GLN 38 -15.451 -7.644 9.275
347 HB2 GLN 38 HB2 GLN 38 -13.646 -9.453 10.180
348 HB3 GLN 38 HB3 GLN 38 -14.053 -8.672 11.710
349 HG2 GLN 38 HG2 GLN 38 -16.570 -9.003 10.733
350 HG3 GLN 38 HG3 GLN 38 -15.773 -10.256 9.786
351 HE21 GLN 38 HE21 GLN 38 -17.673 -11.307 11.231
352 HE22 GLN 38 HE22 GLN 38 -17.081 -11.879 12.802
353 H ARG 39 H ARG 39 -13.976 -4.998 9.969
354 HA ARG 39 HA ARG 39 -14.369 -3.143 11.281
355 HB2 ARG 39 HB2 ARG 39 -17.019 -4.581 11.465
356 HB3 ARG 39 HB3 ARG 39 -16.749 -3.206 12.508
357 HG2 ARG 39 HG2 ARG 39 -16.298 -1.744 10.661
358 HG3 ARG 39 HG3 ARG 39 -16.375 -3.086 9.498
359 HD2 ARG 39 HD2 ARG 39 -18.691 -2.452 11.375
360 HD3 ARG 39 HD3 ARG 39 -18.509 -1.594 9.855
361 HE ARG 39 HE ARG 39 -19.265 -4.419 10.224
362 HH11 ARG 39 HH22 ARG 39 -18.202 -2.053 7.906
363 HH12 ARG 39 HH21 ARG 39 -18.752 -2.963 6.522
364 HH21 ARG 39 HH12 ARG 39 -20.074 -5.534 8.451
365 HH22 ARG 39 HH11 ARG 39 -19.889 -4.871 6.859
366 H TYR 40 H TYR 40 -12.955 -5.473 12.473
367 HA TYR 40 HA TYR 40 -11.988 -6.072 14.383
368 HB2 TYR 40 HB2 TYR 40 -11.640 -3.481 14.044
369 HB3 TYR 40 HB3 TYR 40 -12.535 -3.325 15.517
370 HD1 TYR 40 HD2 TYR 40 -11.561 -5.207 17.436
371 HD2 TYR 40 HD1 TYR 40 -9.405 -3.311 14.222
372 HE1 TYR 40 HE2 TYR 40 -9.414 -5.614 18.630
373 HE2 TYR 40 HE1 TYR 40 -7.253 -3.772 15.392
374 HH TYR 40 HH TYR 40 -7.107 -4.999 18.676
375 HN1 NH2 41 HN1 NH2 41 -14.062 -3.984 16.434
376 HN2 NH2 41 HN2 NH2 41 -14.938 -5.352 17.102
Start of MODEL 17
1 HA TYR 1 HA TYR 1 3.719 12.446 -15.343
2 HB2 TYR 1 HB2 TYR 1 1.786 12.807 -16.659
3 HB3 TYR 1 HB3 TYR 1 0.787 11.777 -15.632
4 HD1 TYR 1 HD1 TYR 1 2.903 14.913 -15.374
5 HD2 TYR 1 HD2 TYR 1 -0.627 12.793 -14.055
6 HE1 TYR 1 HE1 TYR 1 2.204 16.884 -14.004
7 HE2 TYR 1 HE2 TYR 1 -1.302 14.750 -12.706
8 HH TYR 1 HH TYR 1 -0.715 16.847 -11.997
9 H LEU 2 H LEU 2 1.319 10.374 -13.566
10 HA LEU 2 HA LEU 2 1.425 11.585 -11.124
11 HB2 LEU 2 HB2 LEU 2 0.206 9.430 -12.230
12 HB3 LEU 2 HB3 LEU 2 1.351 8.573 -11.216
13 HG LEU 2 HG LEU 2 -0.487 10.743 -10.121
14 HD11 LEU 2 HD11 LEU 2 -1.228 8.052 -11.090
15 HD12 LEU 2 HD12 LEU 2 -1.686 8.329 -9.409
16 HD13 LEU 2 HD13 LEU 2 -2.235 9.448 -10.662
17 HD21 LEU 2 HD21 LEU 2 1.281 10.065 -8.569
18 HD22 LEU 2 HD22 LEU 2 -0.275 9.503 -7.996
19 HD23 LEU 2 HD23 LEU 2 0.840 8.351 -8.774
20 H GLU 3 H GLU 3 3.958 9.523 -12.503
21 HA GLU 3 HA GLU 3 5.535 8.974 -10.301
22 HB2 GLU 3 HB2 GLU 3 6.699 9.870 -12.954
23 HB3 GLU 3 HB3 GLU 3 7.280 8.680 -11.799
24 HG2 GLU 3 HG2 GLU 3 4.976 7.448 -12.477
25 HG3 GLU 3 HG3 GLU 3 5.172 8.446 -13.915
26 H ARG 4 H ARG 4 5.574 12.016 -12.301
27 HA ARG 4 HA ARG 4 7.734 13.235 -10.859
28 HB2 ARG 4 HB2 ARG 4 6.765 13.960 -13.098
29 HB3 ARG 4 HB3 ARG 4 5.409 14.681 -12.210
30 HG2 ARG 4 HG2 ARG 4 6.886 16.232 -11.060
31 HG3 ARG 4 HG3 ARG 4 8.316 15.343 -11.583
32 HD2 ARG 4 HD2 ARG 4 8.524 16.740 -13.265
33 HD3 ARG 4 HD3 ARG 4 7.113 15.987 -14.013
34 HE ARG 4 HE ARG 4 5.950 17.828 -12.375
35 HH11 ARG 4 HH22 ARG 4 8.474 18.156 -14.775
36 HH12 ARG 4 HH21 ARG 4 8.122 19.831 -15.099
37 HH21 ARG 4 HH12 ARG 4 5.572 20.020 -12.751
38 HH22 ARG 4 HH11 ARG 4 6.534 20.878 -13.918
39 H GLU 5 H GLU 5 7.793 14.263 -8.993
40 HA GLU 5 HA GLU 5 7.197 15.396 -7.061
41 HB2 GLU 5 HB2 GLU 5 4.980 16.011 -8.267
42 HB3 GLU 5 HB3 GLU 5 4.296 14.638 -7.381
43 HG2 GLU 5 HG2 GLU 5 5.088 15.775 -5.248
44 HG3 GLU 5 HG3 GLU 5 5.515 17.172 -6.253
45 H LEU 6 H LEU 6 5.532 12.303 -7.796
46 HA LEU 6 HA LEU 6 5.794 11.292 -5.062
47 HB2 LEU 6 HB2 LEU 6 3.846 10.589 -6.127
48 HB3 LEU 6 HB3 LEU 6 4.661 10.355 -7.667
49 HG LEU 6 HG LEU 6 5.728 8.364 -6.930
50 HD11 LEU 6 HD11 LEU 6 5.570 9.049 -4.343
51 HD12 LEU 6 HD12 LEU 6 4.077 8.143 -4.397
52 HD13 LEU 6 HD13 LEU 6 5.607 7.359 -4.851
53 HD21 LEU 6 HD21 LEU 6 2.954 7.620 -6.183
54 HD22 LEU 6 HD22 LEU 6 3.083 8.622 -7.629
55 HD23 LEU 6 HD23 LEU 6 3.972 7.096 -7.533
56 H LYS 7 H LYS 7 7.539 10.880 -8.132
57 HA LYS 7 HA LYS 7 9.203 8.728 -7.344
58 HB2 LYS 7 HB2 LYS 7 8.851 10.284 -9.647
59 HB3 LYS 7 HB3 LYS 7 10.479 10.708 -9.192
60 HG2 LYS 7 HG2 LYS 7 9.595 7.792 -9.278
61 HG3 LYS 7 HG3 LYS 7 9.917 8.663 -10.776
62 HD2 LYS 7 HD2 LYS 7 12.180 9.188 -10.096
63 HD3 LYS 7 HD3 LYS 7 11.942 8.418 -8.509
64 HE2 LYS 7 HE2 LYS 7 11.959 6.274 -9.361
65 HE3 LYS 7 HE3 LYS 7 11.251 6.763 -10.906
66 HZ1 LYS 7 HZ1 LYS 7 13.355 7.686 -11.558
67 HZ2 LYS 7 HZ2 LYS 7 14.058 7.260 -10.122
68 HZ3 LYS 7 HZ3 LYS 7 13.540 6.104 -11.169
69 H LYS 8 H LYS 8 9.560 12.133 -6.814
70 HA LYS 8 HA LYS 8 12.115 11.960 -5.361
71 HB2 LYS 8 HB2 LYS 8 10.120 14.147 -6.037
72 HB3 LYS 8 HB3 LYS 8 11.298 14.434 -4.758
73 HG2 LYS 8 HG2 LYS 8 12.229 13.376 -7.436
74 HG3 LYS 8 HG3 LYS 8 11.886 15.095 -7.244
75 HD2 LYS 8 HD2 LYS 8 13.520 15.384 -5.531
76 HD3 LYS 8 HD3 LYS 8 13.741 13.649 -5.301
77 HE2 LYS 8 HE2 LYS 8 14.446 15.180 -7.843
78 HE3 LYS 8 HE3 LYS 8 15.597 14.756 -6.565
79 HZ1 LYS 8 HZ1 LYS 8 15.110 12.436 -6.962
80 HZ2 LYS 8 HZ2 LYS 8 14.003 12.807 -8.123
81 HZ3 LYS 8 HZ3 LYS 8 15.603 13.131 -8.363
82 H LEU 9 H LEU 9 8.997 11.063 -4.577
83 HA LEU 9 HA LEU 9 9.345 11.569 -1.688
84 HB2 LEU 9 HB2 LEU 9 7.150 11.888 -3.310
85 HB3 LEU 9 HB3 LEU 9 6.895 10.233 -2.804
86 HG LEU 9 HG LEU 9 5.677 11.756 -1.408
87 HD11 LEU 9 HD11 LEU 9 6.411 11.068 0.807
88 HD12 LEU 9 HD12 LEU 9 6.616 9.723 -0.334
89 HD13 LEU 9 HD13 LEU 9 8.025 10.665 0.200
90 HD21 LEU 9 HD21 LEU 9 7.256 13.708 -1.782
91 HD22 LEU 9 HD22 LEU 9 6.624 13.533 -0.135
92 HD23 LEU 9 HD23 LEU 9 8.283 13.036 -0.499
93 H GLU 10 H GLU 10 8.537 8.861 -3.951
94 HA GLU 10 HA GLU 10 8.888 6.757 -2.118
95 HB2 GLU 10 HB2 GLU 10 7.950 6.700 -4.514
96 HB3 GLU 10 HB3 GLU 10 9.638 6.536 -5.034
97 HG2 GLU 10 HG2 GLU 10 9.846 4.520 -3.549
98 HG3 GLU 10 HG3 GLU 10 8.159 4.712 -3.071
99 H ARG 11 H ARG 11 11.315 8.608 -3.932
100 HA ARG 11 HA ARG 11 13.616 7.056 -3.339
101 HB2 ARG 11 HB2 ARG 11 13.061 9.862 -4.119
102 HB3 ARG 11 HB3 ARG 11 14.408 9.749 -3.001
103 HG2 ARG 11 HG2 ARG 11 15.248 7.802 -4.601
104 HG3 ARG 11 HG3 ARG 11 14.148 8.581 -5.763
105 HD2 ARG 11 HD2 ARG 11 15.354 10.786 -4.982
106 HD3 ARG 11 HD3 ARG 11 16.589 9.693 -4.334
107 HE ARG 11 HE ARG 11 16.339 8.804 -6.902
108 HH11 ARG 11 HH22 ARG 11 17.137 11.885 -5.532
109 HH12 ARG 11 HH21 ARG 11 17.875 12.511 -6.972
110 HH21 ARG 11 HH12 ARG 11 17.324 9.568 -8.772
111 HH22 ARG 11 HH11 ARG 11 17.875 11.193 -8.866
112 H GLU 12 H GLU 12 11.945 9.413 -1.228
113 HA GLU 12 HA GLU 12 13.943 9.014 0.888
114 HB2 GLU 12 HB2 GLU 12 12.019 11.049 0.327
115 HB3 GLU 12 HB3 GLU 12 11.458 10.245 1.794
116 HG2 GLU 12 HG2 GLU 12 13.966 10.451 2.573
117 HG3 GLU 12 HG3 GLU 12 14.099 11.644 1.285
118 H LEU 13 H LEU 13 10.552 8.015 0.217
119 HA LEU 13 HA LEU 13 10.212 6.537 2.632
120 HB2 LEU 13 HB2 LEU 13 8.915 6.663 -0.034
121 HB3 LEU 13 HB3 LEU 13 8.666 5.140 0.805
122 HG LEU 13 HG LEU 13 8.088 7.877 2.019
123 HD11 LEU 13 HD11 LEU 13 5.946 5.944 1.112
124 HD12 LEU 13 HD12 LEU 13 5.860 7.695 1.400
125 HD13 LEU 13 HD13 LEU 13 6.665 7.077 -0.048
126 HD21 LEU 13 HD21 LEU 13 6.636 6.394 3.563
127 HD22 LEU 13 HD22 LEU 13 7.537 5.012 2.910
128 HD23 LEU 13 HD23 LEU 13 8.383 6.291 3.804
129 H LYS 14 H LYS 14 11.740 5.527 -0.395
130 HA LYS 14 HA LYS 14 12.327 2.819 0.236
131 HB2 LYS 14 HB2 LYS 14 12.516 3.696 -1.988
132 HB3 LYS 14 HB3 LYS 14 13.698 4.907 -1.510
133 HG2 LYS 14 HG2 LYS 14 14.375 1.991 -1.133
134 HG3 LYS 14 HG3 LYS 14 14.383 2.660 -2.754
135 HD2 LYS 14 HD2 LYS 14 16.068 4.325 -2.193
136 HD3 LYS 14 HD3 LYS 14 15.988 3.948 -0.488
137 HE2 LYS 14 HE2 LYS 14 17.914 2.809 -1.259
138 HE3 LYS 14 HE3 LYS 14 16.665 1.582 -0.995
139 HZ1 LYS 14 HZ1 LYS 14 17.533 1.092 -3.089
140 HZ2 LYS 14 HZ2 LYS 14 16.162 1.930 -3.450
141 HZ3 LYS 14 HZ3 LYS 14 17.619 2.672 -3.555
142 H LYS 15 H LYS 15 13.568 5.626 1.838
143 HA LYS 15 HA LYS 15 16.136 4.849 2.695
144 HB2 LYS 15 HB2 LYS 15 15.189 6.952 3.347
145 HB3 LYS 15 HB3 LYS 15 13.819 6.180 4.149
146 HG2 LYS 15 HG2 LYS 15 16.602 5.634 5.179
147 HG3 LYS 15 HG3 LYS 15 15.808 7.173 5.528
148 HD2 LYS 15 HD2 LYS 15 13.796 5.847 6.411
149 HD3 LYS 15 HD3 LYS 15 14.783 4.398 6.290
150 HE2 LYS 15 HE2 LYS 15 14.993 5.017 8.490
151 HE3 LYS 15 HE3 LYS 15 16.519 5.523 7.740
152 HZ1 LYS 15 HZ1 LYS 15 14.969 7.118 9.228
153 HZ2 LYS 15 HZ2 LYS 15 16.014 7.688 8.087
154 HZ3 LYS 15 HZ3 LYS 15 14.419 7.496 7.721
155 H LEU 16 H LEU 16 12.973 3.613 3.724
156 HA LEU 16 HA LEU 16 14.302 1.668 5.526
157 HB2 LEU 16 HB2 LEU 16 12.414 1.527 6.689
158 HB3 LEU 16 HB3 LEU 16 12.165 3.116 6.039
159 HG LEU 16 HG LEU 16 10.942 1.464 4.107
160 HD11 LEU 16 HD11 LEU 16 10.360 0.359 6.881
161 HD12 LEU 16 HD12 LEU 16 9.582 -0.111 5.355
162 HD13 LEU 16 HD13 LEU 16 11.277 -0.480 5.604
163 HD21 LEU 16 HD21 LEU 16 9.958 3.225 6.314
164 HD22 LEU 16 HD22 LEU 16 9.723 3.308 4.556
