Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
634581 | 6bzj RC | 30389 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HT1 GLY 1 3.911 13.308 71.550
2 H2 GLY 1 HT2 GLY 1 2.352 13.644 72.136
3 H3 GLY 1 HT3 GLY 1 3.480 14.901 71.946
4 HA2 GLY 1 HA2 GLY 1 2.278 15.226 70.062
5 HA3 GLY 1 HA1 GLY 1 3.475 14.072 69.470
6 H SER 2 HN SER 2 0.150 14.568 70.336
7 HA SER 2 HA SER 2 -0.628 12.172 68.891
8 HB2 SER 2 HB2 SER 2 -1.888 11.182 70.711
9 HB3 SER 2 HB1 SER 2 -0.209 11.356 71.210
10 HG SER 2 HG SER 2 -1.607 13.596 71.749
11 H ALA 3 HN ALA 3 -3.000 12.039 68.645
12 HA ALA 3 HA ALA 3 -5.025 12.971 68.097
13 HB1 ALA 3 HB1 ALA 3 -4.885 13.555 70.597
14 HB2 ALA 3 HB2 ALA 3 -6.000 14.498 69.606
15 HB3 ALA 3 HB3 ALA 3 -4.437 15.177 70.066
16 H GLY 4 HN GLY 4 -2.535 13.791 66.726
17 HA2 GLY 4 HA2 GLY 4 -2.103 15.160 64.911
18 HA3 GLY 4 HA1 GLY 4 -3.652 15.947 65.186
19 H LEU 5 HN LEU 5 -1.569 15.746 67.908
20 HA LEU 5 HA LEU 5 -1.456 18.532 68.278
21 HB2 LEU 5 HB2 LEU 5 -1.181 16.941 70.124
22 HB3 LEU 5 HB1 LEU 5 0.329 16.369 69.423
23 HG LEU 5 HG LEU 5 1.314 18.623 69.694
24 HD11 LEU 5 HD11 LEU 5 -0.104 20.160 71.292
25 HD12 LEU 5 HD12 LEU 5 -1.475 19.248 70.659
26 HD13 LEU 5 HD13 LEU 5 -0.445 20.171 69.563
27 HD21 LEU 5 HD21 LEU 5 1.592 17.006 71.502
28 HD22 LEU 5 HD22 LEU 5 0.034 17.466 72.189
29 HD23 LEU 5 HD23 LEU 5 1.372 18.615 72.189
30 H GLN 6 HN GLN 6 0.931 16.252 66.959
31 HA GLN 6 HA GLN 6 2.880 18.312 66.456
32 HB2 GLN 6 HB2 GLN 6 2.673 15.417 65.615
33 HB3 GLN 6 HB1 GLN 6 4.016 16.462 65.159
34 HG2 GLN 6 HG2 GLN 6 4.610 16.831 67.471
35 HG3 GLN 6 HG1 GLN 6 3.157 15.998 68.026
36 HE21 GLN 6 HE21 GLN 6 6.012 15.271 68.575
37 HE22 GLN 6 HE22 GLN 6 6.199 13.691 67.983
38 H GLU 7 HN GLU 7 3.435 19.230 64.494
39 HA GLU 7 HA GLU 7 1.329 19.669 62.650
40 HB2 GLU 7 HB2 GLU 7 2.987 20.925 61.346
41 HB3 GLU 7 HB1 GLU 7 3.055 21.355 63.051
42 HG2 GLU 7 HG2 GLU 7 4.877 19.164 62.073
43 HG3 GLU 7 HG1 GLU 7 5.283 20.825 61.672
44 H LYS 8 HN LYS 8 3.713 17.218 62.887
45 HA LYS 8 HA LYS 8 3.788 16.509 60.102
46 HB2 LYS 8 HB2 LYS 8 4.613 15.027 62.606
47 HB3 LYS 8 HB1 LYS 8 4.833 14.387 60.979
48 HG2 LYS 8 HG2 LYS 8 6.184 16.372 60.382
49 HG3 LYS 8 HG1 LYS 8 5.979 17.000 62.016
50 HD2 LYS 8 HD2 LYS 8 7.113 15.032 62.941
51 HD3 LYS 8 HD1 LYS 8 7.283 14.352 61.323
52 HE2 LYS 8 HE2 LYS 8 9.371 15.449 61.986
53 HE3 LYS 8 HE1 LYS 8 8.625 16.333 60.653
54 HZ1 LYS 8 HZ1 LYS 8 8.787 18.107 61.960
55 HZ2 LYS 8 HZ2 LYS 8 9.138 17.178 63.339
56 HZ3 LYS 8 HZ3 LYS 8 7.525 17.445 62.880
57 H GLU 9 HN GLU 9 2.667 14.913 59.030
58 HA GLU 9 HA GLU 9 0.576 13.440 60.504
59 HB2 GLU 9 HB2 GLU 9 0.144 15.181 58.064
60 HB3 GLU 9 HB1 GLU 9 -1.011 13.961 58.602
61 HG2 GLU 9 HG2 GLU 9 -1.255 15.072 60.754
62 HG3 GLU 9 HG1 GLU 9 0.006 16.230 60.336
63 H ARG 10 HN ARG 10 -0.636 12.103 58.460
64 HA ARG 10 HA ARG 10 1.227 10.093 57.796
65 HB2 ARG 10 HB2 ARG 10 -1.538 10.708 56.744
66 HB3 ARG 10 HB1 ARG 10 -0.623 9.271 56.287
67 HG2 ARG 10 HG2 ARG 10 -0.531 8.520 58.587
68 HG3 ARG 10 HG1 ARG 10 -1.249 10.028 59.154
69 HD2 ARG 10 HD2 ARG 10 -2.628 8.103 57.266
70 HD3 ARG 10 HD1 ARG 10 -2.882 8.123 59.008
71 HE ARG 10 HE ARG 10 -3.315 10.726 58.071
72 HH11 ARG 10 HH11 ARG 10 -5.434 11.447 57.683
73 HH12 ARG 10 HH12 ARG 10 -6.698 10.294 57.408
74 HH21 ARG 10 HH21 ARG 10 -4.618 7.539 57.731
75 HH22 ARG 10 HH22 ARG 10 -6.236 8.081 57.434
76 H GLU 11 HN GLU 11 -0.057 12.832 55.971
77 HA GLU 11 HA GLU 11 0.870 12.166 53.427
78 HB2 GLU 11 HB2 GLU 11 0.649 14.484 52.861
79 HB3 GLU 11 HB1 GLU 11 -0.626 14.112 54.019
80 HG2 GLU 11 HG2 GLU 11 0.882 15.002 55.844
81 HG3 GLU 11 HG1 GLU 11 1.998 15.528 54.586
82 H LEU 12 HN LEU 12 2.651 13.028 56.231
83 HA LEU 12 HA LEU 12 4.938 14.196 55.081
84 HB2 LEU 12 HB2 LEU 12 4.529 14.199 57.500
85 HB3 LEU 12 HB1 LEU 12 4.707 12.447 57.546
86 HG LEU 12 HG LEU 12 7.050 12.665 56.771
87 HD11 LEU 12 HD11 LEU 12 7.179 14.617 55.479
88 HD12 LEU 12 HD12 LEU 12 7.956 15.127 56.976
89 HD13 LEU 12 HD13 LEU 12 6.281 15.578 56.656
90 HD21 LEU 12 HD21 LEU 12 6.327 14.372 59.170
91 HD22 LEU 12 HD22 LEU 12 7.938 13.736 58.838
92 HD23 LEU 12 HD23 LEU 12 6.605 12.632 59.175
93 H GLU 13 HN GLU 13 4.108 10.803 55.721
94 HA GLU 13 HA GLU 13 6.553 9.692 54.827
95 HB2 GLU 13 HB2 GLU 13 3.767 8.545 55.025
96 HB3 GLU 13 HB1 GLU 13 5.157 7.593 54.508
97 HG2 GLU 13 HG2 GLU 13 6.286 7.973 56.611
98 HG3 GLU 13 HG1 GLU 13 5.055 9.122 57.126
99 H ASP 14 HN ASP 14 3.540 10.492 53.159
100 HA ASP 14 HA ASP 14 4.142 9.301 50.677
101 HB2 ASP 14 HB2 ASP 14 2.410 11.662 51.419
102 HB3 ASP 14 HB1 ASP 14 2.514 11.029 49.776
103 H LEU 15 HN LEU 15 4.886 12.496 52.002
104 HA LEU 15 HA LEU 15 5.929 13.651 49.658
105 HB2 LEU 15 HB2 LEU 15 5.377 14.970 51.652
106 HB3 LEU 15 HB1 LEU 15 6.662 14.169 52.551
107 HG LEU 15 HG LEU 15 8.340 15.100 50.986
108 HD11 LEU 15 HD11 LEU 15 5.855 16.137 49.628
109 HD12 LEU 15 HD12 LEU 15 7.279 15.380 48.913
110 HD13 LEU 15 HD13 LEU 15 7.366 17.038 49.495
111 HD21 LEU 15 HD21 LEU 15 6.475 17.253 52.024
112 HD22 LEU 15 HD22 LEU 15 8.215 17.391 51.768
113 HD23 LEU 15 HD23 LEU 15 7.589 16.342 53.043
114 H LYS 16 HN LYS 16 7.486 11.801 52.258
115 HA LYS 16 HA LYS 16 10.132 12.000 51.301
116 HB2 LYS 16 HB2 LYS 16 8.759 9.907 52.996
117 HB3 LYS 16 HB1 LYS 16 10.494 9.904 52.667
118 HG2 LYS 16 HG2 LYS 16 10.686 12.165 53.636
119 HG3 LYS 16 HG1 LYS 16 8.953 12.169 53.971
120 HD2 LYS 16 HD2 LYS 16 9.234 10.189 55.425
121 HD3 LYS 16 HD1 LYS 16 10.968 10.211 55.110
122 HE2 LYS 16 HE2 LYS 16 9.407 12.482 56.373
123 HE3 LYS 16 HE1 LYS 16 10.402 11.326 57.258
124 HZ1 LYS 16 HZ1 LYS 16 11.624 13.352 56.802
125 HZ2 LYS 16 HZ2 LYS 16 11.356 13.170 55.134
126 HZ3 LYS 16 HZ3 LYS 16 12.318 12.046 55.971
127 H ASP 17 HN ASP 17 7.538 9.691 50.630
128 HA ASP 17 HA ASP 17 9.043 7.835 49.137
129 HB2 ASP 17 HB2 ASP 17 6.121 8.595 49.059
130 HB3 ASP 17 HB1 ASP 17 6.795 7.286 48.091
131 H ALA 18 HN ALA 18 7.365 10.808 48.203
132 HA ALA 18 HA ALA 18 7.648 10.555 45.412
133 HB1 ALA 18 HB1 ALA 18 6.200 12.227 46.605
134 HB2 ALA 18 HB2 ALA 18 7.180 12.916 45.310
135 HB3 ALA 18 HB3 ALA 18 7.663 13.134 46.993
136 H GLU 19 HN GLU 19 9.783 11.916 47.885
137 HA GLU 19 HA GLU 19 11.717 13.011 46.144
138 HB2 GLU 19 HB2 GLU 19 11.905 11.990 48.983
139 HB3 GLU 19 HB1 GLU 19 13.244 12.782 48.149
140 HG2 GLU 19 HG2 GLU 19 11.935 14.799 47.839
141 HG3 GLU 19 HG1 GLU 19 10.495 14.011 48.484
142 H LEU 20 HN LEU 20 11.348 9.792 47.564
143 HA LEU 20 HA LEU 20 13.823 8.724 46.755
144 HB2 LEU 20 HB2 LEU 20 12.367 7.612 48.388
145 HB3 LEU 20 HB1 LEU 20 11.157 7.333 47.139
146 HG LEU 20 HG LEU 20 12.770 5.928 45.890
147 HD11 LEU 20 HD11 LEU 20 14.919 6.716 46.398
148 HD12 LEU 20 HD12 LEU 20 14.849 5.236 47.349
149 HD13 LEU 20 HD13 LEU 20 14.593 6.797 48.130
150 HD21 LEU 20 HD21 LEU 20 12.845 4.054 47.524
151 HD22 LEU 20 HD22 LEU 20 11.278 4.863 47.515
152 HD23 LEU 20 HD23 LEU 20 12.430 5.185 48.812
153 H LYS 21 HN LYS 21 10.662 8.799 45.140
154 HA LYS 21 HA LYS 21 11.363 7.288 42.873
155 HB2 LYS 21 HB2 LYS 21 9.037 7.857 43.469
156 HB3 LYS 21 HB1 LYS 21 9.358 9.549 43.092
157 HG2 LYS 21 HG2 LYS 21 9.860 8.956 40.759
158 HG3 LYS 21 HG1 LYS 21 9.603 7.249 41.127
159 HD2 LYS 21 HD2 LYS 21 7.263 7.746 41.758
160 HD3 LYS 21 HD1 LYS 21 7.523 9.445 41.359
161 HE2 LYS 21 HE2 LYS 21 7.844 7.144 39.410
162 HE3 LYS 21 HE1 LYS 21 6.435 8.200 39.499
163 HZ1 LYS 21 HZ1 LYS 21 8.654 8.646 38.002
164 HZ2 LYS 21 HZ2 LYS 21 8.911 9.639 39.356
165 HZ3 LYS 21 HZ3 LYS 21 7.501 9.813 38.426
166 H ARG 22 HN ARG 22 11.525 10.782 43.496
167 HA ARG 22 HA ARG 22 12.384 11.577 40.938
168 HB2 ARG 22 HB2 ARG 22 11.578 13.158 42.651
169 HB3 ARG 22 HB1 ARG 22 13.018 12.836 43.619
170 HG2 ARG 22 HG2 ARG 22 14.457 13.724 41.875
171 HG3 ARG 22 HG1 ARG 22 13.083 13.902 40.781
172 HD2 ARG 22 HD2 ARG 22 13.321 15.318 43.448
173 HD3 ARG 22 HD1 ARG 22 13.764 16.044 41.905
174 HE ARG 22 HE ARG 22 11.144 15.090 41.657
175 HH11 ARG 22 HH11 ARG 22 9.395 16.517 41.912
176 HH12 ARG 22 HH12 ARG 22 9.609 17.992 42.793
177 HH21 ARG 22 HH21 ARG 22 12.955 17.401 43.488
178 HH22 ARG 22 HH22 ARG 22 11.624 18.492 43.687
179 H LEU 23 HN LEU 23 14.220 10.630 43.829
180 HA LEU 23 HA LEU 23 16.794 11.108 42.775
181 HB2 LEU 23 HB2 LEU 23 15.823 9.202 44.911
182 HB3 LEU 23 HB1 LEU 23 17.526 9.461 44.548
183 HG LEU 23 HG LEU 23 15.603 11.684 45.299
184 HD11 LEU 23 HD11 LEU 23 15.846 10.104 47.161
185 HD12 LEU 23 HD12 LEU 23 16.696 11.606 47.522
186 HD13 LEU 23 HD13 LEU 23 17.601 10.180 47.015
187 HD21 LEU 23 HD21 LEU 23 18.556 11.525 44.714
188 HD22 LEU 23 HD22 LEU 23 17.993 12.694 45.907
189 HD23 LEU 23 HD23 LEU 23 17.390 12.766 44.256
190 H ASN 24 HN ASN 24 14.686 8.272 42.693
191 HA ASN 24 HA ASN 24 16.527 6.450 41.585
192 HB2 ASN 24 HB2 ASN 24 14.275 5.897 42.575
193 HB3 ASN 24 HB1 ASN 24 13.547 6.498 41.086
194 HD21 ASN 24 HD21 ASN 24 12.790 4.432 40.326
195 HD22 ASN 24 HD22 ASN 24 13.852 3.188 39.870
196 H GLU 25 HN GLU 25 14.321 8.769 40.083
197 HA GLU 25 HA GLU 25 14.675 7.965 37.406
198 HB2 GLU 25 HB2 GLU 25 13.953 10.632 38.626
199 HB3 GLU 25 HB1 GLU 25 13.958 10.336 36.887
200 HG2 GLU 25 HG2 GLU 25 12.300 8.584 37.121
201 HG3 GLU 25 HG1 GLU 25 12.381 8.684 38.879
202 H GLU 26 HN GLU 26 16.487 10.215 39.445
203 HA GLU 26 HA GLU 26 18.512 11.261 39.156
204 HB2 GLU 26 HB2 GLU 26 18.959 8.962 37.235
205 HB3 GLU 26 HB1 GLU 26 20.215 10.026 37.863
206 HG2 GLU 26 HG2 GLU 26 19.658 9.320 40.165
207 HG3 GLU 26 HG1 GLU 26 18.422 8.237 39.523
208 H ARG 27 HN ARG 27 16.334 12.222 37.615
209 HA ARG 27 HA ARG 27 16.942 12.623 34.893
210 HB2 ARG 27 HB2 ARG 27 14.718 13.045 35.872
211 HB3 ARG 27 HB1 ARG 27 15.375 14.417 36.763
212 HG2 ARG 27 HG2 ARG 27 15.957 15.543 34.669
213 HG3 ARG 27 HG1 ARG 27 15.398 14.149 33.742
214 HD2 ARG 27 HD2 ARG 27 13.122 14.464 34.619
215 HD3 ARG 27 HD1 ARG 27 13.674 15.834 35.579
216 HE ARG 27 HE ARG 27 14.348 16.326 32.895
217 HH11 ARG 27 HH11 ARG 27 13.026 17.693 31.652
218 HH12 ARG 27 HH12 ARG 27 11.386 17.972 32.131
219 HH21 ARG 27 HH21 ARG 27 11.577 15.934 34.930
220 HH22 ARG 27 HH22 ARG 27 10.565 16.975 33.986
221 H HIS 28 HN HIS 28 17.711 14.546 37.780
222 HA HIS 28 HA HIS 28 18.892 16.727 36.446
223 HB2 HIS 28 HB2 HIS 28 19.811 17.332 38.591
224 HB3 HIS 28 HB1 HIS 28 18.189 16.689 38.847
225 HD2 HIS 28 HD2 HIS 28 21.832 15.911 39.891
226 HE1 HIS 28 HE1 HIS 28 19.465 12.663 41.184
227 HE2 HIS 28 HE2 HIS 28 21.764 13.732 41.329
228 H ASP 29 HN ASP 29 20.161 13.566 37.276
229 HA ASP 29 HA ASP 29 22.916 14.166 37.096
230 HB2 ASP 29 HB2 ASP 29 21.381 11.616 36.591
231 HB3 ASP 29 HB1 ASP 29 23.139 11.706 36.531
232 H HIS 30 HN HIS 30 20.520 13.274 34.657
233 HA HIS 30 HA HIS 30 22.300 12.966 32.484
234 HB2 HIS 30 HB2 HIS 30 19.369 13.686 32.630
235 HB3 HIS 30 HB1 HIS 30 20.223 13.456 31.102
236 HD2 HIS 30 HD2 HIS 30 20.648 10.781 30.398
237 HE1 HIS 30 HE1 HIS 30 19.207 9.058 33.973
238 HE2 HIS 30 HE2 HIS 30 20.027 8.560 31.621
239 H ASP 31 HN ASP 31 20.589 15.777 33.787
240 HA ASP 31 HA ASP 31 21.203 17.601 31.734
241 HB2 ASP 31 HB2 ASP 31 19.540 18.026 33.518
242 HB3 ASP 31 HB1 ASP 31 20.852 18.163 34.687
243 H LYS 32 HN LYS 32 22.953 16.753 34.705
244 HA LYS 32 HA LYS 32 25.034 18.649 34.410
245 HB2 LYS 32 HB2 LYS 32 24.921 15.997 35.857
246 HB3 LYS 32 HB1 LYS 32 26.325 17.063 35.912
247 HG2 LYS 32 HG2 LYS 32 24.917 18.882 36.808
248 HG3 LYS 32 HG1 LYS 32 23.510 17.821 36.762
249 HD2 LYS 32 HD2 LYS 32 24.619 16.269 38.323
250 HD3 LYS 32 HD1 LYS 32 26.030 17.327 38.374
251 HE2 LYS 32 HE2 LYS 32 24.638 19.150 39.278
252 HE3 LYS 32 HE1 LYS 32 23.222 18.099 39.224
253 HZ1 LYS 32 HZ1 LYS 32 25.094 18.315 41.261
254 HZ2 LYS 32 HZ2 LYS 32 25.325 16.786 40.560
255 HZ3 LYS 32 HZ3 LYS 32 23.798 17.227 41.159
256 H ARG 33 HN ARG 33 24.651 15.329 33.253
257 HA ARG 33 HA ARG 33 27.257 14.961 32.251
258 HB2 ARG 33 HB2 ARG 33 25.632 13.122 32.513
259 HB3 ARG 33 HB1 ARG 33 24.658 13.806 31.212
260 HG2 ARG 33 HG2 ARG 33 26.467 13.490 29.619
261 HG3 ARG 33 HG1 ARG 33 27.550 12.954 30.903
262 HD2 ARG 33 HD2 ARG 33 26.676 11.009 29.715
263 HD3 ARG 33 HD1 ARG 33 26.030 11.040 31.353
264 HE ARG 33 HE ARG 33 24.269 12.381 29.556
265 HH11 ARG 33 HH11 ARG 33 22.356 11.304 28.972
266 HH12 ARG 33 HH12 ARG 33 22.227 9.593 29.204
267 HH21 ARG 33 HH21 ARG 33 25.415 9.265 30.529
268 HH22 ARG 33 HH22 ARG 33 23.959 8.438 30.085
269 H GLU 34 HN GLU 34 24.326 16.270 30.736
270 HA GLU 34 HA GLU 34 25.385 16.630 28.150
271 HB2 GLU 34 HB2 GLU 34 22.973 16.749 28.660
272 HB3 GLU 34 HB1 GLU 34 23.240 18.234 29.570
273 HG2 GLU 34 HG2 GLU 34 22.443 18.764 27.315
274 HG3 GLU 34 HG1 GLU 34 24.102 19.322 27.505
275 H ALA 35 HN ALA 35 25.312 18.755 30.990
276 HA ALA 35 HA ALA 35 26.415 21.044 29.776
277 HB1 ALA 35 HB1 ALA 35 26.804 20.169 32.644
278 HB2 ALA 35 HB2 ALA 35 25.338 20.946 32.047
279 HB3 ALA 35 HB3 ALA 35 26.874 21.814 32.011
280 H GLU 36 HN GLU 36 27.924 18.233 31.312
281 HA GLU 36 HA GLU 36 30.585 19.168 31.281
282 HB2 GLU 36 HB2 GLU 36 29.840 17.188 32.561
283 HB3 GLU 36 HB1 GLU 36 29.584 16.317 31.049
284 HG2 GLU 36 HG2 GLU 36 31.962 16.534 30.489
285 HG3 GLU 36 HG1 GLU 36 32.237 17.477 31.952
286 H ARG 37 HN ARG 37 28.684 17.364 28.890
287 HA ARG 37 HA ARG 37 30.765 16.935 27.031
288 HB2 ARG 37 HB2 ARG 37 27.775 17.201 26.633
289 HB3 ARG 37 HB1 ARG 37 28.890 16.670 25.380
290 HG2 ARG 37 HG2 ARG 37 28.816 15.280 28.056
291 HG3 ARG 37 HG1 ARG 37 27.658 14.862 26.798
292 HD2 ARG 37 HD2 ARG 37 29.558 14.408 25.246
293 HD3 ARG 37 HD1 ARG 37 30.681 14.729 26.560
294 HE ARG 37 HE ARG 37 30.115 12.678 27.517
295 HH11 ARG 37 HH11 ARG 37 29.147 10.625 27.408
296 HH12 ARG 37 HH12 ARG 37 27.909 10.318 26.237
297 HH21 ARG 37 HH21 ARG 37 27.999 13.520 24.909
298 HH22 ARG 37 HH22 ARG 37 27.258 11.957 24.823
299 H LYS 38 HN LYS 38 28.489 19.598 27.479
300 HA LYS 38 HA LYS 38 29.098 21.037 25.136
301 HB2 LYS 38 HB2 LYS 38 27.162 21.502 26.611
302 HB3 LYS 38 HB1 LYS 38 28.259 22.133 27.835
303 HG2 LYS 38 HG2 LYS 38 29.073 23.826 26.183
304 HG3 LYS 38 HG1 LYS 38 27.881 23.232 25.031
305 HD2 LYS 38 HD2 LYS 38 27.109 24.219 27.783
306 HD3 LYS 38 HD1 LYS 38 27.223 25.302 26.398
307 HE2 LYS 38 HE2 LYS 38 25.606 23.778 25.187
308 HE3 LYS 38 HE1 LYS 38 25.381 22.914 26.706
309 HZ1 LYS 38 HZ1 LYS 38 23.925 25.017 25.975
310 HZ2 LYS 38 HZ2 LYS 38 25.144 25.793 26.869
311 HZ3 LYS 38 HZ3 LYS 38 24.199 24.578 27.591
312 H ALA 39 HN ALA 39 30.523 21.128 28.387
313 HA ALA 39 HA ALA 39 32.311 23.259 27.950
314 HB1 ALA 39 HB1 ALA 39 31.826 22.411 30.190
315 HB2 ALA 39 HB2 ALA 39 33.559 22.328 29.874
316 HB3 ALA 39 HB3 ALA 39 32.574 20.867 29.789
317 H LEU 40 HN LEU 40 32.616 19.775 27.399
318 HA LEU 40 HA LEU 40 35.354 19.727 26.746
319 HB2 LEU 40 HB2 LEU 40 34.066 17.691 27.207
320 HB3 LEU 40 HB1 LEU 40 33.106 17.954 25.754
321 HG LEU 40 HG LEU 40 35.145 17.735 24.366
322 HD11 LEU 40 HD11 LEU 40 36.957 18.447 25.674
323 HD12 LEU 40 HD12 LEU 40 37.166 16.698 25.695
324 HD13 LEU 40 HD13 LEU 40 36.441 17.517 27.081
325 HD21 LEU 40 HD21 LEU 40 33.889 15.719 24.716
326 HD22 LEU 40 HD22 LEU 40 34.558 15.510 26.334
327 HD23 LEU 40 HD23 LEU 40 35.589 15.293 24.919
328 H GLU 41 HN GLU 41 32.467 20.166 24.722
329 HA GLU 41 HA GLU 41 33.807 20.301 22.239
330 HB2 GLU 41 HB2 GLU 41 31.179 21.487 23.157
331 HB3 GLU 41 HB1 GLU 41 31.734 21.506 21.482
332 HG2 GLU 41 HG2 GLU 41 31.462 18.975 23.124
333 HG3 GLU 41 HG1 GLU 41 30.202 19.578 22.050
334 H ASP 42 HN ASP 42 32.983 22.770 24.635
335 HA ASP 42 HA ASP 42 33.625 24.967 24.860
336 HB2 ASP 42 HB2 ASP 42 35.851 23.708 24.866
337 HB3 ASP 42 HB1 ASP 42 36.024 24.218 23.188
338 H LYS 43 HN LYS 43 31.860 24.416 22.680
339 HA LYS 43 HA LYS 43 32.671 25.533 20.230
340 HB2 LYS 43 HB2 LYS 43 30.608 24.209 20.511
341 HB3 LYS 43 HB1 LYS 43 29.910 25.510 21.475
342 HG2 LYS 43 HG2 LYS 43 30.070 27.044 19.560
343 HG3 LYS 43 HG1 LYS 43 30.824 25.776 18.594
344 HD2 LYS 43 HD2 LYS 43 28.793 24.386 18.847
345 HD3 LYS 43 HD1 LYS 43 28.038 25.673 19.787
346 HE2 LYS 43 HE2 LYS 43 29.020 25.965 16.933
347 HE3 LYS 43 HE1 LYS 43 27.337 25.722 17.400
348 HZ1 LYS 43 HZ1 LYS 43 27.421 27.984 17.297
349 HZ2 LYS 43 HZ2 LYS 43 29.051 28.070 17.769
350 HZ3 LYS 43 HZ3 LYS 43 27.844 27.765 18.925
351 H LEU 44 HN LEU 44 31.167 27.009 23.089
352 HA LEU 44 HA LEU 44 30.866 29.606 22.027
353 HB2 LEU 44 HB2 LEU 44 31.217 28.629 24.867
354 HB3 LEU 44 HB1 LEU 44 30.846 30.302 24.456
355 HG LEU 44 HG LEU 44 29.159 27.933 23.590
356 HD11 LEU 44 HD11 LEU 44 28.667 29.885 25.858
357 HD12 LEU 44 HD12 LEU 44 29.221 28.224 26.068
358 HD13 LEU 44 HD13 LEU 44 27.627 28.542 25.387
359 HD21 LEU 44 HD21 LEU 44 27.466 29.987 23.455
360 HD22 LEU 44 HD22 LEU 44 28.568 29.655 22.126
361 HD23 LEU 44 HD23 LEU 44 28.949 30.926 23.287
362 H ALA 45 HN ALA 45 33.542 28.036 23.724
363 HA ALA 45 HA ALA 45 35.734 28.660 24.041
364 HB1 ALA 45 HB1 ALA 45 35.344 30.432 21.627
365 HB2 ALA 45 HB2 ALA 45 35.534 28.682 21.506
366 HB3 ALA 45 HB3 ALA 45 36.832 29.665 22.183
367 H ASP 46 HN ASP 46 33.592 30.246 25.311
368 HA ASP 46 HA ASP 46 34.581 32.990 25.309
369 HB2 ASP 46 HB2 ASP 46 32.741 33.436 26.829
370 HB3 ASP 46 HB1 ASP 46 32.150 32.488 25.466
371 H LYS 47 HN LYS 47 35.730 30.252 26.606
372 HA LYS 47 HA LYS 47 36.102 30.820 29.343
373 HB2 LYS 47 HB2 LYS 47 37.728 29.183 27.388
374 HB3 LYS 47 HB1 LYS 47 38.078 29.246 29.113
375 HG2 LYS 47 HG2 LYS 47 35.295 28.561 28.174
376 HG3 LYS 47 HG1 LYS 47 36.545 27.323 28.181
377 HD2 LYS 47 HD2 LYS 47 36.966 27.810 30.594
378 HD3 LYS 47 HD1 LYS 47 35.622 28.949 30.572
379 HE2 LYS 47 HE2 LYS 47 34.856 26.783 31.414
380 HE3 LYS 47 HE1 LYS 47 34.105 27.120 29.854
381 HZ1 LYS 47 HZ1 LYS 47 35.035 24.831 30.116
382 HZ2 LYS 47 HZ2 LYS 47 36.585 25.524 30.153
383 HZ3 LYS 47 HZ3 LYS 47 35.614 25.682 28.768
384 H GLN 48 HN GLN 48 37.982 31.672 26.472
385 HA GLN 48 HA GLN 48 40.150 32.851 27.907
386 HB2 GLN 48 HB2 GLN 48 40.298 32.046 25.546
387 HB3 GLN 48 HB1 GLN 48 39.260 33.384 25.061
388 HG2 GLN 48 HG2 GLN 48 41.599 33.991 24.697
389 HG3 GLN 48 HG1 GLN 48 40.927 34.983 25.989
390 HE21 GLN 48 HE21 GLN 48 42.438 35.210 27.637
391 HE22 GLN 48 HE22 GLN 48 43.488 33.989 28.172
392 H GLU 49 HN GLU 49 40.360 34.838 28.746
393 HA GLU 49 HA GLU 49 38.481 36.973 27.955
394 HB2 GLU 49 HB2 GLU 49 37.555 35.882 29.980
395 HB3 GLU 49 HB1 GLU 49 39.069 36.202 30.826
396 HG2 GLU 49 HG2 GLU 49 38.761 38.615 30.523
397 HG3 GLU 49 HG1 GLU 49 37.284 38.327 29.604
398 H HIS 50 HN HIS 50 39.443 38.907 27.755
399 HA HIS 50 HA HIS 50 41.862 39.568 29.221
400 HB2 HIS 50 HB2 HIS 50 43.222 39.969 27.224
401 HB3 HIS 50 HB1 HIS 50 42.745 38.273 27.312
402 HD2 HIS 50 HD2 HIS 50 42.398 41.257 24.895
403 HE1 HIS 50 HE1 HIS 50 39.781 38.256 23.494
404 HE2 HIS 50 HE2 HIS 50 40.862 40.483 22.931
405 H LEU 51 HN LEU 51 42.544 41.802 28.831
406 HA LEU 51 HA LEU 51 41.892 44.026 28.979
407 HB2 LEU 51 HB2 LEU 51 40.941 43.365 26.181
408 HB3 LEU 51 HB1 LEU 51 41.364 44.964 26.790
409 HG LEU 51 HG LEU 51 43.264 42.606 26.601
410 HD11 LEU 51 HD11 LEU 51 42.570 43.605 24.409
411 HD12 LEU 51 HD12 LEU 51 44.286 43.819 24.757
412 HD13 LEU 51 HD13 LEU 51 43.167 45.165 24.975
413 HD21 LEU 51 HD21 LEU 51 44.921 44.627 26.964
414 HD22 LEU 51 HD22 LEU 51 44.118 43.910 28.357
415 HD23 LEU 51 HD23 LEU 51 43.509 45.416 27.670
416 H ASP 52 HN ASP 52 39.599 44.885 27.077
417 HA ASP 52 HA ASP 52 37.253 43.858 28.483
418 HB2 ASP 52 HB2 ASP 52 38.178 45.740 29.885
419 HB3 ASP 52 HB1 ASP 52 37.874 46.817 28.523
420 H GLY 53 HN GLY 53 38.227 43.790 25.735
421 HA2 GLY 53 HA2 GLY 53 37.113 43.820 23.692
422 HA3 GLY 53 HA1 GLY 53 35.833 44.776 24.431
423 H ALA 54 HN ALA 54 38.698 46.193 25.266
424 HA ALA 54 HA ALA 54 38.277 48.519 23.735
425 HB1 ALA 54 HB1 ALA 54 39.504 48.664 25.797
426 HB2 ALA 54 HB2 ALA 54 40.599 49.129 24.495
427 HB3 ALA 54 HB3 ALA 54 40.719 47.525 25.217
428 H LEU 55 HN LEU 55 40.428 45.746 23.262
429 HA LEU 55 HA LEU 55 41.886 46.759 21.080
430 HB2 LEU 55 HB2 LEU 55 42.571 44.753 22.317
431 HB3 LEU 55 HB1 LEU 55 41.146 43.896 21.739
432 HG LEU 55 HG LEU 55 41.942 44.137 19.407
433 HD11 LEU 55 HD11 LEU 55 43.223 46.099 19.309
434 HD12 LEU 55 HD12 LEU 55 44.470 44.856 19.272
435 HD13 LEU 55 HD13 LEU 55 44.121 45.710 20.777
436 HD21 LEU 55 HD21 LEU 55 43.736 42.524 19.558
437 HD22 LEU 55 HD22 LEU 55 42.610 42.193 20.873
438 HD23 LEU 55 HD23 LEU 55 44.123 43.034 21.201
439 H ARG 56 HN ARG 56 38.878 44.876 21.216
440 HA ARG 56 HA ARG 56 38.548 44.722 18.383
441 HB2 ARG 56 HB2 ARG 56 36.587 44.371 20.660
442 HB3 ARG 56 HB1 ARG 56 36.209 44.044 18.969
443 HG2 ARG 56 HG2 ARG 56 37.967 42.360 18.855
444 HG3 ARG 56 HG1 ARG 56 38.478 42.740 20.501
445 HD2 ARG 56 HD2 ARG 56 37.076 40.746 20.537
446 HD3 ARG 56 HD1 ARG 56 36.226 42.072 21.323
447 HE ARG 56 HE ARG 56 35.562 41.960 18.553
448 HH11 ARG 56 HH11 ARG 56 33.508 41.156 18.005
449 HH12 ARG 56 HH12 ARG 56 32.619 40.211 19.153
450 HH21 ARG 56 HH21 ARG 56 35.068 40.398 21.602
451 HH22 ARG 56 HH22 ARG 56 33.502 39.783 21.189
452 H TYR 57 HN TYR 57 37.285 45.951 17.016
453 HA TYR 57 HA TYR 57 37.059 48.712 17.560
454 HB2 TYR 57 HB2 TYR 57 35.801 48.812 15.438
455 HB3 TYR 57 HB1 TYR 57 37.262 47.839 15.280
456 HD1 TYR 57 HD1 TYR 57 33.584 47.766 15.472
457 HD2 TYR 57 HD2 TYR 57 37.150 45.413 15.042
458 HE1 TYR 57 HE1 TYR 57 32.215 45.826 14.756
459 HE2 TYR 57 HE2 TYR 57 35.783 43.472 14.326
460 HH TYR 57 HH TYR 57 32.231 43.720 14.075
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 45.616 -8.815 37.377
2 H2 GLY 1 HT2 GLY 1 44.872 -8.281 38.810
3 H3 GLY 1 HT3 GLY 1 45.463 -7.154 37.685
4 HA2 GLY 1 HA2 GLY 1 43.353 -9.095 36.966
5 HA3 GLY 1 HA1 GLY 1 42.969 -7.544 37.713
6 H SER 2 HN SER 2 44.079 -9.150 34.846
7 HA SER 2 HA SER 2 44.965 -6.910 33.367
8 HB2 SER 2 HB2 SER 2 45.469 -9.177 32.641
9 HB3 SER 2 HB1 SER 2 43.755 -9.523 32.432
10 HG SER 2 HG SER 2 45.122 -7.427 31.097
11 H ALA 3 HN ALA 3 43.920 -5.456 32.098
12 HA ALA 3 HA ALA 3 42.192 -4.084 31.451
13 HB1 ALA 3 HB1 ALA 3 41.836 -5.682 29.737
14 HB2 ALA 3 HB2 ALA 3 40.240 -5.367 30.417
15 HB3 ALA 3 HB3 ALA 3 41.112 -6.836 30.856
16 H GLY 4 HN GLY 4 42.206 -5.313 34.296
17 HA2 GLY 4 HA2 GLY 4 40.965 -4.902 36.197
18 HA3 GLY 4 HA1 GLY 4 39.860 -3.959 35.204
19 H LEU 5 HN LEU 5 40.547 -7.235 34.296
20 HA LEU 5 HA LEU 5 37.823 -7.999 34.349
21 HB2 LEU 5 HB2 LEU 5 40.363 -9.624 34.168
22 HB3 LEU 5 HB1 LEU 5 38.761 -10.343 34.065
23 HG LEU 5 HG LEU 5 39.714 -8.105 32.247
24 HD11 LEU 5 HD11 LEU 5 41.110 -10.033 31.834
25 HD12 LEU 5 HD12 LEU 5 39.916 -9.944 30.539
26 HD13 LEU 5 HD13 LEU 5 39.713 -11.108 31.848
27 HD21 LEU 5 HD21 LEU 5 37.382 -8.077 32.092
28 HD22 LEU 5 HD22 LEU 5 37.228 -9.801 32.428
29 HD23 LEU 5 HD23 LEU 5 37.773 -9.255 30.844
30 H GLN 6 HN GLN 6 40.481 -8.517 36.621
31 HA GLN 6 HA GLN 6 39.134 -10.286 38.357
32 HB2 GLN 6 HB2 GLN 6 41.605 -9.797 38.364
33 HB3 GLN 6 HB1 GLN 6 41.240 -8.253 39.131
34 HG2 GLN 6 HG2 GLN 6 40.242 -10.856 40.302
35 HG3 GLN 6 HG1 GLN 6 41.852 -10.245 40.668
36 HE21 GLN 6 HE21 GLN 6 39.488 -10.492 42.507
37 HE22 GLN 6 HE22 GLN 6 39.217 -8.924 43.101
38 H GLU 7 HN GLU 7 39.301 -6.760 38.221
39 HA GLU 7 HA GLU 7 37.970 -6.208 40.644
40 HB2 GLU 7 HB2 GLU 7 39.222 -4.520 39.325
41 HB3 GLU 7 HB1 GLU 7 37.963 -4.577 38.091
42 HG2 GLU 7 HG2 GLU 7 36.295 -3.832 39.731
43 HG3 GLU 7 HG1 GLU 7 37.522 -3.824 40.994
44 H LYS 8 HN LYS 8 36.785 -6.783 37.366
45 HA LYS 8 HA LYS 8 34.072 -6.166 37.782
46 HB2 LYS 8 HB2 LYS 8 35.072 -6.509 35.550
47 HB3 LYS 8 HB1 LYS 8 35.275 -8.222 35.911
48 HG2 LYS 8 HG2 LYS 8 32.843 -8.480 36.166
49 HG3 LYS 8 HG1 LYS 8 32.619 -6.756 35.861
50 HD2 LYS 8 HD2 LYS 8 33.567 -7.006 33.614
51 HD3 LYS 8 HD1 LYS 8 33.866 -8.718 33.914
52 HE2 LYS 8 HE2 LYS 8 31.790 -8.446 32.637
53 HE3 LYS 8 HE1 LYS 8 31.430 -9.067 34.248
54 HZ1 LYS 8 HZ1 LYS 8 30.568 -7.070 34.927
55 HZ2 LYS 8 HZ2 LYS 8 30.098 -7.073 33.294
56 HZ3 LYS 8 HZ3 LYS 8 31.444 -6.165 33.792
57 H GLU 9 HN GLU 9 35.914 -9.129 38.284
58 HA GLU 9 HA GLU 9 33.757 -10.849 38.853
59 HB2 GLU 9 HB2 GLU 9 36.653 -10.908 39.700
60 HB3 GLU 9 HB1 GLU 9 35.512 -12.184 40.120
61 HG2 GLU 9 HG2 GLU 9 35.088 -12.667 37.792
62 HG3 GLU 9 HG1 GLU 9 36.028 -11.271 37.274
63 H ARG 10 HN ARG 10 35.600 -8.640 40.913
64 HA ARG 10 HA ARG 10 34.686 -9.521 43.408
65 HB2 ARG 10 HB2 ARG 10 35.446 -6.748 42.473
66 HB3 ARG 10 HB1 ARG 10 35.141 -7.167 44.158
67 HG2 ARG 10 HG2 ARG 10 36.936 -8.832 44.099
68 HG3 ARG 10 HG1 ARG 10 37.217 -8.494 42.391
69 HD2 ARG 10 HD2 ARG 10 38.852 -7.274 43.733
70 HD3 ARG 10 HD1 ARG 10 37.748 -6.134 42.973
71 HE ARG 10 HE ARG 10 36.815 -6.864 45.568
72 HH11 ARG 10 HH11 ARG 10 37.030 -5.322 47.220
73 HH12 ARG 10 HH12 ARG 10 38.129 -3.998 47.026
74 HH21 ARG 10 HH21 ARG 10 39.182 -4.991 43.875
75 HH22 ARG 10 HH22 ARG 10 39.348 -3.811 45.132
76 H GLU 11 HN GLU 11 32.912 -9.158 44.607
77 HA GLU 11 HA GLU 11 30.461 -8.519 43.335
78 HB2 GLU 11 HB2 GLU 11 31.209 -8.869 46.238
79 HB3 GLU 11 HB1 GLU 11 29.560 -8.541 45.708
80 HG2 GLU 11 HG2 GLU 11 29.511 -10.564 44.384
81 HG3 GLU 11 HG1 GLU 11 31.222 -10.856 44.674
82 H LEU 12 HN LEU 12 32.657 -6.663 45.372
83 HA LEU 12 HA LEU 12 30.990 -4.479 45.923
84 HB2 LEU 12 HB2 LEU 12 33.984 -4.732 45.672
85 HB3 LEU 12 HB1 LEU 12 33.207 -3.214 46.118
86 HG LEU 12 HG LEU 12 32.078 -4.383 48.008
87 HD11 LEU 12 HD11 LEU 12 33.226 -6.652 48.605
88 HD12 LEU 12 HD12 LEU 12 33.643 -6.709 46.893
89 HD13 LEU 12 HD13 LEU 12 31.952 -6.649 47.388
90 HD21 LEU 12 HD21 LEU 12 34.127 -4.629 49.393
91 HD22 LEU 12 HD22 LEU 12 34.191 -3.186 48.381
92 HD23 LEU 12 HD23 LEU 12 35.104 -4.624 47.923
93 H GLU 13 HN GLU 13 33.081 -5.131 43.131
94 HA GLU 13 HA GLU 13 32.848 -2.600 41.912
95 HB2 GLU 13 HB2 GLU 13 34.498 -4.294 41.202
96 HB3 GLU 13 HB1 GLU 13 33.191 -5.309 40.595
97 HG2 GLU 13 HG2 GLU 13 34.189 -4.043 38.750
98 HG3 GLU 13 HG1 GLU 13 32.541 -3.494 39.017
99 H ASP 14 HN ASP 14 30.858 -5.528 41.662
100 HA ASP 14 HA ASP 14 29.116 -4.622 39.644
101 HB2 ASP 14 HB2 ASP 14 28.744 -6.606 41.889
102 HB3 ASP 14 HB1 ASP 14 27.517 -6.313 40.658
103 H LEU 15 HN LEU 15 29.006 -4.274 43.169
104 HA LEU 15 HA LEU 15 26.434 -3.109 43.325
105 HB2 LEU 15 HB2 LEU 15 28.851 -2.874 45.126
106 HB3 LEU 15 HB1 LEU 15 27.275 -2.198 45.525
107 HG LEU 15 HG LEU 15 27.753 -5.123 44.880
108 HD11 LEU 15 HD11 LEU 15 27.678 -5.551 47.255
109 HD12 LEU 15 HD12 LEU 15 27.318 -3.859 47.599