165 HD23 LEU 16 HD23 LEU 16 8.798 2.154 5.525
166 H SER 17 H SER 17 14.272 -0.534 5.116
167 HA SER 17 HA SER 17 14.643 -1.422 2.553
168 HB2 SER 17 HB2 SER 17 15.361 -2.857 4.226
169 HB3 SER 17 HB3 SER 17 13.767 -2.909 4.990
170 HG SER 17 HG SER 17 14.756 -4.415 2.910
171 HA PRO 18 HA PRO 18 10.423 -1.210 0.992
172 HB2 PRO 18 HB2 PRO 18 10.971 -1.922 -1.636
173 HB3 PRO 18 HB3 PRO 18 11.165 -0.289 -0.943
174 HG2 PRO 18 HG2 PRO 18 13.275 -2.308 -1.586
175 HG3 PRO 18 HG3 PRO 18 13.374 -0.522 -1.562
176 HD2 PRO 18 HD2 PRO 18 14.267 -2.294 0.448
177 HD3 PRO 18 HD3 PRO 18 14.058 -0.527 0.618
178 H GLU 19 H GLU 19 12.437 -3.977 1.259
179 HA GLU 19 HA GLU 19 10.303 -5.883 0.511
180 HB2 GLU 19 HB2 GLU 19 12.745 -6.131 -0.127
181 HB3 GLU 19 HB3 GLU 19 13.102 -6.497 1.551
182 HG2 GLU 19 HG2 GLU 19 10.869 -8.046 0.224
183 HG3 GLU 19 HG3 GLU 19 12.478 -8.310 -0.415
184 H GLU 20 H GLU 20 11.811 -4.449 3.398
185 HA GLU 20 HA GLU 20 10.777 -6.381 5.255
186 HB2 GLU 20 HB2 GLU 20 12.672 -4.608 5.462
187 HB3 GLU 20 HB3 GLU 20 11.408 -3.506 5.998
188 HG2 GLU 20 HG2 GLU 20 11.342 -4.492 8.059
189 HG3 GLU 20 HG3 GLU 20 11.342 -6.119 7.390
190 H LEU 21 H LEU 21 9.518 -3.271 3.999
191 HA LEU 21 HA LEU 21 7.228 -3.173 5.693
192 HB2 LEU 21 HB2 LEU 21 8.316 -1.636 3.509
193 HB3 LEU 21 HB3 LEU 21 6.656 -2.014 3.097
194 HG LEU 21 HG LEU 21 7.542 -0.774 5.732
195 HD11 LEU 21 HD11 LEU 21 6.508 1.314 4.759
196 HD12 LEU 21 HD12 LEU 21 7.949 0.763 3.877
197 HD13 LEU 21 HD13 LEU 21 6.338 0.460 3.211
198 HD21 LEU 21 HD21 LEU 21 4.710 -0.802 4.650
199 HD22 LEU 21 HD22 LEU 21 5.307 -2.041 5.775
200 HD23 LEU 21 HD23 LEU 21 5.294 -0.347 6.264
201 H ASN 22 H ASN 22 7.614 -4.492 2.369
202 HA ASN 22 HA ASN 22 4.975 -5.413 1.972
203 HB2 ASN 22 HB2 ASN 22 6.898 -5.357 0.301
204 HB3 ASN 22 HB3 ASN 22 7.472 -6.862 1.021
205 HD21 ASN 22 HD21 ASN 22 6.434 -8.803 0.353
206 HD22 ASN 22 HD22 ASN 22 4.951 -8.761 -0.624
207 H ARG 23 H ARG 23 7.678 -6.976 3.649
208 HA ARG 23 HA ARG 23 6.397 -9.446 4.235
209 HB2 ARG 23 HB2 ARG 23 8.878 -8.587 4.474
210 HB3 ARG 23 HB3 ARG 23 8.418 -8.161 6.121
211 HG2 ARG 23 HG2 ARG 23 8.107 -10.391 6.759
212 HG3 ARG 23 HG3 ARG 23 7.682 -10.908 5.128
213 HD2 ARG 23 HD2 ARG 23 10.341 -10.030 4.849
214 HD3 ARG 23 HD3 ARG 23 10.318 -10.844 6.418
215 HE ARG 23 HE ARG 23 8.927 -12.507 4.601
216 HH11 ARG 23 HH22 ARG 23 12.148 -11.204 4.686
217 HH12 ARG 23 HH21 ARG 23 12.865 -12.542 3.853
218 HH21 ARG 23 HH12 ARG 23 9.800 -14.251 3.521
219 HH22 ARG 23 HH11 ARG 23 11.481 -14.169 3.058
220 H TYR 24 H TYR 24 6.718 -6.571 6.349
221 HA TYR 24 HA TYR 24 4.877 -7.454 8.355
222 HB2 TYR 24 HB2 TYR 24 6.088 -4.828 7.496
223 HB3 TYR 24 HB3 TYR 24 4.730 -4.801 8.601
224 HD1 TYR 24 HD1 TYR 24 4.836 -6.352 10.692
225 HD2 TYR 24 HD2 TYR 24 8.289 -5.107 8.422
226 HE1 TYR 24 HE1 TYR 24 6.299 -6.787 12.668
227 HE2 TYR 24 HE2 TYR 24 9.740 -5.537 10.383
228 HH TYR 24 HH TYR 24 9.743 -5.960 12.674
229 H TYR 25 H TYR 25 4.336 -6.065 5.234
230 HA TYR 25 HA TYR 25 1.635 -5.230 5.520
231 HB2 TYR 25 HB2 TYR 25 3.547 -5.143 3.528
232 HB3 TYR 25 HB3 TYR 25 2.470 -6.336 2.865
233 HD1 TYR 25 HD1 TYR 25 2.839 -2.856 4.048
234 HD2 TYR 25 HD2 TYR 25 0.363 -5.674 1.929
235 HE1 TYR 25 HE1 TYR 25 1.459 -0.971 3.175
236 HE2 TYR 25 HE2 TYR 25 -1.018 -3.788 1.042
237 HH TYR 25 HH TYR 25 -0.709 -0.516 2.235
238 H ALA 26 H ALA 26 2.969 -8.382 4.326
239 HA ALA 26 HA ALA 26 0.398 -9.590 3.906
240 HB1 ALA 26 HB1 ALA 26 2.214 -10.718 2.914
241 HB2 ALA 26 HB2 ALA 26 3.208 -10.653 4.388
242 HB3 ALA 26 HB3 ALA 26 1.828 -11.764 4.296
243 H SER 27 H SER 27 2.509 -9.558 6.804
244 HA SER 27 HA SER 27 0.709 -10.997 8.513
245 HB2 SER 27 HB2 SER 27 3.132 -9.280 8.872
246 HB3 SER 27 HB3 SER 27 2.062 -9.411 10.276
247 HG SER 27 HG SER 27 2.193 -11.691 10.057
248 H LEU 28 H LEU 28 0.356 -7.850 7.257
249 HA LEU 28 HA LEU 28 -1.677 -7.149 9.313
250 HB2 LEU 28 HB2 LEU 28 -0.114 -5.587 7.231
251 HB3 LEU 28 HB3 LEU 28 -1.603 -4.928 7.888
252 HG LEU 28 HG LEU 28 0.712 -5.854 9.628
253 HD11 LEU 28 HD11 LEU 28 1.520 -4.036 8.222
254 HD12 LEU 28 HD12 LEU 28 0.101 -3.044 8.626
255 HD13 LEU 28 HD13 LEU 28 1.290 -3.458 9.882
256 HD21 LEU 28 HD21 LEU 28 -1.281 -3.746 10.465
257 HD22 LEU 28 HD22 LEU 28 -1.815 -5.423 10.503
258 HD23 LEU 28 HD23 LEU 28 -0.399 -4.942 11.442
259 H ARG 29 H ARG 29 -1.316 -7.829 5.853
260 HA ARG 29 HA ARG 29 -4.063 -7.329 5.213
261 HB2 ARG 29 HB2 ARG 29 -1.864 -7.472 3.710
262 HB3 ARG 29 HB3 ARG 29 -2.328 -9.156 3.525
263 HG2 ARG 29 HG2 ARG 29 -4.306 -8.643 2.372
264 HG3 ARG 29 HG3 ARG 29 -4.498 -7.092 3.174
265 HD2 ARG 29 HD2 ARG 29 -2.172 -6.642 1.764
266 HD3 ARG 29 HD3 ARG 29 -3.032 -7.718 0.669
267 HE ARG 29 HE ARG 29 -3.655 -4.956 1.366
268 HH11 ARG 29 HH22 ARG 29 -5.233 -7.867 0.297
269 HH12 ARG 29 HH21 ARG 29 -6.645 -7.040 -0.309
270 HH21 ARG 29 HH12 ARG 29 -5.439 -3.883 0.646
271 HH22 ARG 29 HH11 ARG 29 -6.746 -4.775 -0.091
272 H HIS 30 H HIS 30 -2.286 -10.321 5.943
273 HA HIS 30 HA HIS 30 -4.354 -12.193 5.421
274 HB2 HIS 30 HB2 HIS 30 -1.883 -12.592 6.044
275 HB3 HIS 30 HB3 HIS 30 -2.377 -12.387 7.725
276 HD1 HIS 30 HD1 HIS 30 -2.623 -14.801 4.801
277 HD2 HIS 30 HD2 HIS 30 -4.044 -14.374 8.743
278 HE1 HIS 30 HE1 HIS 30 -3.600 -17.064 5.478
279 H TYR 31 H TYR 31 -3.785 -10.087 8.214
280 HA TYR 31 HA TYR 31 -5.919 -11.022 9.890
281 HB2 TYR 31 HB2 TYR 31 -4.112 -8.651 9.661
282 HB3 TYR 31 HB3 TYR 31 -5.653 -8.346 10.407
283 HD1 TYR 31 HD2 TYR 31 -3.713 -11.568 10.607
284 HD2 TYR 31 HD1 TYR 31 -4.851 -7.923 12.631
285 HE1 TYR 31 HE2 TYR 31 -2.870 -12.487 12.740
286 HE2 TYR 31 HE1 TYR 31 -4.002 -8.871 14.778
287 HH TYR 31 HH TYR 31 -3.668 -11.224 15.733
288 H LEU 32 H LEU 32 -5.833 -8.189 7.638
289 HA LEU 32 HA LEU 32 -8.464 -7.445 7.929
290 HB2 LEU 32 HB2 LEU 32 -7.140 -7.288 5.233
291 HB3 LEU 32 HB3 LEU 32 -8.379 -6.243 5.925
292 HG LEU 32 HG LEU 32 -5.454 -6.391 6.507
293 HD11 LEU 32 HD11 LEU 32 -6.819 -4.776 4.819
294 HD12 LEU 32 HD12 LEU 32 -6.784 -3.765 6.278
295 HD13 LEU 32 HD13 LEU 32 -5.272 -4.374 5.580
296 HD21 LEU 32 HD21 LEU 32 -5.851 -4.607 8.328
297 HD22 LEU 32 HD22 LEU 32 -7.523 -5.218 8.385
298 HD23 LEU 32 HD23 LEU 32 -6.145 -6.279 8.765
299 H ASN 33 H ASN 33 -7.390 -10.138 6.010
300 HA ASN 33 HA ASN 33 -9.551 -11.005 4.513
301 HB2 ASN 33 HB2 ASN 33 -7.238 -12.108 5.027
302 HB3 ASN 33 HB3 ASN 33 -8.040 -12.814 6.424
303 HD21 ASN 33 HD21 ASN 33 -7.627 -13.003 2.965
304 HD22 ASN 33 HD22 ASN 33 -8.694 -14.391 2.773
305 H LEU 34 H LEU 34 -9.245 -11.259 8.066
306 HA LEU 34 HA LEU 34 -12.190 -11.511 8.272
307 HB2 LEU 34 HB2 LEU 34 -12.073 -13.288 9.890
308 HB3 LEU 34 HB3 LEU 34 -11.442 -13.777 8.338
309 HG LEU 34 HG LEU 34 -9.272 -12.792 10.091
310 HD11 LEU 34 HD11 LEU 34 -9.355 -14.824 11.606
311 HD12 LEU 34 HD12 LEU 34 -10.562 -13.573 11.939
312 HD13 LEU 34 HD13 LEU 34 -11.043 -15.056 11.088
313 HD21 LEU 34 HD21 LEU 34 -8.265 -14.963 9.480
314 HD22 LEU 34 HD22 LEU 34 -9.806 -15.482 8.751
315 HD23 LEU 34 HD23 LEU 34 -8.898 -14.129 8.057
316 H VAL 35 H VAL 35 -9.840 -9.556 8.928
317 HA VAL 35 HA VAL 35 -10.673 -8.798 11.670
318 HB VAL 35 HB VAL 35 -8.376 -8.026 9.927
319 HG11 VAL 35 HG11 VAL 35 -7.489 -6.540 11.632
320 HG12 VAL 35 HG12 VAL 35 -8.937 -5.906 10.856
321 HG13 VAL 35 HG13 VAL 35 -9.047 -6.607 12.485
322 HG21 VAL 35 HG21 VAL 35 -8.030 -10.074 11.175
323 HG22 VAL 35 HG22 VAL 35 -7.117 -8.810 12.012
324 HG23 VAL 35 HG23 VAL 35 -8.661 -9.357 12.630
325 H THR 36 H THR 36 -11.322 -7.886 8.445
326 HA THR 36 HA THR 36 -12.601 -5.337 9.394
327 HB THR 36 HB THR 36 -12.824 -4.887 6.919
328 HG1 THR 36 HG1 THR 36 -10.813 -6.892 6.746
329 HG21 THR 36 HG21 THR 36 -10.539 -3.943 6.803
330 HG22 THR 36 HG22 THR 36 -11.278 -3.672 8.387
331 HG23 THR 36 HG23 THR 36 -10.052 -4.943 8.193
332 H ARG 37 H ARG 37 -13.292 -8.289 7.739
333 HA ARG 37 HA ARG 37 -16.070 -7.932 7.225
334 HB2 ARG 37 HB2 ARG 37 -14.308 -10.350 7.720
335 HB3 ARG 37 HB3 ARG 37 -16.053 -10.559 7.520
336 HG2 ARG 37 HG2 ARG 37 -16.077 -9.626 5.351
337 HG3 ARG 37 HG3 ARG 37 -14.443 -8.968 5.488
338 HD2 ARG 37 HD2 ARG 37 -13.428 -10.901 4.983
339 HD3 ARG 37 HD3 ARG 37 -14.530 -11.906 5.922
340 HE ARG 37 HE ARG 37 -14.564 -11.486 3.117
341 HH11 ARG 37 HH22 ARG 37 -16.831 -11.870 5.746
342 HH12 ARG 37 HH21 ARG 37 -18.086 -12.541 4.728
343 HH21 ARG 37 HH12 ARG 37 -16.174 -12.351 1.856
344 HH22 ARG 37 HH11 ARG 37 -17.731 -12.756 2.522
345 H GLN 38 H GLN 38 -14.559 -8.335 10.190
346 HA GLN 38 HA GLN 38 -17.164 -8.786 11.558
347 HB2 GLN 38 HB2 GLN 38 -14.458 -9.780 12.091
348 HB3 GLN 38 HB3 GLN 38 -15.121 -8.953 13.502
349 HG2 GLN 38 HG2 GLN 38 -17.284 -10.386 12.972
350 HG3 GLN 38 HG3 GLN 38 -16.154 -11.400 12.067
351 HE21 GLN 38 HE21 GLN 38 -17.494 -12.614 14.064
352 HE22 GLN 38 HE22 GLN 38 -16.455 -12.771 15.492
353 H ARG 39 H ARG 39 -15.590 -6.212 10.577
354 HA ARG 39 HA ARG 39 -15.191 -4.064 11.317
355 HB2 ARG 39 HB2 ARG 39 -17.793 -4.584 12.814
356 HB3 ARG 39 HB3 ARG 39 -17.080 -3.002 12.481
357 HG2 ARG 39 HG2 ARG 39 -17.293 -3.398 10.054
358 HG3 ARG 39 HG3 ARG 39 -18.062 -4.969 10.359
359 HD2 ARG 39 HD2 ARG 39 -20.027 -4.049 11.125
360 HD3 ARG 39 HD3 ARG 39 -19.235 -2.611 11.793
361 HE ARG 39 HE ARG 39 -18.969 -2.462 9.003
362 HH11 ARG 39 HH22 ARG 39 -21.569 -2.300 11.326
363 HH12 ARG 39 HH21 ARG 39 -22.513 -1.183 10.382
364 HH21 ARG 39 HH12 ARG 39 -20.230 -1.106 7.770
365 HH22 ARG 39 HH11 ARG 39 -21.761 -0.539 8.375
366 H TYR 40 H TYR 40 -13.439 -5.477 12.545
367 HA TYR 40 HA TYR 40 -13.351 -5.740 15.319
368 HB2 TYR 40 HB2 TYR 40 -11.238 -5.173 13.239
369 HB3 TYR 40 HB3 TYR 40 -10.809 -5.146 14.917
370 HD1 TYR 40 HD1 TYR 40 -13.181 -7.632 13.316
371 HD2 TYR 40 HD2 TYR 40 -9.322 -6.895 15.091
372 HE1 TYR 40 HE1 TYR 40 -12.731 -10.083 13.388
373 HE2 TYR 40 HE2 TYR 40 -8.893 -9.347 15.155
374 HH TYR 40 HH TYR 40 -11.318 -11.706 14.041
375 HN1 NH2 41 HN1 NH2 41 -13.594 -2.619 13.771
376 HN2 NH2 41 HN2 NH2 41 -13.076 -1.719 15.187
Start of MODEL 18
1 HA TYR 1 HA TYR 1 -0.460 11.639 -14.106
2 HB2 TYR 1 HB2 TYR 1 1.252 12.995 -15.109
3 HB3 TYR 1 HB3 TYR 1 -0.287 13.333 -15.869
4 HD1 TYR 1 HD1 TYR 1 -1.544 15.541 -15.227
5 HD2 TYR 1 HD2 TYR 1 2.575 14.751 -14.169
6 HE1 TYR 1 HE1 TYR 1 -1.220 17.927 -14.628
7 HE2 TYR 1 HE2 TYR 1 2.875 17.132 -13.562
8 HH TYR 1 HH TYR 1 1.683 19.133 -13.059
9 H LEU 2 H LEU 2 -1.039 11.591 -11.460
10 HA LEU 2 HA LEU 2 0.828 13.242 -9.920
11 HB2 LEU 2 HB2 LEU 2 -1.035 11.003 -9.063
12 HB3 LEU 2 HB3 LEU 2 -0.088 12.027 -7.997
13 HG LEU 2 HG LEU 2 -1.550 13.817 -9.702
14 HD11 LEU 2 HD11 LEU 2 -3.064 11.914 -10.189
15 HD12 LEU 2 HD12 LEU 2 -3.318 11.681 -8.450
16 HD13 LEU 2 HD13 LEU 2 -3.870 13.179 -9.229
17 HD21 LEU 2 HD21 LEU 2 -1.994 13.083 -6.782
18 HD22 LEU 2 HD22 LEU 2 -0.841 14.287 -7.390
19 HD23 LEU 2 HD23 LEU 2 -2.579 14.547 -7.604
20 H GLU 3 H GLU 3 2.392 12.119 -11.613
21 HA GLU 3 HA GLU 3 3.588 9.602 -10.626
22 HB2 GLU 3 HB2 GLU 3 3.662 11.215 -13.128
23 HB3 GLU 3 HB3 GLU 3 5.237 10.598 -12.652
24 HG2 GLU 3 HG2 GLU 3 2.796 8.790 -12.788
25 HG3 GLU 3 HG3 GLU 3 3.810 9.129 -14.192
26 H ARG 4 H ARG 4 4.812 12.948 -11.285
27 HA ARG 4 HA ARG 4 7.301 12.602 -10.081
28 HB2 ARG 4 HB2 ARG 4 6.475 14.626 -11.380
29 HB3 ARG 4 HB3 ARG 4 5.715 15.210 -9.900
30 HG2 ARG 4 HG2 ARG 4 8.639 14.427 -9.806
31 HG3 ARG 4 HG3 ARG 4 8.205 15.907 -10.659
32 HD2 ARG 4 HD2 ARG 4 7.175 16.849 -8.675
33 HD3 ARG 4 HD3 ARG 4 7.443 15.352 -7.761
34 HE ARG 4 HE ARG 4 9.948 16.120 -8.719
35 HH11 ARG 4 HH22 ARG 4 7.602 17.504 -6.528
36 HH12 ARG 4 HH21 ARG 4 8.769 18.442 -5.652
37 HH21 ARG 4 HH12 ARG 4 11.460 17.331 -7.579
38 HH22 ARG 4 HH11 ARG 4 10.924 18.347 -6.273
39 H GLU 5 H GLU 5 4.353 13.681 -8.454
40 HA GLU 5 HA GLU 5 5.383 13.863 -5.802
41 HB2 GLU 5 HB2 GLU 5 2.793 14.014 -7.129
42 HB3 GLU 5 HB3 GLU 5 2.652 13.036 -5.667
43 HG2 GLU 5 HG2 GLU 5 3.503 14.796 -4.276
44 HG3 GLU 5 HG3 GLU 5 4.067 15.728 -5.666
45 H LEU 6 H LEU 6 3.799 11.028 -7.435
46 HA LEU 6 HA LEU 6 4.099 9.195 -5.286
47 HB2 LEU 6 HB2 LEU 6 2.625 8.472 -6.879
48 HB3 LEU 6 HB3 LEU 6 3.570 9.108 -8.216
49 HG LEU 6 HG LEU 6 5.068 7.305 -8.237
50 HD11 LEU 6 HD11 LEU 6 5.561 6.145 -6.379
51 HD12 LEU 6 HD12 LEU 6 4.111 6.711 -5.524
52 HD13 LEU 6 HD13 LEU 6 4.042 5.275 -6.557
53 HD21 LEU 6 HD21 LEU 6 2.275 6.141 -7.971
54 HD22 LEU 6 HD22 LEU 6 2.834 7.111 -9.361
55 HD23 LEU 6 HD23 LEU 6 3.623 5.573 -8.997
56 H LYS 7 H LYS 7 6.284 9.907 -8.048
57 HA LYS 7 HA LYS 7 8.309 8.063 -7.299
58 HB2 LYS 7 HB2 LYS 7 7.847 10.029 -9.338
59 HB3 LYS 7 HB3 LYS 7 9.384 10.464 -8.633
60 HG2 LYS 7 HG2 LYS 7 8.773 7.581 -9.398
61 HG3 LYS 7 HG3 LYS 7 9.201 8.761 -10.637
62 HD2 LYS 7 HD2 LYS 7 11.363 9.194 -9.621
63 HD3 LYS 7 HD3 LYS 7 10.937 8.245 -8.186
64 HE2 LYS 7 HE2 LYS 7 12.360 6.877 -9.603
65 HE3 LYS 7 HE3 LYS 7 10.720 6.210 -9.571
66 HZ1 LYS 7 HZ1 LYS 7 11.219 6.182 -11.793
67 HZ2 LYS 7 HZ2 LYS 7 10.437 7.618 -11.686
68 HZ3 LYS 7 HZ3 LYS 7 12.081 7.598 -11.768
69 H LYS 8 H LYS 8 7.866 11.450 -6.371
70 HA LYS 8 HA LYS 8 10.098 11.474 -4.482
71 HB2 LYS 8 HB2 LYS 8 7.933 13.335 -5.378
72 HB3 LYS 8 HB3 LYS 8 8.396 13.544 -3.713
73 HG2 LYS 8 HG2 LYS 8 10.625 13.259 -5.733
74 HG3 LYS 8 HG3 LYS 8 9.702 14.758 -5.746
75 HD2 LYS 8 HD2 LYS 8 10.413 15.447 -3.683
76 HD3 LYS 8 HD3 LYS 8 10.594 13.814 -3.044
77 HE2 LYS 8 HE2 LYS 8 12.724 13.628 -3.583
78 HE3 LYS 8 HE3 LYS 8 12.509 14.279 -5.209
79 HZ1 LYS 8 HZ1 LYS 8 12.919 16.410 -4.462
80 HZ2 LYS 8 HZ2 LYS 8 12.439 16.112 -2.919
81 HZ3 LYS 8 HZ3 LYS 8 13.897 15.577 -3.448
82 H LEU 9 H LEU 9 7.091 9.978 -4.316
83 HA LEU 9 HA LEU 9 6.972 9.988 -1.382
84 HB2 LEU 9 HB2 LEU 9 4.971 9.876 -3.288
85 HB3 LEU 9 HB3 LEU 9 5.222 8.180 -3.000
86 HG LEU 9 HG LEU 9 5.137 8.894 -0.438
87 HD11 LEU 9 HD11 LEU 9 4.398 11.389 -1.836
88 HD12 LEU 9 HD12 LEU 9 3.132 10.856 -0.726
89 HD13 LEU 9 HD13 LEU 9 4.781 11.110 -0.133
90 HD21 LEU 9 HD21 LEU 9 2.876 8.291 -0.332
91 HD22 LEU 9 HD22 LEU 9 2.527 8.898 -1.971
92 HD23 LEU 9 HD23 LEU 9 3.512 7.437 -1.741
93 H GLU 10 H GLU 10 7.227 7.507 -4.030
94 HA GLU 10 HA GLU 10 7.845 5.317 -2.369
95 HB2 GLU 10 HB2 GLU 10 7.356 5.413 -4.945
96 HB3 GLU 10 HB3 GLU 10 9.107 5.612 -5.102
97 HG2 GLU 10 HG2 GLU 10 9.262 3.492 -3.570
98 HG3 GLU 10 HG3 GLU 10 7.545 3.290 -3.899
99 H ARG 11 H ARG 11 9.967 7.856 -3.618
100 HA ARG 11 HA ARG 11 12.451 6.787 -2.691
101 HB2 ARG 11 HB2 ARG 11 11.484 9.361 -3.771
102 HB3 ARG 11 HB3 ARG 11 12.549 9.632 -2.410
103 HG2 ARG 11 HG2 ARG 11 14.080 7.817 -3.606
104 HG3 ARG 11 HG3 ARG 11 13.164 8.284 -5.043
105 HD2 ARG 11 HD2 ARG 11 14.151 10.364 -5.140
106 HD3 ARG 11 HD3 ARG 11 14.242 10.535 -3.380
107 HE ARG 11 HE ARG 11 16.033 8.538 -3.832
108 HH11 ARG 11 HH22 ARG 11 15.831 11.747 -5.234
109 HH12 ARG 11 HH21 ARG 11 17.567 11.901 -5.372
110 HH21 ARG 11 HH12 ARG 11 18.244 8.766 -4.095
111 HH22 ARG 11 HH11 ARG 11 18.884 10.266 -4.705
112 H GLU 12 H GLU 12 10.044 8.759 -0.950
113 HA GLU 12 HA GLU 12 11.811 8.938 1.393
114 HB2 GLU 12 HB2 GLU 12 9.947 10.652 0.423
115 HB3 GLU 12 HB3 GLU 12 8.935 9.776 1.552
116 HG2 GLU 12 HG2 GLU 12 11.609 10.633 2.635
117 HG3 GLU 12 HG3 GLU 12 10.612 11.951 2.071
118 H LEU 13 H LEU 13 8.718 7.294 0.519
119 HA LEU 13 HA LEU 13 8.397 5.822 2.921
120 HB2 LEU 13 HB2 LEU 13 6.545 5.629 1.660
121 HB3 LEU 13 HB3 LEU 13 7.408 5.779 0.152
122 HG LEU 13 HG LEU 13 8.087 3.375 0.297
123 HD11 LEU 13 HD11 LEU 13 6.294 2.057 1.782
124 HD12 LEU 13 HD12 LEU 13 7.826 2.575 2.471
125 HD13 LEU 13 HD13 LEU 13 6.364 3.528 2.779
126 HD21 LEU 13 HD21 LEU 13 5.102 3.919 0.250
127 HD22 LEU 13 HD22 LEU 13 6.227 4.237 -1.087
128 HD23 LEU 13 HD23 LEU 13 5.981 2.581 -0.538
129 H LYS 14 H LYS 14 10.455 5.051 0.063
130 HA LYS 14 HA LYS 14 11.513 2.592 0.943
131 HB2 LYS 14 HB2 LYS 14 11.912 3.281 -1.277
132 HB3 LYS 14 HB3 LYS 14 12.593 4.836 -0.782
133 HG2 LYS 14 HG2 LYS 14 14.597 3.845 0.010
134 HG3 LYS 14 HG3 LYS 14 13.963 2.194 -0.187
135 HD2 LYS 14 HD2 LYS 14 14.053 2.393 -2.605
136 HD3 LYS 14 HD3 LYS 14 14.380 4.133 -2.488
137 HE2 LYS 14 HE2 LYS 14 16.563 3.456 -2.719
138 HE3 LYS 14 HE3 LYS 14 16.410 3.332 -0.966
139 HZ1 LYS 14 HZ1 LYS 14 15.629 0.901 -1.687
140 HZ2 LYS 14 HZ2 LYS 14 16.646 1.219 -2.940
141 HZ3 LYS 14 HZ3 LYS 14 17.206 1.257 -1.407
142 H LYS 15 H LYS 15 11.949 5.590 2.605
143 HA LYS 15 HA LYS 15 14.478 5.233 3.879
144 HB2 LYS 15 HB2 LYS 15 11.802 6.285 4.897
145 HB3 LYS 15 HB3 LYS 15 13.251 6.328 5.877
146 HG2 LYS 15 HG2 LYS 15 13.428 7.508 3.114
147 HG3 LYS 15 HG3 LYS 15 12.526 8.404 4.341
148 HD2 LYS 15 HD2 LYS 15 14.396 8.565 5.800
149 HD3 LYS 15 HD3 LYS 15 15.363 7.423 4.845
150 HE2 LYS 15 HE2 LYS 15 14.283 10.067 3.779
151 HE3 LYS 15 HE3 LYS 15 15.896 9.899 4.493
152 HZ1 LYS 15 HZ1 LYS 15 15.846 9.677 2.041
153 HZ2 LYS 15 HZ2 LYS 15 16.461 8.327 2.788
154 HZ3 LYS 15 HZ3 LYS 15 14.933 8.312 2.193
155 H LEU 16 H LEU 16 11.439 3.492 4.343
156 HA LEU 16 HA LEU 16 12.772 1.832 6.428
157 HB2 LEU 16 HB2 LEU 16 10.797 1.455 7.397
158 HB3 LEU 16 HB3 LEU 16 10.399 2.966 6.644
159 HG LEU 16 HG LEU 16 9.664 1.171 4.657
160 HD11 LEU 16 HD11 LEU 16 10.191 -0.598 6.621
161 HD12 LEU 16 HD12 LEU 16 8.529 -0.194 7.067
162 HD13 LEU 16 HD13 LEU 16 8.901 -0.825 5.445
163 HD21 LEU 16 HD21 LEU 16 7.974 2.576 4.893
164 HD22 LEU 16 HD22 LEU 16 7.306 1.440 6.077
165 HD23 LEU 16 HD23 LEU 16 8.239 2.826 6.622
166 H SER 17 H SER 17 13.147 -0.319 6.070
167 HA SER 17 HA SER 17 13.956 -1.241 3.634
168 HB2 SER 17 HB2 SER 17 13.105 -2.576 6.160
169 HB3 SER 17 HB3 SER 17 13.379 -3.595 4.727
170 HG SER 17 HG SER 17 15.220 -3.146 6.136
171 HA PRO 18 HA PRO 18 9.910 -1.651 1.646
172 HB2 PRO 18 HB2 PRO 18 10.799 -2.299 -0.911
173 HB3 PRO 18 HB3 PRO 18 10.670 -0.651 -0.239