110 HD13 LEU 15 HD13 LEU 15 28.903 -4.314 46.975
111 HD21 LEU 15 HD21 LEU 15 25.467 -4.819 44.524
112 HD22 LEU 15 HD22 LEU 15 25.352 -3.486 45.673
113 HD23 LEU 15 HD23 LEU 15 25.463 -5.146 46.254
114 H LYS 16 HN LYS 16 29.652 -1.735 42.855
115 HA LYS 16 HA LYS 16 28.969 0.985 43.087
116 HB2 LYS 16 HB2 LYS 16 31.294 0.160 43.057
117 HB3 LYS 16 HB1 LYS 16 31.111 -0.286 41.362
118 HG2 LYS 16 HG2 LYS 16 30.682 2.065 40.770
119 HG3 LYS 16 HG1 LYS 16 30.820 2.525 42.469
120 HD2 LYS 16 HD2 LYS 16 33.149 1.715 42.501
121 HD3 LYS 16 HD1 LYS 16 33.013 1.250 40.805
122 HE2 LYS 16 HE2 LYS 16 32.571 3.594 40.189
123 HE3 LYS 16 HE1 LYS 16 32.693 4.066 41.885
124 HZ1 LYS 16 HZ1 LYS 16 34.979 2.744 41.568
125 HZ2 LYS 16 HZ2 LYS 16 34.826 4.419 41.326
126 HZ3 LYS 16 HZ3 LYS 16 34.784 3.358 39.999
127 H ASP 17 HN ASP 17 28.997 -1.194 40.284
128 HA ASP 17 HA ASP 17 28.339 0.717 38.323
129 HB2 ASP 17 HB2 ASP 17 27.850 -2.259 38.487
130 HB3 ASP 17 HB1 ASP 17 27.448 -1.300 37.064
131 H ALA 18 HN ALA 18 26.320 -1.262 40.450
132 HA ALA 18 HA ALA 18 23.823 -0.649 39.301
133 HB1 ALA 18 HB1 ALA 18 22.892 -1.296 41.512
134 HB2 ALA 18 HB2 ALA 18 24.529 -1.307 42.171
135 HB3 ALA 18 HB3 ALA 18 24.077 -2.458 40.914
136 H GLU 19 HN GLU 19 25.742 0.999 41.780
137 HA GLU 19 HA GLU 19 23.811 2.915 42.529
138 HB2 GLU 19 HB2 GLU 19 26.831 2.966 42.592
139 HB3 GLU 19 HB1 GLU 19 25.829 4.251 43.269
140 HG2 GLU 19 HG2 GLU 19 24.770 2.697 44.799
141 HG3 GLU 19 HG1 GLU 19 25.587 1.331 44.043
142 H LEU 20 HN LEU 20 26.265 2.900 39.979
143 HA LEU 20 HA LEU 20 25.948 5.582 39.151
144 HB2 LEU 20 HB2 LEU 20 26.849 3.116 37.652
145 HB3 LEU 20 HB1 LEU 20 26.910 4.740 36.972
146 HG LEU 20 HG LEU 20 28.251 3.938 39.574
147 HD11 LEU 20 HD11 LEU 20 29.165 2.767 37.542
148 HD12 LEU 20 HD12 LEU 20 30.328 3.825 38.338
149 HD13 LEU 20 HD13 LEU 20 29.530 4.350 36.857
150 HD21 LEU 20 HD21 LEU 20 28.078 6.262 39.698
151 HD22 LEU 20 HD22 LEU 20 28.103 6.471 37.948
152 HD23 LEU 20 HD23 LEU 20 29.594 6.117 38.816
153 H LYS 21 HN LYS 21 24.293 2.600 38.234
154 HA LYS 21 HA LYS 21 22.811 3.608 36.067
155 HB2 LYS 21 HB2 LYS 21 23.004 1.205 36.585
156 HB3 LYS 21 HB1 LYS 21 22.038 1.444 38.040
157 HG2 LYS 21 HG2 LYS 21 20.136 2.202 36.678
158 HG3 LYS 21 HG1 LYS 21 21.101 2.026 35.213
159 HD2 LYS 21 HD2 LYS 21 21.328 -0.381 35.625
160 HD3 LYS 21 HD1 LYS 21 20.420 -0.224 37.130
161 HE2 LYS 21 HE2 LYS 21 18.940 -1.015 35.342
162 HE3 LYS 21 HE1 LYS 21 18.467 0.609 35.843
163 HZ1 LYS 21 HZ1 LYS 21 19.757 1.494 33.980
164 HZ2 LYS 21 HZ2 LYS 21 18.520 0.456 33.452
165 HZ3 LYS 21 HZ3 LYS 21 20.130 -0.084 33.482
166 H ARG 22 HN ARG 22 22.077 3.494 39.541
167 HA ARG 22 HA ARG 22 19.460 4.515 39.405
168 HB2 ARG 22 HB2 ARG 22 20.429 3.480 41.430
169 HB3 ARG 22 HB1 ARG 22 21.496 4.871 41.619
170 HG2 ARG 22 HG2 ARG 22 19.562 6.357 41.866
171 HG3 ARG 22 HG1 ARG 22 18.465 5.002 41.598
172 HD2 ARG 22 HD2 ARG 22 19.355 3.886 43.610
173 HD3 ARG 22 HD1 ARG 22 20.445 5.241 43.881
174 HE ARG 22 HE ARG 22 17.587 5.184 44.400
175 HH11 ARG 22 HH11 ARG 22 16.766 7.028 45.442
176 HH12 ARG 22 HH12 ARG 22 17.735 8.461 45.546
177 HH21 ARG 22 HH21 ARG 22 20.429 7.081 43.855
178 HH22 ARG 22 HH22 ARG 22 19.809 8.490 44.648
179 H LEU 23 HN LEU 23 22.591 6.154 39.724
180 HA LEU 23 HA LEU 23 21.533 8.782 39.951
181 HB2 LEU 23 HB2 LEU 23 24.211 7.567 39.450
182 HB3 LEU 23 HB1 LEU 23 24.009 9.233 38.914
183 HG LEU 23 HG LEU 23 23.214 9.840 41.192
184 HD11 LEU 23 HD11 LEU 23 23.557 8.218 43.031
185 HD12 LEU 23 HD12 LEU 23 23.983 6.981 41.851
186 HD13 LEU 23 HD13 LEU 23 22.349 7.646 41.882
187 HD21 LEU 23 HD21 LEU 23 25.617 10.020 40.525
188 HD22 LEU 23 HD22 LEU 23 25.890 8.415 41.204
189 HD23 LEU 23 HD23 LEU 23 25.405 9.746 42.253
190 H ASN 24 HN ASN 24 22.505 6.785 37.217
191 HA ASN 24 HA ASN 24 22.377 8.731 35.194
192 HB2 ASN 24 HB2 ASN 24 23.300 6.394 34.981
193 HB3 ASN 24 HB1 ASN 24 21.638 5.817 34.894
194 HD21 ASN 24 HD21 ASN 24 21.720 5.156 32.662
195 HD22 ASN 24 HD22 ASN 24 21.903 6.268 31.394
196 H GLU 25 HN GLU 25 19.871 6.684 36.622
197 HA GLU 25 HA GLU 25 17.793 7.300 34.824
198 HB2 GLU 25 HB2 GLU 25 17.734 6.503 37.741
199 HB3 GLU 25 HB1 GLU 25 16.292 6.640 36.736
200 HG2 GLU 25 HG2 GLU 25 18.664 4.901 36.018
201 HG3 GLU 25 HG1 GLU 25 17.251 4.304 36.884
202 H GLU 26 HN GLU 26 18.933 8.929 37.751
203 HA GLU 26 HA GLU 26 16.850 10.744 38.122
204 HB2 GLU 26 HB2 GLU 26 18.751 10.428 39.689
205 HB3 GLU 26 HB1 GLU 26 19.804 11.259 38.545
206 HG2 GLU 26 HG2 GLU 26 18.418 13.278 38.702
207 HG3 GLU 26 HG1 GLU 26 17.316 12.452 39.801
208 H ARG 27 HN ARG 27 16.176 12.522 37.098
209 HA ARG 27 HA ARG 27 17.026 13.133 34.481
210 HB2 ARG 27 HB2 ARG 27 15.337 14.671 36.457
211 HB3 ARG 27 HB1 ARG 27 15.591 15.187 34.789
212 HG2 ARG 27 HG2 ARG 27 14.601 13.149 33.939
213 HG3 ARG 27 HG1 ARG 27 14.508 12.464 35.562
214 HD2 ARG 27 HD2 ARG 27 13.082 14.996 34.707
215 HD3 ARG 27 HD1 ARG 27 12.328 13.404 34.737
216 HE ARG 27 HE ARG 27 13.446 13.845 37.266
217 HH11 ARG 27 HH11 ARG 27 12.130 14.578 38.967
218 HH12 ARG 27 HH12 ARG 27 10.642 15.393 38.615
219 HH21 ARG 27 HH21 ARG 27 11.022 15.161 35.176
220 HH22 ARG 27 HH22 ARG 27 10.014 15.723 36.469
221 H HIS 28 HN HIS 28 17.781 14.611 37.608
222 HA HIS 28 HA HIS 28 19.115 16.899 36.642
223 HB2 HIS 28 HB2 HIS 28 19.446 15.323 39.201
224 HB3 HIS 28 HB1 HIS 28 20.273 16.846 38.887
225 HD2 HIS 28 HD2 HIS 28 16.985 17.496 37.319
226 HE1 HIS 28 HE1 HIS 28 16.295 18.331 41.397
227 HE2 HIS 28 HE2 HIS 28 15.378 18.607 39.046
228 H ASP 29 HN ASP 29 20.263 13.617 37.304
229 HA ASP 29 HA ASP 29 23.018 14.091 36.979
230 HB2 ASP 29 HB2 ASP 29 22.060 11.998 37.898
231 HB3 ASP 29 HB1 ASP 29 21.468 11.587 36.287
232 H HIS 30 HN HIS 30 20.503 13.230 34.626
233 HA HIS 30 HA HIS 30 22.169 12.919 32.385
234 HB2 HIS 30 HB2 HIS 30 19.840 12.195 32.367
235 HB3 HIS 30 HB1 HIS 30 19.295 13.863 32.531
236 HD2 HIS 30 HD2 HIS 30 18.950 15.147 30.104
237 HE1 HIS 30 HE1 HIS 30 21.163 12.469 27.705
238 HE2 HIS 30 HE2 HIS 30 19.691 14.538 27.675
239 H ASP 31 HN ASP 31 20.459 15.791 33.614
240 HA ASP 31 HA ASP 31 21.240 17.564 31.572
241 HB2 ASP 31 HB2 ASP 31 19.462 18.046 33.227
242 HB3 ASP 31 HB1 ASP 31 20.692 18.195 34.482
243 H LYS 32 HN LYS 32 22.768 16.737 34.667
244 HA LYS 32 HA LYS 32 24.868 18.604 34.567
245 HB2 LYS 32 HB2 LYS 32 24.303 17.325 36.591
246 HB3 LYS 32 HB1 LYS 32 24.846 15.844 35.801
247 HG2 LYS 32 HG2 LYS 32 27.109 16.638 35.675
248 HG3 LYS 32 HG1 LYS 32 26.630 18.262 36.160
249 HD2 LYS 32 HD2 LYS 32 27.590 17.229 38.100
250 HD3 LYS 32 HD1 LYS 32 25.847 17.258 38.358
251 HE2 LYS 32 HE2 LYS 32 25.651 14.925 37.737
252 HE3 LYS 32 HE1 LYS 32 27.343 14.870 37.242
253 HZ1 LYS 32 HZ1 LYS 32 26.180 14.898 39.920
254 HZ2 LYS 32 HZ2 LYS 32 27.656 15.709 39.705
255 HZ3 LYS 32 HZ3 LYS 32 27.529 14.055 39.334
256 H ARG 33 HN ARG 33 24.652 15.271 33.357
257 HA ARG 33 HA ARG 33 27.321 15.088 32.431
258 HB2 ARG 33 HB2 ARG 33 24.800 13.640 31.607
259 HB3 ARG 33 HB1 ARG 33 26.385 13.265 30.932
260 HG2 ARG 33 HG2 ARG 33 27.247 12.796 33.194
261 HG3 ARG 33 HG1 ARG 33 25.671 13.179 33.884
262 HD2 ARG 33 HD2 ARG 33 24.651 11.356 32.568
263 HD3 ARG 33 HD1 ARG 33 26.231 10.964 31.892
264 HE ARG 33 HE ARG 33 25.286 10.345 34.570
265 HH11 ARG 33 HH11 ARG 33 26.692 9.064 35.810
266 HH12 ARG 33 HH12 ARG 33 28.326 8.826 35.289
267 HH21 ARG 33 HH21 ARG 33 27.977 10.771 32.438
268 HH22 ARG 33 HH22 ARG 33 29.055 9.793 33.379
269 H GLU 34 HN GLU 34 24.337 16.214 30.908
270 HA GLU 34 HA GLU 34 25.329 16.516 28.288
271 HB2 GLU 34 HB2 GLU 34 22.928 16.597 28.853
272 HB3 GLU 34 HB1 GLU 34 23.182 18.117 29.708
273 HG2 GLU 34 HG2 GLU 34 22.322 18.557 27.458
274 HG3 GLU 34 HG1 GLU 34 23.971 19.155 27.589
275 H ALA 35 HN ALA 35 25.269 18.728 31.059
276 HA ALA 35 HA ALA 35 26.298 21.001 29.754
277 HB1 ALA 35 HB1 ALA 35 26.955 21.739 32.037
278 HB2 ALA 35 HB2 ALA 35 26.553 20.132 32.643
279 HB3 ALA 35 HB3 ALA 35 25.292 21.158 31.963
280 H GLU 36 HN GLU 36 27.886 18.265 31.327
281 HA GLU 36 HA GLU 36 30.526 19.238 31.262
282 HB2 GLU 36 HB2 GLU 36 29.820 17.257 32.561
283 HB3 GLU 36 HB1 GLU 36 29.577 16.371 31.057
284 HG2 GLU 36 HG2 GLU 36 31.947 16.627 30.490
285 HG3 GLU 36 HG1 GLU 36 32.210 17.586 31.945
286 H ARG 37 HN ARG 37 28.629 17.434 28.874
287 HA ARG 37 HA ARG 37 30.703 16.955 27.030
288 HB2 ARG 37 HB2 ARG 37 27.720 17.263 26.658
289 HB3 ARG 37 HB1 ARG 37 28.814 16.788 25.358
290 HG2 ARG 37 HG2 ARG 37 29.569 14.856 26.686
291 HG3 ARG 37 HG1 ARG 37 28.491 15.332 28.001
292 HD2 ARG 37 HD2 ARG 37 26.547 15.071 26.509
293 HD3 ARG 37 HD1 ARG 37 27.617 14.603 25.191
294 HE ARG 37 HE ARG 37 28.105 12.899 27.381
295 HH11 ARG 37 HH11 ARG 37 27.191 10.819 27.377
296 HH12 ARG 37 HH12 ARG 37 25.820 10.483 26.371
297 HH21 ARG 37 HH21 ARG 37 25.650 13.695 25.076
298 HH22 ARG 37 HH22 ARG 37 24.948 12.111 25.069
299 H LYS 38 HN LYS 38 28.507 19.709 27.434
300 HA LYS 38 HA LYS 38 29.223 21.093 25.081
301 HB2 LYS 38 HB2 LYS 38 28.177 22.066 27.744
302 HB3 LYS 38 HB1 LYS 38 28.407 23.122 26.350
303 HG2 LYS 38 HG2 LYS 38 26.898 21.696 25.016
304 HG3 LYS 38 HG1 LYS 38 26.662 20.641 26.411
305 HD2 LYS 38 HD2 LYS 38 25.717 22.526 27.687
306 HD3 LYS 38 HD1 LYS 38 25.960 23.590 26.301
307 HE2 LYS 38 HE2 LYS 38 24.449 22.188 24.950
308 HE3 LYS 38 HE1 LYS 38 24.209 21.114 26.329
309 HZ1 LYS 38 HZ1 LYS 38 23.246 22.914 27.565
310 HZ2 LYS 38 HZ2 LYS 38 22.430 22.770 26.082
311 HZ3 LYS 38 HZ3 LYS 38 23.565 24.012 26.314
312 H ALA 39 HN ALA 39 30.600 21.093 28.341
313 HA ALA 39 HA ALA 39 32.417 23.221 27.995
314 HB1 ALA 39 HB1 ALA 39 32.011 22.431 30.211
315 HB2 ALA 39 HB2 ALA 39 33.696 22.053 29.851
316 HB3 ALA 39 HB3 ALA 39 32.473 20.783 29.780
317 H LEU 40 HN LEU 40 32.678 19.759 27.321
318 HA LEU 40 HA LEU 40 35.417 19.690 26.688
319 HB2 LEU 40 HB2 LEU 40 34.093 17.661 27.075
320 HB3 LEU 40 HB1 LEU 40 33.151 17.986 25.622
321 HG LEU 40 HG LEU 40 35.198 17.779 24.244
322 HD11 LEU 40 HD11 LEU 40 36.465 17.451 26.961
323 HD12 LEU 40 HD12 LEU 40 37.009 18.417 25.588
324 HD13 LEU 40 HD13 LEU 40 37.189 16.667 25.556
325 HD21 LEU 40 HD21 LEU 40 34.952 15.398 26.099
326 HD22 LEU 40 HD22 LEU 40 35.372 15.393 24.387
327 HD23 LEU 40 HD23 LEU 40 33.731 15.796 24.890
328 H GLU 41 HN GLU 41 32.555 20.265 24.665
329 HA GLU 41 HA GLU 41 34.046 20.514 22.245
330 HB2 GLU 41 HB2 GLU 41 31.228 21.332 22.991
331 HB3 GLU 41 HB1 GLU 41 31.886 21.486 21.362
332 HG2 GLU 41 HG2 GLU 41 32.311 19.084 21.267
333 HG3 GLU 41 HG1 GLU 41 31.761 18.898 22.932
334 H ASP 42 HN ASP 42 34.042 22.662 20.931
335 HA ASP 42 HA ASP 42 34.785 24.822 20.758
336 HB2 ASP 42 HB2 ASP 42 32.853 25.074 23.070
337 HB3 ASP 42 HB1 ASP 42 33.620 26.455 22.287
338 H LYS 43 HN LYS 43 36.380 22.982 22.372
339 HA LYS 43 HA LYS 43 37.295 24.169 24.760
340 HB2 LYS 43 HB2 LYS 43 37.795 21.840 24.123
341 HB3 LYS 43 HB1 LYS 43 38.809 22.420 22.803
342 HG2 LYS 43 HG2 LYS 43 40.296 23.538 24.410
343 HG3 LYS 43 HG1 LYS 43 39.265 23.018 25.743
344 HD2 LYS 43 HD2 LYS 43 39.720 20.669 25.206
345 HD3 LYS 43 HD1 LYS 43 40.703 21.160 23.827
346 HE2 LYS 43 HE2 LYS 43 42.148 20.648 25.740
347 HE3 LYS 43 HE1 LYS 43 42.228 22.370 25.367
348 HZ1 LYS 43 HZ1 LYS 43 40.235 21.425 27.303
349 HZ2 LYS 43 HZ2 LYS 43 41.027 22.926 27.213
350 HZ3 LYS 43 HZ3 LYS 43 41.851 21.560 27.799
351 H LEU 44 HN LEU 44 38.402 24.469 21.402
352 HA LEU 44 HA LEU 44 40.616 26.136 21.895
353 HB2 LEU 44 HB2 LEU 44 40.279 24.967 19.765
354 HB3 LEU 44 HB1 LEU 44 38.853 25.948 19.438
355 HG LEU 44 HG LEU 44 40.256 27.988 19.424
356 HD11 LEU 44 HD11 LEU 44 42.826 27.446 19.257
357 HD12 LEU 44 HD12 LEU 44 42.395 25.996 20.165
358 HD13 LEU 44 HD13 LEU 44 42.078 27.593 20.845
359 HD21 LEU 44 HD21 LEU 44 41.384 25.812 17.638
360 HD22 LEU 44 HD22 LEU 44 41.381 27.545 17.311
361 HD23 LEU 44 HD23 LEU 44 39.862 26.651 17.344
362 H ALA 45 HN ALA 45 37.223 26.896 21.169
363 HA ALA 45 HA ALA 45 37.496 29.686 20.976
364 HB1 ALA 45 HB1 ALA 45 35.064 28.294 22.092
365 HB2 ALA 45 HB2 ALA 45 35.471 28.240 20.377
366 HB3 ALA 45 HB3 ALA 45 35.136 29.787 21.154
367 H ASP 46 HN ASP 46 36.923 27.590 23.779
368 HA ASP 46 HA ASP 46 36.925 29.912 25.584
369 HB2 ASP 46 HB2 ASP 46 36.393 26.967 25.999
370 HB3 ASP 46 HB1 ASP 46 36.479 28.128 27.323
371 H LYS 47 HN LYS 47 38.650 30.506 26.749
372 HA LYS 47 HA LYS 47 40.648 28.690 27.661
373 HB2 LYS 47 HB2 LYS 47 42.537 29.512 26.329
374 HB3 LYS 47 HB1 LYS 47 41.318 28.770 25.293
375 HG2 LYS 47 HG2 LYS 47 40.395 31.023 24.797
376 HG3 LYS 47 HG1 LYS 47 41.666 31.745 25.781
377 HD2 LYS 47 HD2 LYS 47 43.371 30.696 24.305
378 HD3 LYS 47 HD1 LYS 47 42.073 30.074 23.285
379 HE2 LYS 47 HE2 LYS 47 42.561 33.006 23.887
380 HE3 LYS 47 HE1 LYS 47 43.008 32.191 22.389
381 HZ1 LYS 47 HZ1 LYS 47 40.324 32.804 23.434
382 HZ2 LYS 47 HZ2 LYS 47 40.540 31.513 22.352
383 HZ3 LYS 47 HZ3 LYS 47 40.962 33.091 21.889
384 H GLN 48 HN GLN 48 38.910 31.322 28.060
385 HA GLN 48 HA GLN 48 41.002 33.023 29.254
386 HB2 GLN 48 HB2 GLN 48 38.055 33.501 28.758
387 HB3 GLN 48 HB1 GLN 48 39.150 34.664 29.510
388 HG2 GLN 48 HG2 GLN 48 40.562 34.642 27.484
389 HG3 GLN 48 HG1 GLN 48 39.460 33.490 26.731
390 HE21 GLN 48 HE21 GLN 48 38.501 34.767 25.098
391 HE22 GLN 48 HE22 GLN 48 37.679 36.222 25.400
392 H GLU 49 HN GLU 49 41.443 32.857 31.337
393 HA GLU 49 HA GLU 49 41.294 32.287 33.557
394 HB2 GLU 49 HB2 GLU 49 38.471 33.247 33.054
395 HB3 GLU 49 HB1 GLU 49 39.153 32.954 34.654
396 HG2 GLU 49 HG2 GLU 49 40.917 34.609 34.224
397 HG3 GLU 49 HG1 GLU 49 40.274 34.887 32.606
398 H HIS 50 HN HIS 50 40.924 30.104 31.721
399 HA HIS 50 HA HIS 50 38.869 28.436 33.032
400 HB2 HIS 50 HB2 HIS 50 40.466 28.060 30.489
401 HB3 HIS 50 HB1 HIS 50 39.339 26.877 31.142
402 HD2 HIS 50 HD2 HIS 50 36.611 27.485 30.744
403 HE1 HIS 50 HE1 HIS 50 37.227 31.147 28.734
404 HE2 HIS 50 HE2 HIS 50 35.488 29.418 29.394
405 H LEU 51 HN LEU 51 39.810 27.721 34.911
406 HA LEU 51 HA LEU 51 42.533 26.959 35.167
407 HB2 LEU 51 HB2 LEU 51 40.084 26.283 36.807
408 HB3 LEU 51 HB1 LEU 51 41.706 25.763 37.250
409 HG LEU 51 HG LEU 51 40.938 28.665 36.784
410 HD11 LEU 51 HD11 LEU 51 41.154 27.087 39.364
411 HD12 LEU 51 HD12 LEU 51 39.685 27.789 38.688
412 HD13 LEU 51 HD13 LEU 51 40.977 28.839 39.268
413 HD21 LEU 51 HD21 LEU 51 43.093 28.839 38.328
414 HD22 LEU 51 HD22 LEU 51 43.269 28.604 36.594
415 HD23 LEU 51 HD23 LEU 51 43.433 27.232 37.688
416 H ASP 52 HN ASP 52 39.579 25.153 34.460
417 HA ASP 52 HA ASP 52 41.148 23.034 33.226
418 HB2 ASP 52 HB2 ASP 52 40.149 21.242 34.551
419 HB3 ASP 52 HB1 ASP 52 41.047 22.340 35.597
420 H GLY 53 HN GLY 53 38.798 25.127 32.943
421 HA2 GLY 53 HA2 GLY 53 37.145 25.272 31.309
422 HA3 GLY 53 HA1 GLY 53 37.339 23.551 30.994
423 H ALA 54 HN ALA 54 37.094 23.888 34.258
424 HA ALA 54 HA ALA 54 34.579 22.636 34.460
425 HB1 ALA 54 HB1 ALA 54 36.215 24.144 36.508
426 HB2 ALA 54 HB2 ALA 54 36.187 22.401 36.240
427 HB3 ALA 54 HB3 ALA 54 34.766 23.215 36.895
428 H LEU 55 HN LEU 55 35.551 26.026 34.746
429 HA LEU 55 HA LEU 55 33.088 27.053 35.656
430 HB2 LEU 55 HB2 LEU 55 35.302 28.313 34.030
431 HB3 LEU 55 HB1 LEU 55 33.929 29.217 34.661
432 HG LEU 55 HG LEU 55 35.801 27.562 36.383
433 HD11 LEU 55 HD11 LEU 55 37.125 29.335 35.490
434 HD12 LEU 55 HD12 LEU 55 36.629 29.874 37.094
435 HD13 LEU 55 HD13 LEU 55 35.813 30.501 35.662
436 HD21 LEU 55 HD21 LEU 55 33.874 27.823 37.678
437 HD22 LEU 55 HD22 LEU 55 33.434 29.351 36.919
438 HD23 LEU 55 HD23 LEU 55 34.735 29.297 38.104
439 H ARG 56 HN ARG 56 34.328 26.442 32.400
440 HA ARG 56 HA ARG 56 32.229 27.682 30.991
441 HB2 ARG 56 HB2 ARG 56 34.304 27.094 29.878
442 HB3 ARG 56 HB1 ARG 56 34.049 25.389 30.219
443 HG2 ARG 56 HG2 ARG 56 33.470 25.896 27.887
444 HG3 ARG 56 HG1 ARG 56 32.035 25.401 28.771
445 HD2 ARG 56 HD2 ARG 56 31.272 27.680 28.956
446 HD3 ARG 56 HD1 ARG 56 32.806 28.303 28.355
447 HE ARG 56 HE ARG 56 31.798 26.630 26.374
448 HH11 ARG 56 HH11 ARG 56 30.589 27.475 24.646
449 HH12 ARG 56 HH12 ARG 56 29.782 28.998 24.823
450 HH21 ARG 56 HH21 ARG 56 30.857 29.487 28.083
451 HH22 ARG 56 HH22 ARG 56 29.935 30.137 26.769
452 H TYR 57 HN TYR 57 30.196 27.060 30.536
453 HA TYR 57 HA TYR 57 29.131 24.701 31.823
454 HB2 TYR 57 HB2 TYR 57 27.803 26.735 31.805
455 HB3 TYR 57 HB1 TYR 57 27.847 26.787 30.044
456 HD1 TYR 57 HD1 TYR 57 26.706 24.726 32.938
457 HD2 TYR 57 HD2 TYR 57 26.274 25.571 28.748
458 HE1 TYR 57 HE1 TYR 57 24.708 23.260 32.848
459 HE2 TYR 57 HE2 TYR 57 24.276 24.105 28.659
460 HH TYR 57 HH TYR 57 22.492 23.291 30.970
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 -6.532 -18.449 44.489
2 H2 GLY 1 HT2 GLY 1 -8.169 -18.035 44.686
3 H3 GLY 1 HT3 GLY 1 -6.979 -17.292 45.645
4 HA2 GLY 1 HA2 GLY 1 -6.482 -16.976 42.840
5 HA3 GLY 1 HA1 GLY 1 -8.020 -16.280 43.349
6 H SER 2 HN SER 2 -7.329 -15.620 46.004
7 HA SER 2 HA SER 2 -6.162 -13.078 45.658
8 HB2 SER 2 HB2 SER 2 -6.600 -14.725 48.156
9 HB3 SER 2 HB1 SER 2 -6.087 -13.040 48.161
10 HG SER 2 HG SER 2 -8.162 -12.681 48.083
11 H ALA 3 HN ALA 3 -4.833 -16.153 46.803
12 HA ALA 3 HA ALA 3 -2.316 -15.203 47.635
13 HB1 ALA 3 HB1 ALA 3 -3.222 -17.894 46.604
14 HB2 ALA 3 HB2 ALA 3 -2.959 -17.407 48.279
15 HB3 ALA 3 HB3 ALA 3 -1.585 -17.594 47.189
16 H GLY 4 HN GLY 4 -3.499 -16.290 44.481
17 HA2 GLY 4 HA2 GLY 4 -2.626 -16.077 42.363
18 HA3 GLY 4 HA1 GLY 4 -1.749 -14.683 42.988
19 H LEU 5 HN LEU 5 0.311 -14.901 42.364
20 HA LEU 5 HA LEU 5 1.634 -17.545 42.636
21 HB2 LEU 5 HB2 LEU 5 2.441 -15.154 40.960
22 HB3 LEU 5 HB1 LEU 5 3.253 -16.720 40.999
23 HG LEU 5 HG LEU 5 0.378 -16.268 40.146
24 HD11 LEU 5 HD11 LEU 5 1.186 -16.706 37.883
25 HD12 LEU 5 HD12 LEU 5 2.826 -16.944 38.488
26 HD13 LEU 5 HD13 LEU 5 2.078 -15.348 38.570
27 HD21 LEU 5 HD21 LEU 5 2.116 -18.713 40.465
28 HD22 LEU 5 HD22 LEU 5 0.870 -18.693 39.217
29 HD23 LEU 5 HD23 LEU 5 0.424 -18.486 40.907
30 H GLN 6 HN GLN 6 3.436 -17.748 43.859
31 HA GLN 6 HA GLN 6 4.990 -15.534 44.780
32 HB2 GLN 6 HB2 GLN 6 4.438 -15.729 47.183
33 HB3 GLN 6 HB1 GLN 6 3.060 -15.179 46.234
34 HG2 GLN 6 HG2 GLN 6 2.126 -16.837 47.615
35 HG3 GLN 6 HG1 GLN 6 2.412 -17.693 46.103
36 HE21 GLN 6 HE21 GLN 6 2.670 -19.769 47.192
37 HE22 GLN 6 HE22 GLN 6 4.041 -20.107 48.134
38 H GLU 7 HN GLU 7 4.816 -18.523 43.812
39 HA GLU 7 HA GLU 7 6.201 -20.082 45.725
40 HB2 GLU 7 HB2 GLU 7 5.976 -20.303 42.722
41 HB3 GLU 7 HB1 GLU 7 6.848 -21.480 43.704
42 HG2 GLU 7 HG2 GLU 7 4.848 -22.024 44.948
43 HG3 GLU 7 HG1 GLU 7 3.950 -20.717 44.180
44 H LYS 8 HN LYS 8 7.310 -17.978 43.109
45 HA LYS 8 HA LYS 8 10.090 -18.626 43.491
46 HB2 LYS 8 HB2 LYS 8 8.700 -16.417 41.963
47 HB3 LYS 8 HB1 LYS 8 10.450 -16.631 41.990
48 HG2 LYS 8 HG2 LYS 8 10.190 -18.914 41.089
49 HG3 LYS 8 HG1 LYS 8 8.440 -18.703 41.055
50 HD2 LYS 8 HD2 LYS 8 8.692 -16.810 39.495
51 HD3 LYS 8 HD1 LYS 8 10.443 -17.019 39.526
52 HE2 LYS 8 HE2 LYS 8 10.195 -19.298 38.617
53 HE3 LYS 8 HE1 LYS 8 8.442 -19.099 38.592
54 HZ1 LYS 8 HZ1 LYS 8 10.481 -17.750 36.944
55 HZ2 LYS 8 HZ2 LYS 8 8.965 -17.027 37.194
56 HZ3 LYS 8 HZ3 LYS 8 9.070 -18.551 36.451
57 H GLU 9 HN GLU 9 11.623 -17.542 44.645
58 HA GLU 9 HA GLU 9 10.746 -15.207 46.259
59 HB2 GLU 9 HB2 GLU 9 10.874 -17.246 47.650
60 HB3 GLU 9 HB1 GLU 9 12.541 -17.486 47.137
61 HG2 GLU 9 HG2 GLU 9 12.492 -16.396 49.328
62 HG3 GLU 9 HG1 GLU 9 13.147 -15.286 48.131
63 H ARG 10 HN ARG 10 13.537 -16.986 44.948
64 HA ARG 10 HA ARG 10 15.469 -14.991 45.385
65 HB2 ARG 10 HB2 ARG 10 16.023 -17.321 44.801
66 HB3 ARG 10 HB1 ARG 10 15.366 -17.068 43.185
67 HG2 ARG 10 HG2 ARG 10 17.040 -15.343 42.732
68 HG3 ARG 10 HG1 ARG 10 17.659 -15.483 44.378
69 HD2 ARG 10 HD2 ARG 10 19.078 -16.756 42.842
70 HD3 ARG 10 HD1 ARG 10 18.244 -17.851 43.941
71 HE ARG 10 HE ARG 10 17.043 -18.694 42.126
72 HH11 ARG 10 HH11 ARG 10 16.636 -18.884 39.901
73 HH12 ARG 10 HH12 ARG 10 17.236 -17.679 38.810
74 HH21 ARG 10 HH21 ARG 10 18.725 -15.784 41.303
75 HH22 ARG 10 HH22 ARG 10 18.418 -15.923 39.605
76 H GLU 11 HN GLU 11 13.377 -15.624 42.583
77 HA GLU 11 HA GLU 11 14.437 -13.613 40.908
78 HB2 GLU 11 HB2 GLU 11 11.697 -14.898 41.019
79 HB3 GLU 11 HB1 GLU 11 12.189 -13.770 39.759
80 HG2 GLU 11 HG2 GLU 11 12.664 -15.867 38.807
81 HG3 GLU 11 HG1 GLU 11 14.229 -15.352 39.426
82 H LEU 12 HN LEU 12 11.855 -13.553 43.333
83 HA LEU 12 HA LEU 12 10.917 -10.943 42.791
84 HB2 LEU 12 HB2 LEU 12 10.909 -12.583 45.330
85 HB3 LEU 12 HB1 LEU 12 10.086 -11.036 45.172
86 HG LEU 12 HG LEU 12 9.584 -13.418 43.361
87 HD11 LEU 12 HD11 LEU 12 7.846 -12.407 45.627
88 HD12 LEU 12 HD12 LEU 12 8.949 -13.773 45.785
89 HD13 LEU 12 HD13 LEU 12 7.599 -13.857 44.654
90 HD21 LEU 12 HD21 LEU 12 7.372 -11.949 43.095
91 HD22 LEU 12 HD22 LEU 12 8.806 -11.587 42.141
92 HD23 LEU 12 HD23 LEU 12 8.445 -10.637 43.582
93 H GLU 13 HN GLU 13 13.494 -12.159 44.880
94 HA GLU 13 HA GLU 13 14.102 -9.698 46.146
95 HB2 GLU 13 HB2 GLU 13 15.776 -12.162 45.633
96 HB3 GLU 13 HB1 GLU 13 16.357 -10.779 46.558
97 HG2 GLU 13 HG2 GLU 13 13.806 -12.277 47.227
98 HG3 GLU 13 HG1 GLU 13 15.367 -12.631 47.963
99 H ASP 14 HN ASP 14 15.251 -11.203 43.160
100 HA ASP 14 HA ASP 14 17.317 -9.385 42.573
101 HB2 ASP 14 HB2 ASP 14 16.992 -11.543 41.402
102 HB3 ASP 14 HB1 ASP 14 15.547 -10.889 40.632
103 H LEU 15 HN LEU 15 13.866 -9.354 41.738
104 HA LEU 15 HA LEU 15 13.920 -7.032 40.129
105 HB2 LEU 15 HB2 LEU 15 11.718 -8.275 41.786
106 HB3 LEU 15 HB1 LEU 15 11.461 -6.914 40.698
107 HG LEU 15 HG LEU 15 12.645 -9.573 39.835
108 HD11 LEU 15 HD11 LEU 15 9.814 -8.546 39.473
109 HD12 LEU 15 HD12 LEU 15 10.292 -9.775 40.642
110 HD13 LEU 15 HD13 LEU 15 10.448 -10.095 38.916
111 HD21 LEU 15 HD21 LEU 15 11.708 -8.541 37.564
112 HD22 LEU 15 HD22 LEU 15 13.289 -8.065 38.171
113 HD23 LEU 15 HD23 LEU 15 11.897 -7.014 38.427
114 H LYS 16 HN LYS 16 13.492 -7.508 43.605
115 HA LYS 16 HA LYS 16 12.799 -4.871 44.281
116 HB2 LYS 16 HB2 LYS 16 12.563 -6.739 45.848
117 HB3 LYS 16 HB1 LYS 16 14.311 -6.941 45.895
118 HG2 LYS 16 HG2 LYS 16 13.521 -5.697 47.866
119 HG3 LYS 16 HG1 LYS 16 14.549 -4.677 46.866
120 HD2 LYS 16 HD2 LYS 16 12.724 -3.422 46.050
121 HD3 LYS 16 HD1 LYS 16 11.551 -4.663 46.500
122 HE2 LYS 16 HE2 LYS 16 11.436 -2.757 48.052
123 HE3 LYS 16 HE1 LYS 16 12.007 -4.199 48.891
124 HZ1 LYS 16 HZ1 LYS 16 14.315 -3.219 48.105
125 HZ2 LYS 16 HZ2 LYS 16 13.585 -2.747 49.565
126 HZ3 LYS 16 HZ3 LYS 16 13.448 -1.763 48.186
127 H ASP 17 HN ASP 17 15.964 -6.460 44.032
128 HA ASP 17 HA ASP 17 17.537 -4.301 44.915
129 HB2 ASP 17 HB2 ASP 17 18.377 -6.614 44.649
130 HB3 ASP 17 HB1 ASP 17 18.266 -6.436 42.899
131 H ALA 18 HN ALA 18 16.411 -5.203 41.672
132 HA ALA 18 HA ALA 18 17.801 -3.226 40.231
133 HB1 ALA 18 HB1 ALA 18 16.000 -3.570 38.511
134 HB2 ALA 18 HB2 ALA 18 15.177 -4.617 39.666
135 HB3 ALA 18 HB3 ALA 18 16.772 -5.058 39.057
136 H GLU 19 HN GLU 19 14.643 -3.183 41.834
137 HA GLU 19 HA GLU 19 13.787 -0.662 40.894
138 HB2 GLU 19 HB2 GLU 19 13.126 -2.208 43.405
139 HB3 GLU 19 HB1 GLU 19 12.335 -0.694 42.967
140 HG2 GLU 19 HG2 GLU 19 11.517 -1.650 40.897
141 HG3 GLU 19 HG1 GLU 19 12.447 -3.124 41.160
142 H LEU 20 HN LEU 20 15.724 -1.616 43.696
143 HA LEU 20 HA LEU 20 15.826 0.891 44.970
144 HB2 LEU 20 HB2 LEU 20 16.540 -1.184 46.069
145 HB3 LEU 20 HB1 LEU 20 17.880 -1.335 44.936
146 HG LEU 20 HG LEU 20 18.829 0.794 45.770
147 HD11 LEU 20 HD11 LEU 20 16.298 0.775 47.408
148 HD12 LEU 20 HD12 LEU 20 17.038 2.108 46.522
149 HD13 LEU 20 HD13 LEU 20 17.743 1.565 48.041
150 HD21 LEU 20 HD21 LEU 20 19.424 -0.031 48.052
151 HD22 LEU 20 HD22 LEU 20 19.546 -1.288 46.821
152 HD23 LEU 20 HD23 LEU 20 18.159 -1.250 47.908
153 H LYS 21 HN LYS 21 17.940 -0.584 42.527
154 HA LYS 21 HA LYS 21 19.848 1.484 42.394
155 HB2 LYS 21 HB2 LYS 21 20.138 -0.767 41.398
156 HB3 LYS 21 HB1 LYS 21 18.943 -0.363 40.169
157 HG2 LYS 21 HG2 LYS 21 20.366 1.567 39.463
158 HG3 LYS 21 HG1 LYS 21 21.582 1.062 40.632
159 HD2 LYS 21 HD2 LYS 21 20.560 -0.788 38.469
160 HD3 LYS 21 HD1 LYS 21 21.930 0.290 38.210
161 HE2 LYS 21 HE2 LYS 21 23.018 -0.751 40.244
162 HE3 LYS 21 HE1 LYS 21 21.718 -1.939 40.252
163 HZ1 LYS 21 HZ1 LYS 21 23.144 -1.482 37.744
164 HZ2 LYS 21 HZ2 LYS 21 22.444 -2.906 38.352
165 HZ3 LYS 21 HZ3 LYS 21 23.936 -2.365 38.957
166 H ARG 22 HN ARG 22 16.818 0.962 40.619
167 HA ARG 22 HA ARG 22 17.031 3.141 38.853
168 HB2 ARG 22 HB2 ARG 22 15.367 1.332 38.603
169 HB3 ARG 22 HB1 ARG 22 14.526 1.920 40.037
170 HG2 ARG 22 HG2 ARG 22 14.092 4.067 38.938
171 HG3 ARG 22 HG1 ARG 22 14.999 3.543 37.520
172 HD2 ARG 22 HD2 ARG 22 13.394 1.715 37.157
173 HD3 ARG 22 HD1 ARG 22 12.497 2.206 38.591
174 HE ARG 22 HE ARG 22 12.689 4.426 36.873
175 HH11 ARG 22 HH11 ARG 22 10.915 4.962 35.558
176 HH12 ARG 22 HH12 ARG 22 9.718 3.763 35.199
177 HH21 ARG 22 HH21 ARG 22 11.279 1.271 37.036
178 HH22 ARG 22 HH22 ARG 22 9.924 1.674 36.035
179 H LEU 23 HN LEU 23 15.612 2.896 42.100
180 HA LEU 23 HA LEU 23 14.614 5.535 42.242
181 HB2 LEU 23 HB2 LEU 23 15.515 3.611 44.394
182 HB3 LEU 23 HB1 LEU 23 14.740 5.154 44.738
183 HG LEU 23 HG LEU 23 13.521 3.004 42.980
184 HD11 LEU 23 HD11 LEU 23 13.168 3.612 45.923
185 HD12 LEU 23 HD12 LEU 23 13.665 2.086 45.190
186 HD13 LEU 23 HD13 LEU 23 12.010 2.662 44.996
187 HD21 LEU 23 HD21 LEU 23 11.414 4.436 43.762
188 HD22 LEU 23 HD22 LEU 23 12.391 4.963 42.398
189 HD23 LEU 23 HD23 LEU 23 12.623 5.700 43.981
190 H ASN 24 HN ASN 24 17.756 4.135 43.061
191 HA ASN 24 HA ASN 24 18.881 6.392 44.309
192 HB2 ASN 24 HB2 ASN 24 19.887 4.131 44.368
193 HB3 ASN 24 HB1 ASN 24 20.284 4.280 42.656
194 HD21 ASN 24 HD21 ASN 24 22.426 4.885 42.364
195 HD22 ASN 24 HD22 ASN 24 23.298 5.915 43.394
196 H GLU 25 HN GLU 25 18.788 5.404 40.905
197 HA GLU 25 HA GLU 25 20.382 7.586 39.968
198 HB2 GLU 25 HB2 GLU 25 18.483 5.701 38.560
199 HB3 GLU 25 HB1 GLU 25 19.457 6.911 37.724
200 HG2 GLU 25 HG2 GLU 25 21.510 5.904 38.567
201 HG3 GLU 25 HG1 GLU 25 20.585 4.756 39.531
202 H GLU 26 HN GLU 26 19.764 9.525 39.071
203 HA GLU 26 HA GLU 26 16.890 10.251 39.205
204 HB2 GLU 26 HB2 GLU 26 19.250 11.879 40.176
205 HB3 GLU 26 HB1 GLU 26 17.608 12.500 40.008
206 HG2 GLU 26 HG2 GLU 26 16.789 10.808 41.590
207 HG3 GLU 26 HG1 GLU 26 18.416 10.147 41.741
208 H ARG 27 HN ARG 27 16.181 11.711 37.661
209 HA ARG 27 HA ARG 27 17.611 11.715 35.185
210 HB2 ARG 27 HB2 ARG 27 15.096 13.130 36.090
211 HB3 ARG 27 HB1 ARG 27 15.724 13.216 34.444
212 HG2 ARG 27 HG2 ARG 27 15.596 10.763 34.257
213 HG3 ARG 27 HG1 ARG 27 14.977 10.667 35.906
214 HD2 ARG 27 HD2 ARG 27 13.024 12.023 35.256
215 HD3 ARG 27 HD1 ARG 27 13.641 12.129 33.610
216 HE ARG 27 HE ARG 27 13.446 9.407 34.321
217 HH11 ARG 27 HH11 ARG 27 11.671 8.203 33.571
218 HH12 ARG 27 HH12 ARG 27 10.231 9.020 33.066
219 HH21 ARG 27 HH21 ARG 27 11.477 12.188 33.725
220 HH22 ARG 27 HH22 ARG 27 10.120 11.277 33.152
221 H HIS 28 HN HIS 28 17.628 13.742 37.931
222 HA HIS 28 HA HIS 28 18.192 16.250 36.777
223 HB2 HIS 28 HB2 HIS 28 18.922 15.034 39.443
224 HB3 HIS 28 HB1 HIS 28 19.314 16.699 39.014
225 HD2 HIS 28 HD2 HIS 28 17.163 18.482 39.179
226 HE1 HIS 28 HE1 HIS 28 14.171 15.624 40.014
227 HE2 HIS 28 HE2 HIS 28 14.665 18.109 39.843
228 H ASP 29 HN ASP 29 20.298 13.539 37.652
229 HA ASP 29 HA ASP 29 22.755 14.882 37.199
230 HB2 ASP 29 HB2 ASP 29 23.749 12.649 37.160
231 HB3 ASP 29 HB1 ASP 29 22.584 12.778 38.476
232 H HIS 30 HN HIS 30 20.376 13.636 35.058
233 HA HIS 30 HA HIS 30 21.955 12.970 32.823
234 HB2 HIS 30 HB2 HIS 30 19.499 12.493 33.087
235 HB3 HIS 30 HB1 HIS 30 19.191 14.198 32.764
236 HD2 HIS 30 HD2 HIS 30 20.103 10.958 30.815
237 HE1 HIS 30 HE1 HIS 30 20.053 14.129 28.029
238 HE2 HIS 30 HE2 HIS 30 20.191 11.607 28.287
239 H ASP 31 HN ASP 31 20.513 16.047 33.846
240 HA ASP 31 HA ASP 31 21.280 17.582 31.611
241 HB2 ASP 31 HB2 ASP 31 20.751 18.327 34.491
242 HB3 ASP 31 HB1 ASP 31 21.096 19.522 33.240
243 H LYS 32 HN LYS 32 22.953 16.781 34.616
244 HA LYS 32 HA LYS 32 25.152 18.513 34.347
245 HB2 LYS 32 HB2 LYS 32 24.631 17.273 36.419
246 HB3 LYS 32 HB1 LYS 32 25.065 15.765 35.617
247 HG2 LYS 32 HG2 LYS 32 27.359 16.580 35.275
248 HG3 LYS 32 HG1 LYS 32 26.933 18.121 36.022
249 HD2 LYS 32 HD2 LYS 32 26.386 16.939 38.125
250 HD3 LYS 32 HD1 LYS 32 26.841 15.408 37.376
251 HE2 LYS 32 HE2 LYS 32 28.691 17.787 37.711
252 HE3 LYS 32 HE1 LYS 32 28.683 16.362 38.751
253 HZ1 LYS 32 HZ1 LYS 32 29.819 15.203 37.255
254 HZ2 LYS 32 HZ2 LYS 32 30.108 16.668 36.443
255 HZ3 LYS 32 HZ3 LYS 32 28.805 15.680 35.980
256 H ARG 33 HN ARG 33 24.590 15.232 33.133
257 HA ARG 33 HA ARG 33 27.151 14.746 32.086
258 HB2 ARG 33 HB2 ARG 33 25.426 13.001 32.321
259 HB3 ARG 33 HB1 ARG 33 24.476 13.772 31.051
260 HG2 ARG 33 HG2 ARG 33 26.240 13.388 29.423
261 HG3 ARG 33 HG1 ARG 33 27.310 12.762 30.678
262 HD2 ARG 33 HD2 ARG 33 25.782 10.893 31.084
263 HD3 ARG 33 HD1 ARG 33 24.654 11.532 29.892
264 HE ARG 33 HE ARG 33 27.101 11.214 28.593
265 HH11 ARG 33 HH11 ARG 33 27.512 9.346 27.367
266 HH12 ARG 33 HH12 ARG 33 26.621 7.895 27.683
267 HH21 ARG 33 HH21 ARG 33 24.743 9.292 30.243
268 HH22 ARG 33 HH22 ARG 33 25.053 7.865 29.311
269 H GLU 34 HN GLU 34 24.297 16.285 30.642
270 HA GLU 34 HA GLU 34 25.376 16.647 28.052
271 HB2 GLU 34 HB2 GLU 34 23.234 18.141 29.572
272 HB3 GLU 34 HB1 GLU 34 23.659 18.520 27.905
273 HG2 GLU 34 HG2 GLU 34 23.049 16.307 27.169
274 HG3 GLU 34 HG1 GLU 34 22.835 15.751 28.827
275 H ALA 35 HN ALA 35 25.457 18.642 30.969
276 HA ALA 35 HA ALA 35 26.619 20.944 29.845
277 HB1 ALA 35 HB1 ALA 35 25.679 21.107 32.027
278 HB2 ALA 35 HB2 ALA 35 27.416 21.353 32.220
279 HB3 ALA 35 HB3 ALA 35 26.693 19.800 32.636
280 H GLU 36 HN GLU 36 28.078 18.005 31.183
281 HA GLU 36 HA GLU 36 30.752 18.871 31.188
282 HB2 GLU 36 HB2 GLU 36 29.978 16.817 32.314
283 HB3 GLU 36 HB1 GLU 36 29.684 16.072 30.743
284 HG2 GLU 36 HG2 GLU 36 32.061 16.264 30.176
285 HG3 GLU 36 HG1 GLU 36 32.376 17.093 31.700
286 H ARG 37 HN ARG 37 28.865 17.220 28.652
287 HA ARG 37 HA ARG 37 30.997 16.997 26.807
288 HB2 ARG 37 HB2 ARG 37 28.001 17.034 26.433
289 HB3 ARG 37 HB1 ARG 37 29.131 16.774 25.103
290 HG2 ARG 37 HG2 ARG 37 30.080 14.831 26.246
291 HG3 ARG 37 HG1 ARG 37 29.033 15.109 27.637
292 HD2 ARG 37 HD2 ARG 37 27.990 14.605 24.843
293 HD3 ARG 37 HD1 ARG 37 28.213 13.331 26.037
294 HE ARG 37 HE ARG 37 26.666 15.342 27.228
295 HH11 ARG 37 HH11 ARG 37 24.408 15.097 27.324
296 HH12 ARG 37 HH12 ARG 37 23.610 14.036 26.213
297 HH21 ARG 37 HH21 ARG 37 26.531 13.087 24.606
298 HH22 ARG 37 HH22 ARG 37 24.812 12.899 24.674
299 H LYS 38 HN LYS 38 28.587 19.533 27.357
300 HA LYS 38 HA LYS 38 29.200 21.108 25.095
301 HB2 LYS 38 HB2 LYS 38 28.065 21.832 27.801
302 HB3 LYS 38 HB1 LYS 38 28.219 22.987 26.477
303 HG2 LYS 38 HG2 LYS 38 26.833 21.540 25.043
304 HG3 LYS 38 HG1 LYS 38 26.681 20.375 26.357
305 HD2 LYS 38 HD2 LYS 38 25.594 22.105 27.755
306 HD3 LYS 38 HD1 LYS 38 25.722 23.251 26.422
307 HE2 LYS 38 HE2 LYS 38 24.230 20.614 26.302
308 HE3 LYS 38 HE1 LYS 38 23.474 22.192 26.525
309 HZ1 LYS 38 HZ1 LYS 38 25.273 22.119 24.296
310 HZ2 LYS 38 HZ2 LYS 38 23.664 22.657 24.373
311 HZ3 LYS 38 HZ3 LYS 38 24.001 21.009 24.138
312 H ALA 39 HN ALA 39 30.561 21.021 28.361
313 HA ALA 39 HA ALA 39 32.199 23.303 28.159
314 HB1 ALA 39 HB1 ALA 39 32.415 20.777 29.797
315 HB2 ALA 39 HB2 ALA 39 31.878 22.373 30.321
316 HB3 ALA 39 HB3 ALA 39 33.578 22.096 29.940
317 H LEU 40 HN LEU 40 32.759 19.917 27.293
318 HA LEU 40 HA LEU 40 35.497 20.158 26.634
319 HB2 LEU 40 HB2 LEU 40 33.359 18.249 25.670
320 HB3 LEU 40 HB1 LEU 40 35.063 18.087 25.255
321 HG LEU 40 HG LEU 40 34.019 18.204 28.101
322 HD11 LEU 40 HD11 LEU 40 34.270 15.790 28.164
323 HD12 LEU 40 HD12 LEU 40 34.891 15.773 26.513
324 HD13 LEU 40 HD13 LEU 40 33.210 16.207 26.818
325 HD21 LEU 40 HD21 LEU 40 36.283 18.749 28.276
326 HD22 LEU 40 HD22 LEU 40 36.731 17.829 26.839
327 HD23 LEU 40 HD23 LEU 40 36.382 16.994 28.352
328 H GLU 41 HN GLU 41 32.544 20.613 24.751
329 HA GLU 41 HA GLU 41 33.914 21.007 22.272
330 HB2 GLU 41 HB2 GLU 41 31.082 21.612 23.159
331 HB3 GLU 41 HB1 GLU 41 31.655 21.848 21.509
332 HG2 GLU 41 HG2 GLU 41 32.243 19.482 21.336
333 HG3 GLU 41 HG1 GLU 41 31.768 19.221 23.014
334 H ASP 42 HN ASP 42 33.648 23.194 21.019
335 HA ASP 42 HA ASP 42 34.115 25.425 20.859
336 HB2 ASP 42 HB2 ASP 42 31.918 25.458 22.181
337 HB3 ASP 42 HB1 ASP 42 32.914 25.735 23.609
338 H LYS 43 HN LYS 43 35.857 23.453 22.475
339 HA LYS 43 HA LYS 43 37.212 24.917 24.483
340 HB2 LYS 43 HB2 LYS 43 37.372 22.466 24.251
341 HB3 LYS 43 HB1 LYS 43 38.243 22.670 22.733
342 HG2 LYS 43 HG2 LYS 43 40.048 23.859 23.905
343 HG3 LYS 43 HG1 LYS 43 39.166 23.721 25.427
344 HD2 LYS 43 HD2 LYS 43 39.273 21.255 25.254
345 HD3 LYS 43 HD1 LYS 43 40.180 21.408 23.749
346 HE2 LYS 43 HE2 LYS 43 41.069 22.524 26.426
347 HE3 LYS 43 HE1 LYS 43 41.669 21.029 25.708
348 HZ1 LYS 43 HZ1 LYS 43 43.219 22.573 25.031
349 HZ2 LYS 43 HZ2 LYS 43 42.070 23.807 24.817
350 HZ3 LYS 43 HZ3 LYS 43 42.172 22.534 23.696
351 H LEU 44 HN LEU 44 37.832 24.482 21.019
352 HA LEU 44 HA LEU 44 40.266 25.904 20.907
353 HB2 LEU 44 HB2 LEU 44 38.153 25.375 18.813
354 HB3 LEU 44 HB1 LEU 44 39.700 26.133 18.455
355 HG LEU 44 HG LEU 44 39.413 23.424 19.791
356 HD11 LEU 44 HD11 LEU 44 38.497 23.409 17.492
357 HD12 LEU 44 HD12 LEU 44 39.988 22.471 17.597
358 HD13 LEU 44 HD13 LEU 44 40.011 24.088 16.890
359 HD21 LEU 44 HD21 LEU 44 41.868 23.354 18.752
360 HD22 LEU 44 HD22 LEU 44 41.582 24.112 20.312
361 HD23 LEU 44 HD23 LEU 44 41.736 25.109 18.866
362 H ALA 45 HN ALA 45 36.907 26.966 20.565
363 HA ALA 45 HA ALA 45 37.421 29.585 19.683
364 HB1 ALA 45 HB1 ALA 45 35.192 28.821 19.518
365 HB2 ALA 45 HB2 ALA 45 35.146 30.063 20.770
366 HB3 ALA 45 HB3 ALA 45 35.139 28.358 21.218
367 H ASP 46 HN ASP 46 37.208 28.233 22.960
368 HA ASP 46 HA ASP 46 38.793 30.438 23.987
369 HB2 ASP 46 HB2 ASP 46 37.157 31.162 25.648
370 HB3 ASP 46 HB1 ASP 46 36.491 31.358 24.029
371 H LYS 47 HN LYS 47 39.270 30.125 26.340
372 HA LYS 47 HA LYS 47 39.844 27.334 26.840
373 HB2 LYS 47 HB2 LYS 47 40.378 29.828 28.459
374 HB3 LYS 47 HB1 LYS 47 40.964 28.219 28.885
375 HG2 LYS 47 HG2 LYS 47 42.047 28.124 26.589
376 HG3 LYS 47 HG1 LYS 47 41.650 29.830 26.412
377 HD2 LYS 47 HD2 LYS 47 43.263 28.743 28.735
378 HD3 LYS 47 HD1 LYS 47 44.000 29.350 27.254
379 HE2 LYS 47 HE2 LYS 47 42.225 30.935 29.142
380 HE3 LYS 47 HE1 LYS 47 43.963 31.114 28.944
381 HZ1 LYS 47 HZ1 LYS 47 43.511 32.577 27.366
382 HZ2 LYS 47 HZ2 LYS 47 41.859 32.186 27.360
383 HZ3 LYS 47 HZ3 LYS 47 42.949 31.294 26.409
384 H GLN 48 HN GLN 48 39.041 26.067 28.501
385 HA GLN 48 HA GLN 48 36.352 26.608 29.316
386 HB2 GLN 48 HB2 GLN 48 37.210 24.316 28.880
387 HB3 GLN 48 HB1 GLN 48 38.256 24.461 30.291
388 HG2 GLN 48 HG2 GLN 48 36.212 23.248 30.885
389 HG3 GLN 48 HG1 GLN 48 36.253 24.797 31.722
390 HE21 GLN 48 HE21 GLN 48 35.049 23.483 28.572
391 HE22 GLN 48 HE22 GLN 48 33.602 24.370 28.600
392 H GLU 49 HN GLU 49 35.613 27.514 31.146
393 HA GLU 49 HA GLU 49 37.414 28.860 32.905
394 HB2 GLU 49 HB2 GLU 49 34.431 28.381 33.028
395 HB3 GLU 49 HB1 GLU 49 35.309 29.369 34.195
396 HG2 GLU 49 HG2 GLU 49 36.065 30.864 32.427
397 HG3 GLU 49 HG1 GLU 49 35.324 29.838 31.200
398 H HIS 50 HN HIS 50 37.998 28.398 34.997
399 HA HIS 50 HA HIS 50 38.093 25.648 35.750
400 HB2 HIS 50 HB2 HIS 50 39.242 26.431 37.738
401 HB3 HIS 50 HB1 HIS 50 39.843 27.324 36.341
402 HD2 HIS 50 HD2 HIS 50 38.088 28.029 39.713
403 HE1 HIS 50 HE1 HIS 50 38.054 31.646 37.537
404 HE2 HIS 50 HE2 HIS 50 37.617 30.595 39.808
405 H LEU 51 HN LEU 51 35.760 28.093 36.163
406 HA LEU 51 HA LEU 51 34.645 27.354 38.658
407 HB2 LEU 51 HB2 LEU 51 33.435 28.678 36.226
408 HB3 LEU 51 HB1 LEU 51 32.544 28.433 37.724
409 HG LEU 51 HG LEU 51 35.190 29.918 37.564
410 HD11 LEU 51 HD11 LEU 51 32.349 30.977 37.595
411 HD12 LEU 51 HD12 LEU 51 33.505 31.121 36.272
412 HD13 LEU 51 HD13 LEU 51 33.794 31.968 37.791
413 HD21 LEU 51 HD21 LEU 51 33.195 29.335 39.748
414 HD22 LEU 51 HD22 LEU 51 34.091 30.852 39.796
415 HD23 LEU 51 HD23 LEU 51 34.956 29.320 39.813
416 H ASP 52 HN ASP 52 34.081 26.221 35.359
417 HA ASP 52 HA ASP 52 31.849 24.584 35.891
418 HB2 ASP 52 HB2 ASP 52 34.009 24.437 33.785
419 HB3 ASP 52 HB1 ASP 52 32.630 23.339 33.821
420 H GLY 53 HN GLY 53 35.328 23.970 36.073
421 HA2 GLY 53 HA2 GLY 53 35.229 21.191 36.517
422 HA3 GLY 53 HA1 GLY 53 36.534 22.258 37.027
423 H ALA 54 HN ALA 54 35.048 23.934 38.754
424 HA ALA 54 HA ALA 54 35.168 22.480 41.161
425 HB1 ALA 54 HB1 ALA 54 35.349 24.986 40.903
426 HB2 ALA 54 HB2 ALA 54 34.300 24.452 42.217
427 HB3 ALA 54 HB3 ALA 54 33.598 25.022 40.704
428 H LEU 55 HN LEU 55 32.444 23.351 39.073
429 HA LEU 55 HA LEU 55 30.377 22.440 40.769
430 HB2 LEU 55 HB2 LEU 55 30.540 22.689 37.761
431 HB3 LEU 55 HB1 LEU 55 29.061 22.270 38.619
432 HG LEU 55 HG LEU 55 30.677 24.780 39.161
433 HD11 LEU 55 HD11 LEU 55 28.111 24.505 37.571
434 HD12 LEU 55 HD12 LEU 55 29.708 24.687 36.846
435 HD13 LEU 55 HD13 LEU 55 29.038 25.982 37.839
436 HD21 LEU 55 HD21 LEU 55 29.372 24.487 41.077
437 HD22 LEU 55 HD22 LEU 55 28.090 23.643 40.212
438 HD23 LEU 55 HD23 LEU 55 28.247 25.393 40.071
439 H ARG 56 HN ARG 56 32.335 20.812 38.318
440 HA ARG 56 HA ARG 56 30.908 18.341 38.414
441 HB2 ARG 56 HB2 ARG 56 33.700 19.020 37.466
442 HB3 ARG 56 HB1 ARG 56 32.942 17.440 37.259
443 HG2 ARG 56 HG2 ARG 56 31.142 18.423 35.944
444 HG3 ARG 56 HG1 ARG 56 31.773 20.044 36.238
445 HD2 ARG 56 HD2 ARG 56 32.478 19.295 34.026
446 HD3 ARG 56 HD1 ARG 56 33.882 19.404 35.084
447 HE ARG 56 HE ARG 56 32.783 16.774 35.145
448 HH11 ARG 56 HH11 ARG 56 33.919 15.143 34.045
449 HH12 ARG 56 HH12 ARG 56 35.088 15.573 32.840
450 HH21 ARG 56 HH21 ARG 56 34.609 18.988 33.211
451 HH22 ARG 56 HH22 ARG 56 35.477 17.749 32.368
452 H TYR 57 HN TYR 57 31.362 16.461 39.527
453 HA TYR 57 HA TYR 57 32.293 16.621 42.139
454 HB2 TYR 57 HB2 TYR 57 32.379 14.153 42.082
455 HB3 TYR 57 HB1 TYR 57 30.905 14.769 41.337
456 HD1 TYR 57 HD1 TYR 57 34.175 13.188 40.720
457 HD2 TYR 57 HD2 TYR 57 30.558 14.653 38.925
458 HE1 TYR 57 HE1 TYR 57 34.750 12.022 38.608
459 HE2 TYR 57 HE2 TYR 57 31.133 13.487 36.814
460 HH TYR 57 HH TYR 57 32.944 11.140 36.445
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 5.052 42.243 56.407
2 H2 GLY 1 HT2 GLY 1 6.571 41.623 56.850
3 H3 GLY 1 HT3 GLY 1 5.566 40.746 55.797
4 HA2 GLY 1 HA2 GLY 1 6.009 43.338 54.756
5 HA3 GLY 1 HA1 GLY 1 7.546 42.547 55.105
6 H SER 2 HN SER 2 8.270 40.994 53.750
7 HA SER 2 HA SER 2 6.408 39.881 51.727
8 HB2 SER 2 HB2 SER 2 9.249 40.835 51.289
9 HB3 SER 2 HB1 SER 2 8.258 40.003 50.093
10 HG SER 2 HG SER 2 6.702 41.777 50.528
11 H ALA 3 HN ALA 3 6.963 37.796 50.949
12 HA ALA 3 HA ALA 3 7.865 35.995 52.909
13 HB1 ALA 3 HB1 ALA 3 6.380 35.416 50.975
14 HB2 ALA 3 HB2 ALA 3 7.732 34.303 51.183
15 HB3 ALA 3 HB3 ALA 3 7.788 35.532 49.918
16 H GLY 4 HN GLY 4 9.501 37.535 50.192
17 HA2 GLY 4 HA2 GLY 4 12.062 37.379 51.366
18 HA3 GLY 4 HA1 GLY 4 11.891 36.065 50.207
19 H LEU 5 HN LEU 5 13.806 37.584 49.454
20 HA LEU 5 HA LEU 5 12.791 39.732 47.699
21 HB2 LEU 5 HB2 LEU 5 14.630 40.346 49.197
22 HB3 LEU 5 HB1 LEU 5 15.609 39.027 48.562
23 HG LEU 5 HG LEU 5 15.565 40.069 46.317
24 HD11 LEU 5 HD11 LEU 5 13.758 42.021 47.738
25 HD12 LEU 5 HD12 LEU 5 13.559 41.275 46.151
26 HD13 LEU 5 HD13 LEU 5 14.736 42.565 46.373
27 HD21 LEU 5 HD21 LEU 5 16.984 42.011 46.870
28 HD22 LEU 5 HD22 LEU 5 17.368 40.639 47.907
29 HD23 LEU 5 HD23 LEU 5 16.395 41.969 48.532
30 H GLN 6 HN GLN 6 12.504 39.305 45.612
31 HA GLN 6 HA GLN 6 13.221 36.802 44.449
32 HB2 GLN 6 HB2 GLN 6 11.242 38.098 43.733
33 HB3 GLN 6 HB1 GLN 6 12.305 39.355 43.104
34 HG2 GLN 6 HG2 GLN 6 13.291 37.788 41.517
35 HG3 GLN 6 HG1 GLN 6 12.347 36.464 42.197
36 HE21 GLN 6 HE21 GLN 6 11.218 36.094 40.153
37 HE22 GLN 6 HE22 GLN 6 10.048 37.185 39.587
38 H GLU 7 HN GLU 7 14.988 36.221 43.330
39 HA GLU 7 HA GLU 7 17.170 36.317 42.588
40 HB2 GLU 7 HB2 GLU 7 15.916 37.278 40.667
41 HB3 GLU 7 HB1 GLU 7 16.171 38.889 41.338
42 HG2 GLU 7 HG2 GLU 7 18.602 38.592 41.188
43 HG3 GLU 7 HG1 GLU 7 18.378 36.957 40.572
44 H LYS 8 HN LYS 8 17.895 36.684 44.820
45 HA LYS 8 HA LYS 8 18.375 39.266 45.867
46 HB2 LYS 8 HB2 LYS 8 18.368 37.160 47.214
47 HB3 LYS 8 HB1 LYS 8 19.916 36.736 46.480
48 HG2 LYS 8 HG2 LYS 8 20.928 38.781 47.367
49 HG3 LYS 8 HG1 LYS 8 19.379 39.279 48.044
50 HD2 LYS 8 HD2 LYS 8 19.362 37.287 49.493
51 HD3 LYS 8 HD1 LYS 8 20.903 36.772 48.807
52 HE2 LYS 8 HE2 LYS 8 21.284 37.919 50.938
53 HE3 LYS 8 HE1 LYS 8 21.944 38.877 49.615
54 HZ1 LYS 8 HZ1 LYS 8 20.035 40.280 49.647
55 HZ2 LYS 8 HZ2 LYS 8 20.625 40.173 51.237
56 HZ3 LYS 8 HZ3 LYS 8 19.247 39.291 50.777
57 H GLU 9 HN GLU 9 20.171 40.573 45.834
58 HA GLU 9 HA GLU 9 21.699 40.640 43.474
59 HB2 GLU 9 HB2 GLU 9 22.068 42.033 46.127
60 HB3 GLU 9 HB1 GLU 9 23.103 42.337 44.732
61 HG2 GLU 9 HG2 GLU 9 20.081 42.594 44.649
62 HG3 GLU 9 HG1 GLU 9 21.164 43.944 44.971
63 H ARG 10 HN ARG 10 22.471 39.356 46.688
64 HA ARG 10 HA ARG 10 25.203 38.950 46.388
65 HB2 ARG 10 HB2 ARG 10 23.976 38.547 48.491
66 HB3 ARG 10 HB1 ARG 10 23.226 37.121 47.774
67 HG2 ARG 10 HG2 ARG 10 25.389 36.048 47.511
68 HG3 ARG 10 HG1 ARG 10 26.220 37.507 48.055
69 HD2 ARG 10 HD2 ARG 10 24.241 35.951 49.741
70 HD3 ARG 10 HD1 ARG 10 25.990 35.759 49.842
71 HE ARG 10 HE ARG 10 25.440 38.484 50.147
72 HH11 ARG 10 HH11 ARG 10 25.338 39.392 52.226
73 HH12 ARG 10 HH12 ARG 10 25.023 38.378 53.594
74 HH21 ARG 10 HH21 ARG 10 24.793 35.470 51.720
75 HH22 ARG 10 HH22 ARG 10 24.715 36.157 53.308
76 H GLU 11 HN GLU 11 26.404 37.717 45.122
77 HA GLU 11 HA GLU 11 25.322 36.173 43.021
78 HB2 GLU 11 HB2 GLU 11 27.546 37.302 42.984
79 HB3 GLU 11 HB1 GLU 11 28.142 36.087 44.112
80 HG2 GLU 11 HG2 GLU 11 26.840 35.286 41.503
81 HG3 GLU 11 HG1 GLU 11 28.550 35.697 41.579
82 H LEU 12 HN LEU 12 26.705 35.259 46.153
83 HA LEU 12 HA LEU 12 26.826 32.482 45.725
84 HB2 LEU 12 HB2 LEU 12 26.448 34.092 48.255
85 HB3 LEU 12 HB1 LEU 12 26.709 32.352 48.245
86 HG LEU 12 HG LEU 12 28.593 34.350 46.959
87 HD11 LEU 12 HD11 LEU 12 28.508 34.699 49.386
88 HD12 LEU 12 HD12 LEU 12 30.037 33.949 48.934
89 HD13 LEU 12 HD13 LEU 12 28.759 32.974 49.658
90 HD21 LEU 12 HD21 LEU 12 30.132 32.212 47.371
91 HD22 LEU 12 HD22 LEU 12 29.112 32.312 45.943
92 HD23 LEU 12 HD23 LEU 12 28.590 31.359 47.333
93 H GLU 13 HN GLU 13 24.193 34.540 46.892
94 HA GLU 13 HA GLU 13 22.427 32.477 47.642
95 HB2 GLU 13 HB2 GLU 13 22.141 34.883 48.223
96 HB3 GLU 13 HB1 GLU 13 21.701 35.205 46.548
97 HG2 GLU 13 HG2 GLU 13 20.249 33.102 48.164
98 HG3 GLU 13 HG1 GLU 13 19.783 34.797 48.251
99 H ASP 14 HN ASP 14 22.987 34.090 44.545
100 HA ASP 14 HA ASP 14 20.835 32.989 43.112
101 HB2 ASP 14 HB2 ASP 14 22.258 34.842 42.286
102 HB3 ASP 14 HB1 ASP 14 23.586 33.703 42.073
103 H LEU 15 HN LEU 15 24.123 31.774 43.674
104 HA LEU 15 HA LEU 15 23.956 29.504 42.005
105 HB2 LEU 15 HB2 LEU 15 25.583 30.040 44.496
106 HB3 LEU 15 HB1 LEU 15 25.783 28.602 43.500
107 HG LEU 15 HG LEU 15 26.015 31.438 42.446
108 HD11 LEU 15 HD11 LEU 15 28.087 29.508 43.503
109 HD12 LEU 15 HD12 LEU 15 27.832 31.196 43.949
110 HD13 LEU 15 HD13 LEU 15 28.509 30.793 42.371
111 HD21 LEU 15 HD21 LEU 15 25.625 30.133 40.550
112 HD22 LEU 15 HD22 LEU 15 26.350 28.689 41.256
113 HD23 LEU 15 HD23 LEU 15 27.376 29.994 40.664
114 H LYS 16 HN LYS 16 23.071 30.037 45.383
115 HA LYS 16 HA LYS 16 22.529 27.377 46.080
116 HB2 LYS 16 HB2 LYS 16 22.698 29.171 47.741
117 HB3 LYS 16 HB1 LYS 16 21.258 29.937 47.084
118 HG2 LYS 16 HG2 LYS 16 20.635 28.711 49.081
119 HG3 LYS 16 HG1 LYS 16 19.947 27.878 47.696
120 HD2 LYS 16 HD2 LYS 16 21.665 26.182 47.770
121 HD3 LYS 16 HD1 LYS 16 22.586 27.094 48.969
122 HE2 LYS 16 HE2 LYS 16 20.736 26.825 50.580
123 HE3 LYS 16 HE1 LYS 16 19.819 25.921 49.375
124 HZ1 LYS 16 HZ1 LYS 16 22.460 24.893 49.705
125 HZ2 LYS 16 HZ2 LYS 16 20.966 24.089 49.810
126 HZ3 LYS 16 HZ3 LYS 16 21.603 24.885 51.169
127 H ASP 17 HN ASP 17 20.453 29.883 44.665
128 HA ASP 17 HA ASP 17 18.047 28.420 44.667
129 HB2 ASP 17 HB2 ASP 17 19.055 30.642 42.888
130 HB3 ASP 17 HB1 ASP 17 17.429 29.974 42.757
131 H ALA 18 HN ALA 18 20.694 28.596 42.325
132 HA ALA 18 HA ALA 18 19.478 27.134 40.249
133 HB1 ALA 18 HB1 ALA 18 22.393 27.386 41.025
134 HB2 ALA 18 HB2 ALA 18 21.520 28.376 39.856
135 HB3 ALA 18 HB3 ALA 18 21.821 26.673 39.517
136 H GLU 19 HN GLU 19 21.339 26.104 43.078
137 HA GLU 19 HA GLU 19 21.561 23.372 42.416
138 HB2 GLU 19 HB2 GLU 19 22.860 24.456 44.218
139 HB3 GLU 19 HB1 GLU 19 21.381 24.638 45.162
140 HG2 GLU 19 HG2 GLU 19 21.087 22.205 45.222
141 HG3 GLU 19 HG1 GLU 19 22.514 21.991 44.211
142 H LEU 20 HN LEU 20 19.073 25.180 44.187
143 HA LEU 20 HA LEU 20 17.498 22.966 44.952
144 HB2 LEU 20 HB2 LEU 20 16.778 25.857 44.435
145 HB3 LEU 20 HB1 LEU 20 15.649 24.681 45.102
146 HG LEU 20 HG LEU 20 18.348 25.321 46.330
147 HD11 LEU 20 HD11 LEU 20 15.608 26.287 47.195
148 HD12 LEU 20 HD12 LEU 20 16.775 27.271 46.312
149 HD13 LEU 20 HD13 LEU 20 17.156 26.697 47.936
150 HD21 LEU 20 HD21 LEU 20 17.763 23.242 47.223
151 HD22 LEU 20 HD22 LEU 20 16.032 23.542 47.080
152 HD23 LEU 20 HD23 LEU 20 16.959 24.309 48.367
153 H LYS 21 HN LYS 21 17.525 24.968 42.043
154 HA LYS 21 HA LYS 21 15.190 23.964 40.838
155 HB2 LYS 21 HB2 LYS 21 16.378 25.978 40.046
156 HB3 LYS 21 HB1 LYS 21 17.720 24.970 39.509
157 HG2 LYS 21 HG2 LYS 21 16.230 23.786 37.948
158 HG3 LYS 21 HG1 LYS 21 14.865 24.757 38.504
159 HD2 LYS 21 HD2 LYS 21 16.003 26.803 37.735
160 HD3 LYS 21 HD1 LYS 21 17.371 25.837 37.182
161 HE2 LYS 21 HE2 LYS 21 15.897 24.628 35.619
162 HE3 LYS 21 HE1 LYS 21 14.522 25.582 36.174
163 HZ1 LYS 21 HZ1 LYS 21 15.466 26.480 34.139
164 HZ2 LYS 21 HZ2 LYS 21 16.974 26.668 34.897
165 HZ3 LYS 21 HZ3 LYS 21 15.639 27.580 35.417
166 H ARG 22 HN ARG 22 18.563 22.864 40.684
167 HA ARG 22 HA ARG 22 18.191 20.823 38.777
168 HB2 ARG 22 HB2 ARG 22 20.204 21.147 41.007
169 HB3 ARG 22 HB1 ARG 22 20.277 19.847 39.817
170 HG2 ARG 22 HG2 ARG 22 20.368 21.503 37.997
171 HG3 ARG 22 HG1 ARG 22 20.276 22.811 39.176
172 HD2 ARG 22 HD2 ARG 22 22.383 22.047 40.199
173 HD3 ARG 22 HD1 ARG 22 22.476 20.731 39.032
174 HE ARG 22 HE ARG 22 22.256 23.160 37.620
175 HH11 ARG 22 HH11 ARG 22 24.129 24.081 36.726
176 HH12 ARG 22 HH12 ARG 22 25.686 23.633 37.339
177 HH21 ARG 22 HH21 ARG 22 24.416 21.434 39.701
178 HH22 ARG 22 HH22 ARG 22 25.849 22.135 39.024
179 H LEU 23 HN LEU 23 17.892 20.839 42.305
180 HA LEU 23 HA LEU 23 17.440 18.023 42.540
181 HB2 LEU 23 HB2 LEU 23 17.297 20.399 44.338
182 HB3 LEU 23 HB1 LEU 23 16.326 19.011 44.818
183 HG LEU 23 HG LEU 23 18.343 17.571 44.654
184 HD11 LEU 23 HD11 LEU 23 19.791 20.193 44.188
185 HD12 LEU 23 HD12 LEU 23 19.578 18.918 42.989
186 HD13 LEU 23 HD13 LEU 23 20.554 18.622 44.425
187 HD21 LEU 23 HD21 LEU 23 18.758 20.013 46.404
188 HD22 LEU 23 HD22 LEU 23 19.418 18.402 46.683
189 HD23 LEU 23 HD23 LEU 23 17.680 18.674 46.795
190 H ASN 24 HN ASN 24 15.353 20.845 42.197
191 HA ASN 24 HA ASN 24 12.885 19.608 42.711
192 HB2 ASN 24 HB2 ASN 24 13.303 22.077 42.495
193 HB3 ASN 24 HB1 ASN 24 13.371 21.851 40.748
194 HD21 ASN 24 HD21 ASN 24 11.402 23.003 40.278
195 HD22 ASN 24 HD22 ASN 24 9.880 22.432 40.769
196 H GLU 25 HN GLU 25 14.694 19.958 39.660
197 HA GLU 25 HA GLU 25 12.645 18.602 38.136
198 HB2 GLU 25 HB2 GLU 25 14.233 18.769 36.272
199 HB3 GLU 25 HB1 GLU 25 14.055 20.320 37.091
200 HG2 GLU 25 HG2 GLU 25 16.108 19.832 38.402
201 HG3 GLU 25 HG1 GLU 25 16.308 18.335 37.495
202 H GLU 26 HN GLU 26 12.699 16.540 37.302
203 HA GLU 26 HA GLU 26 14.208 14.597 38.841
204 HB2 GLU 26 HB2 GLU 26 12.185 14.267 36.611
205 HB3 GLU 26 HB1 GLU 26 12.889 12.945 37.536
206 HG2 GLU 26 HG2 GLU 26 10.880 13.340 38.680
207 HG3 GLU 26 HG1 GLU 26 12.041 14.261 39.630
208 H ARG 27 HN ARG 27 15.499 12.926 37.884
209 HA ARG 27 HA ARG 27 17.257 12.195 36.596
210 HB2 ARG 27 HB2 ARG 27 15.538 13.425 34.430
211 HB3 ARG 27 HB1 ARG 27 16.947 12.409 34.129
212 HG2 ARG 27 HG2 ARG 27 15.849 10.630 35.559
213 HG3 ARG 27 HG1 ARG 27 14.394 11.628 35.558
214 HD2 ARG 27 HD2 ARG 27 15.795 10.604 33.074
215 HD3 ARG 27 HD1 ARG 27 14.344 9.892 33.777
216 HE ARG 27 HE ARG 27 14.517 12.402 32.295
217 HH11 ARG 27 HH11 ARG 27 12.510 13.324 31.766
218 HH12 ARG 27 HH12 ARG 27 11.064 12.726 32.508
219 HH21 ARG 27 HH21 ARG 27 12.708 10.330 34.400
220 HH22 ARG 27 HH22 ARG 27 11.176 11.032 33.999
221 H HIS 28 HN HIS 28 17.637 14.712 37.889
222 HA HIS 28 HA HIS 28 18.675 16.683 36.132
223 HB2 HIS 28 HB2 HIS 28 19.639 17.679 38.123
224 HB3 HIS 28 HB1 HIS 28 18.020 17.093 38.503
225 HD2 HIS 28 HD2 HIS 28 17.926 14.990 40.379
226 HE1 HIS 28 HE1 HIS 28 22.096 14.694 40.978
227 HE2 HIS 28 HE2 HIS 28 19.826 13.909 41.807
228 H ASP 29 HN ASP 29 19.883 13.658 37.186
229 HA ASP 29 HA ASP 29 22.660 14.119 37.139
230 HB2 ASP 29 HB2 ASP 29 21.013 11.656 36.559
231 HB3 ASP 29 HB1 ASP 29 22.775 11.644 36.587
232 H HIS 30 HN HIS 30 20.359 13.328 34.570
233 HA HIS 30 HA HIS 30 22.241 12.916 32.502
234 HB2 HIS 30 HB2 HIS 30 19.349 13.797 32.481
235 HB3 HIS 30 HB1 HIS 30 20.271 13.519 31.005
236 HD2 HIS 30 HD2 HIS 30 20.571 10.828 30.309
237 HE1 HIS 30 HE1 HIS 30 18.860 9.184 33.802
238 HE2 HIS 30 HE2 HIS 30 19.762 8.644 31.490
239 H ASP 31 HN ASP 31 20.604 15.823 33.689
240 HA ASP 31 HA ASP 31 21.457 17.593 31.671
241 HB2 ASP 31 HB2 ASP 31 20.707 18.032 34.563
242 HB3 ASP 31 HB1 ASP 31 21.089 19.355 33.462
243 H LYS 32 HN LYS 32 22.964 16.596 34.718
244 HA LYS 32 HA LYS 32 25.096 18.431 34.717
245 HB2 LYS 32 HB2 LYS 32 24.519 17.051 36.666
246 HB3 LYS 32 HB1 LYS 32 25.031 15.607 35.791
247 HG2 LYS 32 HG2 LYS 32 27.308 16.353 35.704
248 HG3 LYS 32 HG1 LYS 32 26.868 17.967 36.257
249 HD2 LYS 32 HD2 LYS 32 27.790 16.890 38.167
250 HD3 LYS 32 HD1 LYS 32 26.047 16.834 38.413
251 HE2 LYS 32 HE2 LYS 32 27.074 14.658 38.927
252 HE3 LYS 32 HE1 LYS 32 26.002 14.516 37.540
253 HZ1 LYS 32 HZ1 LYS 32 28.902 15.030 37.251
254 HZ2 LYS 32 HZ2 LYS 32 27.809 14.488 36.068
255 HZ3 LYS 32 HZ3 LYS 32 28.270 13.459 37.337
256 H ARG 33 HN ARG 33 24.853 15.155 33.355
257 HA ARG 33 HA ARG 33 27.512 15.039 32.379
258 HB2 ARG 33 HB2 ARG 33 24.998 13.569 31.579
259 HB3 ARG 33 HB1 ARG 33 26.569 13.248 30.844
260 HG2 ARG 33 HG2 ARG 33 27.519 12.643 32.992
261 HG3 ARG 33 HG1 ARG 33 26.048 13.127 33.831
262 HD2 ARG 33 HD2 ARG 33 26.142 10.948 31.735
263 HD3 ARG 33 HD1 ARG 33 26.255 10.644 33.465
264 HE ARG 33 HE ARG 33 23.961 12.193 33.028
265 HH11 ARG 33 HH11 ARG 33 21.930 11.179 32.931
266 HH12 ARG 33 HH12 ARG 33 21.827 9.492 32.553
267 HH21 ARG 33 HH21 ARG 33 25.255 9.083 32.236
268 HH22 ARG 33 HH22 ARG 33 23.709 8.306 32.160
269 H GLU 34 HN GLU 34 24.483 16.171 30.957
270 HA GLU 34 HA GLU 34 25.411 16.566 28.327
271 HB2 GLU 34 HB2 GLU 34 23.022 16.607 28.947
272 HB3 GLU 34 HB1 GLU 34 23.282 18.100 29.845
273 HG2 GLU 34 HG2 GLU 34 22.368 18.605 27.630
274 HG3 GLU 34 HG1 GLU 34 24.015 19.215 27.744
275 H ALA 35 HN ALA 35 25.396 18.689 31.169
276 HA ALA 35 HA ALA 35 26.373 21.010 29.909
277 HB1 ALA 35 HB1 ALA 35 25.399 20.927 32.204
278 HB2 ALA 35 HB2 ALA 35 26.942 21.778 32.137
279 HB3 ALA 35 HB3 ALA 35 26.869 20.130 32.761
280 H GLU 36 HN GLU 36 28.034 18.250 31.379
281 HA GLU 36 HA GLU 36 30.661 19.278 31.224
282 HB2 GLU 36 HB2 GLU 36 29.624 16.436 31.202
283 HB3 GLU 36 HB1 GLU 36 31.333 16.857 31.320
284 HG2 GLU 36 HG2 GLU 36 29.223 17.885 33.233
285 HG3 GLU 36 HG1 GLU 36 30.205 16.455 33.543
286 H ARG 37 HN ARG 37 28.681 17.453 28.931
287 HA ARG 37 HA ARG 37 30.682 16.975 27.000
288 HB2 ARG 37 HB2 ARG 37 27.682 17.244 26.763
289 HB3 ARG 37 HB1 ARG 37 28.723 16.770 25.420
290 HG2 ARG 37 HG2 ARG 37 29.558 14.857 26.724
291 HG3 ARG 37 HG1 ARG 37 28.538 15.333 28.084
292 HD2 ARG 37 HD2 ARG 37 26.529 15.036 26.687
293 HD3 ARG 37 HD1 ARG 37 27.541 14.572 25.324
294 HE ARG 37 HE ARG 37 28.151 12.890 27.500
295 HH11 ARG 37 HH11 ARG 37 27.263 10.800 27.554
296 HH12 ARG 37 HH12 ARG 37 25.851 10.440 26.618
297 HH21 ARG 37 HH21 ARG 37 25.580 13.640 25.310
298 HH22 ARG 37 HH22 ARG 37 24.897 12.048 25.347
299 H LYS 38 HN LYS 38 28.469 19.686 27.504
300 HA LYS 38 HA LYS 38 29.009 21.090 25.125
301 HB2 LYS 38 HB2 LYS 38 27.136 21.597 26.666
302 HB3 LYS 38 HB1 LYS 38 28.289 22.227 27.840
303 HG2 LYS 38 HG2 LYS 38 29.062 23.890 26.138
304 HG3 LYS 38 HG1 LYS 38 27.818 23.300 25.040
305 HD2 LYS 38 HD2 LYS 38 27.168 24.329 27.809
306 HD3 LYS 38 HD1 LYS 38 27.242 25.393 26.406
307 HE2 LYS 38 HE2 LYS 38 25.558 23.877 25.279
308 HE3 LYS 38 HE1 LYS 38 25.381 23.036 26.819
309 HZ1 LYS 38 HZ1 LYS 38 23.748 24.594 26.987
310 HZ2 LYS 38 HZ2 LYS 38 24.599 25.766 26.098
311 HZ3 LYS 38 HZ3 LYS 38 25.031 25.437 27.709
312 H ALA 39 HN ALA 39 30.561 21.197 28.320
313 HA ALA 39 HA ALA 39 32.354 23.302 27.786
314 HB1 ALA 39 HB1 ALA 39 31.895 22.402 30.051
315 HB2 ALA 39 HB2 ALA 39 33.621 22.474 29.696
316 HB3 ALA 39 HB3 ALA 39 32.767 20.930 29.620
317 H LEU 40 HN LEU 40 32.624 19.804 27.284
318 HA LEU 40 HA LEU 40 35.336 19.772 26.487
319 HB2 LEU 40 HB2 LEU 40 33.030 17.932 25.830