174 HG2 PRO 18 HG2 PRO 18 13.114 -2.329 -0.622
175 HG3 PRO 18 HG3 PRO 18 12.939 -0.550 -0.662
176 HD2 PRO 18 HD2 PRO 18 13.924 -2.076 1.485
177 HD3 PRO 18 HD3 PRO 18 13.361 -0.383 1.591
178 H GLU 19 H GLU 19 12.265 -4.089 2.075
179 HA GLU 19 HA GLU 19 10.523 -6.331 1.265
180 HB2 GLU 19 HB2 GLU 19 13.079 -6.128 0.937
181 HB3 GLU 19 HB3 GLU 19 13.221 -6.399 2.665
182 HG2 GLU 19 HG2 GLU 19 13.272 -8.605 2.173
183 HG3 GLU 19 HG3 GLU 19 11.547 -8.499 1.846
184 H GLU 20 H GLU 20 11.114 -4.413 4.142
185 HA GLU 20 HA GLU 20 10.445 -6.583 6.023
186 HB2 GLU 20 HB2 GLU 20 11.983 -4.428 6.356
187 HB3 GLU 20 HB3 GLU 20 10.456 -3.676 6.834
188 HG2 GLU 20 HG2 GLU 20 10.165 -5.505 8.532
189 HG3 GLU 20 HG3 GLU 20 11.686 -6.221 7.990
190 H LEU 21 H LEU 21 8.916 -3.724 4.528
191 HA LEU 21 HA LEU 21 6.472 -3.887 5.950
192 HB2 LEU 21 HB2 LEU 21 7.584 -2.290 3.825
193 HB3 LEU 21 HB3 LEU 21 6.053 -2.921 3.252
194 HG LEU 21 HG LEU 21 6.507 -1.327 5.802
195 HD11 LEU 21 HD11 LEU 21 6.402 0.388 4.364
196 HD12 LEU 21 HD12 LEU 21 5.873 -0.608 3.014
197 HD13 LEU 21 HD13 LEU 21 4.690 0.039 4.165
198 HD21 LEU 21 HD21 LEU 21 3.869 -1.270 5.714
199 HD22 LEU 21 HD22 LEU 21 4.063 -2.809 4.840
200 HD23 LEU 21 HD23 LEU 21 4.713 -2.601 6.481
201 H ASN 22 H ASN 22 7.289 -5.226 2.691
202 HA ASN 22 HA ASN 22 4.894 -6.520 2.095
203 HB2 ASN 22 HB2 ASN 22 6.982 -6.284 0.672
204 HB3 ASN 22 HB3 ASN 22 7.674 -7.634 1.567
205 HD21 ASN 22 HD21 ASN 22 7.812 -8.652 -0.643
206 HD22 ASN 22 HD22 ASN 22 6.344 -9.480 -1.165
207 H ARG 23 H ARG 23 7.491 -7.656 4.193
208 HA ARG 23 HA ARG 23 6.467 -10.262 4.777
209 HB2 ARG 23 HB2 ARG 23 8.802 -9.161 5.247
210 HB3 ARG 23 HB3 ARG 23 8.062 -8.583 6.748
211 HG2 ARG 23 HG2 ARG 23 7.488 -10.878 7.388
212 HG3 ARG 23 HG3 ARG 23 8.135 -11.496 5.855
213 HD2 ARG 23 HD2 ARG 23 10.282 -11.342 6.513
214 HD3 ARG 23 HD3 ARG 23 10.061 -9.769 7.294
215 HE ARG 23 HE ARG 23 8.758 -11.374 9.028
216 HH11 ARG 23 HH22 ARG 23 11.966 -11.774 7.645
217 HH12 ARG 23 HH21 ARG 23 12.542 -12.728 8.980
218 HH21 ARG 23 HH12 ARG 23 9.583 -12.433 10.791
219 HH22 ARG 23 HH11 ARG 23 11.227 -13.026 10.763
220 H TYR 24 H TYR 24 6.181 -7.246 6.714
221 HA TYR 24 HA TYR 24 4.196 -8.246 8.538
222 HB2 TYR 24 HB2 TYR 24 5.233 -5.538 7.704
223 HB3 TYR 24 HB3 TYR 24 3.734 -5.621 8.603
224 HD1 TYR 24 HD1 TYR 24 3.648 -6.767 10.851
225 HD2 TYR 24 HD2 TYR 24 7.356 -5.799 8.870
226 HE1 TYR 24 HE1 TYR 24 4.878 -7.019 13.013
227 HE2 TYR 24 HE2 TYR 24 8.573 -6.051 11.011
228 HH TYR 24 HH TYR 24 8.398 -6.520 13.248
229 H TYR 25 H TYR 25 3.980 -6.979 5.315
230 HA TYR 25 HA TYR 25 1.181 -6.521 5.200
231 HB2 TYR 25 HB2 TYR 25 3.225 -5.968 3.528
232 HB3 TYR 25 HB3 TYR 25 2.664 -7.427 2.736
233 HD1 TYR 25 HD2 TYR 25 1.273 -4.285 4.255
234 HD2 TYR 25 HD1 TYR 25 1.257 -7.030 0.929
235 HE1 TYR 25 HE2 TYR 25 -0.298 -2.793 3.043
236 HE2 TYR 25 HE1 TYR 25 -0.329 -5.529 -0.293
237 HH TYR 25 HH TYR 25 -1.076 -2.323 0.818
238 H ALA 26 H ALA 26 3.070 -9.477 4.265
239 HA ALA 26 HA ALA 26 0.780 -10.997 3.462
240 HB1 ALA 26 HB1 ALA 26 3.529 -11.750 4.546
241 HB2 ALA 26 HB2 ALA 26 2.329 -12.980 4.100
242 HB3 ALA 26 HB3 ALA 26 2.926 -11.840 2.876
243 H SER 27 H SER 27 2.290 -10.675 6.695
244 HA SER 27 HA SER 27 0.347 -12.349 8.053
245 HB2 SER 27 HB2 SER 27 2.340 -10.257 9.023
246 HB3 SER 27 HB3 SER 27 1.260 -11.145 10.108
247 HG SER 27 HG SER 27 3.275 -12.226 8.436
248 H LEU 28 H LEU 28 0.003 -9.264 6.718
249 HA LEU 28 HA LEU 28 -2.326 -8.638 8.466
250 HB2 LEU 28 HB2 LEU 28 -0.522 -7.008 6.676
251 HB3 LEU 28 HB3 LEU 28 -2.154 -6.451 6.993
252 HG LEU 28 HG LEU 28 -0.148 -7.106 9.195
253 HD11 LEU 28 HD11 LEU 28 -0.646 -4.609 7.605
254 HD12 LEU 28 HD12 LEU 28 -0.327 -4.438 9.344
255 HD13 LEU 28 HD13 LEU 28 0.846 -5.258 8.311
256 HD21 LEU 28 HD21 LEU 28 -1.855 -5.582 10.479
257 HD22 LEU 28 HD22 LEU 28 -2.971 -5.993 9.160
258 HD23 LEU 28 HD23 LEU 28 -2.268 -7.266 10.184
259 H ARG 29 H ARG 29 -1.450 -9.265 5.068
260 HA ARG 29 HA ARG 29 -3.966 -8.799 3.918
261 HB2 ARG 29 HB2 ARG 29 -1.671 -9.233 2.813
262 HB3 ARG 29 HB3 ARG 29 -2.044 -10.944 2.950
263 HG2 ARG 29 HG2 ARG 29 -3.584 -10.874 1.258
264 HG3 ARG 29 HG3 ARG 29 -4.315 -9.385 1.835
265 HD2 ARG 29 HD2 ARG 29 -3.399 -8.904 -0.318
266 HD3 ARG 29 HD3 ARG 29 -2.445 -8.057 0.896
267 HE ARG 29 HE ARG 29 -0.591 -9.257 0.253
268 HH11 ARG 29 HH22 ARG 29 -3.355 -11.056 -0.902
269 HH12 ARG 29 HH21 ARG 29 -2.390 -12.207 -1.788
270 HH21 ARG 29 HH12 ARG 29 0.605 -10.634 -1.024
271 HH22 ARG 29 HH11 ARG 29 -0.186 -11.881 -1.932
272 H HIS 30 H HIS 30 -2.670 -11.787 5.329
273 HA HIS 30 HA HIS 30 -5.133 -13.285 4.901
274 HB2 HIS 30 HB2 HIS 30 -2.580 -13.998 5.512
275 HB3 HIS 30 HB3 HIS 30 -3.281 -14.065 7.123
276 HD1 HIS 30 HD1 HIS 30 -2.299 -16.565 5.235
277 HD2 HIS 30 HD2 HIS 30 -6.241 -15.305 6.022
278 HE1 HIS 30 HE1 HIS 30 -3.829 -18.534 4.674
279 H TYR 31 H TYR 31 -4.061 -10.984 7.303
280 HA TYR 31 HA TYR 31 -5.997 -11.684 9.344
281 HB2 TYR 31 HB2 TYR 31 -3.671 -10.352 9.423
282 HB3 TYR 31 HB3 TYR 31 -4.670 -8.960 9.066
283 HD1 TYR 31 HD1 TYR 31 -4.971 -11.943 11.344
284 HD2 TYR 31 HD2 TYR 31 -4.955 -7.642 10.953
285 HE1 TYR 31 HE1 TYR 31 -5.563 -11.713 13.753
286 HE2 TYR 31 HE2 TYR 31 -5.444 -7.419 13.378
287 HH TYR 31 HH TYR 31 -6.408 -8.657 15.198
288 H LEU 32 H LEU 32 -5.749 -8.811 7.210
289 HA LEU 32 HA LEU 32 -8.338 -7.832 7.629
290 HB2 LEU 32 HB2 LEU 32 -8.053 -6.536 5.571
291 HB3 LEU 32 HB3 LEU 32 -6.674 -6.479 6.654
292 HG LEU 32 HG LEU 32 -5.835 -8.480 5.064
293 HD11 LEU 32 HD11 LEU 32 -6.434 -8.450 2.869
294 HD12 LEU 32 HD12 LEU 32 -8.001 -8.237 3.643
295 HD13 LEU 32 HD13 LEU 32 -7.169 -6.832 2.948
296 HD21 LEU 32 HD21 LEU 32 -4.811 -6.529 3.587
297 HD22 LEU 32 HD22 LEU 32 -5.563 -5.497 4.822
298 HD23 LEU 32 HD23 LEU 32 -4.367 -6.711 5.286
299 H ASN 33 H ASN 33 -7.480 -10.600 5.684
300 HA ASN 33 HA ASN 33 -9.677 -11.119 4.080
301 HB2 ASN 33 HB2 ASN 33 -7.572 -12.539 4.713
302 HB3 ASN 33 HB3 ASN 33 -8.551 -13.137 6.053
303 HD21 ASN 33 HD21 ASN 33 -7.624 -13.844 2.905
304 HD22 ASN 33 HD22 ASN 33 -9.045 -14.834 2.534
305 H LEU 34 H LEU 34 -9.506 -11.563 7.641
306 HA LEU 34 HA LEU 34 -12.491 -11.402 7.720
307 HB2 LEU 34 HB2 LEU 34 -12.691 -13.074 9.335
308 HB3 LEU 34 HB3 LEU 34 -11.827 -13.752 7.973
309 HG LEU 34 HG LEU 34 -10.284 -12.715 10.389
310 HD11 LEU 34 HD11 LEU 34 -11.949 -14.101 11.380
311 HD12 LEU 34 HD12 LEU 34 -11.721 -15.374 10.159
312 HD13 LEU 34 HD13 LEU 34 -10.439 -15.017 11.344
313 HD21 LEU 34 HD21 LEU 34 -8.786 -14.675 9.733
314 HD22 LEU 34 HD22 LEU 34 -9.758 -14.820 8.254
315 HD23 LEU 34 HD23 LEU 34 -8.834 -13.339 8.591
316 H VAL 35 H VAL 35 -9.823 -9.827 8.543
317 HA VAL 35 HA VAL 35 -10.919 -8.630 11.042
318 HB VAL 35 HB VAL 35 -8.147 -8.463 9.926
319 HG11 VAL 35 HG11 VAL 35 -9.446 -7.302 12.346
320 HG12 VAL 35 HG12 VAL 35 -7.834 -7.968 12.578
321 HG13 VAL 35 HG13 VAL 35 -8.085 -6.709 11.370
322 HG21 VAL 35 HG21 VAL 35 -7.489 -10.302 11.082
323 HG22 VAL 35 HG22 VAL 35 -8.616 -10.068 12.425
324 HG23 VAL 35 HG23 VAL 35 -9.132 -10.822 10.920
325 H THR 36 H THR 36 -10.772 -8.033 7.776
326 HA THR 36 HA THR 36 -10.567 -5.341 7.254
327 HB THR 36 HB THR 36 -12.245 -7.564 6.379
328 HG1 THR 36 HG1 THR 36 -10.475 -7.242 5.343
329 HG21 THR 36 HG21 THR 36 -14.119 -6.115 6.405
330 HG22 THR 36 HG22 THR 36 -13.205 -4.796 5.632
331 HG23 THR 36 HG23 THR 36 -13.577 -6.285 4.735
332 H ARG 37 H ARG 37 -13.051 -6.830 9.128
333 HA ARG 37 HA ARG 37 -14.955 -4.821 9.547
334 HB2 ARG 37 HB2 ARG 37 -15.567 -6.014 11.517
335 HB3 ARG 37 HB3 ARG 37 -14.974 -7.209 10.371
336 HG2 ARG 37 HG2 ARG 37 -12.647 -6.623 11.799
337 HG3 ARG 37 HG3 ARG 37 -13.896 -6.355 13.023
338 HD2 ARG 37 HD2 ARG 37 -14.787 -8.700 12.142
339 HD3 ARG 37 HD3 ARG 37 -13.151 -8.822 11.485
340 HE ARG 37 HE ARG 37 -12.809 -8.112 14.161
341 HH11 ARG 37 HH22 ARG 37 -14.143 -10.822 12.442
342 HH12 ARG 37 HH21 ARG 37 -14.177 -11.880 13.826
343 HH21 ARG 37 HH12 ARG 37 -12.672 -9.498 15.905
344 HH22 ARG 37 HH11 ARG 37 -13.094 -11.180 15.688
345 H GLN 38 H GLN 38 -11.771 -4.900 10.672
346 HA GLN 38 HA GLN 38 -12.017 -2.147 11.692
347 HB2 GLN 38 HB2 GLN 38 -11.731 -4.378 13.430
348 HB3 GLN 38 HB3 GLN 38 -10.109 -3.695 13.317
349 HG2 GLN 38 HG2 GLN 38 -11.098 -1.427 13.842
350 HG3 GLN 38 HG3 GLN 38 -12.682 -2.205 14.003
351 HE21 GLN 38 HE21 GLN 38 -13.124 -2.054 16.227
352 HE22 GLN 38 HE22 GLN 38 -11.940 -2.644 17.415
353 H ARG 39 H ARG 39 -10.712 -3.851 9.350
354 HA ARG 39 HA ARG 39 -8.338 -2.097 9.233
355 HB2 ARG 39 HB2 ARG 39 -7.617 -4.291 10.296
356 HB3 ARG 39 HB3 ARG 39 -8.074 -5.101 8.802
357 HG2 ARG 39 HG2 ARG 39 -5.706 -4.760 8.694
358 HG3 ARG 39 HG3 ARG 39 -6.397 -3.600 7.581
359 HD2 ARG 39 HD2 ARG 39 -6.307 -2.033 9.817
360 HD3 ARG 39 HD3 ARG 39 -5.023 -3.163 10.203
361 HE ARG 39 HE ARG 39 -3.696 -2.232 8.538