320 HB3 LEU 40 HB1 LEU 40 34.695 17.603 25.359
321 HG LEU 40 HG LEU 40 33.808 18.090 28.219
322 HD11 LEU 40 HD11 LEU 40 32.762 16.057 27.572
323 HD12 LEU 40 HD12 LEU 40 34.243 15.567 28.394
324 HD13 LEU 40 HD13 LEU 40 34.163 15.543 26.632
325 HD21 LEU 40 HD21 LEU 40 36.106 18.496 28.241
326 HD22 LEU 40 HD22 LEU 40 36.425 17.412 26.887
327 HD23 LEU 40 HD23 LEU 40 36.101 16.755 28.490
328 H GLU 41 HN GLU 41 32.330 20.235 24.689
329 HA GLU 41 HA GLU 41 33.432 20.176 22.091
330 HB2 GLU 41 HB2 GLU 41 30.982 21.546 23.212
331 HB3 GLU 41 HB1 GLU 41 31.381 21.531 21.494
332 HG2 GLU 41 HG2 GLU 41 31.299 19.111 21.432
333 HG3 GLU 41 HG1 GLU 41 31.093 19.032 23.182
334 H ASP 42 HN ASP 42 33.008 22.797 24.428
335 HA ASP 42 HA ASP 42 33.734 24.939 22.754
336 HB2 ASP 42 HB2 ASP 42 32.687 25.211 24.979
337 HB3 ASP 42 HB1 ASP 42 34.182 24.664 25.734
338 H LYS 43 HN LYS 43 35.691 22.837 24.843
339 HA LYS 43 HA LYS 43 38.157 24.159 24.419
340 HB2 LYS 43 HB2 LYS 43 37.513 21.312 25.195
341 HB3 LYS 43 HB1 LYS 43 39.160 21.931 25.097
342 HG2 LYS 43 HG2 LYS 43 38.601 23.688 26.741
343 HG3 LYS 43 HG1 LYS 43 36.954 23.069 26.849
344 HD2 LYS 43 HD2 LYS 43 37.812 20.898 27.643
345 HD3 LYS 43 HD1 LYS 43 39.462 21.512 27.537
346 HE2 LYS 43 HE2 LYS 43 38.922 23.265 29.185
347 HE3 LYS 43 HE1 LYS 43 37.268 22.660 29.289
348 HZ1 LYS 43 HZ1 LYS 43 39.042 21.879 30.988
349 HZ2 LYS 43 HZ2 LYS 43 39.509 20.817 29.747
350 HZ3 LYS 43 HZ3 LYS 43 37.927 20.765 30.364
351 H LEU 44 HN LEU 44 36.540 21.532 22.686
352 HA LEU 44 HA LEU 44 38.666 20.902 20.933
353 HB2 LEU 44 HB2 LEU 44 35.672 20.608 20.641
354 HB3 LEU 44 HB1 LEU 44 36.825 19.973 19.472
355 HG LEU 44 HG LEU 44 36.850 19.280 22.427
356 HD11 LEU 44 HD11 LEU 44 34.827 18.362 21.587
357 HD12 LEU 44 HD12 LEU 44 35.986 17.035 21.526
358 HD13 LEU 44 HD13 LEU 44 35.573 17.913 20.053
359 HD21 LEU 44 HD21 LEU 44 38.166 17.254 21.294
360 HD22 LEU 44 HD22 LEU 44 38.998 18.753 21.685
361 HD23 LEU 44 HD23 LEU 44 38.475 18.444 20.030
362 H ALA 45 HN ALA 45 36.035 23.252 20.739
363 HA ALA 45 HA ALA 45 36.432 24.070 18.073
364 HB1 ALA 45 HB1 ALA 45 35.277 26.163 18.786
365 HB2 ALA 45 HB2 ALA 45 35.380 25.609 20.457
366 HB3 ALA 45 HB3 ALA 45 34.427 24.701 19.284
367 H ASP 46 HN ASP 46 37.898 25.152 21.109
368 HA ASP 46 HA ASP 46 39.320 27.357 20.066
369 HB2 ASP 46 HB2 ASP 46 39.814 25.567 22.447
370 HB3 ASP 46 HB1 ASP 46 40.819 26.968 22.080
371 H LYS 47 HN LYS 47 41.368 27.562 19.226
372 HA LYS 47 HA LYS 47 42.393 25.435 17.682
373 HB2 LYS 47 HB2 LYS 47 43.616 28.060 18.551
374 HB3 LYS 47 HB1 LYS 47 44.400 26.949 17.425
375 HG2 LYS 47 HG2 LYS 47 42.446 27.080 15.926
376 HG3 LYS 47 HG1 LYS 47 41.660 28.192 17.047
377 HD2 LYS 47 HD2 LYS 47 43.526 29.790 16.764
378 HD3 LYS 47 HD1 LYS 47 44.289 28.685 15.619
379 HE2 LYS 47 HE2 LYS 47 41.533 29.903 15.277
380 HE3 LYS 47 HE1 LYS 47 42.995 30.466 14.466
381 HZ1 LYS 47 HZ1 LYS 47 41.608 28.908 13.139
382 HZ2 LYS 47 HZ2 LYS 47 41.970 27.690 14.266
383 HZ3 LYS 47 HZ3 LYS 47 43.212 28.400 13.350
384 H GLN 48 HN GLN 48 43.317 26.728 20.842
385 HA GLN 48 HA GLN 48 44.964 24.307 21.305
386 HB2 GLN 48 HB2 GLN 48 45.670 27.138 22.132
387 HB3 GLN 48 HB1 GLN 48 46.592 25.688 22.524
388 HG2 GLN 48 HG2 GLN 48 46.036 26.709 19.723
389 HG3 GLN 48 HG1 GLN 48 47.565 26.872 20.584
390 HE21 GLN 48 HE21 GLN 48 48.281 24.521 21.534
391 HE22 GLN 48 HE22 GLN 48 48.210 23.274 20.385
392 H GLU 49 HN GLU 49 44.975 23.536 23.422
393 HA GLU 49 HA GLU 49 42.601 24.057 24.930
394 HB2 GLU 49 HB2 GLU 49 45.069 22.412 25.521
395 HB3 GLU 49 HB1 GLU 49 43.662 22.479 26.583
396 HG2 GLU 49 HG2 GLU 49 42.226 21.627 24.809
397 HG3 GLU 49 HG1 GLU 49 43.566 21.665 23.664
398 H HIS 50 HN HIS 50 42.350 25.100 26.884
399 HA HIS 50 HA HIS 50 44.656 26.367 28.167
400 HB2 HIS 50 HB2 HIS 50 43.969 28.013 26.476
401 HB3 HIS 50 HB1 HIS 50 42.318 27.968 27.097
402 HD2 HIS 50 HD2 HIS 50 41.874 29.763 29.157
403 HE1 HIS 50 HE1 HIS 50 45.907 30.524 30.153
404 HE2 HIS 50 HE2 HIS 50 43.499 31.165 30.645
405 H LEU 51 HN LEU 51 44.414 26.458 30.319
406 HA LEU 51 HA LEU 51 41.824 25.623 31.458
407 HB2 LEU 51 HB2 LEU 51 44.559 25.801 32.758
408 HB3 LEU 51 HB1 LEU 51 43.104 25.123 33.485
409 HG LEU 51 HG LEU 51 44.450 24.082 30.972
410 HD11 LEU 51 HD11 LEU 51 45.205 22.238 32.334
411 HD12 LEU 51 HD12 LEU 51 44.292 22.824 33.724
412 HD13 LEU 51 HD13 LEU 51 45.691 23.728 33.144
413 HD21 LEU 51 HD21 LEU 51 41.938 23.336 32.469
414 HD22 LEU 51 HD22 LEU 51 42.845 22.086 31.618
415 HD23 LEU 51 HD23 LEU 51 42.200 23.461 30.729
416 H ASP 52 HN ASP 52 42.025 26.641 34.024
417 HA ASP 52 HA ASP 52 41.418 29.451 33.557
418 HB2 ASP 52 HB2 ASP 52 40.562 29.431 35.826
419 HB3 ASP 52 HB1 ASP 52 39.953 28.018 34.968
420 H GLY 53 HN GLY 53 44.206 27.855 34.000
421 HA2 GLY 53 HA2 GLY 53 45.707 30.136 34.710
422 HA3 GLY 53 HA1 GLY 53 45.521 29.111 36.133
423 H ALA 54 HN ALA 54 48.045 29.303 35.536
424 HA ALA 54 HA ALA 54 48.749 26.699 34.424
425 HB1 ALA 54 HB1 ALA 54 48.751 28.341 32.497
426 HB2 ALA 54 HB2 ALA 54 50.289 27.530 32.791
427 HB3 ALA 54 HB3 ALA 54 50.054 29.195 33.326
428 H LEU 55 HN LEU 55 50.855 26.014 35.017
429 HA LEU 55 HA LEU 55 51.699 26.847 37.580
430 HB2 LEU 55 HB2 LEU 55 53.071 25.190 35.457
431 HB3 LEU 55 HB1 LEU 55 53.722 25.420 37.077
432 HG LEU 55 HG LEU 55 50.958 24.305 36.506
433 HD11 LEU 55 HD11 LEU 55 51.899 22.105 36.961
434 HD12 LEU 55 HD12 LEU 55 53.489 22.811 37.257
435 HD13 LEU 55 HD13 LEU 55 52.793 22.852 35.637
436 HD21 LEU 55 HD21 LEU 55 52.587 24.792 38.995
437 HD22 LEU 55 HD22 LEU 55 51.497 23.409 38.957
438 HD23 LEU 55 HD23 LEU 55 50.862 25.032 38.724
439 H ARG 56 HN ARG 56 52.879 27.587 34.332
440 HA ARG 56 HA ARG 56 55.165 29.065 35.197
441 HB2 ARG 56 HB2 ARG 56 53.647 29.054 32.580
442 HB3 ARG 56 HB1 ARG 56 55.165 29.915 32.841
443 HG2 ARG 56 HG2 ARG 56 56.309 27.831 33.374
444 HG3 ARG 56 HG1 ARG 56 54.792 26.936 33.264
445 HD2 ARG 56 HD2 ARG 56 56.040 26.660 31.187
446 HD3 ARG 56 HD1 ARG 56 54.596 27.619 30.878
447 HE ARG 56 HE ARG 56 56.812 29.309 31.477
448 HH11 ARG 56 HH11 ARG 56 57.758 30.440 29.748
449 HH12 ARG 56 HH12 ARG 56 57.473 29.918 28.121
450 HH21 ARG 56 HH21 ARG 56 55.447 27.261 29.045
451 HH22 ARG 56 HH22 ARG 56 56.165 28.119 27.724
452 H TYR 57 HN TYR 57 55.452 31.265 35.427
453 HA TYR 57 HA TYR 57 53.117 32.770 36.201
454 HB2 TYR 57 HB2 TYR 57 56.027 33.578 35.989
455 HB3 TYR 57 HB1 TYR 57 54.753 34.558 36.713
456 HD1 TYR 57 HD1 TYR 57 56.886 31.601 37.105
457 HD2 TYR 57 HD2 TYR 57 53.654 33.862 38.807
458 HE1 TYR 57 HE1 TYR 57 57.163 30.385 39.249
459 HE2 TYR 57 HE2 TYR 57 53.932 32.646 40.950
460 HH TYR 57 HH TYR 57 56.589 30.352 41.430
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 -6.552 22.301 62.005
2 H2 GLY 1 HT2 GLY 1 -5.161 22.682 62.902
3 H3 GLY 1 HT3 GLY 1 -6.612 23.520 63.184
4 HA2 GLY 1 HA2 GLY 1 -5.968 21.720 64.842
5 HA3 GLY 1 HA1 GLY 1 -7.619 21.715 64.222
6 H SER 2 HN SER 2 -4.948 19.817 64.760
7 HA SER 2 HA SER 2 -4.867 18.118 62.511
8 HB2 SER 2 HB2 SER 2 -4.227 17.578 65.417
9 HB3 SER 2 HB1 SER 2 -3.868 16.463 64.102
10 HG SER 2 HG SER 2 -2.521 17.997 63.205
11 H ALA 3 HN ALA 3 -6.826 18.048 65.459
12 HA ALA 3 HA ALA 3 -8.041 15.539 65.057
13 HB1 ALA 3 HB1 ALA 3 -9.272 17.963 66.386
14 HB2 ALA 3 HB2 ALA 3 -8.131 16.872 67.173
15 HB3 ALA 3 HB3 ALA 3 -9.705 16.273 66.650
16 H GLY 4 HN GLY 4 -8.904 18.782 63.936
17 HA2 GLY 4 HA2 GLY 4 -11.423 18.177 62.836
18 HA3 GLY 4 HA1 GLY 4 -10.384 19.506 62.331
19 H LEU 5 HN LEU 5 -8.158 17.986 61.469
20 HA LEU 5 HA LEU 5 -9.240 16.877 58.958
21 HB2 LEU 5 HB2 LEU 5 -7.624 18.712 58.748
22 HB3 LEU 5 HB1 LEU 5 -6.450 17.804 59.696
23 HG LEU 5 HG LEU 5 -6.410 16.039 57.962
24 HD11 LEU 5 HD11 LEU 5 -8.514 16.033 56.926
25 HD12 LEU 5 HD12 LEU 5 -7.517 16.815 55.704
26 HD13 LEU 5 HD13 LEU 5 -8.549 17.787 56.754
27 HD21 LEU 5 HD21 LEU 5 -4.935 18.121 57.891
28 HD22 LEU 5 HD22 LEU 5 -6.039 18.750 56.669
29 HD23 LEU 5 HD23 LEU 5 -5.131 17.270 56.358
30 H GLN 6 HN GLN 6 -9.340 14.741 58.749
31 HA GLN 6 HA GLN 6 -7.872 13.001 60.578
32 HB2 GLN 6 HB2 GLN 6 -10.005 12.491 58.499
33 HB3 GLN 6 HB1 GLN 6 -9.240 11.218 59.448
34 HG2 GLN 6 HG2 GLN 6 -10.035 12.182 61.515
35 HG3 GLN 6 HG1 GLN 6 -10.630 13.611 60.673
36 HE21 GLN 6 HE21 GLN 6 -12.200 11.627 62.289
37 HE22 GLN 6 HE22 GLN 6 -13.381 11.019 61.233
38 H GLU 7 HN GLU 7 -7.203 14.450 57.693
39 HA GLU 7 HA GLU 7 -5.765 14.020 55.948
40 HB2 GLU 7 HB2 GLU 7 -4.504 12.338 58.130
41 HB3 GLU 7 HB1 GLU 7 -3.741 12.663 56.577
42 HG2 GLU 7 HG2 GLU 7 -2.840 14.337 57.953
43 HG3 GLU 7 HG1 GLU 7 -4.159 15.174 57.145
44 H LYS 8 HN LYS 8 -8.115 12.511 55.880
45 HA LYS 8 HA LYS 8 -7.745 9.741 55.527
46 HB2 LYS 8 HB2 LYS 8 -9.961 10.804 55.754
47 HB3 LYS 8 HB1 LYS 8 -9.750 11.572 54.180
48 HG2 LYS 8 HG2 LYS 8 -9.603 9.361 53.104
49 HG3 LYS 8 HG1 LYS 8 -9.769 8.577 54.676
50 HD2 LYS 8 HD2 LYS 8 -11.990 9.611 54.961
51 HD3 LYS 8 HD1 LYS 8 -11.824 10.401 53.393
52 HE2 LYS 8 HE2 LYS 8 -11.661 8.201 52.293
53 HE3 LYS 8 HE1 LYS 8 -11.812 7.404 53.859
54 HZ1 LYS 8 HZ1 LYS 8 -13.941 7.459 52.801
55 HZ2 LYS 8 HZ2 LYS 8 -13.833 9.133 52.540
56 HZ3 LYS 8 HZ3 LYS 8 -13.977 8.524 54.121
57 H GLU 9 HN GLU 9 -7.528 12.451 53.252
58 HA GLU 9 HA GLU 9 -7.139 10.938 50.904
59 HB2 GLU 9 HB2 GLU 9 -6.247 13.732 51.656
60 HB3 GLU 9 HB1 GLU 9 -6.055 13.053 50.043
61 HG2 GLU 9 HG2 GLU 9 -8.096 14.211 49.889
62 HG3 GLU 9 HG1 GLU 9 -8.606 12.552 50.176
63 H ARG 10 HN ARG 10 -4.867 12.152 53.326
64 HA ARG 10 HA ARG 10 -2.645 11.710 53.703
65 HB2 ARG 10 HB2 ARG 10 -3.349 9.168 52.212
66 HB3 ARG 10 HB1 ARG 10 -1.872 9.424 53.141
67 HG2 ARG 10 HG2 ARG 10 -3.344 9.946 55.140
68 HG3 ARG 10 HG1 ARG 10 -4.714 9.385 54.181
69 HD2 ARG 10 HD2 ARG 10 -2.241 7.747 54.806
70 HD3 ARG 10 HD1 ARG 10 -3.795 7.583 55.620
71 HE ARG 10 HE ARG 10 -3.139 6.693 52.918
72 HH11 ARG 10 HH11 ARG 10 -4.728 5.402 51.939
73 HH12 ARG 10 HH12 ARG 10 -6.304 5.288 52.649
74 HH21 ARG 10 HH21 ARG 10 -5.561 7.411 55.288
75 HH22 ARG 10 HH22 ARG 10 -6.774 6.424 54.545
76 H GLU 11 HN GLU 11 -3.196 13.347 51.495
77 HA GLU 11 HA GLU 11 -1.928 12.584 49.102
78 HB2 GLU 11 HB2 GLU 11 -1.933 14.903 48.506
79 HB3 GLU 11 HB1 GLU 11 -3.400 14.615 49.436
80 HG2 GLU 11 HG2 GLU 11 -2.165 15.448 51.484
81 HG3 GLU 11 HG1 GLU 11 -0.834 15.896 50.424
82 H LEU 12 HN LEU 12 -0.637 13.446 52.173
83 HA LEU 12 HA LEU 12 1.889 14.435 51.424
84 HB2 LEU 12 HB2 LEU 12 1.032 14.593 53.717
85 HB3 LEU 12 HB1 LEU 12 1.096 12.840 53.875
86 HG LEU 12 HG LEU 12 3.552 12.900 53.554
87 HD11 LEU 12 HD11 LEU 12 4.544 15.324 53.814
88 HD12 LEU 12 HD12 LEU 12 2.989 15.835 53.157
89 HD13 LEU 12 HD13 LEU 12 4.036 14.768 52.222
90 HD21 LEU 12 HD21 LEU 12 2.579 13.067 55.827
91 HD22 LEU 12 HD22 LEU 12 2.567 14.825 55.684
92 HD23 LEU 12 HD23 LEU 12 4.099 13.952 55.708
93 H GLU 13 HN GLU 13 0.742 11.131 52.036
94 HA GLU 13 HA GLU 13 3.216 9.820 51.715
95 HB2 GLU 13 HB2 GLU 13 1.217 8.742 52.688
96 HB3 GLU 13 HB1 GLU 13 0.427 8.794 51.113
97 HG2 GLU 13 HG2 GLU 13 1.395 6.575 51.492
98 HG3 GLU 13 HG1 GLU 13 2.246 7.376 50.176
99 H ASP 14 HN ASP 14 0.680 10.682 49.391
100 HA ASP 14 HA ASP 14 1.776 9.400 47.138
101 HB2 ASP 14 HB2 ASP 14 -0.523 10.318 47.235
102 HB3 ASP 14 HB1 ASP 14 0.147 11.950 47.223
103 H LEU 15 HN LEU 15 2.250 12.671 48.432
104 HA LEU 15 HA LEU 15 3.893 13.645 46.364
105 HB2 LEU 15 HB2 LEU 15 2.870 15.111 48.048
106 HB3 LEU 15 HB1 LEU 15 3.862 14.377 49.305
107 HG LEU 15 HG LEU 15 5.907 15.183 48.165
108 HD11 LEU 15 HD11 LEU 15 5.394 17.008 46.340
109 HD12 LEU 15 HD12 LEU 15 3.882 16.123 46.139
110 HD13 LEU 15 HD13 LEU 15 5.424 15.309 45.874
111 HD21 LEU 15 HD21 LEU 15 5.469 17.647 48.517
112 HD22 LEU 15 HD22 LEU 15 4.969 16.621 49.861
113 HD23 LEU 15 HD23 LEU 15 3.765 17.249 48.737
114 H LYS 16 HN LYS 16 4.676 11.991 49.408
115 HA LYS 16 HA LYS 16 7.479 12.112 49.190
116 HB2 LYS 16 HB2 LYS 16 6.297 11.475 51.261
117 HB3 LYS 16 HB1 LYS 16 5.773 9.975 50.496
118 HG2 LYS 16 HG2 LYS 16 8.120 9.283 50.213
119 HG3 LYS 16 HG1 LYS 16 8.661 10.795 50.939
120 HD2 LYS 16 HD2 LYS 16 7.496 10.212 53.032
121 HD3 LYS 16 HD1 LYS 16 6.948 8.700 52.307
122 HE2 LYS 16 HE2 LYS 16 9.287 7.989 52.003
123 HE3 LYS 16 HE1 LYS 16 9.844 9.502 52.717
124 HZ1 LYS 16 HZ1 LYS 16 9.844 7.830 54.395
125 HZ2 LYS 16 HZ2 LYS 16 8.245 7.380 54.040
126 HZ3 LYS 16 HZ3 LYS 16 8.570 8.897 54.735
127 H ASP 17 HN ASP 17 5.143 9.687 48.061
128 HA ASP 17 HA ASP 17 6.998 7.818 47.066
129 HB2 ASP 17 HB2 ASP 17 4.586 7.351 47.382
130 HB3 ASP 17 HB1 ASP 17 4.218 8.420 46.031
131 H ALA 18 HN ALA 18 5.416 10.597 45.523
132 HA ALA 18 HA ALA 18 6.419 10.196 42.922
133 HB1 ALA 18 HB1 ALA 18 5.608 12.720 44.377
134 HB2 ALA 18 HB2 ALA 18 4.624 11.761 43.273
135 HB3 ALA 18 HB3 ALA 18 6.009 12.667 42.661
136 H GLU 19 HN GLU 19 7.748 11.902 45.722
137 HA GLU 19 HA GLU 19 9.964 13.078 44.439
138 HB2 GLU 19 HB2 GLU 19 9.201 13.714 46.702
139 HB3 GLU 19 HB1 GLU 19 9.705 12.139 47.310
140 HG2 GLU 19 HG2 GLU 19 11.430 13.810 47.787
141 HG3 GLU 19 HG1 GLU 19 12.044 12.643 46.621
142 H LEU 20 HN LEU 20 9.525 9.922 45.989
143 HA LEU 20 HA LEU 20 12.191 9.044 45.833
144 HB2 LEU 20 HB2 LEU 20 10.495 7.906 47.193
145 HB3 LEU 20 HB1 LEU 20 9.629 7.433 45.736
146 HG LEU 20 HG LEU 20 11.588 6.112 44.996
147 HD11 LEU 20 HD11 LEU 20 13.327 5.718 46.933
148 HD12 LEU 20 HD12 LEU 20 12.781 7.296 47.499
149 HD13 LEU 20 HD13 LEU 20 13.498 7.133 45.895
150 HD21 LEU 20 HD21 LEU 20 11.473 4.388 46.827
151 HD22 LEU 20 HD22 LEU 20 9.894 4.961 46.290
152 HD23 LEU 20 HD23 LEU 20 10.581 5.556 47.800
153 H LYS 21 HN LYS 21 9.488 8.733 43.549
154 HA LYS 21 HA LYS 21 10.817 7.144 41.636
155 HB2 LYS 21 HB2 LYS 21 8.552 9.128 41.373
156 HB3 LYS 21 HB1 LYS 21 9.107 8.110 40.043
157 HG2 LYS 21 HG2 LYS 21 8.666 6.095 41.398
158 HG3 LYS 21 HG1 LYS 21 8.105 7.112 42.726
159 HD2 LYS 21 HD2 LYS 21 6.323 8.022 41.274
160 HD3 LYS 21 HD1 LYS 21 6.869 6.980 39.960
161 HE2 LYS 21 HE2 LYS 21 5.909 5.998 42.664
162 HE3 LYS 21 HE1 LYS 21 4.945 5.995 41.187
163 HZ1 LYS 21 HZ1 LYS 21 6.694 4.040 42.037
164 HZ2 LYS 21 HZ2 LYS 21 7.474 4.802 40.735
165 HZ3 LYS 21 HZ3 LYS 21 5.926 4.137 40.530
166 H ARG 22 HN ARG 22 10.631 10.654 42.070
167 HA ARG 22 HA ARG 22 11.921 11.389 39.667
168 HB2 ARG 22 HB2 ARG 22 11.716 12.773 42.347
169 HB3 ARG 22 HB1 ARG 22 12.448 13.517 40.924
170 HG2 ARG 22 HG2 ARG 22 10.371 13.309 39.680
171 HG3 ARG 22 HG1 ARG 22 9.628 12.409 41.003
172 HD2 ARG 22 HD2 ARG 22 8.901 14.742 41.084
173 HD3 ARG 22 HD1 ARG 22 9.913 14.383 42.480
174 HE ARG 22 HE ARG 22 11.483 15.413 40.331
175 HH11 ARG 22 HH11 ARG 22 12.236 17.546 40.524
176 HH12 ARG 22 HH12 ARG 22 11.492 18.623 41.659
177 HH21 ARG 22 HH21 ARG 22 9.207 16.274 42.792
178 HH22 ARG 22 HH22 ARG 22 9.777 17.902 42.943
179 H LEU 23 HN LEU 23 13.161 10.584 42.881
180 HA LEU 23 HA LEU 23 15.848 11.298 42.450
181 HB2 LEU 23 HB2 LEU 23 14.949 10.818 44.681
182 HB3 LEU 23 HB1 LEU 23 14.693 9.135 44.229
183 HG LEU 23 HG LEU 23 17.130 8.855 43.886
184 HD11 LEU 23 HD11 LEU 23 17.988 10.946 43.258
185 HD12 LEU 23 HD12 LEU 23 18.529 10.825 44.929
186 HD13 LEU 23 HD13 LEU 23 17.115 11.802 44.531
187 HD21 LEU 23 HD21 LEU 23 16.119 8.413 46.104
188 HD22 LEU 23 HD22 LEU 23 16.422 10.087 46.568
189 HD23 LEU 23 HD23 LEU 23 17.775 8.999 46.255
190 H ASN 24 HN ASN 24 14.122 8.240 41.931
191 HA ASN 24 HA ASN 24 16.333 6.693 41.128
192 HB2 ASN 24 HB2 ASN 24 14.115 5.756 41.713
193 HB3 ASN 24 HB1 ASN 24 13.454 6.438 40.228
194 HD21 ASN 24 HD21 ASN 24 13.335 4.893 38.604
195 HD22 ASN 24 HD22 ASN 24 14.443 3.628 38.378
196 H GLU 25 HN GLU 25 14.126 8.764 39.289
197 HA GLU 25 HA GLU 25 15.036 8.098 36.710
198 HB2 GLU 25 HB2 GLU 25 12.956 9.369 37.157
199 HB3 GLU 25 HB1 GLU 25 13.924 10.743 37.686
200 HG2 GLU 25 HG2 GLU 25 13.247 11.069 35.360
201 HG3 GLU 25 HG1 GLU 25 14.989 10.829 35.431
202 H GLU 26 HN GLU 26 16.153 10.497 39.059
203 HA GLU 26 HA GLU 26 18.065 11.757 39.180
204 HB2 GLU 26 HB2 GLU 26 19.135 9.637 37.297
205 HB3 GLU 26 HB1 GLU 26 20.107 10.800 38.195
206 HG2 GLU 26 HG2 GLU 26 19.229 9.896 40.318
207 HG3 GLU 26 HG1 GLU 26 18.272 8.721 39.417
208 H ARG 27 HN ARG 27 16.286 12.939 37.631
209 HA ARG 27 HA ARG 27 16.956 13.406 34.935
210 HB2 ARG 27 HB2 ARG 27 15.489 15.110 36.957
211 HB3 ARG 27 HB1 ARG 27 15.623 15.525 35.248
212 HG2 ARG 27 HG2 ARG 27 14.517 13.442 34.614
213 HG3 ARG 27 HG1 ARG 27 14.466 12.930 36.302
214 HD2 ARG 27 HD2 ARG 27 12.296 13.854 35.660
215 HD3 ARG 27 HD1 ARG 27 13.068 14.908 36.841
216 HE ARG 27 HE ARG 27 13.703 15.731 34.183
217 HH11 ARG 27 HH11 ARG 27 12.683 17.606 33.407
218 HH12 ARG 27 HH12 ARG 27 11.256 18.198 34.189
219 HH21 ARG 27 HH21 ARG 27 11.196 15.676 36.568
220 HH22 ARG 27 HH22 ARG 27 10.414 17.104 35.979
221 H HIS 28 HN HIS 28 17.983 14.992 37.925
222 HA HIS 28 HA HIS 28 19.336 17.176 36.764
223 HB2 HIS 28 HB2 HIS 28 19.756 15.714 39.374
224 HB3 HIS 28 HB1 HIS 28 20.626 17.182 38.937
225 HD2 HIS 28 HD2 HIS 28 17.279 17.902 37.531
226 HE1 HIS 28 HE1 HIS 28 16.869 18.958 41.596
227 HE2 HIS 28 HE2 HIS 28 15.826 19.163 39.291
228 H ASP 29 HN ASP 29 20.401 13.886 37.531
229 HA ASP 29 HA ASP 29 23.145 14.239 37.015
230 HB2 ASP 29 HB2 ASP 29 22.169 12.235 38.110
231 HB3 ASP 29 HB1 ASP 29 21.482 11.753 36.561
232 H HIS 30 HN HIS 30 20.460 13.342 34.875
233 HA HIS 30 HA HIS 30 21.971 12.849 32.555
234 HB2 HIS 30 HB2 HIS 30 19.620 12.210 32.724
235 HB3 HIS 30 HB1 HIS 30 19.143 13.905 32.819
236 HD2 HIS 30 HD2 HIS 30 18.699 15.056 30.340
237 HE1 HIS 30 HE1 HIS 30 20.662 12.153 27.986
238 HE2 HIS 30 HE2 HIS 30 19.265 14.273 27.914
239 H ASP 31 HN ASP 31 20.430 15.841 33.722
240 HA ASP 31 HA ASP 31 21.155 17.471 31.541
241 HB2 ASP 31 HB2 ASP 31 20.569 18.107 34.434
242 HB3 ASP 31 HB1 ASP 31 20.881 19.351 33.225
243 H LYS 32 HN LYS 32 22.829 16.669 34.550
244 HA LYS 32 HA LYS 32 24.972 18.488 34.278
245 HB2 LYS 32 HB2 LYS 32 24.722 15.840 35.709
246 HB3 LYS 32 HB1 LYS 32 26.188 16.809 35.772
247 HG2 LYS 32 HG2 LYS 32 23.546 18.106 36.421
248 HG3 LYS 32 HG1 LYS 32 24.325 17.098 37.636
249 HD2 LYS 32 HD2 LYS 32 25.898 19.265 36.241
250 HD3 LYS 32 HD1 LYS 32 24.839 19.669 37.589
251 HE2 LYS 32 HE2 LYS 32 26.034 17.956 38.975
252 HE3 LYS 32 HE1 LYS 32 27.158 17.709 37.641
253 HZ1 LYS 32 HZ1 LYS 32 28.125 19.272 39.107
254 HZ2 LYS 32 HZ2 LYS 32 26.707 20.204 39.172
255 HZ3 LYS 32 HZ3 LYS 32 27.618 20.136 37.739
256 H ARG 33 HN ARG 33 24.492 15.193 33.096
257 HA ARG 33 HA ARG 33 27.085 14.737 32.135
258 HB2 ARG 33 HB2 ARG 33 25.475 12.929 32.339
259 HB3 ARG 33 HB1 ARG 33 24.415 13.692 31.161
260 HG2 ARG 33 HG2 ARG 33 25.668 11.855 30.121
261 HG3 ARG 33 HG1 ARG 33 26.152 13.388 29.411
262 HD2 ARG 33 HD2 ARG 33 28.194 13.420 30.687
263 HD3 ARG 33 HD1 ARG 33 27.666 12.059 31.674
264 HE ARG 33 HE ARG 33 27.663 11.182 29.032
265 HH11 ARG 33 HH11 ARG 33 29.450 10.067 28.182
266 HH12 ARG 33 HH12 ARG 33 31.010 10.260 28.910
267 HH21 ARG 33 HH21 ARG 33 29.896 12.466 31.342
268 HH22 ARG 33 HH22 ARG 33 31.263 11.619 30.699
269 H GLU 34 HN GLU 34 24.240 16.163 30.565
270 HA GLU 34 HA GLU 34 25.428 16.541 28.022
271 HB2 GLU 34 HB2 GLU 34 23.131 17.947 29.393
272 HB3 GLU 34 HB1 GLU 34 23.618 18.291 27.734
273 HG2 GLU 34 HG2 GLU 34 22.908 15.511 28.718
274 HG3 GLU 34 HG1 GLU 34 21.755 16.596 27.945
275 H ALA 35 HN ALA 35 25.278 18.556 30.919
276 HA ALA 35 HA ALA 35 26.371 20.910 29.827
277 HB1 ALA 35 HB1 ALA 35 25.297 20.867 32.024
278 HB2 ALA 35 HB2 ALA 35 26.943 21.480 32.162
279 HB3 ALA 35 HB3 ALA 35 26.576 19.824 32.644
280 H GLU 36 HN GLU 36 27.891 18.045 31.239
281 HA GLU 36 HA GLU 36 30.537 19.009 31.288
282 HB2 GLU 36 HB2 GLU 36 29.787 16.963 32.466
283 HB3 GLU 36 HB1 GLU 36 29.572 16.160 30.911
284 HG2 GLU 36 HG2 GLU 36 31.734 15.544 31.901
285 HG3 GLU 36 HG1 GLU 36 31.983 16.471 30.425
286 H ARG 37 HN ARG 37 28.703 17.292 28.778
287 HA ARG 37 HA ARG 37 30.832 16.954 26.956
288 HB2 ARG 37 HB2 ARG 37 27.846 17.166 26.539
289 HB3 ARG 37 HB1 ARG 37 28.982 16.775 25.248
290 HG2 ARG 37 HG2 ARG 37 29.767 14.815 26.488
291 HG3 ARG 37 HG1 ARG 37 28.703 15.220 27.836
292 HD2 ARG 37 HD2 ARG 37 27.663 13.492 26.448
293 HD3 ARG 37 HD1 ARG 37 26.741 14.988 26.340
294 HE ARG 37 HE ARG 37 27.364 15.163 24.099
295 HH11 ARG 37 HH11 ARG 37 28.304 14.337 22.203
296 HH12 ARG 37 HH12 ARG 37 29.423 13.018 22.302
297 HH21 ARG 37 HH21 ARG 37 29.223 12.759 25.753
298 HH22 ARG 37 HH22 ARG 37 29.943 12.125 24.311
299 H LYS 38 HN LYS 38 28.502 19.592 27.394
300 HA LYS 38 HA LYS 38 29.247 21.086 25.113
301 HB2 LYS 38 HB2 LYS 38 28.010 21.904 27.740
302 HB3 LYS 38 HB1 LYS 38 28.252 23.029 26.403
303 HG2 LYS 38 HG2 LYS 38 26.954 21.415 24.938
304 HG3 LYS 38 HG1 LYS 38 26.557 20.516 26.399
305 HD2 LYS 38 HD2 LYS 38 25.964 23.467 26.078
306 HD3 LYS 38 HD1 LYS 38 24.811 22.208 25.640
307 HE2 LYS 38 HE2 LYS 38 24.986 21.324 27.988
308 HE3 LYS 38 HE1 LYS 38 25.982 22.723 28.390
309 HZ1 LYS 38 HZ1 LYS 38 23.488 23.304 27.034
310 HZ2 LYS 38 HZ2 LYS 38 24.238 24.105 28.332
311 HZ3 LYS 38 HZ3 LYS 38 23.336 22.692 28.609
312 H ALA 39 HN ALA 39 30.467 21.052 28.432
313 HA ALA 39 HA ALA 39 32.158 23.295 28.250
314 HB1 ALA 39 HB1 ALA 39 31.571 22.178 30.379
315 HB2 ALA 39 HB2 ALA 39 33.316 22.350 30.184
316 HB3 ALA 39 HB3 ALA 39 32.548 20.787 29.902
317 H LEU 40 HN LEU 40 32.689 19.882 27.460
318 HA LEU 40 HA LEU 40 35.459 20.061 26.929
319 HB2 LEU 40 HB2 LEU 40 33.330 18.190 25.877
320 HB3 LEU 40 HB1 LEU 40 35.048 17.988 25.547
321 HG LEU 40 HG LEU 40 33.869 18.153 28.337
322 HD11 LEU 40 HD11 LEU 40 34.407 15.648 28.325
323 HD12 LEU 40 HD12 LEU 40 34.519 15.786 26.571
324 HD13 LEU 40 HD13 LEU 40 32.999 16.149 27.388
325 HD21 LEU 40 HD21 LEU 40 36.133 18.655 28.622
326 HD22 LEU 40 HD22 LEU 40 36.632 17.720 27.213
327 HD23 LEU 40 HD23 LEU 40 36.196 16.897 28.709
328 H GLU 41 HN GLU 41 32.613 20.550 24.893
329 HA GLU 41 HA GLU 41 33.931 20.794 22.417
330 HB2 GLU 41 HB2 GLU 41 31.484 20.529 22.646
331 HB3 GLU 41 HB1 GLU 41 31.382 22.143 23.347
332 HG2 GLU 41 HG2 GLU 41 30.815 22.231 20.968
333 HG3 GLU 41 HG1 GLU 41 32.322 23.094 21.249
334 H ASP 42 HN ASP 42 33.208 23.144 24.947
335 HA ASP 42 HA ASP 42 33.963 25.481 23.588
336 HB2 ASP 42 HB2 ASP 42 34.002 24.753 26.518
337 HB3 ASP 42 HB1 ASP 42 34.402 26.366 25.927
338 H LYS 43 HN LYS 43 35.875 23.107 25.377
339 HA LYS 43 HA LYS 43 38.286 24.529 25.532
340 HB2 LYS 43 HB2 LYS 43 37.864 22.423 26.742
341 HB3 LYS 43 HB1 LYS 43 37.884 21.545 25.214
342 HG2 LYS 43 HG2 LYS 43 40.218 22.233 24.830
343 HG3 LYS 43 HG1 LYS 43 40.200 23.155 26.334
344 HD2 LYS 43 HD2 LYS 43 39.770 21.080 27.600
345 HD3 LYS 43 HD1 LYS 43 39.782 20.159 26.096
346 HE2 LYS 43 HE2 LYS 43 42.112 20.848 25.682
347 HE3 LYS 43 HE1 LYS 43 42.106 21.780 27.179
348 HZ1 LYS 43 HZ1 LYS 43 41.206 19.184 27.733
349 HZ2 LYS 43 HZ2 LYS 43 42.614 19.955 28.290
350 HZ3 LYS 43 HZ3 LYS 43 42.647 19.061 26.845
351 H LEU 44 HN LEU 44 37.075 22.349 22.972
352 HA LEU 44 HA LEU 44 39.377 22.519 21.334
353 HB2 LEU 44 HB2 LEU 44 36.488 21.876 20.720
354 HB3 LEU 44 HB1 LEU 44 37.732 21.881 19.474
355 HG LEU 44 HG LEU 44 39.047 20.264 20.970
356 HD11 LEU 44 HD11 LEU 44 37.513 18.918 22.494
357 HD12 LEU 44 HD12 LEU 44 36.356 20.240 22.359
358 HD13 LEU 44 HD13 LEU 44 37.942 20.523 23.080
359 HD21 LEU 44 HD21 LEU 44 37.798 19.587 18.932
360 HD22 LEU 44 HD22 LEU 44 36.353 19.351 19.915
361 HD23 LEU 44 HD23 LEU 44 37.770 18.332 20.170
362 H ALA 45 HN ALA 45 36.430 24.463 21.516
363 HA ALA 45 HA ALA 45 36.872 26.055 19.236
364 HB1 ALA 45 HB1 ALA 45 34.722 25.989 20.428
365 HB2 ALA 45 HB2 ALA 45 35.315 27.645 20.283
366 HB3 ALA 45 HB3 ALA 45 35.465 26.784 21.816
367 H ASP 46 HN ASP 46 37.932 26.407 22.594
368 HA ASP 46 HA ASP 46 39.446 27.829 23.584
369 HB2 ASP 46 HB2 ASP 46 40.889 26.566 21.934
370 HB3 ASP 46 HB1 ASP 46 40.711 27.937 20.842
371 H LYS 47 HN LYS 47 37.131 29.114 22.842
372 HA LYS 47 HA LYS 47 37.439 31.373 21.202
373 HB2 LYS 47 HB2 LYS 47 35.249 30.562 21.970
374 HB3 LYS 47 HB1 LYS 47 35.661 30.991 23.626
375 HG2 LYS 47 HG2 LYS 47 34.248 32.730 22.640
376 HG3 LYS 47 HG1 LYS 47 35.858 33.378 22.941
377 HD2 LYS 47 HD2 LYS 47 36.432 33.352 20.653
378 HD3 LYS 47 HD1 LYS 47 35.159 32.199 20.251
379 HE2 LYS 47 HE2 LYS 47 34.535 34.440 19.481
380 HE3 LYS 47 HE1 LYS 47 33.462 33.937 20.786
381 HZ1 LYS 47 HZ1 LYS 47 34.202 36.186 21.143
382 HZ2 LYS 47 HZ2 LYS 47 35.830 35.710 21.047
383 HZ3 LYS 47 HZ3 LYS 47 34.861 35.181 22.338
384 H GLN 48 HN GLN 48 37.960 30.922 24.683
385 HA GLN 48 HA GLN 48 38.665 33.627 25.215
386 HB2 GLN 48 HB2 GLN 48 37.915 31.991 26.950
387 HB3 GLN 48 HB1 GLN 48 39.450 31.145 26.763
388 HG2 GLN 48 HG2 GLN 48 39.583 32.667 28.669
389 HG3 GLN 48 HG1 GLN 48 40.652 33.232 27.388
390 HE21 GLN 48 HE21 GLN 48 40.525 35.468 27.222
391 HE22 GLN 48 HE22 GLN 48 39.103 36.380 27.390
392 H GLU 49 HN GLU 49 40.554 34.675 25.000
393 HA GLU 49 HA GLU 49 42.681 33.487 23.506
394 HB2 GLU 49 HB2 GLU 49 42.440 36.132 24.950
395 HB3 GLU 49 HB1 GLU 49 43.839 35.673 23.978
396 HG2 GLU 49 HG2 GLU 49 42.435 35.416 22.002
397 HG3 GLU 49 HG1 GLU 49 40.987 35.740 22.953
398 H HIS 50 HN HIS 50 44.716 32.867 24.159
399 HA HIS 50 HA HIS 50 45.518 33.098 26.947
400 HB2 HIS 50 HB2 HIS 50 44.073 31.064 26.887
401 HB3 HIS 50 HB1 HIS 50 45.165 30.366 25.692
402 HD2 HIS 50 HD2 HIS 50 47.124 28.860 26.898
403 HE1 HIS 50 HE1 HIS 50 47.183 30.806 30.643
404 HE2 HIS 50 HE2 HIS 50 48.182 28.907 29.285
405 H LEU 51 HN LEU 51 47.702 33.062 27.181
406 HA LEU 51 HA LEU 51 49.331 33.415 24.896
407 HB2 LEU 51 HB2 LEU 51 50.013 32.907 27.794
408 HB3 LEU 51 HB1 LEU 51 51.235 33.216 26.566
409 HG LEU 51 HG LEU 51 48.915 35.093 27.141
410 HD11 LEU 51 HD11 LEU 51 51.760 35.078 28.178
411 HD12 LEU 51 HD12 LEU 51 50.274 35.008 29.126
412 HD13 LEU 51 HD13 LEU 51 50.700 36.486 28.262
413 HD21 LEU 51 HD21 LEU 51 51.327 35.166 25.330
414 HD22 LEU 51 HD22 LEU 51 50.727 36.676 26.012
415 HD23 LEU 51 HD23 LEU 51 49.673 35.688 25.010
416 H ASP 52 HN ASP 52 48.797 30.632 27.016
417 HA ASP 52 HA ASP 52 49.418 28.420 26.818
418 HB2 ASP 52 HB2 ASP 52 48.021 28.776 24.735
419 HB3 ASP 52 HB1 ASP 52 49.532 29.000 23.855
420 H GLY 53 HN GLY 53 51.545 30.258 27.319
421 HA2 GLY 53 HA2 GLY 53 53.770 29.738 25.591
422 HA3 GLY 53 HA1 GLY 53 53.838 30.480 27.185
423 H ALA 54 HN ALA 54 52.190 27.880 27.931
424 HA ALA 54 HA ALA 54 54.311 26.519 29.183
425 HB1 ALA 54 HB1 ALA 54 52.115 26.249 30.074
426 HB2 ALA 54 HB2 ALA 54 52.590 24.669 29.451
427 HB3 ALA 54 HB3 ALA 54 51.483 25.685 28.527
428 H LEU 55 HN LEU 55 52.633 25.923 26.118
429 HA LEU 55 HA LEU 55 53.844 23.442 25.520
430 HB2 LEU 55 HB2 LEU 55 52.723 25.605 23.732
431 HB3 LEU 55 HB1 LEU 55 53.258 24.037 23.137
432 HG LEU 55 HG LEU 55 51.161 24.400 25.299
433 HD11 LEU 55 HD11 LEU 55 50.731 23.712 22.378
434 HD12 LEU 55 HD12 LEU 55 50.501 25.327 23.048
435 HD13 LEU 55 HD13 LEU 55 49.492 23.991 23.601
436 HD21 LEU 55 HD21 LEU 55 50.662 21.960 24.343
437 HD22 LEU 55 HD22 LEU 55 51.904 22.204 25.564
438 HD23 LEU 55 HD23 LEU 55 52.360 22.033 23.871
439 H ARG 56 HN ARG 56 54.819 26.777 24.869
440 HA ARG 56 HA ARG 56 57.083 26.097 23.266
441 HB2 ARG 56 HB2 ARG 56 56.357 28.606 24.791
442 HB3 ARG 56 HB1 ARG 56 57.766 28.472 23.739
443 HG2 ARG 56 HG2 ARG 56 56.307 27.895 21.839
444 HG3 ARG 56 HG1 ARG 56 54.893 28.014 22.887
445 HD2 ARG 56 HD2 ARG 56 55.412 30.385 23.324
446 HD3 ARG 56 HD1 ARG 56 56.826 30.268 22.280
447 HE ARG 56 HE ARG 56 54.566 29.440 20.815
448 HH11 ARG 56 HH11 ARG 56 53.612 30.896 19.355
449 HH12 ARG 56 HH12 ARG 56 53.895 32.596 19.527
450 HH21 ARG 56 HH21 ARG 56 55.934 32.245 22.310
451 HH22 ARG 56 HH22 ARG 56 55.210 33.360 21.200
452 H TYR 57 HN TYR 57 59.234 25.929 23.816
453 HA TYR 57 HA TYR 57 59.822 24.946 26.433
454 HB2 TYR 57 HB2 TYR 57 62.145 24.810 25.606
455 HB3 TYR 57 HB1 TYR 57 61.005 24.111 24.456
456 HD1 TYR 57 HD1 TYR 57 63.237 26.958 25.156
457 HD2 TYR 57 HD2 TYR 57 60.490 25.224 22.347
458 HE1 TYR 57 HE1 TYR 57 64.020 28.540 23.415
459 HE2 TYR 57 HE2 TYR 57 61.272 26.806 20.605
460 HH TYR 57 HH TYR 57 63.019 28.236 20.073
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 53.489 7.404 43.605
2 H2 GLY 1 HT2 GLY 1 53.768 7.325 45.278
3 H3 GLY 1 HT3 GLY 1 54.284 8.678 44.392
4 HA2 GLY 1 HA2 GLY 1 51.793 8.219 45.639
5 HA3 GLY 1 HA1 GLY 1 52.380 9.682 44.847
6 H SER 2 HN SER 2 51.984 9.989 42.615
7 HA SER 2 HA SER 2 49.477 9.105 41.688
8 HB2 SER 2 HB2 SER 2 50.508 11.189 40.912
9 HB3 SER 2 HB1 SER 2 51.793 10.276 40.127
10 HG SER 2 HG SER 2 49.905 9.174 39.047
11 H ALA 3 HN ALA 3 52.774 8.064 40.876
12 HA ALA 3 HA ALA 3 52.091 6.225 38.856
13 HB1 ALA 3 HB1 ALA 3 54.300 5.387 39.072
14 HB2 ALA 3 HB2 ALA 3 54.407 5.888 40.759
15 HB3 ALA 3 HB3 ALA 3 54.411 7.101 39.477
16 H GLY 4 HN GLY 4 52.349 5.875 42.369
17 HA2 GLY 4 HA2 GLY 4 51.927 3.049 42.401
18 HA3 GLY 4 HA1 GLY 4 51.795 4.134 43.781
19 H LEU 5 HN LEU 5 50.043 1.949 43.212
20 HA LEU 5 HA LEU 5 47.627 2.773 41.985
21 HB2 LEU 5 HB2 LEU 5 48.209 0.659 44.063
22 HB3 LEU 5 HB1 LEU 5 46.612 0.899 43.366
23 HG LEU 5 HG LEU 5 49.106 0.362 41.716
24 HD11 LEU 5 HD11 LEU 5 46.975 -1.519 42.759
25 HD12 LEU 5 HD12 LEU 5 48.708 -1.582 43.082
26 HD13 LEU 5 HD13 LEU 5 48.098 -1.937 41.466
27 HD21 LEU 5 HD21 LEU 5 47.568 1.299 40.221
28 HD22 LEU 5 HD22 LEU 5 46.171 0.691 41.107
29 HD23 LEU 5 HD23 LEU 5 47.130 -0.402 40.114
30 H GLN 6 HN GLN 6 48.802 2.974 45.312
31 HA GLN 6 HA GLN 6 47.961 3.991 47.173
32 HB2 GLN 6 HB2 GLN 6 46.994 5.955 45.087
33 HB3 GLN 6 HB1 GLN 6 47.257 6.270 46.794
34 HG2 GLN 6 HG2 GLN 6 49.400 5.420 44.842
35 HG3 GLN 6 HG1 GLN 6 49.169 7.058 45.448
36 HE21 GLN 6 HE21 GLN 6 48.985 6.985 48.081
37 HE22 GLN 6 HE22 GLN 6 50.228 6.097 48.820
38 H GLU 7 HN GLU 7 46.304 1.941 46.287
39 HA GLU 7 HA GLU 7 43.601 2.688 45.927
40 HB2 GLU 7 HB2 GLU 7 44.496 0.423 45.446
41 HB3 GLU 7 HB1 GLU 7 44.698 0.157 47.178
42 HG2 GLU 7 HG2 GLU 7 42.289 0.451 47.530
43 HG3 GLU 7 HG1 GLU 7 42.064 0.790 45.815
44 H LYS 8 HN LYS 8 42.059 3.309 47.322
45 HA LYS 8 HA LYS 8 42.588 3.109 50.236
46 HB2 LYS 8 HB2 LYS 8 41.451 5.472 48.719
47 HB3 LYS 8 HB1 LYS 8 41.490 5.328 50.478
48 HG2 LYS 8 HG2 LYS 8 43.951 5.136 50.410
49 HG3 LYS 8 HG1 LYS 8 43.913 5.285 48.651
50 HD2 LYS 8 HD2 LYS 8 42.879 7.517 48.863
51 HD3 LYS 8 HD1 LYS 8 42.923 7.370 50.620
52 HE2 LYS 8 HE2 LYS 8 45.381 7.186 50.551
53 HE3 LYS 8 HE1 LYS 8 45.344 7.324 48.793
54 HZ1 LYS 8 HZ1 LYS 8 44.714 9.517 48.885
55 HZ2 LYS 8 HZ2 LYS 8 45.745 9.416 50.232
56 HZ3 LYS 8 HZ3 LYS 8 44.058 9.391 50.445
57 H GLU 9 HN GLU 9 40.790 2.785 51.540
58 HA GLU 9 HA GLU 9 38.662 1.294 50.415
59 HB2 GLU 9 HB2 GLU 9 39.036 2.535 53.142
60 HB3 GLU 9 HB1 GLU 9 37.626 1.566 52.719
61 HG2 GLU 9 HG2 GLU 9 39.008 -0.361 52.245
62 HG3 GLU 9 HG1 GLU 9 40.481 0.587 52.426
63 H ARG 10 HN ARG 10 38.929 4.659 51.464
64 HA ARG 10 HA ARG 10 36.205 5.351 51.214
65 HB2 ARG 10 HB2 ARG 10 38.726 7.002 50.976
66 HB3 ARG 10 HB1 ARG 10 37.105 7.697 50.960
67 HG2 ARG 10 HG2 ARG 10 36.641 6.829 53.170
68 HG3 ARG 10 HG1 ARG 10 38.152 5.921 53.181
69 HD2 ARG 10 HD2 ARG 10 37.993 8.938 52.965
70 HD3 ARG 10 HD1 ARG 10 38.259 8.073 54.475
71 HE ARG 10 HE ARG 10 40.176 7.167 52.645
72 HH11 ARG 10 HH11 ARG 10 42.274 8.034 52.688
73 HH12 ARG 10 HH12 ARG 10 42.549 9.586 53.406
74 HH21 ARG 10 HH21 ARG 10 39.224 10.075 54.261
75 HH22 ARG 10 HH22 ARG 10 40.822 10.742 54.295
76 H GLU 11 HN GLU 11 38.871 5.342 48.890
77 HA GLU 11 HA GLU 11 37.541 6.638 46.769
78 HB2 GLU 11 HB2 GLU 11 39.980 6.241 46.821
79 HB3 GLU 11 HB1 GLU 11 39.694 4.512 46.624
80 HG2 GLU 11 HG2 GLU 11 38.612 4.911 44.461
81 HG3 GLU 11 HG1 GLU 11 38.807 6.649 44.664
82 H LEU 12 HN LEU 12 37.747 3.218 47.688
83 HA LEU 12 HA LEU 12 36.374 2.162 45.460
84 HB2 LEU 12 HB2 LEU 12 36.664 1.158 48.296
85 HB3 LEU 12 HB1 LEU 12 35.913 0.220 47.008
86 HG LEU 12 HG LEU 12 38.726 1.348 46.860
87 HD11 LEU 12 HD11 LEU 12 37.863 -1.496 47.463
88 HD12 LEU 12 HD12 LEU 12 38.427 -0.350 48.678
89 HD13 LEU 12 HD13 LEU 12 39.517 -0.884 47.400
90 HD21 LEU 12 HD21 LEU 12 38.135 0.928 44.639
91 HD22 LEU 12 HD22 LEU 12 37.020 -0.369 45.063
92 HD23 LEU 12 HD23 LEU 12 38.759 -0.652 45.097
93 H GLU 13 HN GLU 13 35.247 3.390 48.577
94 HA GLU 13 HA GLU 13 32.535 2.627 48.293
95 HB2 GLU 13 HB2 GLU 13 33.859 4.822 49.890
96 HB3 GLU 13 HB1 GLU 13 32.127 4.500 49.961
97 HG2 GLU 13 HG2 GLU 13 32.508 2.250 50.756
98 HG3 GLU 13 HG1 GLU 13 34.245 2.398 50.502
99 H ASP 14 HN ASP 14 34.315 5.523 47.322
100 HA ASP 14 HA ASP 14 32.113 7.078 46.501
101 HB2 ASP 14 HB2 ASP 14 34.409 7.964 46.795
102 HB3 ASP 14 HB1 ASP 14 34.918 7.068 45.365
103 H LEU 15 HN LEU 15 34.123 4.737 44.749
104 HA LEU 15 HA LEU 15 32.981 5.104 42.204
105 HB2 LEU 15 HB2 LEU 15 35.080 3.883 42.553
106 HB3 LEU 15 HB1 LEU 15 34.214 2.618 43.421
107 HG LEU 15 HG LEU 15 32.911 2.106 41.378
108 HD11 LEU 15 HD11 LEU 15 34.470 4.461 40.320
109 HD12 LEU 15 HD12 LEU 15 32.756 4.089 40.136
110 HD13 LEU 15 HD13 LEU 15 33.954 3.185 39.217
111 HD21 LEU 15 HD21 LEU 15 34.697 1.023 40.177
112 HD22 LEU 15 HD22 LEU 15 35.151 1.038 41.880
113 HD23 LEU 15 HD23 LEU 15 35.876 2.195 40.765
114 H LYS 16 HN LYS 16 32.134 2.898 44.857
115 HA LYS 16 HA LYS 16 30.084 1.504 43.518
116 HB2 LYS 16 HB2 LYS 16 30.530 2.092 46.453
117 HB3 LYS 16 HB1 LYS 16 29.253 1.031 45.866
118 HG2 LYS 16 HG2 LYS 16 32.116 0.577 45.029
119 HG3 LYS 16 HG1 LYS 16 31.537 -0.023 46.579
120 HD2 LYS 16 HD2 LYS 16 29.685 -1.210 45.362
121 HD3 LYS 16 HD1 LYS 16 30.427 -0.721 43.841
122 HE2 LYS 16 HE2 LYS 16 32.504 -1.884 44.467
123 HE3 LYS 16 HE1 LYS 16 31.770 -2.375 45.994
124 HZ1 LYS 16 HZ1 LYS 16 30.239 -3.001 43.614
125 HZ2 LYS 16 HZ2 LYS 16 30.532 -3.940 44.999
126 HZ3 LYS 16 HZ3 LYS 16 31.703 -3.845 43.770
127 H ASP 17 HN ASP 17 30.060 4.495 45.406
128 HA ASP 17 HA ASP 17 27.267 4.860 45.506
129 HB2 ASP 17 HB2 ASP 17 29.565 6.819 45.562
130 HB3 ASP 17 HB1 ASP 17 27.884 7.308 45.773
131 H ALA 18 HN ALA 18 29.687 5.789 43.099
132 HA ALA 18 HA ALA 18 28.023 7.367 41.461
133 HB1 ALA 18 HB1 ALA 18 30.298 5.641 40.479
134 HB2 ALA 18 HB2 ALA 18 30.556 7.153 41.350
135 HB3 ALA 18 HB3 ALA 18 29.717 7.160 39.798
136 H GLU 19 HN GLU 19 28.665 3.889 41.522
137 HA GLU 19 HA GLU 19 27.304 3.197 39.155
138 HB2 GLU 19 HB2 GLU 19 28.818 1.664 40.369
139 HB3 GLU 19 HB1 GLU 19 27.643 1.558 41.679
140 HG2 GLU 19 HG2 GLU 19 25.982 0.605 40.150
141 HG3 GLU 19 HG1 GLU 19 27.102 0.775 38.801
142 H LEU 20 HN LEU 20 26.185 3.508 42.509
143 HA LEU 20 HA LEU 20 23.568 2.555 42.119
144 HB2 LEU 20 HB2 LEU 20 24.543 2.876 44.347
145 HB3 LEU 20 HB1 LEU 20 24.592 4.618 44.089
146 HG LEU 20 HG LEU 20 22.123 4.661 43.897
147 HD11 LEU 20 HD11 LEU 20 21.454 2.575 43.061
148 HD12 LEU 20 HD12 LEU 20 21.003 2.440 44.758
149 HD13 LEU 20 HD13 LEU 20 22.485 1.681 44.178
150 HD21 LEU 20 HD21 LEU 20 23.038 3.180 46.381
151 HD22 LEU 20 HD22 LEU 20 21.649 4.257 46.247
152 HD23 LEU 20 HD23 LEU 20 23.283 4.906 46.108
153 H LYS 21 HN LYS 21 24.915 5.838 41.910
154 HA LYS 21 HA LYS 21 22.489 7.173 41.367
155 HB2 LYS 21 HB2 LYS 21 25.353 7.844 40.669
156 HB3 LYS 21 HB1 LYS 21 24.001 8.932 40.364
157 HG2 LYS 21 HG2 LYS 21 23.422 8.894 42.763
158 HG3 LYS 21 HG1 LYS 21 24.777 7.808 43.071
159 HD2 LYS 21 HD2 LYS 21 26.343 9.525 42.220
160 HD3 LYS 21 HD1 LYS 21 24.984 10.616 41.942
161 HE2 LYS 21 HE2 LYS 21 25.747 9.449 44.635
162 HE3 LYS 21 HE1 LYS 21 26.125 11.085 44.099
163 HZ1 LYS 21 HZ1 LYS 21 23.630 11.279 43.694
164 HZ2 LYS 21 HZ2 LYS 21 24.170 11.315 45.305
165 HZ3 LYS 21 HZ3 LYS 21 23.482 9.899 44.667
166 H ARG 22 HN ARG 22 24.871 5.625 39.257
167 HA ARG 22 HA ARG 22 23.829 6.479 36.785
168 HB2 ARG 22 HB2 ARG 22 26.034 5.403 37.033
169 HB3 ARG 22 HB1 ARG 22 25.241 3.881 37.443
170 HG2 ARG 22 HG2 ARG 22 24.177 3.792 35.254
171 HG3 ARG 22 HG1 ARG 22 24.822 5.381 34.841
172 HD2 ARG 22 HD2 ARG 22 27.111 4.513 34.994
173 HD3 ARG 22 HD1 ARG 22 26.495 2.933 35.472
174 HE ARG 22 HE ARG 22 25.929 2.527 33.246
175 HH11 ARG 22 HH11 ARG 22 25.958 3.049 31.036
176 HH12 ARG 22 HH12 ARG 22 26.312 4.670 30.539
177 HH21 ARG 22 HH21 ARG 22 26.716 5.856 33.773
178 HH22 ARG 22 HH22 ARG 22 26.740 6.259 32.089
179 H LEU 23 HN LEU 23 23.106 3.625 38.770
180 HA LEU 23 HA LEU 23 21.291 2.406 36.981
181 HB2 LEU 23 HB2 LEU 23 21.541 2.270 39.992
182 HB3 LEU 23 HB1 LEU 23 20.439 1.258 39.064
183 HG LEU 23 HG LEU 23 23.431 1.386 38.577
184 HD11 LEU 23 HD11 LEU 23 23.387 -0.902 39.681
185 HD12 LEU 23 HD12 LEU 23 21.758 -0.515 40.234
186 HD13 LEU 23 HD13 LEU 23 23.125 0.462 40.768
187 HD21 LEU 23 HD21 LEU 23 22.543 0.512 36.602
188 HD22 LEU 23 HD22 LEU 23 21.148 -0.199 37.411
189 HD23 LEU 23 HD23 LEU 23 22.729 -0.966 37.539
190 H ASN 24 HN ASN 24 20.861 4.806 39.534
191 HA ASN 24 HA ASN 24 18.047 4.847 39.571
192 HB2 ASN 24 HB2 ASN 24 20.103 6.961 40.225
193 HB3 ASN 24 HB1 ASN 24 18.373 7.197 40.466
194 HD21 ASN 24 HD21 ASN 24 20.270 7.146 42.655
195 HD22 ASN 24 HD22 ASN 24 19.916 5.787 43.607
196 H GLU 25 HN GLU 25 20.396 6.564 37.564
197 HA GLU 25 HA GLU 25 20.164 7.813 35.653
198 HB2 GLU 25 HB2 GLU 25 17.605 6.208 35.430
199 HB3 GLU 25 HB1 GLU 25 18.311 7.174 34.135
200 HG2 GLU 25 HG2 GLU 25 20.367 5.815 34.237
201 HG3 GLU 25 HG1 GLU 25 19.659 4.846 35.530
202 H GLU 26 HN GLU 26 19.578 9.278 37.817
203 HA GLU 26 HA GLU 26 16.980 10.422 37.879
204 HB2 GLU 26 HB2 GLU 26 19.657 11.475 38.815
205 HB3 GLU 26 HB1 GLU 26 18.119 12.279 39.132
206 HG2 GLU 26 HG2 GLU 26 17.292 10.295 40.304
207 HG3 GLU 26 HG1 GLU 26 18.786 9.435 39.937
208 H ARG 27 HN ARG 27 16.173 12.292 36.966
209 HA ARG 27 HA ARG 27 17.007 12.962 34.366
210 HB2 ARG 27 HB2 ARG 27 14.713 13.323 35.197
211 HB3 ARG 27 HB1 ARG 27 15.307 14.585 36.274
212 HG2 ARG 27 HG2 ARG 27 16.038 15.930 34.388
213 HG3 ARG 27 HG1 ARG 27 15.634 14.635 33.261
214 HD2 ARG 27 HD2 ARG 27 13.623 15.996 35.069
215 HD3 ARG 27 HD1 ARG 27 13.893 16.440 33.386
216 HE ARG 27 HE ARG 27 13.399 13.685 33.452
217 HH11 ARG 27 HH11 ARG 27 11.318 12.901 32.991
218 HH12 ARG 27 HH12 ARG 27 9.946 13.944 33.164
219 HH21 ARG 27 HH21 ARG 27 11.821 16.673 34.196
220 HH22 ARG 27 HH22 ARG 27 10.230 16.080 33.846
221 H HIS 28 HN HIS 28 17.570 14.555 37.482
222 HA HIS 28 HA HIS 28 18.872 16.850 36.489
223 HB2 HIS 28 HB2 HIS 28 19.105 15.412 39.138
224 HB3 HIS 28 HB1 HIS 28 19.860 16.969 38.800
225 HD2 HIS 28 HD2 HIS 28 16.462 15.625 39.948
226 HE1 HIS 28 HE1 HIS 28 15.790 19.602 38.705
227 HE2 HIS 28 HE2 HIS 28 14.774 17.617 39.917
228 H ASP 29 HN ASP 29 20.086 13.645 37.386
229 HA ASP 29 HA ASP 29 22.839 14.213 37.216
230 HB2 ASP 29 HB2 ASP 29 21.275 11.665 36.788
231 HB3 ASP 29 HB1 ASP 29 23.035 11.723 36.751
232 H HIS 30 HN HIS 30 20.494 13.215 34.748
233 HA HIS 30 HA HIS 30 22.356 12.838 32.649
234 HB2 HIS 30 HB2 HIS 30 19.410 13.514 32.645
235 HB3 HIS 30 HB1 HIS 30 20.331 13.223 31.169
236 HD2 HIS 30 HD2 HIS 30 18.375 11.178 33.691
237 HE1 HIS 30 HE1 HIS 30 21.065 8.463 31.900
238 HE2 HIS 30 HE2 HIS 30 19.008 8.665 33.376
239 H ASP 31 HN ASP 31 20.563 15.667 33.781
240 HA ASP 31 HA ASP 31 21.223 17.420 31.678
241 HB2 ASP 31 HB2 ASP 31 20.567 17.909 34.585
242 HB3 ASP 31 HB1 ASP 31 20.818 19.215 33.427
243 H LYS 32 HN LYS 32 22.908 16.599 34.677
244 HA LYS 32 HA LYS 32 24.945 18.554 34.490
245 HB2 LYS 32 HB2 LYS 32 24.870 15.854 35.844
246 HB3 LYS 32 HB1 LYS 32 26.243 16.952 35.967
247 HG2 LYS 32 HG2 LYS 32 24.768 18.702 36.892
248 HG3 LYS 32 HG1 LYS 32 23.391 17.608 36.777
249 HD2 LYS 32 HD2 LYS 32 24.506 16.032 38.311
250 HD3 LYS 32 HD1 LYS 32 25.887 17.125 38.429
251 HE2 LYS 32 HE2 LYS 32 24.426 18.878 39.362
252 HE3 LYS 32 HE1 LYS 32 23.041 17.793 39.239
253 HZ1 LYS 32 HZ1 LYS 32 23.779 17.588 41.429
254 HZ2 LYS 32 HZ2 LYS 32 25.417 17.544 40.981
255 HZ3 LYS 32 HZ3 LYS 32 24.408 16.218 40.652
256 H ARG 33 HN ARG 33 24.667 15.272 33.211
257 HA ARG 33 HA ARG 33 27.315 15.047 32.234
258 HB2 ARG 33 HB2 ARG 33 24.730 13.731 31.381
259 HB3 ARG 33 HB1 ARG 33 26.287 13.324 30.668
260 HG2 ARG 33 HG2 ARG 33 25.958 13.264 33.668
261 HG3 ARG 33 HG1 ARG 33 25.387 11.910 32.697
262 HD2 ARG 33 HD2 ARG 33 27.646 11.683 31.706
263 HD3 ARG 33 HD1 ARG 33 28.217 13.008 32.709
264 HE ARG 33 HE ARG 33 27.054 11.087 34.396
265 HH11 ARG 33 HH11 ARG 33 28.401 9.638 35.511
266 HH12 ARG 33 HH12 ARG 33 30.007 9.337 34.934
267 HH21 ARG 33 HH21 ARG 33 29.725 11.491 32.232
268 HH22 ARG 33 HH22 ARG 33 30.757 10.386 33.079
269 H GLU 34 HN GLU 34 24.347 16.331 30.811
270 HA GLU 34 HA GLU 34 25.314 16.721 28.193
271 HB2 GLU 34 HB2 GLU 34 22.923 16.853 28.808
272 HB3 GLU 34 HB1 GLU 34 23.245 18.342 29.697
273 HG2 GLU 34 HG2 GLU 34 23.993 19.443 27.640
274 HG3 GLU 34 HG1 GLU 34 23.763 17.948 26.735
275 H ALA 35 HN ALA 35 25.364 18.807 31.060
276 HA ALA 35 HA ALA 35 26.434 21.106 29.833
277 HB1 ALA 35 HB1 ALA 35 26.953 21.859 32.050
278 HB2 ALA 35 HB2 ALA 35 26.951 20.210 32.674
279 HB3 ALA 35 HB3 ALA 35 25.442 20.957 32.151
280 H GLU 36 HN GLU 36 27.984 18.269 31.278
281 HA GLU 36 HA GLU 36 30.646 19.197 31.152
282 HB2 GLU 36 HB2 GLU 36 29.476 16.410 31.113
283 HB3 GLU 36 HB1 GLU 36 31.211 16.730 31.178
284 HG2 GLU 36 HG2 GLU 36 30.967 17.946 33.261
285 HG3 GLU 36 HG1 GLU 36 29.210 17.839 33.167
286 H ARG 37 HN ARG 37 28.617 17.479 28.815
287 HA ARG 37 HA ARG 37 30.600 16.930 26.895
288 HB2 ARG 37 HB2 ARG 37 28.315 15.952 26.882
289 HB3 ARG 37 HB1 ARG 37 27.667 17.524 26.418
290 HG2 ARG 37 HG2 ARG 37 29.053 17.492 24.370
291 HG3 ARG 37 HG1 ARG 37 29.689 15.913 24.831
292 HD2 ARG 37 HD2 ARG 37 26.763 16.531 24.350
293 HD3 ARG 37 HD1 ARG 37 27.826 15.732 23.197
294 HE ARG 37 HE ARG 37 26.674 14.561 25.592
295 HH11 ARG 37 HH11 ARG 37 27.071 12.341 25.861
296 HH12 ARG 37 HH12 ARG 37 28.276 11.560 24.893
297 HH21 ARG 37 HH21 ARG 37 29.143 14.440 23.170
298 HH22 ARG 37 HH22 ARG 37 29.450 12.748 23.370
299 H LYS 38 HN LYS 38 28.462 19.738 27.312
300 HA LYS 38 HA LYS 38 29.276 21.139 25.001
301 HB2 LYS 38 HB2 LYS 38 28.150 22.083 27.638
302 HB3 LYS 38 HB1 LYS 38 28.433 23.163 26.274
303 HG2 LYS 38 HG2 LYS 38 27.001 21.623 24.867
304 HG3 LYS 38 HG1 LYS 38 26.590 20.758 26.344
305 HD2 LYS 38 HD2 LYS 38 26.161 23.737 26.015
306 HD3 LYS 38 HD1 LYS 38 24.926 22.545 25.618
307 HE2 LYS 38 HE2 LYS 38 25.123 21.665 27.971
308 HE3 LYS 38 HE1 LYS 38 26.191 23.018 28.333
309 HZ1 LYS 38 HZ1 LYS 38 23.419 23.005 28.343
310 HZ2 LYS 38 HZ2 LYS 38 23.889 23.967 27.024
311 HZ3 LYS 38 HZ3 LYS 38 24.450 24.328 28.587
312 H ALA 39 HN ALA 39 30.534 21.082 28.308
313 HA ALA 39 HA ALA 39 32.380 23.194 28.059
314 HB1 ALA 39 HB1 ALA 39 32.605 20.703 29.764
315 HB2 ALA 39 HB2 ALA 39 31.739 22.171 30.218
316 HB3 ALA 39 HB3 ALA 39 33.489 22.211 30.003
317 H LEU 40 HN LEU 40 32.643 19.739 27.338
318 HA LEU 40 HA LEU 40 35.405 19.673 26.792
319 HB2 LEU 40 HB2 LEU 40 34.065 17.640 27.101
320 HB3 LEU 40 HB1 LEU 40 33.170 17.992 25.624
321 HG LEU 40 HG LEU 40 35.259 17.806 24.309
322 HD11 LEU 40 HD11 LEU 40 37.029 18.418 25.720
323 HD12 LEU 40 HD12 LEU 40 37.208 16.667 25.663
324 HD13 LEU 40 HD13 LEU 40 36.442 17.429 27.058
325 HD21 LEU 40 HD21 LEU 40 35.543 15.374 24.559
326 HD22 LEU 40 HD22 LEU 40 33.839 15.812 24.696
327 HD23 LEU 40 HD23 LEU 40 34.773 15.438 26.144
328 H GLU 41 HN GLU 41 32.608 20.272 24.688
329 HA GLU 41 HA GLU 41 34.043 20.503 22.266
330 HB2 GLU 41 HB2 GLU 41 31.404 21.698 23.139
331 HB3 GLU 41 HB1 GLU 41 32.024 21.775 21.489
332 HG2 GLU 41 HG2 GLU 41 31.637 19.185 23.009
333 HG3 GLU 41 HG1 GLU 41 30.433 19.859 21.912
334 H ASP 42 HN ASP 42 33.190 22.857 24.762
335 HA ASP 42 HA ASP 42 33.925 25.003 25.164
336 HB2 ASP 42 HB2 ASP 42 36.120 23.737 25.036
337 HB3 ASP 42 HB1 ASP 42 36.251 24.304 23.372
338 H LYS 43 HN LYS 43 32.023 24.812 23.117
339 HA LYS 43 HA LYS 43 32.775 26.014 20.678
340 HB2 LYS 43 HB2 LYS 43 30.145 25.928 22.149
341 HB3 LYS 43 HB1 LYS 43 30.316 26.659 20.556
342 HG2 LYS 43 HG2 LYS 43 31.312 24.452 19.770
343 HG3 LYS 43 HG1 LYS 43 30.813 23.765 21.312
344 HD2 LYS 43 HD2 LYS 43 28.894 25.161 19.433
345 HD3 LYS 43 HD1 LYS 43 29.185 23.425 19.391
346 HE2 LYS 43 HE2 LYS 43 28.121 24.996 21.763
347 HE3 LYS 43 HE1 LYS 43 27.203 23.900 20.741
348 HZ1 LYS 43 HZ1 LYS 43 29.141 22.278 21.424
349 HZ2 LYS 43 HZ2 LYS 43 27.758 22.479 22.391
350 HZ3 LYS 43 HZ3 LYS 43 29.198 23.291 22.783
351 H LEU 44 HN LEU 44 31.744 27.388 23.767
352 HA LEU 44 HA LEU 44 31.460 30.063 22.926
353 HB2 LEU 44 HB2 LEU 44 32.196 28.877 25.609
354 HB3 LEU 44 HB1 LEU 44 31.874 30.591 25.362
355 HG LEU 44 HG LEU 44 29.920 28.384 24.645
356 HD11 LEU 44 HD11 LEU 44 28.715 29.049 26.700
357 HD12 LEU 44 HD12 LEU 44 30.020 30.167 27.098
358 HD13 LEU 44 HD13 LEU 44 30.324 28.429 27.069
359 HD21 LEU 44 HD21 LEU 44 29.214 30.231 23.403
360 HD22 LEU 44 HD22 LEU 44 29.859 31.396 24.556
361 HD23 LEU 44 HD23 LEU 44 28.365 30.532 24.914
362 H ALA 45 HN ALA 45 34.274 28.244 24.070
363 HA ALA 45 HA ALA 45 36.523 28.735 24.042
364 HB1 ALA 45 HB1 ALA 45 37.347 29.934 22.117
365 HB2 ALA 45 HB2 ALA 45 35.767 30.662 21.836
366 HB3 ALA 45 HB3 ALA 45 35.994 28.928 21.599
367 H ASP 46 HN ASP 46 34.710 30.313 25.761
368 HA ASP 46 HA ASP 46 35.421 33.040 25.796
369 HB2 ASP 46 HB2 ASP 46 34.490 31.164 27.973
370 HB3 ASP 46 HB1 ASP 46 34.747 32.888 28.240
371 H LYS 47 HN LYS 47 36.896 30.196 27.298
372 HA LYS 47 HA LYS 47 38.852 31.665 28.783
373 HB2 LYS 47 HB2 LYS 47 38.717 28.763 27.937
374 HB3 LYS 47 HB1 LYS 47 39.952 29.424 29.009
375 HG2 LYS 47 HG2 LYS 47 38.197 30.171 30.576
376 HG3 LYS 47 HG1 LYS 47 36.962 29.500 29.509
377 HD2 LYS 47 HD2 LYS 47 37.916 27.253 29.784
378 HD3 LYS 47 HD1 LYS 47 39.186 27.908 30.818
379 HE2 LYS 47 HE2 LYS 47 37.399 26.955 32.200
380 HE3 LYS 47 HE1 LYS 47 37.451 28.705 32.408
381 HZ1 LYS 47 HZ1 LYS 47 35.591 27.191 30.659
382 HZ2 LYS 47 HZ2 LYS 47 35.680 28.885 30.738
383 HZ3 LYS 47 HZ3 LYS 47 35.193 27.992 32.099
384 H GLN 48 HN GLN 48 40.995 32.070 28.308
385 HA GLN 48 HA GLN 48 42.137 31.215 25.770
386 HB2 GLN 48 HB2 GLN 48 42.592 33.501 24.995
387 HB3 GLN 48 HB1 GLN 48 40.856 33.215 25.122
388 HG2 GLN 48 HG2 GLN 48 40.882 34.288 27.375
389 HG3 GLN 48 HG1 GLN 48 42.591 34.656 27.149
390 HE21 GLN 48 HE21 GLN 48 39.614 36.083 26.912
391 HE22 GLN 48 HE22 GLN 48 39.942 37.225 25.698
392 H GLU 49 HN GLU 49 44.410 31.767 25.590
393 HA GLU 49 HA GLU 49 46.535 31.785 26.467
394 HB2 GLU 49 HB2 GLU 49 45.298 33.835 28.321
395 HB3 GLU 49 HB1 GLU 49 47.024 33.603 28.040
396 HG2 GLU 49 HG2 GLU 49 45.021 34.296 25.874
397 HG3 GLU 49 HG1 GLU 49 46.054 35.472 26.686
398 H HIS 50 HN HIS 50 44.876 29.725 27.423
399 HA HIS 50 HA HIS 50 44.986 29.510 30.272
400 HB2 HIS 50 HB2 HIS 50 44.388 27.146 29.872
401 HB3 HIS 50 HB1 HIS 50 43.361 28.242 28.946
402 HD2 HIS 50 HD2 HIS 50 43.554 27.959 26.165
403 HE1 HIS 50 HE1 HIS 50 46.676 25.117 26.145
404 HE2 HIS 50 HE2 HIS 50 44.983 26.338 24.698
405 H LEU 51 HN LEU 51 46.374 28.260 31.552
406 HA LEU 51 HA LEU 51 49.109 28.286 30.810
407 HB2 LEU 51 HB2 LEU 51 47.614 26.993 33.090
408 HB3 LEU 51 HB1 LEU 51 49.357 26.830 32.908
409 HG LEU 51 HG LEU 51 48.695 28.696 34.434
410 HD11 LEU 51 HD11 LEU 51 50.774 28.672 32.764
411 HD12 LEU 51 HD12 LEU 51 50.407 30.087 33.745
412 HD13 LEU 51 HD13 LEU 51 49.926 30.045 32.051
413 HD21 LEU 51 HD21 LEU 51 46.616 29.235 33.012
414 HD22 LEU 51 HD22 LEU 51 47.714 30.142 31.969
415 HD23 LEU 51 HD23 LEU 51 47.522 30.602 33.659
416 H ASP 52 HN ASP 52 46.683 25.708 30.946
417 HA ASP 52 HA ASP 52 48.271 24.123 29.072
418 HB2 ASP 52 HB2 ASP 52 48.237 22.121 30.454
419 HB3 ASP 52 HB1 ASP 52 49.063 23.419 31.315
420 H GLY 53 HN GLY 53 45.452 25.458 29.815
421 HA2 GLY 53 HA2 GLY 53 43.412 25.185 28.717
422 HA3 GLY 53 HA1 GLY 53 43.938 23.594 28.169
423 H ALA 54 HN ALA 54 41.394 23.715 29.046
424 HA ALA 54 HA ALA 54 40.967 23.386 31.811
425 HB1 ALA 54 HB1 ALA 54 39.165 23.817 30.164
426 HB2 ALA 54 HB2 ALA 54 38.823 22.413 31.175
427 HB3 ALA 54 HB3 ALA 54 39.390 22.190 29.521
428 H LEU 55 HN LEU 55 41.730 21.065 29.248
429 HA LEU 55 HA LEU 55 42.217 18.810 29.325
430 HB2 LEU 55 HB2 LEU 55 43.541 19.642 31.919
431 HB3 LEU 55 HB1 LEU 55 43.930 18.218 30.955
432 HG LEU 55 HG LEU 55 44.200 21.095 30.026
433 HD11 LEU 55 HD11 LEU 55 46.674 20.424 30.036
434 HD12 LEU 55 HD12 LEU 55 46.186 19.037 31.011
435 HD13 LEU 55 HD13 LEU 55 45.926 20.674 31.615
436 HD21 LEU 55 HD21 LEU 55 44.600 18.419 28.689
437 HD22 LEU 55 HD22 LEU 55 45.585 19.796 28.198
438 HD23 LEU 55 HD23 LEU 55 43.832 19.874 28.054
439 H ARG 56 HN ARG 56 42.650 18.090 32.500
440 HA ARG 56 HA ARG 56 40.283 16.494 32.641
441 HB2 ARG 56 HB2 ARG 56 42.362 17.173 34.734
442 HB3 ARG 56 HB1 ARG 56 41.085 15.974 34.942
443 HG2 ARG 56 HG2 ARG 56 41.941 14.641 33.118
444 HG3 ARG 56 HG1 ARG 56 43.099 15.898 32.680
445 HD2 ARG 56 HD2 ARG 56 43.074 14.450 35.342
446 HD3 ARG 56 HD1 ARG 56 44.125 14.027 33.991
447 HE ARG 56 HE ARG 56 44.492 16.753 34.509
448 HH11 ARG 56 HH11 ARG 56 46.256 17.434 35.764
449 HH12 ARG 56 HH12 ARG 56 47.019 16.323 36.851
450 HH21 ARG 56 HH21 ARG 56 44.913 13.688 36.056
451 HH22 ARG 56 HH22 ARG 56 46.259 14.201 37.017
452 H TYR 57 HN TYR 57 38.460 16.745 33.904
453 HA TYR 57 HA TYR 57 38.110 18.852 35.789
454 HB2 TYR 57 HB2 TYR 57 38.060 20.276 33.819
455 HB3 TYR 57 HB1 TYR 57 36.868 19.227 33.052
456 HD1 TYR 57 HD1 TYR 57 37.441 21.428 36.010
457 HD2 TYR 57 HD2 TYR 57 34.550 19.487 33.494
458 HE1 TYR 57 HE1 TYR 57 35.620 22.680 37.136
459 HE2 TYR 57 HE2 TYR 57 32.729 20.738 34.621
460 HH TYR 57 HH TYR 57 32.946 23.332 36.133
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 -11.483 13.588 61.634
2 H2 GLY 1 HT2 GLY 1 -12.883 12.767 62.140
3 H3 GLY 1 HT3 GLY 1 -11.489 12.755 63.112
4 HA2 GLY 1 HA2 GLY 1 -12.998 14.284 64.088
5 HA3 GLY 1 HA1 GLY 1 -11.696 15.207 63.337
6 H SER 2 HN SER 2 -12.326 15.144 60.690
7 HA SER 2 HA SER 2 -15.106 15.942 60.320
8 HB2 SER 2 HB2 SER 2 -14.048 18.018 61.101
9 HB3 SER 2 HB1 SER 2 -12.806 17.861 59.863
10 HG SER 2 HG SER 2 -14.194 18.491 58.391
11 H ALA 3 HN ALA 3 -15.721 15.983 58.137
12 HA ALA 3 HA ALA 3 -14.414 14.158 56.445
13 HB1 ALA 3 HB1 ALA 3 -15.967 14.957 54.707
14 HB2 ALA 3 HB2 ALA 3 -16.397 16.333 55.724
15 HB3 ALA 3 HB3 ALA 3 -16.805 14.695 56.235
16 H GLY 4 HN GLY 4 -14.292 17.672 56.667
17 HA2 GLY 4 HA2 GLY 4 -12.597 19.107 55.982
18 HA3 GLY 4 HA1 GLY 4 -11.753 17.729 55.283
19 H LEU 5 HN LEU 5 -11.428 19.506 53.598
20 HA LEU 5 HA LEU 5 -13.562 20.332 51.930
21 HB2 LEU 5 HB2 LEU 5 -10.593 20.087 51.427
22 HB3 LEU 5 HB1 LEU 5 -11.711 20.752 50.242
23 HG LEU 5 HG LEU 5 -11.428 21.819 53.073
24 HD11 LEU 5 HD11 LEU 5 -9.324 22.162 51.936
25 HD12 LEU 5 HD12 LEU 5 -10.191 23.699 51.947
26 HD13 LEU 5 HD13 LEU 5 -10.148 22.720 50.479
27 HD21 LEU 5 HD21 LEU 5 -13.008 22.623 50.634
28 HD22 LEU 5 HD22 LEU 5 -12.447 23.877 51.737
29 HD23 LEU 5 HD23 LEU 5 -13.502 22.599 52.326
30 H GLN 6 HN GLN 6 -11.389 17.551 51.830
31 HA GLN 6 HA GLN 6 -11.343 15.695 50.463
32 HB2 GLN 6 HB2 GLN 6 -13.360 15.327 51.901
33 HB3 GLN 6 HB1 GLN 6 -14.344 16.027 50.617
34 HG2 GLN 6 HG2 GLN 6 -13.616 14.288 49.060
35 HG3 GLN 6 HG1 GLN 6 -12.535 13.618 50.280
36 HE21 GLN 6 HE21 GLN 6 -14.276 11.769 49.424
37 HE22 GLN 6 HE22 GLN 6 -15.569 11.549 50.501
38 H GLU 7 HN GLU 7 -10.486 17.200 48.749
39 HA GLU 7 HA GLU 7 -12.190 16.993 46.352
40 HB2 GLU 7 HB2 GLU 7 -12.465 19.288 47.222
41 HB3 GLU 7 HB1 GLU 7 -10.716 19.506 47.185
42 HG2 GLU 7 HG2 GLU 7 -10.689 19.189 44.767
43 HG3 GLU 7 HG1 GLU 7 -12.420 18.854 44.764
44 H LYS 8 HN LYS 8 -11.092 16.030 44.774
45 HA LYS 8 HA LYS 8 -9.343 15.076 43.624
46 HB2 LYS 8 HB2 LYS 8 -8.233 17.820 44.206
47 HB3 LYS 8 HB1 LYS 8 -7.492 16.683 43.080
48 HG2 LYS 8 HG2 LYS 8 -9.696 16.577 41.859
49 HG3 LYS 8 HG1 LYS 8 -10.270 17.883 42.889
50 HD2 LYS 8 HD2 LYS 8 -7.764 18.098 41.204
51 HD3 LYS 8 HD1 LYS 8 -9.350 18.602 40.627
52 HE2 LYS 8 HE2 LYS 8 -9.513 20.117 42.639
53 HE3 LYS 8 HE1 LYS 8 -7.836 19.715 43.007
54 HZ1 LYS 8 HZ1 LYS 8 -7.630 20.361 40.443
55 HZ2 LYS 8 HZ2 LYS 8 -7.431 21.478 41.707
56 HZ3 LYS 8 HZ3 LYS 8 -8.917 21.373 40.887
57 H GLU 9 HN GLU 9 -9.383 14.214 46.240
58 HA GLU 9 HA GLU 9 -6.945 14.551 47.638
59 HB2 GLU 9 HB2 GLU 9 -9.012 12.351 47.693
60 HB3 GLU 9 HB1 GLU 9 -7.594 12.354 48.740
61 HG2 GLU 9 HG2 GLU 9 -8.263 14.448 49.749
62 HG3 GLU 9 HG1 GLU 9 -9.580 14.643 48.596
63 H ARG 10 HN ARG 10 -7.977 12.229 45.176
64 HA ARG 10 HA ARG 10 -5.762 10.500 45.337
65 HB2 ARG 10 HB2 ARG 10 -6.439 9.699 43.154
66 HB3 ARG 10 HB1 ARG 10 -7.879 10.000 44.125
67 HG2 ARG 10 HG2 ARG 10 -8.071 12.255 43.039
68 HG3 ARG 10 HG1 ARG 10 -6.730 11.813 41.980
69 HD2 ARG 10 HD2 ARG 10 -8.023 9.857 41.181
70 HD3 ARG 10 HD1 ARG 10 -9.372 10.342 42.206
71 HE ARG 10 HE ARG 10 -8.574 11.563 39.697
72 HH11 ARG 10 HH11 ARG 10 -9.954 13.203 38.943
73 HH12 ARG 10 HH12 ARG 10 -11.139 13.886 40.007
74 HH21 ARG 10 HH21 ARG 10 -10.255 11.894 42.703
75 HH22 ARG 10 HH22 ARG 10 -11.310 13.145 42.135