362 HH11 ARG 39 HH22 ARG 39 -6.922 -0.989 8.102
363 HH12 ARG 39 HH21 ARG 39 -6.441 0.253 6.982
364 HH21 ARG 39 HH12 ARG 39 -3.078 -0.642 7.056
365 HH22 ARG 39 HH11 ARG 39 -4.289 0.416 6.408
366 H TYR 40 H TYR 40 -10.264 -1.341 7.829
367 HA TYR 40 HA TYR 40 -10.925 -0.665 5.760
368 HB2 TYR 40 HB2 TYR 40 -8.837 -0.064 5.074
369 HB3 TYR 40 HB3 TYR 40 -8.147 -1.654 5.254
370 HD1 TYR 40 HD2 TYR 40 -8.359 -3.398 3.518
371 HD2 TYR 40 HD1 TYR 40 -9.805 0.624 2.921
372 HE1 TYR 40 HE2 TYR 40 -8.624 -3.869 1.110
373 HE2 TYR 40 HE1 TYR 40 -9.972 0.184 0.475
374 HH TYR 40 HH TYR 40 -9.260 -3.017 -0.941
375 HN1 NH2 41 HN1 NH2 41 -9.677 -3.941 5.303
376 HN2 NH2 41 HN2 NH2 41 -11.127 -4.641 4.606
Start of MODEL 19
1 HA TYR 1 HA TYR 1 3.132 17.880 -14.806
2 HB2 TYR 1 HB2 TYR 1 3.355 19.172 -12.795
3 HB3 TYR 1 HB3 TYR 1 2.358 20.089 -13.905
4 HD1 TYR 1 HD1 TYR 1 -0.212 20.128 -13.542
5 HD2 TYR 1 HD2 TYR 1 2.558 18.615 -10.558
6 HE1 TYR 1 HE1 TYR 1 -2.003 20.153 -11.825
7 HE2 TYR 1 HE2 TYR 1 0.767 18.649 -8.889
8 HH TYR 1 HH TYR 1 -2.558 19.018 -9.644
9 H LEU 2 H LEU 2 3.445 17.315 -11.963
10 HA LEU 2 HA LEU 2 3.500 15.604 -10.538
11 HB2 LEU 2 HB2 LEU 2 1.160 16.319 -10.313
12 HB3 LEU 2 HB3 LEU 2 0.656 15.075 -11.434
13 HG LEU 2 HG LEU 2 2.336 13.970 -9.284
14 HD11 LEU 2 HD11 LEU 2 1.436 15.855 -7.979
15 HD12 LEU 2 HD12 LEU 2 -0.222 15.384 -8.425
16 HD13 LEU 2 HD13 LEU 2 0.782 14.307 -7.419
17 HD21 LEU 2 HD21 LEU 2 0.502 12.855 -10.869
18 HD22 LEU 2 HD22 LEU 2 0.749 12.278 -9.221
19 HD23 LEU 2 HD23 LEU 2 -0.613 13.355 -9.595
20 H GLU 3 H GLU 3 5.025 15.056 -12.482
21 HA GLU 3 HA GLU 3 4.546 12.186 -13.201
22 HB2 GLU 3 HB2 GLU 3 5.002 14.530 -14.927
23 HB3 GLU 3 HB3 GLU 3 6.249 13.329 -15.164
24 HG2 GLU 3 HG2 GLU 3 3.259 12.746 -15.246
25 HG3 GLU 3 HG3 GLU 3 4.250 13.069 -16.668
26 H ARG 4 H ARG 4 7.275 14.538 -13.312
27 HA ARG 4 HA ARG 4 9.118 12.463 -12.489
28 HB2 ARG 4 HB2 ARG 4 9.621 14.490 -13.963
29 HB3 ARG 4 HB3 ARG 4 9.664 15.466 -12.476
30 HG2 ARG 4 HG2 ARG 4 11.486 14.117 -11.567
31 HG3 ARG 4 HG3 ARG 4 11.268 12.896 -12.833
32 HD2 ARG 4 HD2 ARG 4 11.762 14.902 -14.473
33 HD3 ARG 4 HD3 ARG 4 12.500 15.646 -13.055
34 HE ARG 4 HE ARG 4 13.370 13.275 -14.574
35 HH11 ARG 4 HH22 ARG 4 13.896 15.069 -11.626
36 HH12 ARG 4 HH21 ARG 4 15.465 14.356 -11.330
37 HH21 ARG 4 HH12 ARG 4 15.361 12.354 -14.158
38 HH22 ARG 4 HH11 ARG 4 16.270 12.822 -12.756
39 H GLU 5 H GLU 5 7.659 15.226 -10.831
40 HA GLU 5 HA GLU 5 8.970 15.079 -8.351
41 HB2 GLU 5 HB2 GLU 5 7.032 16.129 -7.365
42 HB3 GLU 5 HB3 GLU 5 7.405 16.881 -8.914
43 HG2 GLU 5 HG2 GLU 5 5.542 15.972 -9.986
44 HG3 GLU 5 HG3 GLU 5 5.308 14.686 -8.822
45 H LEU 6 H LEU 6 6.487 12.957 -9.652
46 HA LEU 6 HA LEU 6 5.844 11.556 -7.255
47 HB2 LEU 6 HB2 LEU 6 5.383 11.251 -10.189
48 HB3 LEU 6 HB3 LEU 6 5.420 9.732 -9.315
49 HG LEU 6 HG LEU 6 3.629 12.079 -8.591
50 HD11 LEU 6 HD11 LEU 6 3.319 9.712 -10.449
51 HD12 LEU 6 HD12 LEU 6 1.906 10.238 -9.520
52 HD13 LEU 6 HD13 LEU 6 2.726 11.360 -10.601
53 HD21 LEU 6 HD21 LEU 6 4.152 10.462 -6.699
54 HD22 LEU 6 HD22 LEU 6 2.456 10.510 -7.173
55 HD23 LEU 6 HD23 LEU 6 3.490 9.162 -7.712
56 H LYS 7 H LYS 7 8.322 11.025 -9.758
57 HA LYS 7 HA LYS 7 9.256 8.527 -8.663
58 HB2 LYS 7 HB2 LYS 7 9.752 9.807 -11.014
59 HB3 LYS 7 HB3 LYS 7 11.132 10.411 -10.103
60 HG2 LYS 7 HG2 LYS 7 11.022 7.632 -9.503
61 HG3 LYS 7 HG3 LYS 7 10.597 7.724 -11.211
62 HD2 LYS 7 HD2 LYS 7 12.691 8.685 -11.789
63 HD3 LYS 7 HD3 LYS 7 13.035 9.167 -10.106
64 HE2 LYS 7 HE2 LYS 7 13.106 6.786 -9.428
65 HE3 LYS 7 HE3 LYS 7 12.828 6.297 -11.105
66 HZ1 LYS 7 HZ1 LYS 7 15.242 7.058 -9.854
67 HZ2 LYS 7 HZ2 LYS 7 15.022 6.395 -11.339
68 HZ3 LYS 7 HZ3 LYS 7 14.949 8.030 -11.168
69 H LYS 8 H LYS 8 10.072 11.913 -8.097
70 HA LYS 8 HA LYS 8 12.081 11.277 -6.070
71 HB2 LYS 8 HB2 LYS 8 11.489 13.587 -7.566
72 HB3 LYS 8 HB3 LYS 8 10.926 13.998 -5.949
73 HG2 LYS 8 HG2 LYS 8 13.340 12.804 -5.350
74 HG3 LYS 8 HG3 LYS 8 13.704 13.415 -6.953
75 HD2 LYS 8 HD2 LYS 8 12.484 15.257 -4.862
76 HD3 LYS 8 HD3 LYS 8 14.171 14.759 -4.733
77 HE2 LYS 8 HE2 LYS 8 14.302 15.505 -7.271
78 HE3 LYS 8 HE3 LYS 8 12.864 16.453 -6.872
79 HZ1 LYS 8 HZ1 LYS 8 15.576 16.945 -6.188
80 HZ2 LYS 8 HZ2 LYS 8 14.280 17.947 -6.012
81 HZ3 LYS 8 HZ3 LYS 8 14.674 16.875 -4.828
82 H LEU 9 H LEU 9 8.787 11.019 -6.003
83 HA LEU 9 HA LEU 9 8.450 11.590 -3.132
84 HB2 LEU 9 HB2 LEU 9 6.845 12.082 -5.276
85 HB3 LEU 9 HB3 LEU 9 6.203 10.522 -4.839
86 HG LEU 9 HG LEU 9 6.584 12.721 -2.775
87 HD11 LEU 9 HD11 LEU 9 4.350 13.542 -3.230
88 HD12 LEU 9 HD12 LEU 9 5.327 13.672 -4.699
89 HD13 LEU 9 HD13 LEU 9 4.134 12.364 -4.549
90 HD21 LEU 9 HD21 LEU 9 6.011 10.391 -2.013
91 HD22 LEU 9 HD22 LEU 9 4.761 11.579 -1.622
92 HD23 LEU 9 HD23 LEU 9 4.528 10.471 -2.991
93 H GLU 10 H GLU 10 7.905 8.876 -5.470
94 HA GLU 10 HA GLU 10 7.418 6.852 -3.568
95 HB2 GLU 10 HB2 GLU 10 7.294 6.784 -6.173
96 HB3 GLU 10 HB3 GLU 10 9.017 6.371 -6.090
97 HG2 GLU 10 HG2 GLU 10 8.379 4.465 -4.513
98 HG3 GLU 10 HG3 GLU 10 6.689 4.893 -4.771
99 H ARG 11 H ARG 11 10.454 8.340 -4.513
100 HA ARG 11 HA ARG 11 12.289 6.522 -3.370
101 HB2 ARG 11 HB2 ARG 11 12.448 9.097 -4.517
102 HB3 ARG 11 HB3 ARG 11 12.955 9.363 -2.848
103 HG2 ARG 11 HG2 ARG 11 14.454 7.226 -3.225
104 HG3 ARG 11 HG3 ARG 11 14.135 7.516 -4.938
105 HD2 ARG 11 HD2 ARG 11 15.970 8.876 -4.819
106 HD3 ARG 11 HD3 ARG 11 14.848 10.048 -4.144
107 HE ARG 11 HE ARG 11 15.810 9.781 -2.040
108 HH11 ARG 11 HH22 ARG 11 16.967 7.207 -4.093
109 HH12 ARG 11 HH21 ARG 11 18.143 6.620 -2.954
110 HH21 ARG 11 HH12 ARG 11 17.270 8.970 -0.530
111 HH22 ARG 11 HH11 ARG 11 18.275 7.612 -0.920
112 H GLU 12 H GLU 12 10.446 9.120 -1.752
113 HA GLU 12 HA GLU 12 11.691 8.779 0.808
114 HB2 GLU 12 HB2 GLU 12 10.013 10.652 -0.335
115 HB3 GLU 12 HB3 GLU 12 8.890 9.809 0.709
116 HG2 GLU 12 HG2 GLU 12 11.460 10.431 2.070
117 HG3 GLU 12 HG3 GLU 12 10.755 11.860 1.359
118 H LEU 13 H LEU 13 9.180 7.067 -0.828
119 HA LEU 13 HA LEU 13 8.265 5.564 1.560
120 HB2 LEU 13 HB2 LEU 13 7.619 5.592 -1.427
121 HB3 LEU 13 HB3 LEU 13 7.160 4.215 -0.469
122 HG LEU 13 HG LEU 13 6.428 6.689 0.918
123 HD11 LEU 13 HD11 LEU 13 4.990 7.786 -0.514
124 HD12 LEU 13 HD12 LEU 13 6.343 7.436 -1.581
125 HD13 LEU 13 HD13 LEU 13 4.880 6.434 -1.664
126 HD21 LEU 13 HD21 LEU 13 4.412 4.756 -0.218
127 HD22 LEU 13 HD22 LEU 13 5.536 4.191 1.027
128 HD23 LEU 13 HD23 LEU 13 4.475 5.556 1.373
129 H LYS 14 H LYS 14 10.051 4.762 -1.457
130 HA LYS 14 HA LYS 14 10.859 2.143 -0.602
131 HB2 LYS 14 HB2 LYS 14 10.924 2.859 -2.935
132 HB3 LYS 14 HB3 LYS 14 12.158 4.071 -2.577
133 HG2 LYS 14 HG2 LYS 14 13.855 2.552 -2.525
134 HG3 LYS 14 HG3 LYS 14 12.886 1.303 -1.723
135 HD2 LYS 14 HD2 LYS 14 11.830 0.613 -3.718
136 HD3 LYS 14 HD3 LYS 14 12.613 1.921 -4.652
137 HE2 LYS 14 HE2 LYS 14 14.842 1.009 -3.997
138 HE3 LYS 14 HE3 LYS 14 14.060 -0.319 -3.137
139 HZ1 LYS 14 HZ1 LYS 14 13.377 0.137 -5.941
140 HZ2 LYS 14 HZ2 LYS 14 14.813 -0.612 -5.595
141 HZ3 LYS 14 HZ3 LYS 14 13.374 -1.270 -5.108
142 H LYS 15 H LYS 15 11.995 5.207 0.426
143 HA LYS 15 HA LYS 15 14.538 4.852 1.340
144 HB2 LYS 15 HB2 LYS 15 12.540 6.663 1.742
145 HB3 LYS 15 HB3 LYS 15 12.608 5.981 3.365
146 HG2 LYS 15 HG2 LYS 15 14.915 6.613 3.608
147 HG3 LYS 15 HG3 LYS 15 15.092 6.897 1.873
148 HD2 LYS 15 HD2 LYS 15 14.586 9.022 2.095
149 HD3 LYS 15 HD3 LYS 15 12.973 8.633 2.701
150 HE2 LYS 15 HE2 LYS 15 13.641 8.705 4.963
151 HE3 LYS 15 HE3 LYS 15 15.356 8.533 4.552
152 HZ1 LYS 15 HZ1 LYS 15 14.790 10.783 3.302
153 HZ2 LYS 15 HZ2 LYS 15 13.717 10.913 4.541
154 HZ3 LYS 15 HZ3 LYS 15 15.336 10.730 4.855
155 H LEU 16 H LEU 16 11.656 3.492 2.879
156 HA LEU 16 HA LEU 16 13.288 1.952 4.828
157 HB2 LEU 16 HB2 LEU 16 10.305 2.439 4.427
158 HB3 LEU 16 HB3 LEU 16 10.913 1.114 5.424
159 HG LEU 16 HG LEU 16 12.161 2.644 6.831
160 HD11 LEU 16 HD11 LEU 16 11.662 5.120 6.770
161 HD12 LEU 16 HD12 LEU 16 12.723 4.519 5.510
162 HD13 LEU 16 HD13 LEU 16 11.015 4.869 5.126
163 HD21 LEU 16 HD21 LEU 16 9.640 4.017 7.205
164 HD22 LEU 16 HD22 LEU 16 9.342 2.332 6.761
165 HD23 LEU 16 HD23 LEU 16 10.380 2.705 8.146
166 H SER 17 H SER 17 13.674 -0.150 4.602
167 HA SER 17 HA SER 17 14.002 -1.437 2.294
168 HB2 SER 17 HB2 SER 17 13.582 -2.382 5.070
169 HB3 SER 17 HB3 SER 17 13.462 -3.612 3.789
170 HG SER 17 HG SER 17 15.487 -3.335 3.265
171 HA PRO 18 HA PRO 18 9.731 -1.960 0.897
172 HB2 PRO 18 HB2 PRO 18 10.310 -2.901 -1.654
173 HB3 PRO 18 HB3 PRO 18 10.276 -1.186 -1.166
174 HG2 PRO 18 HG2 PRO 18 12.638 -2.937 -1.675
175 HG3 PRO 18 HG3 PRO 18 12.479 -1.163 -1.821
176 HD2 PRO 18 HD2 PRO 18 13.658 -2.605 0.312
177 HD3 PRO 18 HD3 PRO 18 13.259 -0.862 0.301
178 H GLU 19 H GLU 19 12.027 -4.304 1.574
179 HA GLU 19 HA GLU 19 10.181 -6.586 1.139
180 HB2 GLU 19 HB2 GLU 19 12.928 -6.336 0.703