76 H GLU 11 HN GLU 11 -6.156 13.618 43.802
77 HA GLU 11 HA GLU 11 -3.931 13.468 42.047
78 HB2 GLU 11 HB2 GLU 11 -5.322 15.830 43.317
79 HB3 GLU 11 HB1 GLU 11 -4.008 15.995 42.155
80 HG2 GLU 11 HG2 GLU 11 -6.542 14.425 41.595
81 HG3 GLU 11 HG1 GLU 11 -6.316 16.109 41.135
82 H LEU 12 HN LEU 12 -4.279 14.476 45.413
83 HA LEU 12 HA LEU 12 -1.670 15.491 45.777
84 HB2 LEU 12 HB2 LEU 12 -3.630 14.256 47.718
85 HB3 LEU 12 HB1 LEU 12 -2.116 15.006 48.215
86 HG LEU 12 HG LEU 12 -4.249 16.421 46.582
87 HD11 LEU 12 HD11 LEU 12 -4.660 17.630 48.790
88 HD12 LEU 12 HD12 LEU 12 -3.732 16.344 49.563
89 HD13 LEU 12 HD13 LEU 12 -5.230 15.963 48.713
90 HD21 LEU 12 HD21 LEU 12 -1.598 17.218 47.778
91 HD22 LEU 12 HD22 LEU 12 -2.884 18.422 47.696
92 HD23 LEU 12 HD23 LEU 12 -2.301 17.659 46.221
93 H GLU 13 HN GLU 13 -3.022 12.241 46.094
94 HA GLU 13 HA GLU 13 -0.772 10.993 47.238
95 HB2 GLU 13 HB2 GLU 13 -3.008 9.945 47.113
96 HB3 GLU 13 HB1 GLU 13 -2.834 9.805 45.364
97 HG2 GLU 13 HG2 GLU 13 -0.873 8.361 45.648
98 HG3 GLU 13 HG1 GLU 13 -0.969 8.547 47.398
99 H ASP 14 HN ASP 14 -1.699 11.527 43.855
100 HA ASP 14 HA ASP 14 0.402 10.076 42.662
101 HB2 ASP 14 HB2 ASP 14 -1.592 10.888 41.439
102 HB3 ASP 14 HB1 ASP 14 -1.002 12.541 41.603
103 H LEU 15 HN LEU 15 0.161 13.480 43.642
104 HA LEU 15 HA LEU 15 2.658 14.319 42.651
105 HB2 LEU 15 HB2 LEU 15 0.918 15.895 43.365
106 HB3 LEU 15 HB1 LEU 15 1.084 15.344 45.030
107 HG LEU 15 HG LEU 15 3.432 16.132 45.058
108 HD11 LEU 15 HD11 LEU 15 3.984 17.733 43.045
109 HD12 LEU 15 HD12 LEU 15 2.798 16.758 42.178
110 HD13 LEU 15 HD13 LEU 15 4.237 16.000 42.861
111 HD21 LEU 15 HD21 LEU 15 1.532 18.271 44.053
112 HD22 LEU 15 HD22 LEU 15 2.931 18.509 45.099
113 HD23 LEU 15 HD23 LEU 15 1.524 17.631 45.697
114 H LYS 16 HN LYS 16 1.700 13.025 45.818
115 HA LYS 16 HA LYS 16 4.197 13.270 47.092
116 HB2 LYS 16 HB2 LYS 16 2.097 12.786 48.292
117 HB3 LYS 16 HB1 LYS 16 2.041 11.191 47.542
118 HG2 LYS 16 HG2 LYS 16 4.170 10.589 48.612
119 HG3 LYS 16 HG1 LYS 16 4.279 12.199 49.326
120 HD2 LYS 16 HD2 LYS 16 2.169 11.791 50.549
121 HD3 LYS 16 HD1 LYS 16 2.085 10.172 49.853
122 HE2 LYS 16 HE2 LYS 16 4.362 11.198 51.571
123 HE3 LYS 16 HE1 LYS 16 3.059 10.158 52.143
124 HZ1 LYS 16 HZ1 LYS 16 3.911 8.840 49.967
125 HZ2 LYS 16 HZ2 LYS 16 4.436 8.518 51.549
126 HZ3 LYS 16 HZ3 LYS 16 5.364 9.509 50.529
127 H ASP 17 HN ASP 17 2.785 10.619 45.193
128 HA ASP 17 HA ASP 17 4.881 8.769 45.540
129 HB2 ASP 17 HB2 ASP 17 2.862 9.144 43.325
130 HB3 ASP 17 HB1 ASP 17 4.006 7.803 43.362
131 H ALA 18 HN ALA 18 4.379 11.348 43.171
132 HA ALA 18 HA ALA 18 6.531 10.737 41.462
133 HB1 ALA 18 HB1 ALA 18 5.524 13.517 42.081
134 HB2 ALA 18 HB2 ALA 18 4.655 12.391 41.038
135 HB3 ALA 18 HB3 ALA 18 6.267 12.943 40.587
136 H GLU 19 HN GLU 19 6.346 12.685 44.412
137 HA GLU 19 HA GLU 19 8.946 13.766 44.322
138 HB2 GLU 19 HB2 GLU 19 7.176 14.574 45.846
139 HB3 GLU 19 HB1 GLU 19 7.280 13.066 46.752
140 HG2 GLU 19 HG2 GLU 19 9.621 13.533 47.313
141 HG3 GLU 19 HG1 GLU 19 9.574 15.007 46.348
142 H LEU 20 HN LEU 20 7.693 10.757 45.722
143 HA LEU 20 HA LEU 20 10.094 9.907 46.941
144 HB2 LEU 20 HB2 LEU 20 7.729 8.356 45.870
145 HB3 LEU 20 HB1 LEU 20 9.044 7.614 46.776
146 HG LEU 20 HG LEU 20 7.371 9.926 47.809
147 HD11 LEU 20 HD11 LEU 20 7.153 6.969 48.450
148 HD12 LEU 20 HD12 LEU 20 6.016 7.876 47.452
149 HD13 LEU 20 HD13 LEU 20 6.189 8.262 49.164
150 HD21 LEU 20 HD21 LEU 20 9.602 8.237 48.934
151 HD22 LEU 20 HD22 LEU 20 8.351 8.823 50.029
152 HD23 LEU 20 HD23 LEU 20 9.314 9.969 49.106
153 H LYS 21 HN LYS 21 8.784 9.442 43.691
154 HA LYS 21 HA LYS 21 10.695 7.598 42.756
155 HB2 LYS 21 HB2 LYS 21 8.580 8.147 41.587
156 HB3 LYS 21 HB1 LYS 21 9.233 9.731 41.178
157 HG2 LYS 21 HG2 LYS 21 11.124 8.607 39.987
158 HG3 LYS 21 HG1 LYS 21 10.372 7.050 40.326
159 HD2 LYS 21 HD2 LYS 21 8.914 9.260 38.864
160 HD3 LYS 21 HD1 LYS 21 9.905 8.073 38.020
161 HE2 LYS 21 HE2 LYS 21 8.521 6.264 39.121
162 HE3 LYS 21 HE1 LYS 21 7.448 7.531 39.712
163 HZ1 LYS 21 HZ1 LYS 21 7.221 6.309 37.325
164 HZ2 LYS 21 HZ2 LYS 21 8.048 7.733 36.909
165 HZ3 LYS 21 HZ3 LYS 21 6.553 7.819 37.711
166 H ARG 22 HN ARG 22 10.647 11.146 42.743
167 HA ARG 22 HA ARG 22 13.017 11.554 41.285
168 HB2 ARG 22 HB2 ARG 22 11.387 13.343 41.781
169 HB3 ARG 22 HB1 ARG 22 11.842 13.276 43.483
170 HG2 ARG 22 HG2 ARG 22 14.142 13.910 42.925
171 HG3 ARG 22 HG1 ARG 22 13.746 13.902 41.206
172 HD2 ARG 22 HD2 ARG 22 12.110 15.702 41.563
173 HD3 ARG 22 HD1 ARG 22 12.471 15.699 43.287
174 HE ARG 22 HE ARG 22 14.881 16.088 41.890
175 HH11 ARG 22 HH11 ARG 22 15.721 18.189 41.696
176 HH12 ARG 22 HH12 ARG 22 14.674 19.556 41.891
177 HH21 ARG 22 HH21 ARG 22 11.846 17.640 42.486
178 HH22 ARG 22 HH22 ARG 22 12.480 19.244 42.339
179 H LEU 23 HN LEU 23 12.452 11.180 44.772
180 HA LEU 23 HA LEU 23 15.111 11.628 45.607
181 HB2 LEU 23 HB2 LEU 23 12.869 10.015 46.837
182 HB3 LEU 23 HB1 LEU 23 14.404 10.315 47.647
183 HG LEU 23 HG LEU 23 12.585 12.509 46.604
184 HD11 LEU 23 HD11 LEU 23 11.928 12.830 48.961
185 HD12 LEU 23 HD12 LEU 23 12.899 11.432 49.423
186 HD13 LEU 23 HD13 LEU 23 11.482 11.220 48.393
187 HD21 LEU 23 HD21 LEU 23 15.188 12.439 48.125
188 HD22 LEU 23 HD22 LEU 23 14.046 13.740 48.461
189 HD23 LEU 23 HD23 LEU 23 14.676 13.526 46.832
190 H ASN 24 HN ASN 24 13.403 8.699 44.596
191 HA ASN 24 HA ASN 24 15.414 6.836 45.251
192 HB2 ASN 24 HB2 ASN 24 13.037 6.309 44.593
193 HB3 ASN 24 HB1 ASN 24 13.495 6.642 42.923
194 HD21 ASN 24 HD21 ASN 24 13.301 4.445 42.174
195 HD22 ASN 24 HD22 ASN 24 14.335 3.210 42.713
196 H GLU 25 HN GLU 25 14.833 8.755 42.332
197 HA GLU 25 HA GLU 25 17.622 8.288 41.499
198 HB2 GLU 25 HB2 GLU 25 16.213 6.661 40.264
199 HB3 GLU 25 HB1 GLU 25 15.238 7.997 39.651
200 HG2 GLU 25 HG2 GLU 25 17.204 8.958 38.545
201 HG3 GLU 25 HG1 GLU 25 18.221 7.678 39.205
202 H GLU 26 HN GLU 26 18.588 10.096 40.777
203 HA GLU 26 HA GLU 26 17.035 12.572 40.739
204 HB2 GLU 26 HB2 GLU 26 19.208 12.459 41.926
205 HB3 GLU 26 HB1 GLU 26 20.009 12.111 40.394
206 HG2 GLU 26 HG2 GLU 26 19.266 14.260 39.486
207 HG3 GLU 26 HG1 GLU 26 18.382 14.603 40.971
208 H ARG 27 HN ARG 27 16.192 13.351 38.926
209 HA ARG 27 HA ARG 27 16.948 12.283 36.340
210 HB2 ARG 27 HB2 ARG 27 14.945 14.406 37.140
211 HB3 ARG 27 HB1 ARG 27 15.152 13.788 35.501
212 HG2 ARG 27 HG2 ARG 27 14.524 11.560 36.186
213 HG3 ARG 27 HG1 ARG 27 14.529 12.028 37.886
214 HD2 ARG 27 HD2 ARG 27 12.694 13.220 35.792
215 HD3 ARG 27 HD1 ARG 27 12.231 11.934 36.901
216 HE ARG 27 HE ARG 27 13.239 14.038 38.446
217 HH11 ARG 27 HH11 ARG 27 11.810 15.504 39.429
218 HH12 ARG 27 HH12 ARG 27 10.206 15.694 38.800
219 HH21 ARG 27 HH21 ARG 27 10.638 13.370 36.263
220 HH22 ARG 27 HH22 ARG 27 9.543 14.487 37.008
221 H HIS 28 HN HIS 28 18.015 14.809 38.307
222 HA HIS 28 HA HIS 28 18.706 16.661 36.190
223 HB2 HIS 28 HB2 HIS 28 19.535 16.560 39.100
224 HB3 HIS 28 HB1 HIS 28 19.875 17.888 37.992
225 HD2 HIS 28 HD2 HIS 28 17.092 16.814 40.372
226 HE1 HIS 28 HE1 HIS 28 15.340 19.610 37.740
227 HE2 HIS 28 HE2 HIS 28 15.011 18.318 39.900
228 H ASP 29 HN ASP 29 20.001 13.780 37.384
229 HA ASP 29 HA ASP 29 22.776 14.254 37.229
230 HB2 ASP 29 HB2 ASP 29 21.127 11.756 36.821
231 HB3 ASP 29 HB1 ASP 29 22.889 11.756 36.787
232 H HIS 30 HN HIS 30 20.392 13.330 34.780
233 HA HIS 30 HA HIS 30 22.211 12.844 32.671
234 HB2 HIS 30 HB2 HIS 30 19.307 13.678 32.704
235 HB3 HIS 30 HB1 HIS 30 20.187 13.344 31.212
236 HD2 HIS 30 HD2 HIS 30 20.530 10.625 30.647
237 HE1 HIS 30 HE1 HIS 30 18.937 9.128 34.260
238 HE2 HIS 30 HE2 HIS 30 19.795 8.488 31.957
239 H ASP 31 HN ASP 31 20.575 15.776 33.786
240 HA ASP 31 HA ASP 31 21.332 17.473 31.667
241 HB2 ASP 31 HB2 ASP 31 20.686 18.022 34.565
242 HB3 ASP 31 HB1 ASP 31 21.010 19.302 33.399
243 H LYS 32 HN LYS 32 22.951 16.593 34.685
244 HA LYS 32 HA LYS 32 25.074 18.435 34.558
245 HB2 LYS 32 HB2 LYS 32 24.546 17.098 36.563
246 HB3 LYS 32 HB1 LYS 32 25.064 15.637 35.722
247 HG2 LYS 32 HG2 LYS 32 27.334 16.561 35.482
248 HG3 LYS 32 HG1 LYS 32 26.822 18.047 36.284
249 HD2 LYS 32 HD2 LYS 32 26.273 16.762 38.316
250 HD3 LYS 32 HD1 LYS 32 26.779 15.275 37.515
251 HE2 LYS 32 HE2 LYS 32 29.056 16.183 37.251
252 HE3 LYS 32 HE1 LYS 32 28.555 17.677 38.041
253 HZ1 LYS 32 HZ1 LYS 32 27.839 15.420 39.602
254 HZ2 LYS 32 HZ2 LYS 32 28.814 16.748 40.020
255 HZ3 LYS 32 HZ3 LYS 32 29.499 15.392 39.258
256 H ARG 33 HN ARG 33 24.744 15.151 33.252
257 HA ARG 33 HA ARG 33 27.371 14.938 32.221
258 HB2 ARG 33 HB2 ARG 33 24.786 13.587 31.434
259 HB3 ARG 33 HB1 ARG 33 26.336 13.199 30.690
260 HG2 ARG 33 HG2 ARG 33 27.265 12.615 32.895
261 HG3 ARG 33 HG1 ARG 33 25.730 13.019 33.661
262 HD2 ARG 33 HD2 ARG 33 24.602 11.274 32.337
263 HD3 ARG 33 HD1 ARG 33 26.131 10.872 31.561
264 HE ARG 33 HE ARG 33 26.475 10.692 34.352
265 HH11 ARG 33 HH11 ARG 33 26.434 8.643 35.332
266 HH12 ARG 33 HH12 ARG 33 25.679 7.314 34.517
267 HH21 ARG 33 HH21 ARG 33 24.775 9.184 31.742
268 HH22 ARG 33 HH22 ARG 33 24.740 7.620 32.484
269 H GLU 34 HN GLU 34 24.366 16.192 30.844
270 HA GLU 34 HA GLU 34 25.285 16.575 28.206
271 HB2 GLU 34 HB2 GLU 34 22.903 16.685 28.857
272 HB3 GLU 34 HB1 GLU 34 23.222 18.179 29.738
273 HG2 GLU 34 HG2 GLU 34 23.927 19.281 27.668
274 HG3 GLU 34 HG1 GLU 34 23.697 17.783 26.769
275 H ALA 35 HN ALA 35 25.349 18.678 31.056
276 HA ALA 35 HA ALA 35 26.396 20.976 29.804
277 HB1 ALA 35 HB1 ALA 35 27.223 21.515 32.150
278 HB2 ALA 35 HB2 ALA 35 26.551 19.961 32.644
279 HB3 ALA 35 HB3 ALA 35 25.493 21.214 31.996
280 H GLU 36 HN GLU 36 27.946 18.141 31.227
281 HA GLU 36 HA GLU 36 30.604 19.048 31.164
282 HB2 GLU 36 HB2 GLU 36 29.880 17.029 32.379
283 HB3 GLU 36 HB1 GLU 36 29.555 16.224 30.847
284 HG2 GLU 36 HG2 GLU 36 31.745 15.541 31.703
285 HG3 GLU 36 HG1 GLU 36 31.952 16.473 30.226
286 H ARG 37 HN ARG 37 28.667 17.356 28.698
287 HA ARG 37 HA ARG 37 30.758 17.003 26.836
288 HB2 ARG 37 HB2 ARG 37 27.767 17.241 26.462
289 HB3 ARG 37 HB1 ARG 37 28.878 16.878 25.141
290 HG2 ARG 37 HG2 ARG 37 29.738 14.939 26.542
291 HG3 ARG 37 HG1 ARG 37 28.389 15.238 27.639
292 HD2 ARG 37 HD2 ARG 37 28.094 14.701 24.674
293 HD3 ARG 37 HD1 ARG 37 27.902 13.478 25.925
294 HE ARG 37 HE ARG 37 26.045 15.643 25.300
295 HH11 ARG 37 HH11 ARG 37 24.023 15.459 26.318
296 HH12 ARG 37 HH12 ARG 37 23.812 14.336 27.619
297 HH21 ARG 37 HH21 ARG 37 27.081 13.185 27.508
298 HH22 ARG 37 HH22 ARG 37 25.542 13.047 28.292
299 H LYS 38 HN LYS 38 28.495 19.682 27.355
300 HA LYS 38 HA LYS 38 29.221 21.192 25.079
301 HB2 LYS 38 HB2 LYS 38 28.082 22.010 27.755
302 HB3 LYS 38 HB1 LYS 38 28.327 23.141 26.423
303 HG2 LYS 38 HG2 LYS 38 26.890 21.751 24.974
304 HG3 LYS 38 HG1 LYS 38 26.636 20.625 26.309
305 HD2 LYS 38 HD2 LYS 38 25.611 22.422 27.644
306 HD3 LYS 38 HD1 LYS 38 25.877 23.561 26.323
307 HE2 LYS 38 HE2 LYS 38 24.439 22.204 24.853
308 HE3 LYS 38 HE1 LYS 38 24.177 21.055 26.163
309 HZ1 LYS 38 HZ1 LYS 38 23.636 23.662 27.077
310 HZ2 LYS 38 HZ2 LYS 38 22.580 22.336 26.963
311 HZ3 LYS 38 HZ3 LYS 38 22.768 23.391 25.646
312 H ALA 39 HN ALA 39 30.528 21.056 28.361
313 HA ALA 39 HA ALA 39 32.287 23.247 28.178
314 HB1 ALA 39 HB1 ALA 39 31.644 21.922 30.260
315 HB2 ALA 39 HB2 ALA 39 33.343 22.376 30.121
316 HB3 ALA 39 HB3 ALA 39 32.835 20.728 29.747
317 H LEU 40 HN LEU 40 32.682 19.838 27.298
318 HA LEU 40 HA LEU 40 35.440 19.933 26.700
319 HB2 LEU 40 HB2 LEU 40 33.220 18.171 25.648
320 HB3 LEU 40 HB1 LEU 40 34.922 17.918 25.269
321 HG LEU 40 HG LEU 40 33.817 18.038 28.093
322 HD11 LEU 40 HD11 LEU 40 34.592 15.591 26.479
323 HD12 LEU 40 HD12 LEU 40 32.929 16.115 26.744
324 HD13 LEU 40 HD13 LEU 40 33.924 15.615 28.112
325 HD21 LEU 40 HD21 LEU 40 36.105 18.450 28.329
326 HD22 LEU 40 HD22 LEU 40 36.533 17.533 26.885
327 HD23 LEU 40 HD23 LEU 40 36.100 16.690 28.371
328 H GLU 41 HN GLU 41 32.561 20.581 24.755
329 HA GLU 41 HA GLU 41 33.844 20.860 22.259
330 HB2 GLU 41 HB2 GLU 41 31.397 20.649 22.515
331 HB3 GLU 41 HB1 GLU 41 31.342 22.235 23.282
332 HG2 GLU 41 HG2 GLU 41 30.738 22.429 20.916
333 HG3 GLU 41 HG1 GLU 41 32.268 23.250 21.206
334 H ASP 42 HN ASP 42 33.147 23.187 24.841
335 HA ASP 42 HA ASP 42 34.035 25.507 23.513
336 HB2 ASP 42 HB2 ASP 42 33.905 24.779 26.442
337 HB3 ASP 42 HB1 ASP 42 34.388 26.376 25.871
338 H LYS 43 HN LYS 43 35.754 23.099 25.456
339 HA LYS 43 HA LYS 43 38.216 24.428 25.640
340 HB2 LYS 43 HB2 LYS 43 37.678 22.451 26.984
341 HB3 LYS 43 HB1 LYS 43 37.619 21.458 25.534
342 HG2 LYS 43 HG2 LYS 43 39.757 21.104 26.626
343 HG3 LYS 43 HG1 LYS 43 40.047 21.989 25.135
344 HD2 LYS 43 HD2 LYS 43 40.319 24.067 26.336
345 HD3 LYS 43 HD1 LYS 43 39.761 23.331 27.839
346 HE2 LYS 43 HE2 LYS 43 41.719 21.830 27.820
347 HE3 LYS 43 HE1 LYS 43 42.268 22.567 26.315
348 HZ1 LYS 43 HZ1 LYS 43 43.435 23.763 27.860
349 HZ2 LYS 43 HZ2 LYS 43 42.196 23.702 29.022
350 HZ3 LYS 43 HZ3 LYS 43 42.062 24.745 27.686
351 H LEU 44 HN LEU 44 36.968 22.171 23.201
352 HA LEU 44 HA LEU 44 39.299 22.046 21.620
353 HB2 LEU 44 HB2 LEU 44 37.451 20.445 21.391
354 HB3 LEU 44 HB1 LEU 44 36.397 21.730 20.806
355 HG LEU 44 HG LEU 44 37.884 22.064 18.855
356 HD11 LEU 44 HD11 LEU 44 39.576 20.072 18.524
357 HD12 LEU 44 HD12 LEU 44 39.507 19.962 20.283
358 HD13 LEU 44 HD13 LEU 44 40.050 21.453 19.511
359 HD21 LEU 44 HD21 LEU 44 35.982 20.377 18.887
360 HD22 LEU 44 HD22 LEU 44 37.200 19.130 19.157
361 HD23 LEU 44 HD23 LEU 44 37.227 20.082 17.673
362 H ALA 45 HN ALA 45 36.485 24.194 21.521
363 HA ALA 45 HA ALA 45 37.521 25.688 19.255
364 HB1 ALA 45 HB1 ALA 45 35.113 26.144 21.029
365 HB2 ALA 45 HB2 ALA 45 35.117 25.357 19.451
366 HB3 ALA 45 HB3 ALA 45 35.495 27.075 19.581
367 H ASP 46 HN ASP 46 38.954 25.595 21.946
368 HA ASP 46 HA ASP 46 38.748 28.298 22.961
369 HB2 ASP 46 HB2 ASP 46 40.515 27.666 24.481
370 HB3 ASP 46 HB1 ASP 46 39.355 26.343 24.398
371 H LYS 47 HN LYS 47 39.997 27.121 20.183
372 HA LYS 47 HA LYS 47 42.561 28.381 20.084
373 HB2 LYS 47 HB2 LYS 47 40.690 27.447 17.899
374 HB3 LYS 47 HB1 LYS 47 42.327 28.039 17.613
375 HG2 LYS 47 HG2 LYS 47 43.225 26.269 19.081
376 HG3 LYS 47 HG1 LYS 47 41.590 25.674 19.364
377 HD2 LYS 47 HD2 LYS 47 41.332 25.225 16.951
378 HD3 LYS 47 HD1 LYS 47 42.968 25.818 16.666
379 HE2 LYS 47 HE2 LYS 47 43.872 24.049 18.126
380 HE3 LYS 47 HE1 LYS 47 42.239 23.455 18.421
381 HZ1 LYS 47 HZ1 LYS 47 43.443 22.234 16.660
382 HZ2 LYS 47 HZ2 LYS 47 43.474 23.655 15.731
383 HZ3 LYS 47 HZ3 LYS 47 41.991 22.926 16.124
384 H GLN 48 HN GLN 48 43.158 30.346 19.214
385 HA GLN 48 HA GLN 48 41.337 32.491 19.488
386 HB2 GLN 48 HB2 GLN 48 43.140 33.885 18.559
387 HB3 GLN 48 HB1 GLN 48 43.735 32.806 19.815
388 HG2 GLN 48 HG2 GLN 48 43.862 31.818 16.977
389 HG3 GLN 48 HG1 GLN 48 45.002 33.070 17.452
390 HE21 GLN 48 HE21 GLN 48 46.852 31.645 17.411
391 HE22 GLN 48 HE22 GLN 48 47.056 30.408 18.555
392 H GLU 49 HN GLU 49 42.085 30.409 16.841
393 HA GLU 49 HA GLU 49 41.342 30.317 14.672
394 HB2 GLU 49 HB2 GLU 49 39.114 31.962 15.890
395 HB3 GLU 49 HB1 GLU 49 39.059 31.251 14.278
396 HG2 GLU 49 HG2 GLU 49 39.355 29.009 15.238
397 HG3 GLU 49 HG1 GLU 49 39.455 29.703 16.855
398 H HIS 50 HN HIS 50 43.284 32.294 15.195
399 HA HIS 50 HA HIS 50 44.213 34.210 14.328
400 HB2 HIS 50 HB2 HIS 50 43.902 32.718 12.313
401 HB3 HIS 50 HB1 HIS 50 42.430 33.621 11.967
402 HD2 HIS 50 HD2 HIS 50 46.272 34.028 11.597
403 HE1 HIS 50 HE1 HIS 50 44.517 37.690 10.441
404 HE2 HIS 50 HE2 HIS 50 46.681 36.363 10.499
405 H LEU 51 HN LEU 51 43.227 35.664 15.820
406 HA LEU 51 HA LEU 51 40.715 36.947 15.084
407 HB2 LEU 51 HB2 LEU 51 42.650 37.568 17.337
408 HB3 LEU 51 HB1 LEU 51 41.053 38.283 17.131
409 HG LEU 51 HG LEU 51 41.605 35.325 17.527
410 HD11 LEU 51 HD11 LEU 51 40.576 35.688 19.745
411 HD12 LEU 51 HD12 LEU 51 40.460 37.413 19.401
412 HD13 LEU 51 HD13 LEU 51 42.042 36.649 19.550
413 HD21 LEU 51 HD21 LEU 51 39.113 36.939 17.005
414 HD22 LEU 51 HD22 LEU 51 39.008 35.487 18.002
415 HD23 LEU 51 HD23 LEU 51 39.584 35.374 16.342
416 H ASP 52 HN ASP 52 41.132 39.599 15.753
417 HA ASP 52 HA ASP 52 42.660 40.526 13.440
418 HB2 ASP 52 HB2 ASP 52 41.592 42.672 13.857
419 HB3 ASP 52 HB1 ASP 52 40.380 41.394 13.860
420 H GLY 53 HN GLY 53 43.553 39.688 16.410
421 HA2 GLY 53 HA2 GLY 53 45.577 40.099 17.486
422 HA3 GLY 53 HA1 GLY 53 45.850 41.461 16.404
423 H ALA 54 HN ALA 54 42.772 41.740 17.591
424 HA ALA 54 HA ALA 54 43.338 44.038 19.138
425 HB1 ALA 54 HB1 ALA 54 40.849 42.314 19.110
426 HB2 ALA 54 HB2 ALA 54 41.168 43.679 18.039
427 HB3 ALA 54 HB3 ALA 54 40.962 43.945 19.770
428 H LEU 55 HN LEU 55 43.451 44.369 21.332
429 HA LEU 55 HA LEU 55 44.479 42.294 22.945
430 HB2 LEU 55 HB2 LEU 55 43.345 45.006 23.650
431 HB3 LEU 55 HB1 LEU 55 44.116 43.944 24.823
432 HG LEU 55 HG LEU 55 45.449 44.893 22.270
433 HD11 LEU 55 HD11 LEU 55 45.112 46.847 23.595
434 HD12 LEU 55 HD12 LEU 55 46.772 46.341 23.911
435 HD13 LEU 55 HD13 LEU 55 45.505 45.991 25.087
436 HD21 LEU 55 HD21 LEU 55 46.303 43.214 24.624
437 HD22 LEU 55 HD22 LEU 55 47.501 44.243 23.843
438 HD23 LEU 55 HD23 LEU 55 46.667 43.007 22.911
439 H ARG 56 HN ARG 56 41.248 43.702 22.666
440 HA ARG 56 HA ARG 56 40.135 42.233 24.837
441 HB2 ARG 56 HB2 ARG 56 39.086 44.291 24.080
442 HB3 ARG 56 HB1 ARG 56 38.841 43.616 22.475
443 HG2 ARG 56 HG2 ARG 56 36.751 43.552 23.760
444 HG3 ARG 56 HG1 ARG 56 37.302 41.917 23.432
445 HD2 ARG 56 HD2 ARG 56 38.131 41.664 25.680
446 HD3 ARG 56 HD1 ARG 56 37.898 43.379 26.019
447 HE ARG 56 HE ARG 56 35.407 42.363 25.309
448 HH11 ARG 56 HH11 ARG 56 33.936 41.681 26.901
449 HH12 ARG 56 HH12 ARG 56 34.516 41.223 28.467
450 HH21 ARG 56 HH21 ARG 56 37.844 41.823 27.705
451 HH22 ARG 56 HH22 ARG 56 36.728 41.303 28.924
452 H TYR 57 HN TYR 57 39.364 40.204 24.905
453 HA TYR 57 HA TYR 57 39.807 38.425 22.710
454 HB2 TYR 57 HB2 TYR 57 40.023 37.623 24.991
455 HB3 TYR 57 HB1 TYR 57 38.343 38.040 25.333
456 HD1 TYR 57 HD1 TYR 57 40.503 35.891 23.178
457 HD2 TYR 57 HD2 TYR 57 36.583 36.537 24.809
458 HE1 TYR 57 HE1 TYR 57 39.782 33.678 22.321
459 HE2 TYR 57 HE2 TYR 57 35.862 34.325 23.952
460 HH TYR 57 HH TYR 57 37.120 32.734 21.685
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 21.188 -4.215 13.728
2 H2 GLY 1 HT2 GLY 1 20.468 -5.250 14.866
3 H3 GLY 1 HT3 GLY 1 20.787 -3.632 15.269
4 HA2 GLY 1 HA2 GLY 1 18.638 -3.313 14.767
5 HA3 GLY 1 HA1 GLY 1 19.255 -3.288 13.114
6 H SER 2 HN SER 2 18.256 -5.625 15.624
7 HA SER 2 HA SER 2 16.883 -7.210 13.528
8 HB2 SER 2 HB2 SER 2 18.455 -8.255 15.896
9 HB3 SER 2 HB1 SER 2 17.499 -9.241 14.793
10 HG SER 2 HG SER 2 19.383 -7.486 13.710
11 H ALA 3 HN ALA 3 15.012 -8.327 14.231
12 HA ALA 3 HA ALA 3 13.345 -6.888 15.979
13 HB1 ALA 3 HB1 ALA 3 12.665 -8.502 14.115
14 HB2 ALA 3 HB2 ALA 3 11.730 -8.587 15.607
15 HB3 ALA 3 HB3 ALA 3 12.967 -9.798 15.274
16 H GLY 4 HN GLY 4 15.345 -9.753 16.455
17 HA2 GLY 4 HA2 GLY 4 16.268 -10.547 18.442
18 HA3 GLY 4 HA1 GLY 4 15.352 -9.327 19.325
19 H LEU 5 HN LEU 5 13.237 -10.819 17.265
20 HA LEU 5 HA LEU 5 11.793 -12.112 19.329
21 HB2 LEU 5 HB2 LEU 5 11.607 -12.301 16.320
22 HB3 LEU 5 HB1 LEU 5 10.497 -13.135 17.400
23 HG LEU 5 HG LEU 5 10.972 -10.135 17.463
24 HD11 LEU 5 HD11 LEU 5 10.000 -10.655 15.326
25 HD12 LEU 5 HD12 LEU 5 8.700 -10.053 16.354
26 HD13 LEU 5 HD13 LEU 5 8.859 -11.784 16.055
27 HD21 LEU 5 HD21 LEU 5 8.576 -10.401 18.578
28 HD22 LEU 5 HD22 LEU 5 10.027 -10.655 19.539
29 HD23 LEU 5 HD23 LEU 5 9.136 -12.039 18.911
30 H GLN 6 HN GLN 6 14.048 -13.300 16.885
31 HA GLN 6 HA GLN 6 13.669 -16.060 17.370
32 HB2 GLN 6 HB2 GLN 6 16.022 -14.511 16.270
33 HB3 GLN 6 HB1 GLN 6 15.983 -16.267 16.356
34 HG2 GLN 6 HG2 GLN 6 13.940 -14.568 14.887
35 HG3 GLN 6 HG1 GLN 6 15.282 -15.411 14.124
36 HE21 GLN 6 HE21 GLN 6 12.097 -15.752 14.323
37 HE22 GLN 6 HE22 GLN 6 11.949 -17.436 14.485
38 H GLU 7 HN GLU 7 15.833 -13.658 18.809
39 HA GLU 7 HA GLU 7 17.346 -15.469 20.378
40 HB2 GLU 7 HB2 GLU 7 18.042 -13.136 19.906
41 HB3 GLU 7 HB1 GLU 7 16.719 -12.552 20.913
42 HG2 GLU 7 HG2 GLU 7 18.789 -12.569 22.210
43 HG3 GLU 7 HG1 GLU 7 17.686 -13.783 22.852
44 H LYS 8 HN LYS 8 16.856 -16.523 22.206
45 HA LYS 8 HA LYS 8 14.243 -16.021 23.475
46 HB2 LYS 8 HB2 LYS 8 16.195 -18.307 23.853
47 HB3 LYS 8 HB1 LYS 8 14.578 -18.203 24.542
48 HG2 LYS 8 HG2 LYS 8 15.111 -18.144 21.558
49 HG3 LYS 8 HG1 LYS 8 14.768 -19.625 22.445
50 HD2 LYS 8 HD2 LYS 8 12.627 -18.509 23.255
51 HD3 LYS 8 HD1 LYS 8 12.946 -17.234 22.081
52 HE2 LYS 8 HE2 LYS 8 11.457 -18.904 21.095
53 HE3 LYS 8 HE1 LYS 8 13.018 -18.923 20.273
54 HZ1 LYS 8 HZ1 LYS 8 13.282 -21.031 20.840
55 HZ2 LYS 8 HZ2 LYS 8 11.738 -21.035 21.550
56 HZ3 LYS 8 HZ3 LYS 8 13.105 -20.660 22.485
57 H GLU 9 HN GLU 9 17.518 -15.312 23.906
58 HA GLU 9 HA GLU 9 17.742 -15.461 26.726
59 HB2 GLU 9 HB2 GLU 9 19.179 -13.788 24.664
60 HB3 GLU 9 HB1 GLU 9 19.579 -13.734 26.379
61 HG2 GLU 9 HG2 GLU 9 20.128 -16.086 26.397
62 HG3 GLU 9 HG1 GLU 9 19.535 -16.292 24.752
63 H ARG 10 HN ARG 10 16.641 -12.905 24.548
64 HA ARG 10 HA ARG 10 15.600 -10.891 24.941
65 HB2 ARG 10 HB2 ARG 10 14.502 -12.465 27.283
66 HB3 ARG 10 HB1 ARG 10 13.822 -10.968 26.644
67 HG2 ARG 10 HG2 ARG 10 13.417 -12.041 24.480
68 HG3 ARG 10 HG1 ARG 10 14.167 -13.529 25.058
69 HD2 ARG 10 HD2 ARG 10 11.766 -13.777 25.243
70 HD3 ARG 10 HD1 ARG 10 12.432 -13.631 26.866
71 HE ARG 10 HE ARG 10 11.689 -11.069 25.883
72 HH11 ARG 10 HH11 ARG 10 9.783 -10.138 26.697
73 HH12 ARG 10 HH12 ARG 10 8.598 -11.138 27.468
74 HH21 ARG 10 HH21 ARG 10 10.406 -14.066 27.040
75 HH22 ARG 10 HH22 ARG 10 8.951 -13.363 27.662
76 H GLU 11 HN GLU 11 18.196 -11.629 26.485
77 HA GLU 11 HA GLU 11 18.125 -10.208 28.943
78 HB2 GLU 11 HB2 GLU 11 20.395 -10.990 27.114
79 HB3 GLU 11 HB1 GLU 11 20.649 -10.131 28.634
80 HG2 GLU 11 HG2 GLU 11 19.654 -11.924 29.900
81 HG3 GLU 11 HG1 GLU 11 19.121 -12.741 28.435
82 H LEU 12 HN LEU 12 18.898 -9.251 25.630
83 HA LEU 12 HA LEU 12 19.864 -6.663 26.203
84 HB2 LEU 12 HB2 LEU 12 18.497 -7.796 23.756
85 HB3 LEU 12 HB1 LEU 12 19.197 -6.181 23.813
86 HG LEU 12 HG LEU 12 20.744 -8.718 24.429
87 HD11 LEU 12 HD11 LEU 12 20.533 -7.101 21.873
88 HD12 LEU 12 HD12 LEU 12 20.061 -8.784 22.106
89 HD13 LEU 12 HD13 LEU 12 21.764 -8.330 22.165
90 HD21 LEU 12 HD21 LEU 12 21.997 -7.007 25.407
91 HD22 LEU 12 HD22 LEU 12 21.433 -5.788 24.266
92 HD23 LEU 12 HD23 LEU 12 22.645 -6.966 23.771
93 H GLU 13 HN GLU 13 16.599 -7.889 25.618
94 HA GLU 13 HA GLU 13 15.300 -5.374 25.534
95 HB2 GLU 13 HB2 GLU 13 14.306 -8.136 26.245
96 HB3 GLU 13 HB1 GLU 13 13.250 -6.725 26.187
97 HG2 GLU 13 HG2 GLU 13 13.753 -6.360 23.851
98 HG3 GLU 13 HG1 GLU 13 14.995 -7.608 23.869
99 H ASP 14 HN ASP 14 16.093 -7.566 28.191
100 HA ASP 14 HA ASP 14 14.671 -6.240 30.230
101 HB2 ASP 14 HB2 ASP 14 15.647 -8.504 30.461
102 HB3 ASP 14 HB1 ASP 14 17.260 -7.791 30.463
103 H LEU 15 HN LEU 15 17.985 -5.821 29.028
104 HA LEU 15 HA LEU 15 18.813 -3.910 30.932
105 HB2 LEU 15 HB2 LEU 15 19.699 -4.421 28.086
106 HB3 LEU 15 HB1 LEU 15 20.505 -3.284 29.163
107 HG LEU 15 HG LEU 15 20.072 -6.216 29.815
108 HD11 LEU 15 HD11 LEU 15 22.583 -6.334 29.356
109 HD12 LEU 15 HD12 LEU 15 22.415 -4.766 28.565
110 HD13 LEU 15 HD13 LEU 15 21.547 -6.168 27.938
111 HD21 LEU 15 HD21 LEU 15 22.121 -5.524 31.375
112 HD22 LEU 15 HD22 LEU 15 20.468 -5.200 31.881
113 HD23 LEU 15 HD23 LEU 15 21.444 -3.907 31.185
114 H LYS 16 HN LYS 16 17.194 -3.579 27.801
115 HA LYS 16 HA LYS 16 17.337 -0.767 27.612
116 HB2 LYS 16 HB2 LYS 16 15.361 -2.760 26.492
117 HB3 LYS 16 HB1 LYS 16 15.331 -1.041 26.097
118 HG2 LYS 16 HG2 LYS 16 17.648 -1.184 25.265
119 HG3 LYS 16 HG1 LYS 16 17.685 -2.902 25.660
120 HD2 LYS 16 HD2 LYS 16 15.823 -3.309 24.097
121 HD3 LYS 16 HD1 LYS 16 15.779 -1.591 23.700
122 HE2 LYS 16 HE2 LYS 16 18.094 -1.717 22.864
123 HE3 LYS 16 HE1 LYS 16 18.148 -3.434 23.266
124 HZ1 LYS 16 HZ1 LYS 16 16.712 -3.970 21.589
125 HZ2 LYS 16 HZ2 LYS 16 17.524 -2.658 20.877
126 HZ3 LYS 16 HZ3 LYS 16 15.981 -2.439 21.555
127 H ASP 17 HN ASP 17 14.976 -2.917 29.140
128 HA ASP 17 HA ASP 17 13.036 -0.977 29.776
129 HB2 ASP 17 HB2 ASP 17 12.661 -3.420 29.935
130 HB3 ASP 17 HB1 ASP 17 13.750 -3.481 31.320
131 H ALA 18 HN ALA 18 15.875 -2.127 31.567
132 HA ALA 18 HA ALA 18 15.445 -0.657 33.930
133 HB1 ALA 18 HB1 ALA 18 17.070 -2.461 33.848
134 HB2 ALA 18 HB2 ALA 18 17.887 -0.965 34.298
135 HB3 ALA 18 HB3 ALA 18 18.027 -1.585 32.653
136 H GLU 19 HN GLU 19 17.094 0.171 30.911
137 HA GLU 19 HA GLU 19 18.218 2.617 31.736
138 HB2 GLU 19 HB2 GLU 19 18.832 1.459 29.641
139 HB3 GLU 19 HB1 GLU 19 17.241 1.832 28.979
140 HG2 GLU 19 HG2 GLU 19 17.693 4.233 29.171
141 HG3 GLU 19 HG1 GLU 19 19.256 3.897 29.914
142 H LEU 20 HN LEU 20 15.053 1.848 30.325
143 HA LEU 20 HA LEU 20 14.164 4.545 30.127
144 HB2 LEU 20 HB2 LEU 20 12.917 1.842 29.934
145 HB3 LEU 20 HB1 LEU 20 11.825 3.170 30.315
146 HG LEU 20 HG LEU 20 12.647 4.402 28.325
147 HD11 LEU 20 HD11 LEU 20 14.056 3.229 26.680
148 HD12 LEU 20 HD12 LEU 20 14.196 1.853 27.771
149 HD13 LEU 20 HD13 LEU 20 14.905 3.408 28.214
150 HD21 LEU 20 HD21 LEU 20 10.696 2.774 28.259
151 HD22 LEU 20 HD22 LEU 20 11.809 1.589 27.576
152 HD23 LEU 20 HD23 LEU 20 11.464 3.081 26.701
153 H LYS 21 HN LYS 21 13.932 2.085 32.656
154 HA LYS 21 HA LYS 21 12.182 3.456 34.386
155 HB2 LYS 21 HB2 LYS 21 12.815 1.075 34.632
156 HB3 LYS 21 HB1 LYS 21 14.434 1.565 35.120
157 HG2 LYS 21 HG2 LYS 21 13.470 2.821 37.033
158 HG3 LYS 21 HG1 LYS 21 11.860 2.285 36.559
159 HD2 LYS 21 HD2 LYS 21 14.060 0.293 37.107
160 HD3 LYS 21 HD1 LYS 21 13.093 0.958 38.420
161 HE2 LYS 21 HE2 LYS 21 12.003 -0.531 36.006
162 HE3 LYS 21 HE1 LYS 21 12.141 -1.168 37.638
163 HZ1 LYS 21 HZ1 LYS 21 10.079 0.386 36.551
164 HZ2 LYS 21 HZ2 LYS 21 10.817 1.278 37.796
165 HZ3 LYS 21 HZ3 LYS 21 10.196 -0.273 38.109
166 H ARG 22 HN ARG 22 15.720 3.485 34.122
167 HA ARG 22 HA ARG 22 16.229 5.188 36.314
168 HB2 ARG 22 HB2 ARG 22 17.970 3.837 35.207
169 HB3 ARG 22 HB1 ARG 22 17.832 4.848 33.768
170 HG2 ARG 22 HG2 ARG 22 18.548 6.809 35.014
171 HG3 ARG 22 HG1 ARG 22 18.544 5.895 36.523
172 HD2 ARG 22 HD2 ARG 22 20.830 6.065 35.681
173 HD3 ARG 22 HD1 ARG 22 20.289 4.392 35.587
174 HE ARG 22 HE ARG 22 19.755 5.759 33.142
175 HH11 ARG 22 HH11 ARG 22 21.088 5.276 31.368
176 HH12 ARG 22 HH12 ARG 22 22.622 4.516 31.625
177 HH21 ARG 22 HH21 ARG 22 22.272 4.376 35.073
178 HH22 ARG 22 HH22 ARG 22 23.294 4.006 33.723
179 H LEU 23 HN LEU 23 15.545 5.841 32.918
180 HA LEU 23 HA LEU 23 16.139 8.571 32.858
181 HB2 LEU 23 HB2 LEU 23 15.754 7.237 30.844