181 HB3 GLU 19 HB3 GLU 19 12.874 -7.083 2.288
182 HG2 GLU 19 HG2 GLU 19 11.012 -8.609 0.908
183 HG3 GLU 19 HG3 GLU 19 12.090 -8.130 -0.393
184 H GLU 20 H GLU 20 11.175 -4.384 3.633
185 HA GLU 20 HA GLU 20 10.775 -6.309 5.842
186 HB2 GLU 20 HB2 GLU 20 12.365 -4.082 5.625
187 HB3 GLU 20 HB3 GLU 20 10.971 -3.392 6.455
188 HG2 GLU 20 HG2 GLU 20 11.187 -5.187 8.186
189 HG3 GLU 20 HG3 GLU 20 12.552 -5.862 7.293
190 H LEU 21 H LEU 21 9.111 -3.493 4.294
191 HA LEU 21 HA LEU 21 6.919 -3.425 6.083
192 HB2 LEU 21 HB2 LEU 21 7.700 -2.358 3.420
193 HB3 LEU 21 HB3 LEU 21 5.993 -2.574 3.613
194 HG LEU 21 HG LEU 21 7.218 -0.335 4.258
195 HD11 LEU 21 HD11 LEU 21 4.752 -1.605 5.279
196 HD12 LEU 21 HD12 LEU 21 5.349 -0.309 6.327
197 HD13 LEU 21 HD13 LEU 21 5.027 0.014 4.620
198 HD21 LEU 21 HD21 LEU 21 7.257 -1.495 7.046
199 HD22 LEU 21 HD22 LEU 21 8.695 -1.532 6.004
200 HD23 LEU 21 HD23 LEU 21 7.957 0.014 6.431
201 H ASN 22 H ASN 22 7.191 -5.071 2.892
202 HA ASN 22 HA ASN 22 4.791 -6.399 2.776
203 HB2 ASN 22 HB2 ASN 22 6.605 -6.539 1.091
204 HB3 ASN 22 HB3 ASN 22 7.485 -7.651 2.140
205 HD21 ASN 22 HD21 ASN 22 6.985 -9.859 1.940
206 HD22 ASN 22 HD22 ASN 22 5.506 -10.396 1.139
207 H ARG 23 H ARG 23 7.570 -7.354 4.737
208 HA ARG 23 HA ARG 23 6.611 -9.825 5.746
209 HB2 ARG 23 HB2 ARG 23 8.930 -8.722 5.961
210 HB3 ARG 23 HB3 ARG 23 8.307 -7.862 7.371
211 HG2 ARG 23 HG2 ARG 23 8.055 -9.765 8.665
212 HG3 ARG 23 HG3 ARG 23 7.823 -10.816 7.257
213 HD2 ARG 23 HD2 ARG 23 10.328 -10.094 6.711
214 HD3 ARG 23 HD3 ARG 23 10.386 -9.809 8.463
215 HE ARG 23 HE ARG 23 9.212 -12.288 8.233
216 HH11 ARG 23 HH22 ARG 23 12.150 -11.001 6.907
217 HH12 ARG 23 HH21 ARG 23 12.954 -12.548 6.804
218 HH21 ARG 23 HH12 ARG 23 10.229 -14.265 8.157
219 HH22 ARG 23 HH11 ARG 23 11.870 -14.385 7.639
220 H TYR 24 H TYR 24 6.498 -6.691 7.416
221 HA TYR 24 HA TYR 24 4.597 -7.466 9.445
222 HB2 TYR 24 HB2 TYR 24 5.812 -4.905 8.406
223 HB3 TYR 24 HB3 TYR 24 4.362 -4.796 9.383
224 HD1 TYR 24 HD1 TYR 24 4.279 -5.974 11.640
225 HD2 TYR 24 HD2 TYR 24 7.958 -5.192 9.523
226 HE1 TYR 24 HE1 TYR 24 5.547 -6.134 13.783
227 HE2 TYR 24 HE2 TYR 24 9.218 -5.330 11.669
228 HH TYR 24 HH TYR 24 8.912 -5.174 14.034
229 H TYR 25 H TYR 25 4.259 -6.488 6.160
230 HA TYR 25 HA TYR 25 1.485 -5.755 6.201
231 HB2 TYR 25 HB2 TYR 25 3.556 -5.639 4.355
232 HB3 TYR 25 HB3 TYR 25 2.577 -6.905 3.675
233 HD1 TYR 25 HD2 TYR 25 2.234 -3.531 5.290
234 HD2 TYR 25 HD1 TYR 25 1.090 -6.143 2.055
235 HE1 TYR 25 HE2 TYR 25 0.948 -1.667 4.237
236 HE2 TYR 25 HE1 TYR 25 -0.197 -4.289 1.007
237 HH TYR 25 HH TYR 25 -0.947 -2.122 1.260
238 H ALA 26 H ALA 26 3.173 -8.847 5.341
239 HA ALA 26 HA ALA 26 0.763 -10.207 4.651
240 HB1 ALA 26 HB1 ALA 26 2.122 -12.085 4.421
241 HB2 ALA 26 HB2 ALA 26 3.374 -10.828 4.380
242 HB3 ALA 26 HB3 ALA 26 3.075 -11.726 5.878
243 H SER 27 H SER 27 2.483 -9.926 7.749
244 HA SER 27 HA SER 27 0.640 -11.483 9.329
245 HB2 SER 27 HB2 SER 27 2.938 -9.679 9.828
246 HB3 SER 27 HB3 SER 27 1.704 -9.617 11.090
247 HG SER 27 HG SER 27 3.183 -11.847 10.174
248 H LEU 28 H LEU 28 0.174 -8.444 7.868
249 HA LEU 28 HA LEU 28 -2.092 -7.786 9.671
250 HB2 LEU 28 HB2 LEU 28 -0.399 -6.199 7.719
251 HB3 LEU 28 HB3 LEU 28 -1.992 -5.610 8.168
252 HG LEU 28 HG LEU 28 0.166 -6.311 10.183
253 HD11 LEU 28 HD11 LEU 28 -0.552 -3.463 9.403
254 HD12 LEU 28 HD12 LEU 28 0.863 -4.077 10.289
255 HD13 LEU 28 HD13 LEU 28 0.711 -4.365 8.554
256 HD21 LEU 28 HD21 LEU 28 -1.203 -5.478 11.847
257 HD22 LEU 28 HD22 LEU 28 -2.073 -4.367 10.765
258 HD23 LEU 28 HD23 LEU 28 -2.464 -6.076 10.773
259 H ARG 29 H ARG 29 -1.336 -8.222 6.210
260 HA ARG 29 HA ARG 29 -3.990 -8.019 5.249
261 HB2 ARG 29 HB2 ARG 29 -1.572 -8.230 4.058
262 HB3 ARG 29 HB3 ARG 29 -2.048 -9.917 3.921
263 HG2 ARG 29 HG2 ARG 29 -3.981 -9.377 2.597
264 HG3 ARG 29 HG3 ARG 29 -3.940 -7.682 3.096
265 HD2 ARG 29 HD2 ARG 29 -3.116 -7.511 0.970
266 HD3 ARG 29 HD3 ARG 29 -1.632 -7.551 1.903
267 HE ARG 29 HE ARG 29 -2.705 -9.591 0.073
268 HH11 ARG 29 HH22 ARG 29 -0.284 -9.044 2.527
269 HH12 ARG 29 HH21 ARG 29 0.699 -10.398 2.031
270 HH21 ARG 29 HH12 ARG 29 -1.437 -11.317 -0.551
271 HH22 ARG 29 HH11 ARG 29 0.005 -11.695 0.327
272 H HIS 30 H HIS 30 -2.168 -10.845 6.434
273 HA HIS 30 HA HIS 30 -4.142 -12.828 5.926
274 HB2 HIS 30 HB2 HIS 30 -1.704 -13.087 6.750
275 HB3 HIS 30 HB3 HIS 30 -2.330 -12.786 8.371
276 HD1 HIS 30 HD1 HIS 30 -1.958 -15.401 5.780
277 HD2 HIS 30 HD2 HIS 30 -4.339 -14.729 9.173
278 HE1 HIS 30 HE1 HIS 30 -2.983 -17.675 6.428
279 H TYR 31 H TYR 31 -3.797 -10.478 8.612
280 HA TYR 31 HA TYR 31 -5.938 -11.520 10.224
281 HB2 TYR 31 HB2 TYR 31 -4.261 -9.052 10.109
282 HB3 TYR 31 HB3 TYR 31 -5.881 -8.823 10.701
283 HD1 TYR 31 HD1 TYR 31 -3.535 -11.756 11.073
284 HD2 TYR 31 HD2 TYR 31 -5.523 -8.435 12.973
285 HE1 TYR 31 HE1 TYR 31 -2.680 -12.513 13.255
286 HE2 TYR 31 HE2 TYR 31 -4.667 -9.203 15.195
287 HH TYR 31 HH TYR 31 -2.312 -11.815 15.445
288 H LEU 32 H LEU 32 -5.823 -8.751 7.918
289 HA LEU 32 HA LEU 32 -8.528 -8.106 7.989
290 HB2 LEU 32 HB2 LEU 32 -6.988 -7.965 5.410
291 HB3 LEU 32 HB3 LEU 32 -8.312 -6.938 5.962
292 HG LEU 32 HG LEU 32 -5.443 -6.992 6.810
293 HD11 LEU 32 HD11 LEU 32 -6.952 -4.506 6.104
294 HD12 LEU 32 HD12 LEU 32 -5.222 -4.891 5.955
295 HD13 LEU 32 HD13 LEU 32 -6.386 -5.610 4.834
296 HD21 LEU 32 HD21 LEU 32 -7.546 -5.327 8.255
297 HD22 LEU 32 HD22 LEU 32 -6.769 -6.760 8.949
298 HD23 LEU 32 HD23 LEU 32 -5.791 -5.354 8.563
299 H ASN 33 H ASN 33 -7.152 -10.858 6.309
300 HA ASN 33 HA ASN 33 -9.208 -11.792 4.695
301 HB2 ASN 33 HB2 ASN 33 -6.991 -12.915 5.346
302 HB3 ASN 33 HB3 ASN 33 -7.827 -13.489 6.796
303 HD21 ASN 33 HD21 ASN 33 -8.946 -15.392 6.653
304 HD22 ASN 33 HD22 ASN 33 -9.394 -16.103 5.098
305 H LEU 34 H LEU 34 -9.175 -11.893 8.264
306 HA LEU 34 HA LEU 34 -12.120 -12.207 8.259
307 HB2 LEU 34 HB2 LEU 34 -12.245 -14.044 9.568
308 HB3 LEU 34 HB3 LEU 34 -10.926 -14.455 8.508
309 HG LEU 34 HG LEU 34 -9.819 -13.198 10.909
310 HD11 LEU 34 HD11 LEU 34 -10.582 -14.892 12.568
311 HD12 LEU 34 HD12 LEU 34 -11.908 -13.859 12.013
312 HD13 LEU 34 HD13 LEU 34 -11.750 -15.513 11.386
313 HD21 LEU 34 HD21 LEU 34 -8.617 -14.760 9.425
314 HD22 LEU 34 HD22 LEU 34 -8.607 -15.279 11.115
315 HD23 LEU 34 HD23 LEU 34 -9.692 -16.081 9.960
316 H VAL 35 H VAL 35 -9.912 -10.158 8.978
317 HA VAL 35 HA VAL 35 -10.877 -9.403 11.686
318 HB VAL 35 HB VAL 35 -8.468 -8.689 10.066
319 HG11 VAL 35 HG11 VAL 35 -7.738 -7.141 11.779
320 HG12 VAL 35 HG12 VAL 35 -9.056 -6.553 10.775
321 HG13 VAL 35 HG13 VAL 35 -9.402 -7.157 12.420
322 HG21 VAL 35 HG21 VAL 35 -7.860 -10.502 11.421
323 HG22 VAL 35 HG22 VAL 35 -7.579 -9.212 12.582
324 HG23 VAL 35 HG23 VAL 35 -9.070 -10.137 12.642
325 H THR 36 H THR 36 -11.336 -8.497 8.402
326 HA THR 36 HA THR 36 -12.654 -5.956 9.236
327 HB THR 36 HB THR 36 -13.017 -5.828 6.676
328 HG1 THR 36 HG1 THR 36 -12.110 -7.394 5.556
329 HG21 THR 36 HG21 THR 36 -10.171 -5.796 7.816
330 HG22 THR 36 HG22 THR 36 -10.731 -4.922 6.376
331 HG23 THR 36 HG23 THR 36 -11.344 -4.473 7.980
332 H ARG 37 H ARG 37 -13.447 -9.078 7.969
333 HA ARG 37 HA ARG 37 -16.260 -8.655 7.545
334 HB2 ARG 37 HB2 ARG 37 -14.676 -10.732 6.939
335 HB3 ARG 37 HB3 ARG 37 -15.261 -11.339 8.495
336 HG2 ARG 37 HG2 ARG 37 -17.660 -10.715 7.501
337 HG3 ARG 37 HG3 ARG 37 -16.795 -10.654 5.968
338 HD2 ARG 37 HD2 ARG 37 -15.942 -13.089 7.057
339 HD3 ARG 37 HD3 ARG 37 -17.582 -12.956 7.677
340 HE ARG 37 HE ARG 37 -18.444 -13.111 5.499
341 HH11 ARG 37 HH22 ARG 37 -14.951 -12.875 5.303
342 HH12 ARG 37 HH21 ARG 37 -14.912 -13.238 3.601
343 HH21 ARG 37 HH12 ARG 37 -18.324 -13.658 3.299
344 HH22 ARG 37 HH11 ARG 37 -16.793 -13.663 2.494
345 H GLN 38 H GLN 38 -14.538 -8.794 10.376
346 HA GLN 38 HA GLN 38 -16.987 -8.962 12.071
347 HB2 GLN 38 HB2 GLN 38 -14.476 -10.458 12.201
348 HB3 GLN 38 HB3 GLN 38 -14.724 -9.569 13.697
349 HG2 GLN 38 HG2 GLN 38 -16.988 -10.496 13.933
350 HG3 GLN 38 HG3 GLN 38 -16.817 -11.357 12.393
351 HE21 GLN 38 HE21 GLN 38 -17.511 -12.910 14.546
352 HE22 GLN 38 HE22 GLN 38 -16.063 -13.831 14.985
353 H ARG 39 H ARG 39 -15.485 -6.609 10.729
354 HA ARG 39 HA ARG 39 -14.994 -4.413 11.261
355 HB2 ARG 39 HB2 ARG 39 -17.119 -5.182 13.285
356 HB3 ARG 39 HB3 ARG 39 -16.362 -3.614 13.426
357 HG2 ARG 39 HG2 ARG 39 -18.272 -3.268 12.183
358 HG3 ARG 39 HG3 ARG 39 -16.921 -3.099 11.061
359 HD2 ARG 39 HD2 ARG 39 -17.532 -4.966 9.832
360 HD3 ARG 39 HD3 ARG 39 -18.091 -5.846 11.252
361 HE ARG 39 HE ARG 39 -20.210 -5.021 11.018
362 HH11 ARG 39 HH22 ARG 39 -18.177 -3.157 8.904
363 HH12 ARG 39 HH21 ARG 39 -19.502 -2.290 8.161
364 HH21 ARG 39 HH12 ARG 39 -21.914 -3.900 10.084
365 HH22 ARG 39 HH11 ARG 39 -21.607 -2.717 8.852
366 H TYR 40 H TYR 40 -13.052 -6.308 12.183
367 HA TYR 40 HA TYR 40 -11.353 -6.642 13.576
368 HB2 TYR 40 HB2 TYR 40 -11.266 -4.217 12.447