182 HB3 LEU 23 HB1 LEU 23 14.061 7.032 31.284
183 HG LEU 23 HG LEU 23 13.718 9.478 31.118
184 HD11 LEU 23 HD11 LEU 23 15.765 10.503 31.635
185 HD12 LEU 23 HD12 LEU 23 15.696 10.699 29.887
186 HD13 LEU 23 HD13 LEU 23 16.687 9.421 30.591
187 HD21 LEU 23 HD21 LEU 23 13.479 7.934 29.133
188 HD22 LEU 23 HD22 LEU 23 15.106 8.407 28.647
189 HD23 LEU 23 HD23 LEU 23 13.821 9.612 28.710
190 H ASN 24 HN ASN 24 13.097 6.934 33.746
191 HA ASN 24 HA ASN 24 11.479 9.214 33.877
192 HB2 ASN 24 HB2 ASN 24 9.974 7.924 35.246
193 HB3 ASN 24 HB1 ASN 24 10.652 6.866 34.013
194 HD21 ASN 24 HD21 ASN 24 10.047 5.089 35.602
195 HD22 ASN 24 HD22 ASN 24 11.128 4.735 36.861
196 H GLU 25 HN GLU 25 14.107 8.326 35.866
197 HA GLU 25 HA GLU 25 13.466 10.546 37.701
198 HB2 GLU 25 HB2 GLU 25 14.157 9.237 39.644
199 HB3 GLU 25 HB1 GLU 25 12.820 8.428 38.828
200 HG2 GLU 25 HG2 GLU 25 14.490 6.991 37.632
201 HG3 GLU 25 HG1 GLU 25 15.764 7.731 38.599
202 H GLU 26 HN GLU 26 15.627 10.739 39.251
203 HA GLU 26 HA GLU 26 17.778 11.558 39.216
204 HB2 GLU 26 HB2 GLU 26 17.954 8.933 37.743
205 HB3 GLU 26 HB1 GLU 26 19.391 9.929 37.969
206 HG2 GLU 26 HG2 GLU 26 17.581 9.091 40.247
207 HG3 GLU 26 HG1 GLU 26 19.014 8.185 39.766
208 H ARG 27 HN ARG 27 15.940 12.518 37.134
209 HA ARG 27 HA ARG 27 17.250 12.698 34.631
210 HB2 ARG 27 HB2 ARG 27 15.680 14.520 34.165
211 HB3 ARG 27 HB1 ARG 27 14.850 13.166 34.929
212 HG2 ARG 27 HG2 ARG 27 14.981 14.307 37.112
213 HG3 ARG 27 HG1 ARG 27 15.820 15.663 36.359
214 HD2 ARG 27 HD2 ARG 27 13.062 14.715 35.548
215 HD3 ARG 27 HD1 ARG 27 13.363 16.055 36.650
216 HE ARG 27 HE ARG 27 14.828 16.578 34.336
217 HH11 ARG 27 HH11 ARG 27 13.981 17.941 32.728
218 HH12 ARG 27 HH12 ARG 27 12.270 18.185 32.620
219 HH21 ARG 27 HH21 ARG 27 11.537 16.109 35.299
220 HH22 ARG 27 HH22 ARG 27 10.887 17.148 34.076
221 H HIS 28 HN HIS 28 17.711 14.352 37.633
222 HA HIS 28 HA HIS 28 18.907 16.731 36.694
223 HB2 HIS 28 HB2 HIS 28 19.265 15.193 39.272
224 HB3 HIS 28 HB1 HIS 28 19.973 16.781 38.974
225 HD2 HIS 28 HD2 HIS 28 16.641 15.302 40.162
226 HE1 HIS 28 HE1 HIS 28 15.847 19.320 39.136
227 HE2 HIS 28 HE2 HIS 28 14.911 17.255 40.280
228 H ASP 29 HN ASP 29 20.237 13.534 37.431
229 HA ASP 29 HA ASP 29 22.966 14.186 37.175
230 HB2 ASP 29 HB2 ASP 29 21.456 11.606 36.748
231 HB3 ASP 29 HB1 ASP 29 23.212 11.716 36.644
232 H HIS 30 HN HIS 30 20.549 13.192 34.789
233 HA HIS 30 HA HIS 30 22.310 12.888 32.596
234 HB2 HIS 30 HB2 HIS 30 19.364 13.548 32.747
235 HB3 HIS 30 HB1 HIS 30 20.214 13.274 31.227
236 HD2 HIS 30 HD2 HIS 30 21.837 10.798 33.473
237 HE1 HIS 30 HE1 HIS 30 18.365 8.803 32.142
238 HE2 HIS 30 HE2 HIS 30 20.614 8.502 33.281
239 H ASP 31 HN ASP 31 20.540 15.678 33.861
240 HA ASP 31 HA ASP 31 21.079 17.470 31.759
241 HB2 ASP 31 HB2 ASP 31 19.425 17.889 33.554
242 HB3 ASP 31 HB1 ASP 31 20.747 18.093 34.702
243 H LYS 32 HN LYS 32 22.888 16.733 34.721
244 HA LYS 32 HA LYS 32 24.907 18.684 34.372
245 HB2 LYS 32 HB2 LYS 32 24.893 16.053 35.857
246 HB3 LYS 32 HB1 LYS 32 26.263 17.161 35.880
247 HG2 LYS 32 HG2 LYS 32 24.809 18.950 36.766
248 HG3 LYS 32 HG1 LYS 32 23.436 17.844 36.753
249 HD2 LYS 32 HD2 LYS 32 24.631 16.346 38.317
250 HD3 LYS 32 HD1 LYS 32 25.987 17.475 38.348
251 HE2 LYS 32 HE2 LYS 32 23.150 18.150 39.180
252 HE3 LYS 32 HE1 LYS 32 24.471 17.792 40.292
253 HZ1 LYS 32 HZ1 LYS 32 23.855 20.225 39.024
254 HZ2 LYS 32 HZ2 LYS 32 25.389 19.714 38.506
255 HZ3 LYS 32 HZ3 LYS 32 25.068 19.904 40.163
256 H ARG 33 HN ARG 33 24.616 15.340 33.259
257 HA ARG 33 HA ARG 33 27.223 15.032 32.246
258 HB2 ARG 33 HB2 ARG 33 25.645 13.158 32.533
259 HB3 ARG 33 HB1 ARG 33 24.649 13.802 31.227
260 HG2 ARG 33 HG2 ARG 33 26.468 13.516 29.633
261 HG3 ARG 33 HG1 ARG 33 27.561 13.013 30.922
262 HD2 ARG 33 HD2 ARG 33 26.165 11.045 31.365
263 HD3 ARG 33 HD1 ARG 33 25.024 11.558 30.125
264 HE ARG 33 HE ARG 33 26.508 10.791 28.499
265 HH11 ARG 33 HH11 ARG 33 28.383 9.685 27.849
266 HH12 ARG 33 HH12 ARG 33 29.650 9.393 28.993
267 HH21 ARG 33 HH21 ARG 33 28.005 10.953 31.616
268 HH22 ARG 33 HH22 ARG 33 29.436 10.112 31.125
269 H GLU 34 HN GLU 34 24.259 16.265 30.731
270 HA GLU 34 HA GLU 34 25.291 16.613 28.134
271 HB2 GLU 34 HB2 GLU 34 22.883 16.702 28.666
272 HB3 GLU 34 HB1 GLU 34 23.136 18.202 29.556
273 HG2 GLU 34 HG2 GLU 34 22.311 18.694 27.304
274 HG3 GLU 34 HG1 GLU 34 23.963 19.278 27.470
275 H ALA 35 HN ALA 35 25.224 18.769 30.949
276 HA ALA 35 HA ALA 35 26.275 21.063 29.700
277 HB1 ALA 35 HB1 ALA 35 26.766 20.248 32.567
278 HB2 ALA 35 HB2 ALA 35 25.234 20.918 32.006
279 HB3 ALA 35 HB3 ALA 35 26.708 21.881 31.904
280 H GLU 36 HN GLU 36 27.844 18.284 31.220
281 HA GLU 36 HA GLU 36 30.491 19.253 31.166
282 HB2 GLU 36 HB2 GLU 36 29.371 16.448 31.097
283 HB3 GLU 36 HB1 GLU 36 31.096 16.796 31.215
284 HG2 GLU 36 HG2 GLU 36 30.769 18.016 33.285
285 HG3 GLU 36 HG1 GLU 36 29.018 17.873 33.138
286 H ARG 37 HN ARG 37 28.562 17.524 28.757
287 HA ARG 37 HA ARG 37 30.608 16.960 26.918
288 HB2 ARG 37 HB2 ARG 37 28.331 16.006 26.783
289 HB3 ARG 37 HB1 ARG 37 27.702 17.593 26.342
290 HG2 ARG 37 HG2 ARG 37 29.087 17.615 24.321
291 HG3 ARG 37 HG1 ARG 37 29.804 16.067 24.774
292 HD2 ARG 37 HD2 ARG 37 27.579 15.006 24.661
293 HD3 ARG 37 HD1 ARG 37 26.865 16.551 24.203
294 HE ARG 37 HE ARG 37 28.436 14.792 22.503
295 HH11 ARG 37 HH11 ARG 37 28.559 15.426 20.325
296 HH12 ARG 37 HH12 ARG 37 28.060 17.018 19.863
297 HH21 ARG 37 HH21 ARG 37 27.198 17.971 23.083
298 HH22 ARG 37 HH22 ARG 37 27.289 18.460 21.425
299 H LYS 38 HN LYS 38 28.523 19.822 27.253
300 HA LYS 38 HA LYS 38 29.444 21.190 24.967
301 HB2 LYS 38 HB2 LYS 38 28.270 22.187 27.566
302 HB3 LYS 38 HB1 LYS 38 28.636 23.246 26.204
303 HG2 LYS 38 HG2 LYS 38 27.163 21.891 24.755
304 HG3 LYS 38 HG1 LYS 38 26.786 20.843 26.124
305 HD2 LYS 38 HD2 LYS 38 25.806 22.726 27.339
306 HD3 LYS 38 HD1 LYS 38 26.247 23.826 26.031
307 HE2 LYS 38 HE2 LYS 38 23.889 23.187 25.824
308 HE3 LYS 38 HE1 LYS 38 24.814 22.524 24.477
309 HZ1 LYS 38 HZ1 LYS 38 25.010 20.444 25.812
310 HZ2 LYS 38 HZ2 LYS 38 23.431 20.808 25.302
311 HZ3 LYS 38 HZ3 LYS 38 23.897 21.099 26.910
312 H ALA 39 HN ALA 39 30.628 21.111 28.303
313 HA ALA 39 HA ALA 39 32.530 23.177 28.088
314 HB1 ALA 39 HB1 ALA 39 32.598 20.683 29.804
315 HB2 ALA 39 HB2 ALA 39 31.864 22.225 30.245
316 HB3 ALA 39 HB3 ALA 39 33.612 22.108 30.033
317 H LEU 40 HN LEU 40 32.740 19.712 27.382
318 HA LEU 40 HA LEU 40 35.536 19.732 26.784
319 HB2 LEU 40 HB2 LEU 40 33.275 17.804 26.491
320 HB3 LEU 40 HB1 LEU 40 34.657 17.549 25.429
321 HG LEU 40 HG LEU 40 36.157 17.545 27.407
322 HD11 LEU 40 HD11 LEU 40 34.788 18.965 28.887
323 HD12 LEU 40 HD12 LEU 40 35.165 17.427 29.662
324 HD13 LEU 40 HD13 LEU 40 33.565 17.697 28.975
325 HD21 LEU 40 HD21 LEU 40 33.837 15.615 27.710
326 HD22 LEU 40 HD22 LEU 40 35.501 15.353 28.234
327 HD23 LEU 40 HD23 LEU 40 35.122 15.442 26.514
328 H GLU 41 HN GLU 41 32.591 20.118 24.872
329 HA GLU 41 HA GLU 41 33.770 20.065 22.313
330 HB2 GLU 41 HB2 GLU 41 31.334 19.920 22.707
331 HB3 GLU 41 HB1 GLU 41 31.329 21.605 23.230
332 HG2 GLU 41 HG2 GLU 41 32.124 22.322 21.026
333 HG3 GLU 41 HG1 GLU 41 32.222 20.643 20.496
334 H ASP 42 HN ASP 42 33.203 22.725 24.591
335 HA ASP 42 HA ASP 42 34.033 24.834 22.920
336 HB2 ASP 42 HB2 ASP 42 34.049 24.510 25.922
337 HB3 ASP 42 HB1 ASP 42 34.509 26.011 25.118
338 H LYS 43 HN LYS 43 35.835 22.698 25.088
339 HA LYS 43 HA LYS 43 38.324 24.005 24.960
340 HB2 LYS 43 HB2 LYS 43 37.801 22.226 26.587
341 HB3 LYS 43 HB1 LYS 43 37.753 21.046 25.278
342 HG2 LYS 43 HG2 LYS 43 40.112 21.497 24.754
343 HG3 LYS 43 HG1 LYS 43 40.169 22.726 26.019
344 HD2 LYS 43 HD2 LYS 43 39.631 21.005 27.710
345 HD3 LYS 43 HD1 LYS 43 39.596 19.778 26.442
346 HE2 LYS 43 HE2 LYS 43 42.001 21.499 27.113
347 HE3 LYS 43 HE1 LYS 43 41.779 19.832 27.642
348 HZ1 LYS 43 HZ1 LYS 43 43.136 20.004 25.628
349 HZ2 LYS 43 HZ2 LYS 43 41.834 20.728 24.811
350 HZ3 LYS 43 HZ3 LYS 43 41.712 19.123 25.356
351 H LEU 44 HN LEU 44 36.915 21.451 22.932
352 HA LEU 44 HA LEU 44 39.163 21.045 21.274
353 HB2 LEU 44 HB2 LEU 44 36.209 20.642 20.781
354 HB3 LEU 44 HB1 LEU 44 37.459 20.130 19.652
355 HG LEU 44 HG LEU 44 37.342 19.257 22.555
356 HD11 LEU 44 HD11 LEU 44 36.541 17.079 21.603
357 HD12 LEU 44 HD12 LEU 44 36.369 17.874 20.038
358 HD13 LEU 44 HD13 LEU 44 35.386 18.397 21.406
359 HD21 LEU 44 HD21 LEU 44 39.552 18.866 21.906
360 HD22 LEU 44 HD22 LEU 44 39.129 18.627 20.211
361 HD23 LEU 44 HD23 LEU 44 38.806 17.358 21.388
362 H ALA 45 HN ALA 45 36.428 23.277 21.055
363 HA ALA 45 HA ALA 45 36.948 24.273 18.473
364 HB1 ALA 45 HB1 ALA 45 35.801 25.894 20.748
365 HB2 ALA 45 HB2 ALA 45 34.875 24.653 19.904
366 HB3 ALA 45 HB3 ALA 45 35.474 26.057 19.022
367 H ASP 46 HN ASP 46 38.151 25.252 21.657
368 HA ASP 46 HA ASP 46 40.496 26.434 20.464
369 HB2 ASP 46 HB2 ASP 46 38.618 28.201 20.337
370 HB3 ASP 46 HB1 ASP 46 38.775 28.302 22.089
371 H LYS 47 HN LYS 47 42.050 27.148 22.091
372 HA LYS 47 HA LYS 47 41.514 26.204 24.833
373 HB2 LYS 47 HB2 LYS 47 42.630 24.356 23.666
374 HB3 LYS 47 HB1 LYS 47 43.908 25.441 23.133
375 HG2 LYS 47 HG2 LYS 47 44.723 24.187 25.038
376 HG3 LYS 47 HG1 LYS 47 44.486 25.850 25.553
377 HD2 LYS 47 HD2 LYS 47 42.421 25.287 26.670
378 HD3 LYS 47 HD1 LYS 47 42.418 23.671 25.962
379 HE2 LYS 47 HE2 LYS 47 44.491 23.141 27.195
380 HE3 LYS 47 HE1 LYS 47 44.486 24.760 27.896
381 HZ1 LYS 47 HZ1 LYS 47 42.595 24.308 29.132
382 HZ2 LYS 47 HZ2 LYS 47 43.468 22.853 29.238
383 HZ3 LYS 47 HZ3 LYS 47 42.148 22.981 28.174
384 H GLN 48 HN GLN 48 42.199 27.618 26.324
385 HA GLN 48 HA GLN 48 44.302 29.581 25.599
386 HB2 GLN 48 HB2 GLN 48 41.720 30.173 27.076
387 HB3 GLN 48 HB1 GLN 48 43.022 31.322 26.771
388 HG2 GLN 48 HG2 GLN 48 41.417 29.889 24.634
389 HG3 GLN 48 HG1 GLN 48 41.190 31.566 25.122
390 HE21 GLN 48 HE21 GLN 48 43.518 32.799 25.112
391 HE22 GLN 48 HE22 GLN 48 44.407 32.559 23.686
392 H GLU 49 HN GLU 49 45.626 30.250 27.277
393 HA GLU 49 HA GLU 49 45.744 28.434 29.561
394 HB2 GLU 49 HB2 GLU 49 47.590 30.630 28.597
395 HB3 GLU 49 HB1 GLU 49 47.893 29.634 30.021
396 HG2 GLU 49 HG2 GLU 49 47.860 27.608 28.640
397 HG3 GLU 49 HG1 GLU 49 47.491 28.570 27.210
398 H HIS 50 HN HIS 50 44.243 31.317 28.860
399 HA HIS 50 HA HIS 50 44.692 32.906 31.130
400 HB2 HIS 50 HB2 HIS 50 43.536 33.762 29.163
401 HB3 HIS 50 HB1 HIS 50 42.206 32.635 29.425
402 HD2 HIS 50 HD2 HIS 50 40.220 33.650 31.064
403 HE1 HIS 50 HE1 HIS 50 42.424 36.825 32.763
404 HE2 HIS 50 HE2 HIS 50 40.136 35.729 32.643
405 H LEU 51 HN LEU 51 42.194 30.425 30.530
406 HA LEU 51 HA LEU 51 42.017 29.941 33.411
407 HB2 LEU 51 HB2 LEU 51 40.349 31.701 33.021
408 HB3 LEU 51 HB1 LEU 51 39.616 30.739 31.742
409 HG LEU 51 HG LEU 51 39.068 28.968 33.384
410 HD11 LEU 51 HD11 LEU 51 40.570 30.822 35.228
411 HD12 LEU 51 HD12 LEU 51 40.678 29.067 35.085
412 HD13 LEU 51 HD13 LEU 51 39.285 29.799 35.874
413 HD21 LEU 51 HD21 LEU 51 37.490 30.851 32.916
414 HD22 LEU 51 HD22 LEU 51 38.158 31.713 34.302
415 HD23 LEU 51 HD23 LEU 51 37.303 30.189 34.540
416 H ASP 52 HN ASP 52 41.050 29.090 30.122
417 HA ASP 52 HA ASP 52 39.867 26.599 30.685
418 HB2 ASP 52 HB2 ASP 52 41.288 27.646 28.235
419 HB3 ASP 52 HB1 ASP 52 40.511 26.066 28.287
420 H GLY 53 HN GLY 53 43.235 27.515 30.096
421 HA2 GLY 53 HA2 GLY 53 44.178 24.781 30.223
422 HA3 GLY 53 HA1 GLY 53 45.174 26.231 30.114
423 H ALA 54 HN ALA 54 46.199 24.489 31.802
424 HA ALA 54 HA ALA 54 46.832 24.100 33.975
425 HB1 ALA 54 HB1 ALA 54 46.783 26.035 35.478
426 HB2 ALA 54 HB2 ALA 54 45.676 26.868 34.388
427 HB3 ALA 54 HB3 ALA 54 47.325 26.515 33.871
428 H LEU 55 HN LEU 55 44.268 23.117 33.187
429 HA LEU 55 HA LEU 55 42.227 23.661 35.046
430 HB2 LEU 55 HB2 LEU 55 41.823 22.454 32.948
431 HB3 LEU 55 HB1 LEU 55 42.809 21.110 33.518
432 HG LEU 55 HG LEU 55 41.226 20.737 35.384
433 HD11 LEU 55 HD11 LEU 55 38.942 21.999 35.037
434 HD12 LEU 55 HD12 LEU 55 39.936 23.194 34.205
435 HD13 LEU 55 HD13 LEU 55 40.251 22.807 35.896
436 HD21 LEU 55 HD21 LEU 55 39.279 20.012 33.959
437 HD22 LEU 55 HD22 LEU 55 40.847 19.496 33.339
438 HD23 LEU 55 HD23 LEU 55 40.019 20.870 32.606
439 H ARG 56 HN ARG 56 44.814 21.225 35.049
440 HA ARG 56 HA ARG 56 44.042 19.977 37.482
441 HB2 ARG 56 HB2 ARG 56 45.543 18.928 35.807
442 HB3 ARG 56 HB1 ARG 56 46.787 20.110 36.213
443 HG2 ARG 56 HG2 ARG 56 46.824 19.312 38.533
444 HG3 ARG 56 HG1 ARG 56 45.532 18.166 38.174
445 HD2 ARG 56 HD2 ARG 56 46.986 17.057 36.513
446 HD3 ARG 56 HD1 ARG 56 48.279 18.193 36.889
447 HE ARG 56 HE ARG 56 47.422 15.939 38.511
448 HH11 ARG 56 HH11 ARG 56 48.705 15.532 40.340
449 HH12 ARG 56 HH12 ARG 56 49.847 16.721 40.872
450 HH21 ARG 56 HH21 ARG 56 49.073 18.975 38.354
451 HH22 ARG 56 HH22 ARG 56 50.055 18.670 39.747
452 H TYR 57 HN TYR 57 44.397 20.530 39.547
453 HA TYR 57 HA TYR 57 45.460 23.122 40.167
454 HB2 TYR 57 HB2 TYR 57 44.622 20.838 41.969
455 HB3 TYR 57 HB1 TYR 57 45.006 22.471 42.515
456 HD1 TYR 57 HD1 TYR 57 42.566 20.360 40.768
457 HD2 TYR 57 HD2 TYR 57 43.558 24.377 41.922
458 HE1 TYR 57 HE1 TYR 57 40.250 21.081 40.252
459 HE2 TYR 57 HE2 TYR 57 41.243 25.098 41.404
460 HH TYR 57 HH TYR 57 38.811 22.762 40.235
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 6.764 -24.086 20.333
2 H2 GLY 1 HT2 GLY 1 5.512 -23.993 21.478
3 H3 GLY 1 HT3 GLY 1 7.132 -23.885 21.977
4 HA2 GLY 1 HA2 GLY 1 6.368 -21.924 20.000
5 HA3 GLY 1 HA1 GLY 1 5.536 -21.771 21.548
6 H SER 2 HN SER 2 8.255 -20.881 19.872
7 HA SER 2 HA SER 2 9.533 -19.848 22.268
8 HB2 SER 2 HB2 SER 2 11.696 -20.861 21.843
9 HB3 SER 2 HB1 SER 2 10.494 -22.137 22.015
10 HG SER 2 HG SER 2 10.456 -21.510 19.497
11 H ALA 3 HN ALA 3 11.354 -18.396 21.710
12 HA ALA 3 HA ALA 3 10.639 -16.596 19.669
13 HB1 ALA 3 HB1 ALA 3 12.102 -16.245 21.795
14 HB2 ALA 3 HB2 ALA 3 12.486 -15.329 20.338
15 HB3 ALA 3 HB3 ALA 3 13.437 -16.753 20.762
16 H GLY 4 HN GLY 4 13.018 -19.208 19.777
17 HA2 GLY 4 HA2 GLY 4 13.852 -20.454 18.000
18 HA3 GLY 4 HA1 GLY 4 13.011 -19.385 16.887
19 H LEU 5 HN LEU 5 14.975 -19.525 15.630
20 HA LEU 5 HA LEU 5 17.501 -18.627 16.480
21 HB2 LEU 5 HB2 LEU 5 16.197 -18.779 13.762
22 HB3 LEU 5 HB1 LEU 5 17.857 -18.224 13.981
23 HG LEU 5 HG LEU 5 18.372 -20.361 15.168
24 HD11 LEU 5 HD11 LEU 5 16.324 -21.149 16.015
25 HD12 LEU 5 HD12 LEU 5 16.616 -22.225 14.651
26 HD13 LEU 5 HD13 LEU 5 15.479 -20.886 14.489
27 HD21 LEU 5 HD21 LEU 5 17.200 -20.689 12.387
28 HD22 LEU 5 HD22 LEU 5 18.397 -21.747 13.133
29 HD23 LEU 5 HD23 LEU 5 18.814 -20.079 12.745
30 H GLN 6 HN GLN 6 14.721 -16.894 15.186
31 HA GLN 6 HA GLN 6 15.970 -14.435 14.654
32 HB2 GLN 6 HB2 GLN 6 13.131 -15.113 15.430
33 HB3 GLN 6 HB1 GLN 6 13.646 -13.479 15.023
34 HG2 GLN 6 HG2 GLN 6 14.433 -14.277 12.818
35 HG3 GLN 6 HG1 GLN 6 13.892 -15.905 13.215
36 HE21 GLN 6 HE21 GLN 6 12.087 -16.189 11.860
37 HE22 GLN 6 HE22 GLN 6 10.763 -15.129 11.810
38 H GLU 7 HN GLU 7 14.610 -15.759 17.639
39 HA GLU 7 HA GLU 7 14.737 -15.049 19.821
40 HB2 GLU 7 HB2 GLU 7 17.242 -13.743 18.734
41 HB3 GLU 7 HB1 GLU 7 16.842 -13.861 20.446
42 HG2 GLU 7 HG2 GLU 7 16.782 -16.310 20.284
43 HG3 GLU 7 HG1 GLU 7 17.141 -16.215 18.562
44 H LYS 8 HN LYS 8 13.117 -13.522 18.040
45 HA LYS 8 HA LYS 8 13.470 -10.737 18.280
46 HB2 LYS 8 HB2 LYS 8 11.928 -11.785 16.666
47 HB3 LYS 8 HB1 LYS 8 10.896 -12.306 17.997
48 HG2 LYS 8 HG2 LYS 8 10.508 -9.966 18.642
49 HG3 LYS 8 HG1 LYS 8 11.587 -9.422 17.357
50 HD2 LYS 8 HD2 LYS 8 10.098 -10.463 15.677
51 HD3 LYS 8 HD1 LYS 8 9.011 -10.976 16.970
52 HE2 LYS 8 HE2 LYS 8 9.759 -8.096 16.382
53 HE3 LYS 8 HE1 LYS 8 8.252 -8.866 15.885
54 HZ1 LYS 8 HZ1 LYS 8 8.778 -7.639 18.298
55 HZ2 LYS 8 HZ2 LYS 8 8.738 -9.302 18.642
56 HZ3 LYS 8 HZ3 LYS 8 7.409 -8.555 17.894
57 H GLU 9 HN GLU 9 11.751 -13.075 20.318
58 HA GLU 9 HA GLU 9 10.559 -11.213 22.069
59 HB2 GLU 9 HB2 GLU 9 11.339 -14.105 22.438
60 HB3 GLU 9 HB1 GLU 9 10.505 -13.177 23.683
61 HG2 GLU 9 HG2 GLU 9 8.625 -12.771 22.221
62 HG3 GLU 9 HG1 GLU 9 9.472 -13.476 20.847
63 H ARG 10 HN ARG 10 13.720 -12.820 22.168
64 HA ARG 10 HA ARG 10 14.471 -11.937 24.743
65 HB2 ARG 10 HB2 ARG 10 16.114 -12.689 22.323
66 HB3 ARG 10 HB1 ARG 10 16.822 -12.309 23.891
67 HG2 ARG 10 HG2 ARG 10 15.494 -14.105 24.936
68 HG3 ARG 10 HG1 ARG 10 14.779 -14.488 23.369
69 HD2 ARG 10 HD2 ARG 10 17.000 -15.033 22.472
70 HD3 ARG 10 HD1 ARG 10 17.739 -14.611 24.013
71 HE ARG 10 HE ARG 10 16.989 -16.642 24.888
72 HH11 ARG 10 HH11 ARG 10 16.077 -18.708 24.661
73 HH12 ARG 10 HH12 ARG 10 15.146 -19.089 23.251
74 HH21 ARG 10 HH21 ARG 10 15.542 -15.955 21.820
75 HH22 ARG 10 HH22 ARG 10 14.844 -17.530 21.643
76 H GLU 11 HN GLU 11 14.800 -10.467 21.544
77 HA GLU 11 HA GLU 11 16.434 -8.291 22.319
78 HB2 GLU 11 HB2 GLU 11 14.481 -8.635 20.040
79 HB3 GLU 11 HB1 GLU 11 15.460 -7.184 20.250
80 HG2 GLU 11 HG2 GLU 11 17.508 -8.456 20.076
81 HG3 GLU 11 HG1 GLU 11 16.624 -9.979 20.087
82 H LEU 12 HN LEU 12 12.922 -8.720 22.249
83 HA LEU 12 HA LEU 12 12.220 -6.053 22.864
84 HB2 LEU 12 HB2 LEU 12 10.800 -8.670 23.387
85 HB3 LEU 12 HB1 LEU 12 10.074 -7.094 23.693
86 HG LEU 12 HG LEU 12 11.176 -7.961 21.002
87 HD11 LEU 12 HD11 LEU 12 8.888 -8.380 20.330
88 HD12 LEU 12 HD12 LEU 12 8.280 -7.819 21.888
89 HD13 LEU 12 HD13 LEU 12 9.207 -9.316 21.790
90 HD21 LEU 12 HD21 LEU 12 11.119 -5.631 20.887
91 HD22 LEU 12 HD22 LEU 12 9.793 -5.493 22.041
92 HD23 LEU 12 HD23 LEU 12 9.472 -6.001 20.385
93 H GLU 13 HN GLU 13 12.990 -8.840 24.889
94 HA GLU 13 HA GLU 13 12.308 -7.673 27.376
95 HB2 GLU 13 HB2 GLU 13 14.233 -9.881 26.643
96 HB3 GLU 13 HB1 GLU 13 13.924 -9.397 28.310
97 HG2 GLU 13 HG2 GLU 13 11.577 -9.939 28.105
98 HG3 GLU 13 HG1 GLU 13 11.741 -10.230 26.376
99 H ASP 14 HN ASP 14 15.292 -7.672 25.480
100 HA ASP 14 HA ASP 14 16.975 -6.487 27.402
101 HB2 ASP 14 HB2 ASP 14 17.020 -6.452 24.383
102 HB3 ASP 14 HB1 ASP 14 18.289 -5.727 25.368
103 H LEU 15 HN LEU 15 14.801 -5.080 24.989
104 HA LEU 15 HA LEU 15 15.565 -2.382 25.334
105 HB2 LEU 15 HB2 LEU 15 12.958 -3.630 24.447
106 HB3 LEU 15 HB1 LEU 15 13.267 -1.898 24.403
107 HG LEU 15 HG LEU 15 15.007 -3.963 23.018
108 HD11 LEU 15 HD11 LEU 15 12.669 -3.870 22.122
109 HD12 LEU 15 HD12 LEU 15 13.882 -3.343 20.956
110 HD13 LEU 15 HD13 LEU 15 12.898 -2.151 21.806
111 HD21 LEU 15 HD21 LEU 15 16.361 -2.070 23.196
112 HD22 LEU 15 HD22 LEU 15 14.998 -0.953 23.189
113 HD23 LEU 15 HD23 LEU 15 15.528 -1.710 21.689
114 H LYS 16 HN LYS 16 13.181 -4.408 26.978
115 HA LYS 16 HA LYS 16 11.939 -2.400 28.508
116 HB2 LYS 16 HB2 LYS 16 11.039 -4.685 28.271
117 HB3 LYS 16 HB1 LYS 16 12.389 -5.311 29.217
118 HG2 LYS 16 HG2 LYS 16 11.683 -3.958 31.149
119 HG3 LYS 16 HG1 LYS 16 10.353 -3.290 30.203
120 HD2 LYS 16 HD2 LYS 16 9.405 -5.550 29.932
121 HD3 LYS 16 HD1 LYS 16 10.737 -6.223 30.872
122 HE2 LYS 16 HE2 LYS 16 10.060 -4.867 32.816
123 HE3 LYS 16 HE1 LYS 16 8.733 -4.181 31.879
124 HZ1 LYS 16 HZ1 LYS 16 9.001 -6.824 33.056
125 HZ2 LYS 16 HZ2 LYS 16 8.279 -6.765 31.520
126 HZ3 LYS 16 HZ3 LYS 16 7.614 -5.881 32.810
127 H ASP 17 HN ASP 17 14.770 -4.437 29.172
128 HA ASP 17 HA ASP 17 15.248 -3.566 31.805
129 HB2 ASP 17 HB2 ASP 17 16.334 -5.539 30.776
130 HB3 ASP 17 HB1 ASP 17 17.272 -4.462 29.741
131 H ALA 18 HN ALA 18 16.401 -2.325 28.687
132 HA ALA 18 HA ALA 18 18.138 -0.352 29.693
133 HB1 ALA 18 HB1 ALA 18 16.547 -0.412 27.119
134 HB2 ALA 18 HB2 ALA 18 18.189 -1.011 27.352
135 HB3 ALA 18 HB3 ALA 18 17.856 0.717 27.466
136 H GLU 19 HN GLU 19 14.671 -0.286 28.972
137 HA GLU 19 HA GLU 19 14.266 2.481 29.351
138 HB2 GLU 19 HB2 GLU 19 12.418 0.110 29.663
139 HB3 GLU 19 HB1 GLU 19 11.877 1.783 29.812
140 HG2 GLU 19 HG2 GLU 19 12.580 2.278 27.549
141 HG3 GLU 19 HG1 GLU 19 13.329 0.690 27.389
142 H LEU 20 HN LEU 20 14.221 -0.249 31.607
143 HA LEU 20 HA LEU 20 13.270 1.159 33.863
144 HB2 LEU 20 HB2 LEU 20 15.022 -1.292 33.622
145 HB3 LEU 20 HB1 LEU 20 14.395 -0.697 35.156
146 HG LEU 20 HG LEU 20 12.653 -1.411 32.777
147 HD11 LEU 20 HD11 LEU 20 13.163 -3.033 35.287
148 HD12 LEU 20 HD12 LEU 20 13.917 -3.361 33.727
149 HD13 LEU 20 HD13 LEU 20 12.169 -3.500 33.908
150 HD21 LEU 20 HD21 LEU 20 11.312 -0.028 34.095
151 HD22 LEU 20 HD22 LEU 20 12.132 -0.469 35.592
152 HD23 LEU 20 HD23 LEU 20 10.985 -1.583 34.852
153 H LYS 21 HN LYS 21 16.523 0.644 32.580
154 HA LYS 21 HA LYS 21 17.961 1.749 34.741
155 HB2 LYS 21 HB2 LYS 21 18.602 1.543 31.793
156 HB3 LYS 21 HB1 LYS 21 19.750 2.130 32.997
157 HG2 LYS 21 HG2 LYS 21 19.544 0.008 34.238
158 HG3 LYS 21 HG1 LYS 21 18.394 -0.583 33.037
159 HD2 LYS 21 HD2 LYS 21 20.114 -0.381 31.281
160 HD3 LYS 21 HD1 LYS 21 21.267 0.213 32.477
161 HE2 LYS 21 HE2 LYS 21 21.073 -1.904 33.726
162 HE3 LYS 21 HE1 LYS 21 19.914 -2.501 32.540
163 HZ1 LYS 21 HZ1 LYS 21 21.638 -3.233 31.382
164 HZ2 LYS 21 HZ2 LYS 21 22.747 -2.459 32.411
165 HZ3 LYS 21 HZ3 LYS 21 22.082 -1.623 31.089
166 H ARG 22 HN ARG 22 16.516 3.214 31.861
167 HA ARG 22 HA ARG 22 17.593 5.788 32.152
168 HB2 ARG 22 HB2 ARG 22 16.488 5.101 30.099
169 HB3 ARG 22 HB1 ARG 22 14.965 4.882 30.951
170 HG2 ARG 22 HG2 ARG 22 14.957 7.003 29.717
171 HG3 ARG 22 HG1 ARG 22 14.899 7.316 31.446
172 HD2 ARG 22 HD2 ARG 22 17.234 7.906 31.493
173 HD3 ARG 22 HD1 ARG 22 17.473 7.327 29.845
174 HE ARG 22 HE ARG 22 15.518 9.307 29.726
175 HH11 ARG 22 HH11 ARG 22 16.073 11.451 29.220
176 HH12 ARG 22 HH12 ARG 22 17.694 12.005 29.481
177 HH21 ARG 22 HH21 ARG 22 18.819 8.962 30.706
178 HH22 ARG 22 HH22 ARG 22 19.248 10.596 30.321
179 H LEU 23 HN LEU 23 14.600 4.358 33.415
180 HA LEU 23 HA LEU 23 13.597 6.686 34.661
181 HB2 LEU 23 HB2 LEU 23 13.198 3.752 35.275
182 HB3 LEU 23 HB1 LEU 23 12.304 5.041 36.075
183 HG LEU 23 HG LEU 23 12.380 4.650 33.067
184 HD11 LEU 23 HD11 LEU 23 10.229 3.848 35.052
185 HD12 LEU 23 HD12 LEU 23 11.314 2.731 34.224
186 HD13 LEU 23 HD13 LEU 23 10.143 3.671 33.299
187 HD21 LEU 23 HD21 LEU 23 11.704 6.865 33.363
188 HD22 LEU 23 HD22 LEU 23 10.971 6.550 34.935
189 HD23 LEU 23 HD23 LEU 23 10.147 6.052 33.459
190 H ASN 24 HN ASN 24 15.776 4.140 35.784
191 HA ASN 24 HA ASN 24 15.916 4.905 38.490
192 HB2 ASN 24 HB2 ASN 24 16.797 2.766 37.485
193 HB3 ASN 24 HB1 ASN 24 18.160 3.696 36.865
194 HD21 ASN 24 HD21 ASN 24 19.770 2.732 38.241
195 HD22 ASN 24 HD22 ASN 24 19.773 2.950 39.924
196 H GLU 25 HN GLU 25 17.768 5.942 35.653
197 HA GLU 25 HA GLU 25 19.660 7.537 37.012
198 HB2 GLU 25 HB2 GLU 25 19.872 6.833 34.643
199 HB3 GLU 25 HB1 GLU 25 18.551 7.921 34.221
200 HG2 GLU 25 HG2 GLU 25 19.842 9.844 35.029
201 HG3 GLU 25 HG1 GLU 25 21.153 8.774 35.525
202 H GLU 26 HN GLU 26 19.555 9.527 37.874
203 HA GLU 26 HA GLU 26 17.012 10.795 38.229
204 HB2 GLU 26 HB2 GLU 26 19.822 11.721 38.884
205 HB3 GLU 26 HB1 GLU 26 18.355 12.563 39.373
206 HG2 GLU 26 HG2 GLU 26 18.833 11.246 41.255
207 HG3 GLU 26 HG1 GLU 26 17.646 10.268 40.400
208 H ARG 27 HN ARG 27 16.245 12.708 37.370
209 HA ARG 27 HA ARG 27 16.921 13.303 34.694
210 HB2 ARG 27 HB2 ARG 27 15.330 14.841 36.755
211 HB3 ARG 27 HB1 ARG 27 15.472 15.337 35.068
212 HG2 ARG 27 HG2 ARG 27 14.460 13.276 34.308
213 HG3 ARG 27 HG1 ARG 27 14.481 12.611 35.941
214 HD2 ARG 27 HD2 ARG 27 12.964 15.110 35.154
215 HD3 ARG 27 HD1 ARG 27 12.239 13.509 35.246
216 HE ARG 27 HE ARG 27 13.510 13.995 37.694
217 HH11 ARG 27 HH11 ARG 27 12.294 14.724 39.468
218 HH12 ARG 27 HH12 ARG 27 10.772 15.508 39.205
219 HH21 ARG 27 HH21 ARG 27 10.934 15.244 35.751
220 HH22 ARG 27 HH22 ARG 27 10.001 15.802 37.100
221 H HIS 28 HN HIS 28 17.806 14.827 37.761
222 HA HIS 28 HA HIS 28 19.103 17.094 36.686
223 HB2 HIS 28 HB2 HIS 28 19.437 15.607 39.295
224 HB3 HIS 28 HB1 HIS 28 20.322 17.085 38.918
225 HD2 HIS 28 HD2 HIS 28 18.830 19.440 39.187
226 HE1 HIS 28 HE1 HIS 28 15.106 17.615 39.977
227 HE2 HIS 28 HE2 HIS 28 16.344 19.831 39.884
228 H ASP 29 HN ASP 29 20.247 13.836 37.453
229 HA ASP 29 HA ASP 29 22.997 14.280 37.039
230 HB2 ASP 29 HB2 ASP 29 21.285 11.809 36.757
231 HB3 ASP 29 HB1 ASP 29 23.036 11.787 36.562
232 H HIS 30 HN HIS 30 20.387 13.419 34.812
233 HA HIS 30 HA HIS 30 21.953 12.893 32.538
234 HB2 HIS 30 HB2 HIS 30 19.584 12.320 32.628
235 HB3 HIS 30 HB1 HIS 30 19.151 14.026 32.725
236 HD2 HIS 30 HD2 HIS 30 18.803 15.208 30.248
237 HE1 HIS 30 HE1 HIS 30 20.768 12.284 27.921
238 HE2 HIS 30 HE2 HIS 30 19.424 14.437 27.832
239 H ASP 31 HN ASP 31 20.468 15.923 33.674
240 HA ASP 31 HA ASP 31 21.303 17.541 31.525
241 HB2 ASP 31 HB2 ASP 31 20.657 18.181 34.405
242 HB3 ASP 31 HB1 ASP 31 21.038 19.421 33.211
243 H LYS 32 HN LYS 32 22.871 16.675 34.574
244 HA LYS 32 HA LYS 32 25.060 18.434 34.417
245 HB2 LYS 32 HB2 LYS 32 24.493 17.175 36.454
246 HB3 LYS 32 HB1 LYS 32 24.934 15.673 35.641
247 HG2 LYS 32 HG2 LYS 32 27.230 16.349 35.449
248 HG3 LYS 32 HG1 LYS 32 26.851 17.995 35.952
249 HD2 LYS 32 HD2 LYS 32 27.816 16.904 37.859
250 HD3 LYS 32 HD1 LYS 32 26.085 17.022 38.172
251 HE2 LYS 32 HE2 LYS 32 25.751 14.704 37.547
252 HE3 LYS 32 HE1 LYS 32 27.423 14.565 37.003
253 HZ1 LYS 32 HZ1 LYS 32 28.156 14.973 39.262
254 HZ2 LYS 32 HZ2 LYS 32 27.107 13.637 39.217
255 HZ3 LYS 32 HZ3 LYS 32 26.550 15.139 39.783
256 H ARG 33 HN ARG 33 24.631 15.128 33.196
257 HA ARG 33 HA ARG 33 27.242 14.746 32.220
258 HB2 ARG 33 HB2 ARG 33 25.602 12.922 32.452
259 HB3 ARG 33 HB1 ARG 33 24.643 13.621 31.147
260 HG2 ARG 33 HG2 ARG 33 26.461 13.295 29.565
261 HG3 ARG 33 HG1 ARG 33 27.531 12.745 30.857
262 HD2 ARG 33 HD2 ARG 33 26.644 10.815 29.649
263 HD3 ARG 33 HD1 ARG 33 25.998 10.841 31.287
264 HE ARG 33 HE ARG 33 24.250 12.206 29.493
265 HH11 ARG 33 HH11 ARG 33 22.325 11.150 28.912
266 HH12 ARG 33 HH12 ARG 33 22.177 9.440 29.144
267 HH21 ARG 33 HH21 ARG 33 25.363 9.076 30.464
268 HH22 ARG 33 HH22 ARG 33 23.898 8.266 30.024
269 H GLU 34 HN GLU 34 24.343 16.087 30.668
270 HA GLU 34 HA GLU 34 25.492 16.466 28.107
271 HB2 GLU 34 HB2 GLU 34 23.179 17.819 29.504
272 HB3 GLU 34 HB1 GLU 34 23.643 18.190 27.844
273 HG2 GLU 34 HG2 GLU 34 23.259 15.905 27.153
274 HG3 GLU 34 HG1 GLU 34 23.002 15.390 28.817
275 H ALA 35 HN ALA 35 25.337 18.516 30.984
276 HA ALA 35 HA ALA 35 26.365 20.875 29.841
277 HB1 ALA 35 HB1 ALA 35 26.786 19.914 32.678
278 HB2 ALA 35 HB2 ALA 35 25.304 20.681 32.108
279 HB3 ALA 35 HB3 ALA 35 26.821 21.580 32.102
280 H GLU 36 HN GLU 36 27.964 18.060 31.271
281 HA GLU 36 HA GLU 36 30.595 19.072 31.272
282 HB2 GLU 36 HB2 GLU 36 29.911 17.021 32.473
283 HB3 GLU 36 HB1 GLU 36 29.680 16.206 30.928
284 HG2 GLU 36 HG2 GLU 36 32.049 16.514 30.378
285 HG3 GLU 36 HG1 GLU 36 32.298 17.405 31.879
286 H ARG 37 HN ARG 37 28.746 17.313 28.809