369 HB3 TYR 40 HB3 TYR 40 -11.240 -3.689 14.113
370 HD1 TYR 40 HD1 TYR 40 -9.418 -5.958 15.242
371 HD2 TYR 40 HD2 TYR 40 -9.209 -3.642 11.598
372 HE1 TYR 40 HE1 TYR 40 -6.997 -6.389 15.110
373 HE2 TYR 40 HE2 TYR 40 -6.757 -4.063 11.490
374 HH TYR 40 HH TYR 40 -5.149 -6.353 13.568
375 HN1 NH2 41 HN1 NH2 41 -14.116 -6.748 14.927
376 HN2 NH2 41 HN2 NH2 41 -13.676 -6.410 16.612
Start of MODEL 20
1 HA TYR 1 HA TYR 1 0.872 15.294 -13.802
2 HB2 TYR 1 HB2 TYR 1 -1.766 15.206 -13.963
3 HB3 TYR 1 HB3 TYR 1 -1.624 13.914 -12.780
4 HD1 TYR 1 HD1 TYR 1 -0.660 17.474 -13.486
5 HD2 TYR 1 HD2 TYR 1 -1.442 14.504 -10.436
6 HE1 TYR 1 HE1 TYR 1 -0.596 19.240 -11.734
7 HE2 TYR 1 HE2 TYR 1 -1.344 16.292 -8.697
8 HH TYR 1 HH TYR 1 -0.050 19.048 -8.845
9 H LEU 2 H LEU 2 0.885 14.534 -11.273
10 HA LEU 2 HA LEU 2 1.925 13.255 -9.741
11 HB2 LEU 2 HB2 LEU 2 -0.204 11.943 -10.427
12 HB3 LEU 2 HB3 LEU 2 0.904 10.801 -11.172
13 HG LEU 2 HG LEU 2 0.866 11.620 -8.224
14 HD11 LEU 2 HD11 LEU 2 -0.277 9.271 -9.767
15 HD12 LEU 2 HD12 LEU 2 0.203 9.076 -8.071
16 HD13 LEU 2 HD13 LEU 2 -1.029 10.268 -8.500
17 HD21 LEU 2 HD21 LEU 2 2.463 9.462 -9.631
18 HD22 LEU 2 HD22 LEU 2 3.120 10.950 -8.914
19 HD23 LEU 2 HD23 LEU 2 2.403 9.734 -7.866
20 H GLU 3 H GLU 3 3.880 14.092 -10.627
21 HA GLU 3 HA GLU 3 5.730 12.037 -11.795
22 HB2 GLU 3 HB2 GLU 3 5.223 14.892 -12.351
23 HB3 GLU 3 HB3 GLU 3 6.912 14.597 -12.023
24 HG2 GLU 3 HG2 GLU 3 5.364 12.843 -13.972
25 HG3 GLU 3 HG3 GLU 3 6.020 14.402 -14.460
26 H ARG 4 H ARG 4 6.026 14.971 -9.711
27 HA ARG 4 HA ARG 4 8.298 13.939 -8.366
28 HB2 ARG 4 HB2 ARG 4 7.026 16.430 -8.511
29 HB3 ARG 4 HB3 ARG 4 6.656 15.923 -6.880
30 HG2 ARG 4 HG2 ARG 4 8.666 17.047 -6.603
31 HG3 ARG 4 HG3 ARG 4 9.228 15.378 -6.674
32 HD2 ARG 4 HD2 ARG 4 9.054 17.133 -9.158
33 HD3 ARG 4 HD3 ARG 4 10.444 17.241 -8.073
34 HE ARG 4 HE ARG 4 10.364 14.574 -8.586
35 HH11 ARG 4 HH22 ARG 4 10.532 17.330 -10.753
36 HH12 ARG 4 HH21 ARG 4 11.279 16.418 -12.041
37 HH21 ARG 4 HH12 ARG 4 11.269 13.428 -10.321
38 HH22 ARG 4 HH11 ARG 4 11.694 14.299 -11.762
39 H GLU 5 H GLU 5 4.901 14.018 -7.351
40 HA GLU 5 HA GLU 5 5.150 12.916 -4.778
41 HB2 GLU 5 HB2 GLU 5 2.939 12.529 -6.833
42 HB3 GLU 5 HB3 GLU 5 2.837 12.046 -5.141
43 HG2 GLU 5 HG2 GLU 5 3.712 14.787 -5.152
44 HG3 GLU 5 HG3 GLU 5 2.429 14.668 -6.347
45 H LEU 6 H LEU 6 4.849 11.122 -7.908
46 HA LEU 6 HA LEU 6 5.050 8.503 -6.808
47 HB2 LEU 6 HB2 LEU 6 4.301 8.421 -8.932
48 HB3 LEU 6 HB3 LEU 6 5.264 9.792 -9.495
49 HG LEU 6 HG LEU 6 7.213 8.394 -9.711
50 HD11 LEU 6 HD11 LEU 6 7.489 6.479 -8.604
51 HD12 LEU 6 HD12 LEU 6 5.842 6.545 -7.968
52 HD13 LEU 6 HD13 LEU 6 6.166 5.711 -9.488
53 HD21 LEU 6 HD21 LEU 6 4.653 7.692 -11.105
54 HD22 LEU 6 HD22 LEU 6 6.144 8.419 -11.727
55 HD23 LEU 6 HD23 LEU 6 6.071 6.681 -11.437
56 H LYS 7 H LYS 7 7.547 10.775 -8.040
57 HA LYS 7 HA LYS 7 9.690 8.977 -7.545
58 HB2 LYS 7 HB2 LYS 7 9.519 11.353 -8.811
59 HB3 LYS 7 HB3 LYS 7 10.123 11.966 -7.275
60 HG2 LYS 7 HG2 LYS 7 11.643 9.585 -8.075
61 HG3 LYS 7 HG3 LYS 7 11.551 10.702 -9.432
62 HD2 LYS 7 HD2 LYS 7 12.626 12.442 -8.232
63 HD3 LYS 7 HD3 LYS 7 12.389 11.641 -6.663
64 HE2 LYS 7 HE2 LYS 7 14.116 10.219 -6.908
65 HE3 LYS 7 HE3 LYS 7 13.849 9.978 -8.634
66 HZ1 LYS 7 HZ1 LYS 7 15.080 11.849 -9.153
67 HZ2 LYS 7 HZ2 LYS 7 14.945 12.537 -7.666
68 HZ3 LYS 7 HZ3 LYS 7 15.938 11.249 -7.894
69 H LYS 8 H LYS 8 8.211 11.355 -5.393
70 HA LYS 8 HA LYS 8 9.895 10.754 -3.120
71 HB2 LYS 8 HB2 LYS 8 8.831 12.869 -3.136
72 HB3 LYS 8 HB3 LYS 8 7.254 12.195 -3.506
73 HG2 LYS 8 HG2 LYS 8 7.384 13.050 -1.206
74 HG3 LYS 8 HG3 LYS 8 6.977 11.345 -1.279
75 HD2 LYS 8 HD2 LYS 8 8.594 10.977 0.232
76 HD3 LYS 8 HD3 LYS 8 9.774 11.305 -1.031
77 HE2 LYS 8 HE2 LYS 8 9.642 13.756 -0.424
78 HE3 LYS 8 HE3 LYS 8 8.681 13.280 0.991
79 HZ1 LYS 8 HZ1 LYS 8 10.487 12.009 1.797
80 HZ2 LYS 8 HZ2 LYS 8 11.324 12.121 0.385
81 HZ3 LYS 8 HZ3 LYS 8 11.155 13.450 1.338
82 H LEU 9 H LEU 9 7.174 9.164 -4.473
83 HA LEU 9 HA LEU 9 6.523 7.558 -2.155
84 HB2 LEU 9 HB2 LEU 9 5.194 8.256 -4.443
85 HB3 LEU 9 HB3 LEU 9 5.723 6.686 -4.927
86 HG LEU 9 HG LEU 9 4.651 6.498 -2.226
87 HD11 LEU 9 HD11 LEU 9 3.001 8.152 -4.173
88 HD12 LEU 9 HD12 LEU 9 2.249 7.186 -2.892
89 HD13 LEU 9 HD13 LEU 9 3.392 8.477 -2.474
90 HD21 LEU 9 HD21 LEU 9 3.186 5.544 -4.683
91 HD22 LEU 9 HD22 LEU 9 4.713 4.778 -4.177
92 HD23 LEU 9 HD23 LEU 9 3.337 4.805 -3.072
93 H GLU 10 H GLU 10 8.104 6.796 -5.317
94 HA GLU 10 HA GLU 10 8.858 4.124 -4.695
95 HB2 GLU 10 HB2 GLU 10 8.976 5.366 -6.946
96 HB3 GLU 10 HB3 GLU 10 10.520 6.017 -6.370
97 HG2 GLU 10 HG2 GLU 10 11.262 3.603 -5.977
98 HG3 GLU 10 HG3 GLU 10 9.777 3.080 -6.773
99 H ARG 11 H ARG 11 10.373 7.205 -3.883
100 HA ARG 11 HA ARG 11 12.743 6.041 -2.634
101 HB2 ARG 11 HB2 ARG 11 11.569 8.776 -2.810
102 HB3 ARG 11 HB3 ARG 11 12.241 8.407 -1.232
103 HG2 ARG 11 HG2 ARG 11 14.079 9.274 -2.356
104 HG3 ARG 11 HG3 ARG 11 14.342 7.539 -2.429
105 HD2 ARG 11 HD2 ARG 11 12.782 8.295 -4.751
106 HD3 ARG 11 HD3 ARG 11 14.069 9.472 -4.570
107 HE ARG 11 HE ARG 11 15.678 7.837 -5.038
108 HH11 ARG 11 HH22 ARG 11 12.559 6.250 -4.893
109 HH12 ARG 11 HH21 ARG 11 13.071 4.941 -5.933
110 HH21 ARG 11 HH12 ARG 11 16.408 5.900 -5.964
111 HH22 ARG 11 HH11 ARG 11 15.223 4.674 -6.296
112 H GLU 12 H GLU 12 9.611 7.164 -1.210
113 HA GLU 12 HA GLU 12 10.165 6.573 1.429
114 HB2 GLU 12 HB2 GLU 12 7.940 7.428 0.100
115 HB3 GLU 12 HB3 GLU 12 7.455 5.782 0.510
116 HG2 GLU 12 HG2 GLU 12 8.445 6.493 2.915
117 HG3 GLU 12 HG3 GLU 12 8.128 8.115 2.306
118 H LEU 13 H LEU 13 9.228 4.261 -1.075
119 HA LEU 13 HA LEU 13 8.966 1.950 0.580
120 HB2 LEU 13 HB2 LEU 13 9.779 2.287 -2.328
121 HB3 LEU 13 HB3 LEU 13 9.447 0.719 -1.613
122 HG LEU 13 HG LEU 13 7.302 2.801 -1.293
123 HD11 LEU 13 HD11 LEU 13 7.247 3.323 -3.461
124 HD12 LEU 13 HD12 LEU 13 8.289 1.966 -3.958
125 HD13 LEU 13 HD13 LEU 13 6.549 1.736 -3.716
126 HD21 LEU 13 HD21 LEU 13 5.896 1.034 -1.113
127 HD22 LEU 13 HD22 LEU 13 6.772 0.028 -2.292
128 HD23 LEU 13 HD23 LEU 13 7.389 0.187 -0.659
129 H LYS 14 H LYS 14 11.755 2.609 -1.567
130 HA LYS 14 HA LYS 14 13.539 0.787 -0.271
131 HB2 LYS 14 HB2 LYS 14 13.910 1.518 -2.529
132 HB3 LYS 14 HB3 LYS 14 14.032 3.202 -2.048
133 HG2 LYS 14 HG2 LYS 14 16.043 1.483 -0.683
134 HG3 LYS 14 HG3 LYS 14 16.145 1.369 -2.417
135 HD2 LYS 14 HD2 LYS 14 16.524 3.686 -2.712
136 HD3 LYS 14 HD3 LYS 14 16.025 4.087 -1.055
137 HE2 LYS 14 HE2 LYS 14 17.973 3.139 -0.096
138 HE3 LYS 14 HE3 LYS 14 18.400 2.273 -1.577
139 HZ1 LYS 14 HZ1 LYS 14 18.481 5.220 -1.286
140 HZ2 LYS 14 HZ2 LYS 14 19.786 4.225 -1.262
141 HZ3 LYS 14 HZ3 LYS 14 18.926 4.378 -2.632
142 H LYS 15 H LYS 15 12.684 4.050 0.625
143 HA LYS 15 HA LYS 15 14.749 4.898 2.288
144 HB2 LYS 15 HB2 LYS 15 11.971 5.531 1.965
145 HB3 LYS 15 HB3 LYS 15 12.175 5.234 3.658
146 HG2 LYS 15 HG2 LYS 15 12.746 7.401 3.760
147 HG3 LYS 15 HG3 LYS 15 14.334 6.835 3.261
148 HD2 LYS 15 HD2 LYS 15 13.028 7.145 0.812
149 HD3 LYS 15 HD3 LYS 15 12.250 8.386 1.779
150 HE2 LYS 15 HE2 LYS 15 14.096 9.363 0.619
151 HE3 LYS 15 HE3 LYS 15 14.571 9.275 2.324
152 HZ1 LYS 15 HZ1 LYS 15 16.086 7.650 1.865
153 HZ2 LYS 15 HZ2 LYS 15 15.247 7.028 0.593
154 HZ3 LYS 15 HZ3 LYS 15 16.127 8.425 0.416
155 H LEU 16 H LEU 16 12.356 2.437 2.994
156 HA LEU 16 HA LEU 16 13.992 1.507 5.285
157 HB2 LEU 16 HB2 LEU 16 11.794 0.695 6.296
158 HB3 LEU 16 HB3 LEU 16 12.206 2.364 6.460
159 HG LEU 16 HG LEU 16 10.570 1.794 4.031
160 HD11 LEU 16 HD11 LEU 16 9.558 0.112 5.368
161 HD12 LEU 16 HD12 LEU 16 9.407 1.201 6.765
162 HD13 LEU 16 HD13 LEU 16 8.451 1.494 5.290
163 HD21 LEU 16 HD21 LEU 16 10.457 4.028 4.388
164 HD22 LEU 16 HD22 LEU 16 9.164 3.643 5.510
165 HD23 LEU 16 HD23 LEU 16 10.801 3.923 6.118
166 H SER 17 H SER 17 14.426 0.709 2.693
167 HA SER 17 HA SER 17 14.794 -1.107 1.437
168 HB2 SER 17 HB2 SER 17 14.550 -2.287 4.132
169 HB3 SER 17 HB3 SER 17 14.349 -3.427 2.801
170 HG SER 17 HG SER 17 16.525 -3.170 3.421
171 HA PRO 18 HA PRO 18 10.898 -2.155 -0.341
172 HB2 PRO 18 HB2 PRO 18 11.682 -3.916 -2.330
173 HB3 PRO 18 HB3 PRO 18 11.842 -2.140 -2.412
174 HG2 PRO 18 HG2 PRO 18 13.964 -4.186 -1.903
175 HG3 PRO 18 HG3 PRO 18 14.097 -2.573 -2.662
176 HD2 PRO 18 HD2 PRO 18 14.767 -3.253 0.005
177 HD3 PRO 18 HD3 PRO 18 14.595 -1.601 -0.652
178 H GLU 19 H GLU 19 13.071 -4.842 0.583
179 HA GLU 19 HA GLU 19 10.894 -6.777 0.754
180 HB2 GLU 19 HB2 GLU 19 13.484 -7.137 0.297
181 HB3 GLU 19 HB3 GLU 19 13.585 -7.155 2.060
182 HG2 GLU 19 HG2 GLU 19 11.507 -8.890 1.722
183 HG3 GLU 19 HG3 GLU 19 12.243 -9.070 0.142
184 H GLU 20 H GLU 20 11.848 -4.244 2.791
185 HA GLU 20 HA GLU 20 11.139 -5.552 5.361
186 HB2 GLU 20 HB2 GLU 20 12.636 -3.266 4.468
187 HB3 GLU 20 HB3 GLU 20 11.359 -2.712 5.547
188 HG2 GLU 20 HG2 GLU 20 13.099 -5.012 6.416
189 HG3 GLU 20 HG3 GLU 20 13.808 -3.404 6.368
190 H LEU 21 H LEU 21 9.823 -3.112 3.019
191 HA LEU 21 HA LEU 21 7.553 -2.564 4.634
192 HB2 LEU 21 HB2 LEU 21 8.553 -1.748 2.046
193 HB3 LEU 21 HB3 LEU 21 6.900 -2.281 1.835
194 HG LEU 21 HG LEU 21 7.910 -0.132 3.731
195 HD11 LEU 21 HD11 LEU 21 6.443 1.327 2.342
196 HD12 LEU 21 HD12 LEU 21 7.754 0.544 1.458
197 HD13 LEU 21 HD13 LEU 21 6.091 -0.078 1.305
198 HD21 LEU 21 HD21 LEU 21 5.443 0.333 4.177
199 HD22 LEU 21 HD22 LEU 21 5.102 -1.286 3.517
200 HD23 LEU 21 HD23 LEU 21 6.096 -1.086 4.981
201 H ASN 22 H ASN 22 7.952 -4.830 1.878
202 HA ASN 22 HA ASN 22 5.401 -6.005 1.897
203 HB2 ASN 22 HB2 ASN 22 7.357 -6.419 0.304
204 HB3 ASN 22 HB3 ASN 22 7.955 -7.591 1.474
205 HD21 ASN 22 HD21 ASN 22 5.953 -9.206 2.246
206 HD22 ASN 22 HD22 ASN 22 5.123 -9.816 0.811
207 H ARG 23 H ARG 23 8.146 -6.649 4.047
208 HA ARG 23 HA ARG 23 7.115 -8.925 5.425
209 HB2 ARG 23 HB2 ARG 23 9.479 -7.829 5.582
210 HB3 ARG 23 HB3 ARG 23 8.759 -6.715 6.728
211 HG2 ARG 23 HG2 ARG 23 9.591 -8.304 8.140
212 HG3 ARG 23 HG3 ARG 23 7.914 -8.824 8.006
213 HD2 ARG 23 HD2 ARG 23 9.608 -9.991 5.878
214 HD3 ARG 23 HD3 ARG 23 10.262 -10.298 7.489
215 HE ARG 23 HE ARG 23 7.394 -10.875 7.181
216 HH11 ARG 23 HH22 ARG 23 10.596 -12.208 6.902
217 HH12 ARG 23 HH21 ARG 23 10.087 -13.864 7.101
218 HH21 ARG 23 HH12 ARG 23 6.728 -13.033 7.476
219 HH22 ARG 23 HH11 ARG 23 7.910 -14.304 7.341
220 H TYR 24 H TYR 24 6.959 -5.493 6.376
221 HA TYR 24 HA TYR 24 5.070 -5.813 8.519
222 HB2 TYR 24 HB2 TYR 24 6.220 -3.538 6.909
223 HB3 TYR 24 HB3 TYR 24 4.759 -3.244 7.828
224 HD1 TYR 24 HD2 TYR 24 8.039 -5.068 8.498
225 HD2 TYR 24 HD1 TYR 24 5.112 -2.193 9.848
226 HE1 TYR 24 HE2 TYR 24 9.288 -4.790 10.622
227 HE2 TYR 24 HE1 TYR 24 6.362 -1.906 11.955
228 HH TYR 24 HH TYR 24 8.131 -2.553 13.160
229 H TYR 25 H TYR 25 4.669 -5.570 5.096
230 HA TYR 25 HA TYR 25 1.895 -4.923 4.987
231 HB2 TYR 25 HB2 TYR 25 3.871 -5.178 3.155
232 HB3 TYR 25 HB3 TYR 25 3.127 -6.749 2.924
233 HD1 TYR 25 HD2 TYR 25 2.246 -3.124 3.253
234 HD2 TYR 25 HD1 TYR 25 1.517 -6.868 1.242
235 HE1 TYR 25 HE2 TYR 25 0.734 -1.961 1.663
236 HE2 TYR 25 HE1 TYR 25 0.024 -5.703 -0.379
237 HH TYR 25 HH TYR 25 -0.382 -2.194 -0.383
238 H ALA 26 H ALA 26 3.543 -8.154 5.026
239 HA ALA 26 HA ALA 26 1.099 -9.658 4.887
240 HB1 ALA 26 HB1 ALA 26 3.766 -10.412 6.169
241 HB2 ALA 26 HB2 ALA 26 2.460 -11.533 5.719
242 HB3 ALA 26 HB3 ALA 26 3.327 -10.633 4.458
243 H SER 27 H SER 27 2.977 -8.472 7.731
244 HA SER 27 HA SER 27 1.171 -9.405 9.732
245 HB2 SER 27 HB2 SER 27 3.130 -7.082 9.672
246 HB3 SER 27 HB3 SER 27 2.245 -7.581 11.123
247 HG SER 27 HG SER 27 3.462 -9.299 11.305
248 H LEU 28 H LEU 28 0.603 -6.997 7.407
249 HA LEU 28 HA LEU 28 -1.611 -5.806 9.007
250 HB2 LEU 28 HB2 LEU 28 0.026 -4.879 6.631
251 HB3 LEU 28 HB3 LEU 28 -1.566 -4.207 6.921
252 HG LEU 28 HG LEU 28 0.679 -4.177 8.988
253 HD11 LEU 28 HD11 LEU 28 1.547 -2.756 7.405
254 HD12 LEU 28 HD12 LEU 28 -0.039 -2.276 6.762
255 HD13 LEU 28 HD13 LEU 28 0.541 -1.610 8.301
256 HD21 LEU 28 HD21 LEU 28 -0.738 -2.392 10.040
257 HD22 LEU 28 HD22 LEU 28 -2.016 -2.743 8.854
258 HD23 LEU 28 HD23 LEU 28 -1.517 -3.964 10.045
259 H ARG 29 H ARG 29 -0.928 -7.444 5.899
260 HA ARG 29 HA ARG 29 -3.668 -7.534 5.047
261 HB2 ARG 29 HB2 ARG 29 -1.306 -8.114 3.818
262 HB3 ARG 29 HB3 ARG 29 -1.747 -9.738 4.302
263 HG2 ARG 29 HG2 ARG 29 -2.719 -9.607 2.204
264 HG3 ARG 29 HG3 ARG 29 -4.102 -9.167 3.217
265 HD2 ARG 29 HD2 ARG 29 -3.822 -6.817 2.719
266 HD3 ARG 29 HD3 ARG 29 -2.203 -7.095 2.054
267 HE ARG 29 HE ARG 29 -4.350 -8.494 0.644
268 HH11 ARG 29 HH22 ARG 29 -2.425 -5.564 0.685
269 HH12 ARG 29 HH21 ARG 29 -2.706 -5.225 -0.998
270 HH21 ARG 29 HH12 ARG 29 -4.611 -8.061 -1.567
271 HH22 ARG 29 HH11 ARG 29 -3.830 -6.696 -2.264
272 H HIS 30 H HIS 30 -1.684 -9.831 6.944
273 HA HIS 30 HA HIS 30 -3.617 -11.899 7.099
274 HB2 HIS 30 HB2 HIS 30 -1.101 -11.821 7.816
275 HB3 HIS 30 HB3 HIS 30 -1.710 -11.262 9.365
276 HD1 HIS 30 HD1 HIS 30 -0.257 -13.833 9.579
277 HD2 HIS 30 HD2 HIS 30 -4.261 -13.720 8.313
278 HE1 HIS 30 HE1 HIS 30 -1.209 -16.197 9.909
279 H TYR 31 H TYR 31 -3.307 -8.862 8.941
280 HA TYR 31 HA TYR 31 -5.353 -9.449 10.862
281 HB2 TYR 31 HB2 TYR 31 -3.978 -6.992 9.804
282 HB3 TYR 31 HB3 TYR 31 -5.513 -6.776 10.565
283 HD1 TYR 31 HD1 TYR 31 -5.455 -8.661 12.874
284 HD2 TYR 31 HD2 TYR 31 -2.353 -6.166 11.197
285 HE1 TYR 31 HE1 TYR 31 -4.283 -8.654 15.049
286 HE2 TYR 31 HE2 TYR 31 -1.171 -6.178 13.363
287 HH TYR 31 HH TYR 31 -1.051 -7.436 15.376
288 H LEU 32 H LEU 32 -5.480 -7.564 7.760
289 HA LEU 32 HA LEU 32 -8.253 -7.176 7.815
290 HB2 LEU 32 HB2 LEU 32 -6.822 -7.638 5.205
291 HB3 LEU 32 HB3 LEU 32 -8.202 -6.598 5.545
292 HG LEU 32 HG LEU 32 -5.303 -6.183 6.203
293 HD11 LEU 32 HD11 LEU 32 -5.409 -4.282 4.852
294 HD12 LEU 32 HD12 LEU 32 -6.236 -5.571 3.962
295 HD13 LEU 32 HD13 LEU 32 -7.190 -4.313 4.790
296 HD21 LEU 32 HD21 LEU 32 -7.651 -4.910 7.585
297 HD22 LEU 32 HD22 LEU 32 -6.019 -5.259 8.191
298 HD23 LEU 32 HD23 LEU 32 -6.288 -3.862 7.155
299 H ASN 33 H ASN 33 -6.642 -10.134 7.004
300 HA ASN 33 HA ASN 33 -8.647 -11.656 5.762
301 HB2 ASN 33 HB2 ASN 33 -6.177 -12.140 6.661
302 HB3 ASN 33 HB3 ASN 33 -7.027 -12.766 8.066
303 HD21 ASN 33 HD21 ASN 33 -5.328 -14.281 6.198
304 HD22 ASN 33 HD22 ASN 33 -6.452 -15.417 5.456
305 H LEU 34 H LEU 34 -8.446 -10.649 9.161
306 HA LEU 34 HA LEU 34 -11.256 -11.492 9.650
307 HB2 LEU 34 HB2 LEU 34 -9.568 -11.857 11.997
308 HB3 LEU 34 HB3 LEU 34 -10.797 -12.903 11.328
309 HG LEU 34 HG LEU 34 -7.953 -12.783 10.252
310 HD11 LEU 34 HD11 LEU 34 -8.668 -15.079 11.990
311 HD12 LEU 34 HD12 LEU 34 -7.138 -14.217 11.724
312 HD13 LEU 34 HD13 LEU 34 -8.368 -13.535 12.788
313 HD21 LEU 34 HD21 LEU 34 -10.336 -14.219 9.391
314 HD22 LEU 34 HD22 LEU 34 -8.740 -14.186 8.662
315 HD23 LEU 34 HD23 LEU 34 -9.096 -15.384 9.886
316 H VAL 35 H VAL 35 -9.247 -8.935 9.568
317 HA VAL 35 HA VAL 35 -10.449 -7.430 11.813
318 HB VAL 35 HB VAL 35 -8.123 -6.921 9.990
319 HG11 VAL 35 HG11 VAL 35 -9.067 -4.740 10.062
320 HG12 VAL 35 HG12 VAL 35 -9.230 -4.822 11.837
321 HG13 VAL 35 HG13 VAL 35 -7.625 -4.797 11.059
322 HG21 VAL 35 HG21 VAL 35 -7.377 -8.178 11.798
323 HG22 VAL 35 HG22 VAL 35 -7.109 -6.549 12.428
324 HG23 VAL 35 HG23 VAL 35 -8.530 -7.479 12.928
325 H THR 36 H THR 36 -10.962 -7.785 8.428
326 HA THR 36 HA THR 36 -12.762 -5.410 8.558
327 HB THR 36 HB THR 36 -12.866 -5.613 6.093
328 HG1 THR 36 HG1 THR 36 -10.583 -6.830 5.678
329 HG21 THR 36 HG21 THR 36 -11.203 -4.115 7.520
330 HG22 THR 36 HG22 THR 36 -9.966 -5.164 6.809
331 HG23 THR 36 HG23 THR 36 -11.052 -4.213 5.763
332 H ARG 37 H ARG 37 -12.689 -8.768 7.655
333 HA ARG 37 HA ARG 37 -15.472 -9.141 7.116
334 HB2 ARG 37 HB2 ARG 37 -13.353 -11.043 8.202
335 HB3 ARG 37 HB3 ARG 37 -15.018 -11.558 7.891
336 HG2 ARG 37 HG2 ARG 37 -14.849 -10.806 5.552
337 HG3 ARG 37 HG3 ARG 37 -13.153 -10.351 5.799
338 HD2 ARG 37 HD2 ARG 37 -12.472 -12.601 6.122
339 HD3 ARG 37 HD3 ARG 37 -14.107 -13.167 6.438
340 HE ARG 37 HE ARG 37 -12.832 -12.763 3.849
341 HH11 ARG 37 HH22 ARG 37 -15.914 -13.119 5.434
342 HH12 ARG 37 HH21 ARG 37 -16.775 -13.574 3.983
343 HH21 ARG 37 HH12 ARG 37 -13.936 -13.383 1.989
344 HH22 ARG 37 HH11 ARG 37 -15.658 -13.674 2.066
345 H GLN 38 H GLN 38 -14.116 -8.350 10.033
346 HA GLN 38 HA GLN 38 -16.735 -8.668 11.389
347 HB2 GLN 38 HB2 GLN 38 -14.533 -10.292 11.984
348 HB3 GLN 38 HB3 GLN 38 -14.407 -9.021 13.196
349 HG2 GLN 38 HG2 GLN 38 -16.867 -9.455 13.747
350 HG3 GLN 38 HG3 GLN 38 -16.801 -10.823 12.629
351 HE21 GLN 38 HE21 GLN 38 -15.598 -12.752 13.265
352 HE22 GLN 38 HE22 GLN 38 -15.064 -12.902 14.939
353 H ARG 39 H ARG 39 -14.903 -6.394 10.217
354 HA ARG 39 HA ARG 39 -15.754 -4.361 12.054
355 HB2 ARG 39 HB2 ARG 39 -13.555 -5.552 13.111
356 HB3 ARG 39 HB3 ARG 39 -12.750 -4.370 12.099
357 HG2 ARG 39 HG2 ARG 39 -14.082 -2.564 13.090
358 HG3 ARG 39 HG3 ARG 39 -14.850 -3.744 14.178
359 HD2 ARG 39 HD2 ARG 39 -12.725 -4.317 15.189
360 HD3 ARG 39 HD3 ARG 39 -11.821 -3.384 13.996
361 HE ARG 39 HE ARG 39 -13.248 -2.373 16.337
362 HH11 ARG 39 HH22 ARG 39 -11.930 -1.415 13.221
363 HH12 ARG 39 HH21 ARG 39 -11.987 0.292 13.602
364 HH21 ARG 39 HH12 ARG 39 -13.254 -0.149 16.771
365 HH22 ARG 39 HH11 ARG 39 -12.698 0.961 15.547
366 H TYR 40 H TYR 40 -16.539 -4.095 9.788
367 HA TYR 40 HA TYR 40 -15.019 -1.973 8.446
368 HB2 TYR 40 HB2 TYR 40 -14.056 -4.088 7.550
369 HB3 TYR 40 HB3 TYR 40 -15.654 -4.557 6.972
370 HD1 TYR 40 HD1 TYR 40 -13.625 -1.372 6.781
371 HD2 TYR 40 HD2 TYR 40 -15.588 -4.567 4.644
372 HE1 TYR 40 HE1 TYR 40 -13.168 -0.216 4.649
373 HE2 TYR 40 HE2 TYR 40 -15.075 -3.419 2.480
374 HH TYR 40 HH TYR 40 -13.835 -0.130 2.447
375 HN1 NH2 41 HN1 NH2 41 -17.973 -4.128 8.209
376 HN2 NH2 41 HN2 NH2 41 -18.926 -2.817 7.519