287 HA ARG 37 HA ARG 37 30.837 17.013 26.939
288 HB2 ARG 37 HB2 ARG 37 27.841 17.215 26.550
289 HB3 ARG 37 HB1 ARG 37 28.969 16.769 25.273
290 HG2 ARG 37 HG2 ARG 37 28.948 15.264 27.889
291 HG3 ARG 37 HG1 ARG 37 27.793 14.868 26.620
292 HD2 ARG 37 HD2 ARG 37 29.700 14.544 25.039
293 HD3 ARG 37 HD1 ARG 37 30.817 14.824 26.367
294 HE ARG 37 HE ARG 37 29.039 12.791 27.138
295 HH11 ARG 37 HH11 ARG 37 29.720 10.628 27.012
296 HH12 ARG 37 HH12 ARG 37 31.041 10.201 25.976
297 HH21 ARG 37 HH21 ARG 37 31.554 13.441 24.853
298 HH22 ARG 37 HH22 ARG 37 32.080 11.793 24.753
299 H LYS 38 HN LYS 38 28.498 19.602 27.486
300 HA LYS 38 HA LYS 38 29.066 21.142 25.200
301 HB2 LYS 38 HB2 LYS 38 27.115 21.535 26.660
302 HB3 LYS 38 HB1 LYS 38 28.192 22.082 27.944
303 HG2 LYS 38 HG2 LYS 38 28.985 23.926 26.523
304 HG3 LYS 38 HG1 LYS 38 27.960 23.361 25.202
305 HD2 LYS 38 HD2 LYS 38 25.960 23.716 26.613
306 HD3 LYS 38 HD1 LYS 38 26.992 24.304 27.917
307 HE2 LYS 38 HE2 LYS 38 26.823 25.542 25.153
308 HE3 LYS 38 HE1 LYS 38 26.008 26.165 26.587
309 HZ1 LYS 38 HZ1 LYS 38 27.859 27.221 27.128
310 HZ2 LYS 38 HZ2 LYS 38 28.653 26.593 25.763
311 HZ3 LYS 38 HZ3 LYS 38 28.689 25.746 27.236
312 H ALA 39 HN ALA 39 30.497 21.167 28.453
313 HA ALA 39 HA ALA 39 32.225 23.357 28.073
314 HB1 ALA 39 HB1 ALA 39 33.512 22.389 29.964
315 HB2 ALA 39 HB2 ALA 39 32.534 20.925 29.848
316 HB3 ALA 39 HB3 ALA 39 31.781 22.457 30.289
317 H LEU 40 HN LEU 40 32.649 19.896 27.436
318 HA LEU 40 HA LEU 40 35.389 19.995 26.753
319 HB2 LEU 40 HB2 LEU 40 33.183 18.104 25.917
320 HB3 LEU 40 HB1 LEU 40 34.879 17.858 25.508
321 HG LEU 40 HG LEU 40 33.850 18.183 28.343
322 HD11 LEU 40 HD11 LEU 40 32.995 16.128 27.167
323 HD12 LEU 40 HD12 LEU 40 34.017 15.780 28.561
324 HD13 LEU 40 HD13 LEU 40 34.670 15.632 26.929
325 HD21 LEU 40 HD21 LEU 40 36.548 17.672 27.105
326 HD22 LEU 40 HD22 LEU 40 36.184 16.928 28.661
327 HD23 LEU 40 HD23 LEU 40 36.125 18.677 28.489
328 H GLU 41 HN GLU 41 32.445 20.436 24.849
329 HA GLU 41 HA GLU 41 33.653 20.527 22.301
330 HB2 GLU 41 HB2 GLU 41 31.116 21.770 23.374
331 HB3 GLU 41 HB1 GLU 41 31.585 21.844 21.675
332 HG2 GLU 41 HG2 GLU 41 31.585 19.427 21.506
333 HG3 GLU 41 HG1 GLU 41 31.310 19.266 23.240
334 H ASP 42 HN ASP 42 33.051 23.028 24.730
335 HA ASP 42 HA ASP 42 33.781 25.263 23.179
336 HB2 ASP 42 HB2 ASP 42 33.879 24.748 26.153
337 HB3 ASP 42 HB1 ASP 42 34.279 26.308 25.438
338 H LYS 43 HN LYS 43 35.694 23.043 25.160
339 HA LYS 43 HA LYS 43 38.142 24.428 25.061
340 HB2 LYS 43 HB2 LYS 43 37.709 22.530 26.578
341 HB3 LYS 43 HB1 LYS 43 37.664 21.438 25.194
342 HG2 LYS 43 HG2 LYS 43 39.997 22.007 24.650
343 HG3 LYS 43 HG1 LYS 43 40.045 23.137 26.004
344 HD2 LYS 43 HD2 LYS 43 39.611 21.283 27.571
345 HD3 LYS 43 HD1 LYS 43 39.558 20.152 26.220
346 HE2 LYS 43 HE2 LYS 43 41.889 20.713 25.649
347 HE3 LYS 43 HE1 LYS 43 41.945 21.857 26.989
348 HZ1 LYS 43 HZ1 LYS 43 41.784 20.152 28.548
349 HZ2 LYS 43 HZ2 LYS 43 42.857 19.532 27.386
350 HZ3 LYS 43 HZ3 LYS 43 41.238 19.019 27.409
351 H LEU 44 HN LEU 44 36.746 21.976 22.903
352 HA LEU 44 HA LEU 44 38.955 21.746 21.158
353 HB2 LEU 44 HB2 LEU 44 35.996 21.301 20.720
354 HB3 LEU 44 HB1 LEU 44 37.223 20.901 19.523
355 HG LEU 44 HG LEU 44 37.214 19.824 22.359
356 HD11 LEU 44 HD11 LEU 44 36.301 18.474 19.801
357 HD12 LEU 44 HD12 LEU 44 35.228 19.077 21.064
358 HD13 LEU 44 HD13 LEU 44 36.335 17.747 21.407
359 HD21 LEU 44 HD21 LEU 44 39.410 19.536 21.613
360 HD22 LEU 44 HD22 LEU 44 38.936 19.396 19.922
361 HD23 LEU 44 HD23 LEU 44 38.682 18.046 21.025
362 H ALA 45 HN ALA 45 36.165 23.909 21.198
363 HA ALA 45 HA ALA 45 36.552 25.118 18.686
364 HB1 ALA 45 HB1 ALA 45 35.397 26.345 21.202
365 HB2 ALA 45 HB2 ALA 45 34.497 25.379 20.033
366 HB3 ALA 45 HB3 ALA 45 35.168 26.939 19.558
367 H ASP 46 HN ASP 46 37.893 25.848 21.878
368 HA ASP 46 HA ASP 46 39.140 28.288 21.240
369 HB2 ASP 46 HB2 ASP 46 39.801 26.153 23.271
370 HB3 ASP 46 HB1 ASP 46 40.684 27.675 23.161
371 H LYS 47 HN LYS 47 41.164 28.805 20.483
372 HA LYS 47 HA LYS 47 42.342 27.104 18.572
373 HB2 LYS 47 HB2 LYS 47 43.358 29.598 19.941
374 HB3 LYS 47 HB1 LYS 47 44.226 28.789 18.636
375 HG2 LYS 47 HG2 LYS 47 42.263 29.048 17.164
376 HG3 LYS 47 HG1 LYS 47 41.395 29.862 18.466
377 HD2 LYS 47 HD2 LYS 47 43.070 31.651 18.500
378 HD3 LYS 47 HD1 LYS 47 44.000 30.827 17.250
379 HE2 LYS 47 HE2 LYS 47 42.636 32.595 16.242
380 HE3 LYS 47 HE1 LYS 47 42.060 31.015 15.711
381 HZ1 LYS 47 HZ1 LYS 47 40.875 32.126 18.135
382 HZ2 LYS 47 HZ2 LYS 47 40.164 31.194 16.905
383 HZ3 LYS 47 HZ3 LYS 47 40.442 32.853 16.665
384 H GLN 48 HN GLN 48 43.186 27.805 21.939
385 HA GLN 48 HA GLN 48 45.639 26.346 21.921
386 HB2 GLN 48 HB2 GLN 48 43.815 27.239 24.161
387 HB3 GLN 48 HB1 GLN 48 45.358 26.429 24.430
388 HG2 GLN 48 HG2 GLN 48 46.561 28.200 23.311
389 HG3 GLN 48 HG1 GLN 48 45.057 28.958 22.792
390 HE21 GLN 48 HE21 GLN 48 47.208 30.113 24.544
391 HE22 GLN 48 HE22 GLN 48 46.431 30.526 25.995
392 H GLU 49 HN GLU 49 46.088 24.267 22.548
393 HA GLU 49 HA GLU 49 43.811 22.474 23.167
394 HB2 GLU 49 HB2 GLU 49 46.004 21.998 21.134
395 HB3 GLU 49 HB1 GLU 49 44.866 20.767 21.685
396 HG2 GLU 49 HG2 GLU 49 42.983 22.126 20.884
397 HG3 GLU 49 HG1 GLU 49 44.101 23.386 20.361
398 H HIS 50 HN HIS 50 44.324 20.667 24.429
399 HA HIS 50 HA HIS 50 46.482 21.056 26.264
400 HB2 HIS 50 HB2 HIS 50 45.696 18.722 27.069
401 HB3 HIS 50 HB1 HIS 50 44.578 20.076 27.219
402 HD2 HIS 50 HD2 HIS 50 44.751 18.867 23.583
403 HE1 HIS 50 HE1 HIS 50 41.385 16.984 25.293
404 HE2 HIS 50 HE2 HIS 50 42.596 17.473 23.116
405 H LEU 51 HN LEU 51 48.073 19.378 26.781
406 HA LEU 51 HA LEU 51 49.676 18.730 24.541
407 HB2 LEU 51 HB2 LEU 51 49.788 17.847 27.426
408 HB3 LEU 51 HB1 LEU 51 50.994 17.375 26.235
409 HG LEU 51 HG LEU 51 50.275 20.263 26.847
410 HD11 LEU 51 HD11 LEU 51 52.462 20.272 28.079
411 HD12 LEU 51 HD12 LEU 51 52.512 18.517 27.911
412 HD13 LEU 51 HD13 LEU 51 51.224 19.277 28.846
413 HD21 LEU 51 HD21 LEU 51 52.301 18.891 25.083
414 HD22 LEU 51 HD22 LEU 51 52.719 20.438 25.817
415 HD23 LEU 51 HD23 LEU 51 51.322 20.321 24.756
416 H ASP 52 HN ASP 52 47.414 16.826 26.468
417 HA ASP 52 HA ASP 52 48.119 14.326 25.256
418 HB2 ASP 52 HB2 ASP 52 46.208 13.432 26.446
419 HB3 ASP 52 HB1 ASP 52 47.096 14.519 27.512
420 H GLY 53 HN GLY 53 46.676 16.942 23.915
421 HA2 GLY 53 HA2 GLY 53 44.404 15.927 22.594
422 HA3 GLY 53 HA1 GLY 53 45.395 17.268 22.027
423 H ALA 54 HN ALA 54 47.840 15.888 21.731
424 HA ALA 54 HA ALA 54 47.578 14.865 19.121
425 HB1 ALA 54 HB1 ALA 54 49.851 14.368 21.055
426 HB2 ALA 54 HB2 ALA 54 49.668 15.833 20.091
427 HB3 ALA 54 HB3 ALA 54 49.920 14.279 19.295
428 H LEU 55 HN LEU 55 47.821 13.249 22.263
429 HA LEU 55 HA LEU 55 48.063 10.607 21.300
430 HB2 LEU 55 HB2 LEU 55 46.918 11.704 23.874
431 HB3 LEU 55 HB1 LEU 55 47.143 9.985 23.570
432 HG LEU 55 HG LEU 55 49.370 12.038 23.395
433 HD11 LEU 55 HD11 LEU 55 48.552 11.929 25.688
434 HD12 LEU 55 HD12 LEU 55 50.099 11.088 25.587
435 HD13 LEU 55 HD13 LEU 55 48.597 10.166 25.653
436 HD21 LEU 55 HD21 LEU 55 50.665 9.743 23.796
437 HD22 LEU 55 HD22 LEU 55 50.152 10.204 22.179
438 HD23 LEU 55 HD23 LEU 55 49.203 9.042 23.103
439 H ARG 56 HN ARG 56 45.240 12.613 22.026
440 HA ARG 56 HA ARG 56 43.329 10.534 21.567
441 HB2 ARG 56 HB2 ARG 56 43.073 13.547 21.641
442 HB3 ARG 56 HB1 ARG 56 41.702 12.452 21.457
443 HG2 ARG 56 HG2 ARG 56 42.290 11.351 23.587
444 HG3 ARG 56 HG1 ARG 56 43.658 12.451 23.775
445 HD2 ARG 56 HD2 ARG 56 42.113 14.373 23.795
446 HD3 ARG 56 HD1 ARG 56 40.746 13.279 23.604
447 HE ARG 56 HE ARG 56 42.234 12.487 25.868
448 HH11 ARG 56 HH11 ARG 56 41.473 13.060 27.930
449 HH12 ARG 56 HH12 ARG 56 40.352 14.368 28.101
450 HH21 ARG 56 HH21 ARG 56 40.230 15.055 24.703
451 HH22 ARG 56 HH22 ARG 56 39.647 15.498 26.274
452 H TYR 57 HN TYR 57 42.092 10.107 19.759
453 HA TYR 57 HA TYR 57 43.215 10.208 17.256
454 HB2 TYR 57 HB2 TYR 57 41.292 8.804 17.738
455 HB3 TYR 57 HB1 TYR 57 40.274 10.225 17.972
456 HD1 TYR 57 HD1 TYR 57 42.365 8.434 15.452
457 HD2 TYR 57 HD2 TYR 57 39.233 11.296 16.126
458 HE1 TYR 57 HE1 TYR 57 41.893 8.491 13.018
459 HE2 TYR 57 HE2 TYR 57 38.762 11.353 13.692
460 HH TYR 57 HH TYR 57 40.845 9.735 11.380
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 12.781 -13.341 66.131
2 H2 GLY 1 HT2 GLY 1 12.477 -14.575 65.002
3 H3 GLY 1 HT3 GLY 1 11.751 -13.050 64.816
4 HA2 GLY 1 HA2 GLY 1 14.585 -13.800 64.430
5 HA3 GLY 1 HA1 GLY 1 13.488 -13.040 63.276
6 H SER 2 HN SER 2 15.458 -12.545 66.129
7 HA SER 2 HA SER 2 14.793 -9.846 66.645
8 HB2 SER 2 HB2 SER 2 16.873 -9.775 67.916
9 HB3 SER 2 HB1 SER 2 16.036 -11.294 68.225
10 HG SER 2 HG SER 2 17.796 -12.211 67.554
11 H ALA 3 HN ALA 3 16.730 -11.346 64.204
12 HA ALA 3 HA ALA 3 18.453 -9.220 63.538
13 HB1 ALA 3 HB1 ALA 3 18.488 -10.318 61.262
14 HB2 ALA 3 HB2 ALA 3 17.276 -11.447 61.867
15 HB3 ALA 3 HB3 ALA 3 18.875 -11.388 62.610
16 H GLY 4 HN GLY 4 15.150 -9.980 62.525
17 HA2 GLY 4 HA2 GLY 4 13.501 -8.505 61.796
18 HA3 GLY 4 HA1 GLY 4 14.692 -7.208 61.804
19 H LEU 5 HN LEU 5 16.069 -9.761 60.209
20 HA LEU 5 HA LEU 5 15.580 -8.528 57.599
21 HB2 LEU 5 HB2 LEU 5 17.446 -10.769 58.421
22 HB3 LEU 5 HB1 LEU 5 17.382 -10.025 56.824
23 HG LEU 5 HG LEU 5 18.015 -8.548 59.401
24 HD11 LEU 5 HD11 LEU 5 19.753 -9.657 57.188
25 HD12 LEU 5 HD12 LEU 5 19.862 -9.980 58.918
26 HD13 LEU 5 HD13 LEU 5 20.310 -8.396 58.287
27 HD21 LEU 5 HD21 LEU 5 18.870 -6.870 57.538
28 HD22 LEU 5 HD22 LEU 5 17.167 -6.893 57.977
29 HD23 LEU 5 HD23 LEU 5 17.710 -7.722 56.517
30 H GLN 6 HN GLN 6 14.211 -10.935 59.454
31 HA GLN 6 HA GLN 6 13.744 -12.995 57.590
32 HB2 GLN 6 HB2 GLN 6 13.341 -13.165 60.051
33 HB3 GLN 6 HB1 GLN 6 11.938 -12.116 59.857
34 HG2 GLN 6 HG2 GLN 6 11.218 -14.450 59.870
35 HG3 GLN 6 HG1 GLN 6 10.956 -13.762 58.270
36 HE21 GLN 6 HE21 GLN 6 11.528 -15.257 56.692
37 HE22 GLN 6 HE22 GLN 6 12.850 -16.318 56.787
38 H GLU 7 HN GLU 7 11.974 -10.019 58.320
39 HA GLU 7 HA GLU 7 9.785 -10.572 56.563
40 HB2 GLU 7 HB2 GLU 7 10.796 -7.970 57.744
41 HB3 GLU 7 HB1 GLU 7 9.288 -8.141 56.850
42 HG2 GLU 7 HG2 GLU 7 8.581 -8.354 59.077
43 HG3 GLU 7 HG1 GLU 7 8.744 -10.032 58.569
44 H LYS 8 HN LYS 8 9.411 -9.880 54.486
45 HA LYS 8 HA LYS 8 11.707 -9.519 52.820
46 HB2 LYS 8 HB2 LYS 8 8.743 -9.427 52.248
47 HB3 LYS 8 HB1 LYS 8 9.973 -9.211 51.002
48 HG2 LYS 8 HG2 LYS 8 10.940 -11.412 51.568
49 HG3 LYS 8 HG1 LYS 8 9.707 -11.637 52.808
50 HD2 LYS 8 HD2 LYS 8 7.945 -11.505 51.092
51 HD3 LYS 8 HD1 LYS 8 9.173 -11.273 49.847
52 HE2 LYS 8 HE2 LYS 8 10.150 -13.470 50.395
53 HE3 LYS 8 HE1 LYS 8 8.929 -13.702 51.645
54 HZ1 LYS 8 HZ1 LYS 8 8.696 -14.432 49.035
55 HZ2 LYS 8 HZ2 LYS 8 7.796 -12.992 49.115
56 HZ3 LYS 8 HZ3 LYS 8 7.419 -14.290 50.142
57 H GLU 9 HN GLU 9 9.544 -7.372 54.445
58 HA GLU 9 HA GLU 9 9.418 -5.074 54.544
59 HB2 GLU 9 HB2 GLU 9 12.143 -5.152 53.231
60 HB3 GLU 9 HB1 GLU 9 11.456 -3.837 54.180
61 HG2 GLU 9 HG2 GLU 9 11.973 -6.622 55.252
62 HG3 GLU 9 HG1 GLU 9 13.054 -5.252 55.486
63 H ARG 10 HN ARG 10 8.111 -6.241 52.350
64 HA ARG 10 HA ARG 10 8.793 -5.176 49.838
65 HB2 ARG 10 HB2 ARG 10 6.129 -6.007 50.998
66 HB3 ARG 10 HB1 ARG 10 6.355 -5.554 49.310
67 HG2 ARG 10 HG2 ARG 10 8.163 -7.331 49.185
68 HG3 ARG 10 HG1 ARG 10 7.635 -7.869 50.780
69 HD2 ARG 10 HD2 ARG 10 5.862 -7.670 48.330
70 HD3 ARG 10 HD1 ARG 10 6.547 -9.164 48.963
71 HE ARG 10 HE ARG 10 4.344 -7.632 50.114
72 HH11 ARG 10 HH11 ARG 10 3.250 -8.672 51.807
73 HH12 ARG 10 HH12 ARG 10 3.929 -10.095 52.525
74 HH21 ARG 10 HH21 ARG 10 6.732 -10.111 50.486
75 HH22 ARG 10 HH22 ARG 10 5.899 -10.909 51.778
76 H GLU 11 HN GLU 11 6.793 -3.875 52.463
77 HA GLU 11 HA GLU 11 5.710 -1.687 51.078
78 HB2 GLU 11 HB2 GLU 11 4.900 -2.430 53.281
79 HB3 GLU 11 HB1 GLU 11 6.414 -1.909 54.018
80 HG2 GLU 11 HG2 GLU 11 4.688 -0.201 54.343
81 HG3 GLU 11 HG1 GLU 11 5.950 0.424 53.286
82 H LEU 12 HN LEU 12 8.712 -1.936 52.992
83 HA LEU 12 HA LEU 12 9.480 0.772 52.658
84 HB2 LEU 12 HB2 LEU 12 11.092 -1.717 53.241
85 HB3 LEU 12 HB1 LEU 12 11.786 -0.098 53.225
86 HG LEU 12 HG LEU 12 9.429 -0.916 54.953
87 HD11 LEU 12 HD11 LEU 12 11.214 -0.715 56.802
88 HD12 LEU 12 HD12 LEU 12 12.398 -0.853 55.502
89 HD13 LEU 12 HD13 LEU 12 11.255 -2.163 55.797
90 HD21 LEU 12 HD21 LEU 12 11.017 1.615 54.583
91 HD22 LEU 12 HD22 LEU 12 10.421 1.236 56.196
92 HD23 LEU 12 HD23 LEU 12 9.289 1.409 54.862
93 H GLU 13 HN GLU 13 10.102 -2.149 50.779
94 HA GLU 13 HA GLU 13 11.968 -1.015 48.973
95 HB2 GLU 13 HB2 GLU 13 10.089 -3.368 48.726
96 HB3 GLU 13 HB1 GLU 13 11.229 -2.918 47.459
97 HG2 GLU 13 HG2 GLU 13 13.110 -3.232 48.946
98 HG3 GLU 13 HG1 GLU 13 12.045 -3.470 50.329
99 H ASP 14 HN ASP 14 8.441 -1.227 48.956
100 HA ASP 14 HA ASP 14 7.991 -0.291 46.342
101 HB2 ASP 14 HB2 ASP 14 6.248 -1.313 47.773
102 HB3 ASP 14 HB1 ASP 14 6.265 0.123 48.794
103 H LEU 15 HN LEU 15 8.340 1.450 49.418
104 HA LEU 15 HA LEU 15 7.787 4.033 48.420
105 HB2 LEU 15 HB2 LEU 15 9.469 3.106 50.755
106 HB3 LEU 15 HB1 LEU 15 9.104 4.799 50.436
107 HG LEU 15 HG LEU 15 6.990 2.651 50.791
108 HD11 LEU 15 HD11 LEU 15 6.666 3.634 53.045
109 HD12 LEU 15 HD12 LEU 15 8.060 4.681 52.776
110 HD13 LEU 15 HD13 LEU 15 8.274 2.933 52.862
111 HD21 LEU 15 HD21 LEU 15 5.685 4.907 51.348
112 HD22 LEU 15 HD22 LEU 15 5.894 4.390 49.679
113 HD23 LEU 15 HD23 LEU 15 6.946 5.632 50.351
114 H LYS 16 HN LYS 16 10.785 2.171 48.656
115 HA LYS 16 HA LYS 16 12.557 4.222 47.866
116 HB2 LYS 16 HB2 LYS 16 12.722 1.214 47.616
117 HB3 LYS 16 HB1 LYS 16 14.049 2.296 47.194
118 HG2 LYS 16 HG2 LYS 16 14.030 3.219 49.482
119 HG3 LYS 16 HG1 LYS 16 12.706 2.134 49.908
120 HD2 LYS 16 HD2 LYS 16 14.140 0.188 49.388
121 HD3 LYS 16 HD1 LYS 16 15.468 1.279 48.993
122 HE2 LYS 16 HE2 LYS 16 14.087 1.133 51.689
123 HE3 LYS 16 HE1 LYS 16 15.646 0.402 51.312
124 HZ1 LYS 16 HZ1 LYS 16 16.357 2.702 50.618
125 HZ2 LYS 16 HZ2 LYS 16 16.121 2.469 52.284
126 HZ3 LYS 16 HZ3 LYS 16 14.946 3.277 51.360
127 H ASP 17 HN ASP 17 10.676 1.865 46.020
128 HA ASP 17 HA ASP 17 11.792 2.362 43.484
129 HB2 ASP 17 HB2 ASP 17 10.311 0.445 44.001
130 HB3 ASP 17 HB1 ASP 17 8.950 1.556 44.146
131 H ALA 18 HN ALA 18 9.061 3.869 45.176
132 HA ALA 18 HA ALA 18 8.211 5.550 43.083
133 HB1 ALA 18 HB1 ALA 18 7.264 6.955 44.972
134 HB2 ALA 18 HB2 ALA 18 8.012 5.809 46.086
135 HB3 ALA 18 HB3 ALA 18 6.768 5.262 44.962
136 H GLU 19 HN GLU 19 10.640 5.998 45.620
137 HA GLU 19 HA GLU 19 11.193 8.722 45.126
138 HB2 GLU 19 HB2 GLU 19 12.886 6.498 46.276
139 HB3 GLU 19 HB1 GLU 19 13.414 8.180 46.211
140 HG2 GLU 19 HG2 GLU 19 11.536 8.885 47.570
141 HG3 GLU 19 HG1 GLU 19 10.837 7.266 47.519
142 H LEU 20 HN LEU 20 12.515 5.746 43.737
143 HA LEU 20 HA LEU 20 14.588 6.939 42.231
144 HB2 LEU 20 HB2 LEU 20 13.011 4.393 41.809
145 HB3 LEU 20 HB1 LEU 20 14.404 4.843 40.831
146 HG LEU 20 HG LEU 20 14.470 4.585 43.853
147 HD11 LEU 20 HD11 LEU 20 15.503 2.628 41.781
148 HD12 LEU 20 HD12 LEU 20 13.982 2.429 42.650
149 HD13 LEU 20 HD13 LEU 20 15.509 2.423 43.531
150 HD21 LEU 20 HD21 LEU 20 16.322 5.907 43.339
151 HD22 LEU 20 HD22 LEU 20 16.509 5.220 41.726
152 HD23 LEU 20 HD23 LEU 20 17.026 4.306 43.141
153 H LYS 21 HN LYS 21 11.184 6.308 41.514
154 HA LYS 21 HA LYS 21 11.226 6.978 38.789
155 HB2 LYS 21 HB2 LYS 21 9.317 5.860 39.837
156 HB3 LYS 21 HB1 LYS 21 8.999 7.284 40.821
157 HG2 LYS 21 HG2 LYS 21 7.472 7.215 38.903
158 HG3 LYS 21 HG1 LYS 21 8.551 8.598 38.760
159 HD2 LYS 21 HD2 LYS 21 9.851 7.553 37.072
160 HD3 LYS 21 HD1 LYS 21 9.198 5.954 37.442
161 HE2 LYS 21 HE2 LYS 21 7.609 8.274 36.302
162 HE3 LYS 21 HE1 LYS 21 8.219 6.909 35.368
163 HZ1 LYS 21 HZ1 LYS 21 6.835 5.955 37.623
164 HZ2 LYS 21 HZ2 LYS 21 6.474 5.720 35.979
165 HZ3 LYS 21 HZ3 LYS 21 5.845 7.065 36.807
166 H ARG 22 HN ARG 22 10.676 8.978 41.672
167 HA ARG 22 HA ARG 22 10.122 11.399 40.348
168 HB2 ARG 22 HB2 ARG 22 9.725 11.030 42.761
169 HB3 ARG 22 HB1 ARG 22 11.468 10.989 43.031
170 HG2 ARG 22 HG2 ARG 22 11.678 13.291 42.216
171 HG3 ARG 22 HG1 ARG 22 9.954 13.338 41.849
172 HD2 ARG 22 HD2 ARG 22 9.437 12.984 44.236
173 HD3 ARG 22 HD1 ARG 22 11.160 12.938 44.602
174 HE ARG 22 HE ARG 22 9.572 15.300 44.007
175 HH11 ARG 22 HH11 ARG 22 10.669 17.275 44.253
176 HH12 ARG 22 HH12 ARG 22 12.394 17.288 44.411
177 HH21 ARG 22 HH21 ARG 22 12.705 13.841 44.189
178 HH22 ARG 22 HH22 ARG 22 13.546 15.344 44.375
179 H LEU 23 HN LEU 23 13.180 9.981 41.461
180 HA LEU 23 HA LEU 23 14.851 12.144 40.796
181 HB2 LEU 23 HB2 LEU 23 15.586 10.287 42.222
182 HB3 LEU 23 HB1 LEU 23 15.472 9.178 40.859
183 HG LEU 23 HG LEU 23 17.211 10.469 39.658
184 HD11 LEU 23 HD11 LEU 23 18.506 12.128 41.239
185 HD12 LEU 23 HD12 LEU 23 16.968 12.228 42.095
186 HD13 LEU 23 HD13 LEU 23 17.065 12.691 40.397
187 HD21 LEU 23 HD21 LEU 23 19.095 9.975 41.316
188 HD22 LEU 23 HD22 LEU 23 18.018 8.627 40.951
189 HD23 LEU 23 HD23 LEU 23 17.835 9.517 42.462
190 H ASN 24 HN ASN 24 13.826 9.306 38.925
191 HA ASN 24 HA ASN 24 15.384 9.784 36.632
192 HB2 ASN 24 HB2 ASN 24 14.102 7.680 37.163
193 HB3 ASN 24 HB1 ASN 24 12.635 8.530 36.683
194 HD21 ASN 24 HD21 ASN 24 12.244 7.281 34.758
195 HD22 ASN 24 HD22 ASN 24 13.283 7.334 33.416
196 H GLU 25 HN GLU 25 12.154 10.917 37.546
197 HA GLU 25 HA GLU 25 11.506 12.177 35.104
198 HB2 GLU 25 HB2 GLU 25 10.611 12.700 37.943
199 HB3 GLU 25 HB1 GLU 25 9.936 13.543 36.548
200 HG2 GLU 25 HG2 GLU 25 9.183 11.458 35.575
201 HG3 GLU 25 HG1 GLU 25 10.008 10.527 36.825
202 H GLU 26 HN GLU 26 13.222 13.312 37.980
203 HA GLU 26 HA GLU 26 13.407 16.036 37.266
204 HB2 GLU 26 HB2 GLU 26 15.170 14.276 38.979
205 HB3 GLU 26 HB1 GLU 26 15.414 16.015 38.810
206 HG2 GLU 26 HG2 GLU 26 13.204 16.472 39.695
207 HG3 GLU 26 HG1 GLU 26 12.810 14.755 39.707
208 H ARG 27 HN ARG 27 15.451 13.248 36.522
209 HA ARG 27 HA ARG 27 17.174 12.957 35.028
210 HB2 ARG 27 HB2 ARG 27 15.851 15.314 33.660
211 HB3 ARG 27 HB1 ARG 27 17.015 14.215 32.924
212 HG2 ARG 27 HG2 ARG 27 15.465 12.318 33.383
213 HG3 ARG 27 HG1 ARG 27 14.284 13.469 34.008
214 HD2 ARG 27 HD2 ARG 27 13.719 13.024 31.705
215 HD3 ARG 27 HD1 ARG 27 14.375 14.656 31.792
216 HE ARG 27 HE ARG 27 16.209 13.939 30.544
217 HH11 ARG 27 HH11 ARG 27 17.316 12.398 29.297
218 HH12 ARG 27 HH12 ARG 27 16.868 10.728 29.396
219 HH21 ARG 27 HH21 ARG 27 14.345 11.268 31.713
220 HH22 ARG 27 HH22 ARG 27 15.186 10.088 30.764
221 H HIS 28 HN HIS 28 17.548 14.747 37.341
222 HA HIS 28 HA HIS 28 19.024 17.046 36.676
223 HB2 HIS 28 HB2 HIS 28 18.168 16.603 38.939
224 HB3 HIS 28 HB1 HIS 28 19.302 15.262 39.105
225 HD2 HIS 28 HD2 HIS 28 19.356 19.193 39.086
226 HE1 HIS 28 HE1 HIS 28 23.226 17.830 40.077
227 HE2 HIS 28 HE2 HIS 28 21.741 19.882 39.891
228 H ASP 29 HN ASP 29 20.084 13.709 37.308
229 HA ASP 29 HA ASP 29 22.851 14.167 37.086
230 HB2 ASP 29 HB2 ASP 29 21.166 11.710 36.594
231 HB3 ASP 29 HB1 ASP 29 22.926 11.695 36.512
232 H HIS 30 HN HIS 30 20.408 13.392 34.639
233 HA HIS 30 HA HIS 30 22.183 12.989 32.476
234 HB2 HIS 30 HB2 HIS 30 19.304 13.900 32.572
235 HB3 HIS 30 HB1 HIS 30 20.163 13.563 31.071
236 HD2 HIS 30 HD2 HIS 30 21.527 10.920 33.275
237 HE1 HIS 30 HE1 HIS 30 17.877 9.278 31.934
238 HE2 HIS 30 HE2 HIS 30 20.092 8.754 33.059
239 H ASP 31 HN ASP 31 20.618 15.888 33.765
240 HA ASP 31 HA ASP 31 21.357 17.674 31.718
241 HB2 ASP 31 HB2 ASP 31 19.699 18.193 33.483
242 HB3 ASP 31 HB1 ASP 31 21.004 18.260 34.666
243 H LYS 32 HN LYS 32 23.017 16.722 34.710
244 HA LYS 32 HA LYS 32 25.193 18.495 34.512
245 HB2 LYS 32 HB2 LYS 32 24.680 17.216 36.552
246 HB3 LYS 32 HB1 LYS 32 25.111 15.723 35.717
247 HG2 LYS 32 HG2 LYS 32 27.398 16.404 35.483
248 HG3 LYS 32 HG1 LYS 32 27.027 18.052 35.982
249 HD2 LYS 32 HD2 LYS 32 28.019 17.038 37.889
250 HD3 LYS 32 HD1 LYS 32 26.289 17.042 38.226
251 HE2 LYS 32 HE2 LYS 32 27.287 14.862 38.790
252 HE3 LYS 32 HE1 LYS 32 26.144 14.687 37.464
253 HZ1 LYS 32 HZ1 LYS 32 27.785 14.272 35.978
254 HZ2 LYS 32 HZ2 LYS 32 28.572 13.695 37.369
255 HZ3 LYS 32 HZ3 LYS 32 28.923 15.247 36.774
256 H ARG 33 HN ARG 33 24.756 15.188 33.287
257 HA ARG 33 HA ARG 33 27.343 14.840 32.234
258 HB2 ARG 33 HB2 ARG 33 25.733 12.995 32.515
259 HB3 ARG 33 HB1 ARG 33 24.728 13.680 31.239
260 HG2 ARG 33 HG2 ARG 33 26.497 13.376 29.604
261 HG3 ARG 33 HG1 ARG 33 27.620 12.852 30.860
262 HD2 ARG 33 HD2 ARG 33 25.033 11.422 30.195
263 HD3 ARG 33 HD1 ARG 33 26.608 10.957 29.558
264 HE ARG 33 HE ARG 33 26.843 11.084 32.343
265 HH11 ARG 33 HH11 ARG 33 26.692 9.182 33.577
266 HH12 ARG 33 HH12 ARG 33 25.891 7.792 32.923
267 HH21 ARG 33 HH21 ARG 33 25.115 9.328 29.912
268 HH22 ARG 33 HH22 ARG 33 24.997 7.876 30.848
269 H GLU 34 HN GLU 34 24.379 16.140 30.772
270 HA GLU 34 HA GLU 34 25.400 16.520 28.173
271 HB2 GLU 34 HB2 GLU 34 22.986 16.620 28.786
272 HB3 GLU 34 HB1 GLU 34 23.280 18.161 29.584
273 HG2 GLU 34 HG2 GLU 34 24.063 17.728 26.696
274 HG3 GLU 34 HG1 GLU 34 22.423 18.201 27.133
275 H ALA 35 HN ALA 35 25.366 18.620 31.026
276 HA ALA 35 HA ALA 35 26.396 20.941 29.809
277 HB1 ALA 35 HB1 ALA 35 26.714 19.960 32.658
278 HB2 ALA 35 HB2 ALA 35 25.405 20.971 32.045
279 HB3 ALA 35 HB3 ALA 35 27.052 21.600 32.100
280 H GLU 36 HN GLU 36 27.997 18.137 31.263
281 HA GLU 36 HA GLU 36 30.638 19.118 31.182
282 HB2 GLU 36 HB2 GLU 36 29.960 17.097 32.438
283 HB3 GLU 36 HB1 GLU 36 29.682 16.255 30.914
284 HG2 GLU 36 HG2 GLU 36 32.041 16.528 30.302
285 HG3 GLU 36 HG1 GLU 36 32.335 17.444 31.780
286 H ARG 37 HN ARG 37 28.714 17.328 28.798
287 HA ARG 37 HA ARG 37 30.742 16.941 26.886
288 HB2 ARG 37 HB2 ARG 37 28.564 15.788 26.806
289 HB3 ARG 37 HB1 ARG 37 27.771 17.319 26.436
290 HG2 ARG 37 HG2 ARG 37 29.000 17.520 24.353
291 HG3 ARG 37 HG1 ARG 37 29.967 16.098 24.742
292 HD2 ARG 37 HD2 ARG 37 26.956 16.061 24.426
293 HD3 ARG 37 HD1 ARG 37 28.084 15.630 23.144
294 HE ARG 37 HE ARG 37 28.747 14.093 25.387
295 HH11 ARG 37 HH11 ARG 37 28.000 11.955 25.551
296 HH12 ARG 37 HH12 ARG 37 26.609 11.458 24.646
297 HH21 ARG 37 HH21 ARG 37 26.118 14.565 23.189
298 HH22 ARG 37 HH22 ARG 37 25.544 12.935 23.308
299 H LYS 38 HN LYS 38 28.418 19.592 27.325
300 HA LYS 38 HA LYS 38 29.115 21.078 25.038
301 HB2 LYS 38 HB2 LYS 38 27.093 21.518 26.387
302 HB3 LYS 38 HB1 LYS 38 28.108 22.085 27.712
303 HG2 LYS 38 HG2 LYS 38 28.991 23.889 26.295
304 HG3 LYS 38 HG1 LYS 38 28.027 23.306 24.936
305 HD2 LYS 38 HD2 LYS 38 25.963 23.708 26.239
306 HD3 LYS 38 HD1 LYS 38 26.935 24.315 27.579
307 HE2 LYS 38 HE2 LYS 38 26.912 25.494 24.785
308 HE3 LYS 38 HE1 LYS 38 26.036 26.155 26.166
309 HZ1 LYS 38 HZ1 LYS 38 28.975 25.860 25.886
310 HZ2 LYS 38 HZ2 LYS 38 28.202 26.303 27.332
311 HZ3 LYS 38 HZ3 LYS 38 28.096 27.307 25.965
312 H ALA 39 HN ALA 39 30.370 21.158 28.358
313 HA ALA 39 HA ALA 39 32.146 23.319 28.029
314 HB1 ALA 39 HB1 ALA 39 33.276 22.445 30.025
315 HB2 ALA 39 HB2 ALA 39 32.409 20.918 29.857
316 HB3 ALA 39 HB3 ALA 39 31.525 22.397 30.230
317 H LEU 40 HN LEU 40 32.529 19.847 27.466
318 HA LEU 40 HA LEU 40 35.297 19.836 26.967
319 HB2 LEU 40 HB2 LEU 40 34.007 17.782 27.332
320 HB3 LEU 40 HB1 LEU 40 33.130 18.051 25.828
321 HG LEU 40 HG LEU 40 35.248 17.869 24.558
322 HD11 LEU 40 HD11 LEU 40 36.388 17.634 27.340
323 HD12 LEU 40 HD12 LEU 40 36.973 18.586 25.976
324 HD13 LEU 40 HD13 LEU 40 37.200 16.840 25.989
325 HD21 LEU 40 HD21 LEU 40 33.812 15.861 25.148
326 HD22 LEU 40 HD22 LEU 40 34.946 15.529 26.458
327 HD23 LEU 40 HD23 LEU 40 35.497 15.488 24.783
328 H GLU 41 HN GLU 41 32.527 20.272 24.782
329 HA GLU 41 HA GLU 41 34.009 20.444 22.384
330 HB2 GLU 41 HB2 GLU 41 31.323 21.602 23.156
331 HB3 GLU 41 HB1 GLU 41 31.976 21.641 21.518
332 HG2 GLU 41 HG2 GLU 41 31.623 19.095 23.117
333 HG3 GLU 41 HG1 GLU 41 30.428 19.700 21.972
334 H ASP 42 HN ASP 42 33.021 22.883 24.748
335 HA ASP 42 HA ASP 42 34.291 25.024 23.208
336 HB2 ASP 42 HB2 ASP 42 32.081 25.221 24.541
337 HB3 ASP 42 HB1 ASP 42 33.103 25.288 25.974
338 H LYS 43 HN LYS 43 35.257 26.612 25.302
339 HA LYS 43 HA LYS 43 37.148 27.016 26.505
340 HB2 LYS 43 HB2 LYS 43 36.829 24.101 27.253
341 HB3 LYS 43 HB1 LYS 43 37.966 25.211 28.009
342 HG2 LYS 43 HG2 LYS 43 36.103 26.683 28.671
343 HG3 LYS 43 HG1 LYS 43 34.958 25.571 27.920
344 HD2 LYS 43 HD2 LYS 43 35.661 23.783 29.453
345 HD3 LYS 43 HD1 LYS 43 36.838 24.869 30.193
346 HE2 LYS 43 HE2 LYS 43 34.806 24.789 31.561
347 HE3 LYS 43 HE1 LYS 43 34.986 26.392 30.848
348 HZ1 LYS 43 HZ1 LYS 43 33.526 24.525 29.208
349 HZ2 LYS 43 HZ2 LYS 43 33.161 26.134 29.613
350 HZ3 LYS 43 HZ3 LYS 43 32.768 24.875 30.684
351 H LEU 44 HN LEU 44 37.126 24.679 24.016
352 HA LEU 44 HA LEU 44 39.878 23.992 23.953
353 HB2 LEU 44 HB2 LEU 44 37.774 24.085 21.780
354 HB3 LEU 44 HB1 LEU 44 39.399 23.451 21.537
355 HG LEU 44 HG LEU 44 37.471 22.428 23.645
356 HD11 LEU 44 HD11 LEU 44 37.001 20.581 22.179
357 HD12 LEU 44 HD12 LEU 44 38.224 21.110 21.024
358 HD13 LEU 44 HD13 LEU 44 36.749 22.053 21.243
359 HD21 LEU 44 HD21 LEU 44 39.193 20.412 23.341
360 HD22 LEU 44 HD22 LEU 44 39.570 21.757 24.410
361 HD23 LEU 44 HD23 LEU 44 40.267 21.700 22.792
362 H ALA 45 HN ALA 45 37.959 26.610 22.582
363 HA ALA 45 HA ALA 45 39.936 27.746 20.927
364 HB1 ALA 45 HB1 ALA 45 38.587 29.845 21.172
365 HB2 ALA 45 HB2 ALA 45 37.606 29.016 22.380
366 HB3 ALA 45 HB3 ALA 45 37.632 28.433 20.716
367 H ASP 46 HN ASP 46 39.192 28.216 24.357
368 HA ASP 46 HA ASP 46 41.266 30.234 24.668
369 HB2 ASP 46 HB2 ASP 46 39.174 30.376 25.965
370 HB3 ASP 46 HB1 ASP 46 39.552 28.837 26.736
371 H LYS 47 HN LYS 47 43.303 29.494 24.531
372 HA LYS 47 HA LYS 47 44.153 26.882 25.192
373 HB2 LYS 47 HB2 LYS 47 45.404 28.398 23.688
374 HB3 LYS 47 HB1 LYS 47 45.792 29.427 25.066
375 HG2 LYS 47 HG2 LYS 47 46.978 27.560 26.147
376 HG3 LYS 47 HG1 LYS 47 46.563 26.505 24.796
377 HD2 LYS 47 HD2 LYS 47 47.814 27.973 23.259
378 HD3 LYS 47 HD1 LYS 47 48.227 29.032 24.607
379 HE2 LYS 47 HE2 LYS 47 49.409 27.175 25.716
380 HE3 LYS 47 HE1 LYS 47 48.991 26.105 24.378
381 HZ1 LYS 47 HZ1 LYS 47 50.705 26.867 23.231
382 HZ2 LYS 47 HZ2 LYS 47 51.178 27.799 24.570
383 HZ3 LYS 47 HZ3 LYS 47 50.165 28.468 23.382
384 H GLN 48 HN GLN 48 44.740 25.967 27.066
385 HA GLN 48 HA GLN 48 45.429 27.623 29.386
386 HB2 GLN 48 HB2 GLN 48 42.946 27.248 29.460
387 HB3 GLN 48 HB1 GLN 48 43.257 25.516 29.516
388 HG2 GLN 48 HG2 GLN 48 42.922 26.353 31.785
389 HG3 GLN 48 HG1 GLN 48 44.597 25.846 31.585
390 HE21 GLN 48 HE21 GLN 48 45.962 27.312 32.602
391 HE22 GLN 48 HE22 GLN 48 45.745 28.996 32.619
392 H GLU 49 HN GLU 49 46.906 26.669 30.698
393 HA GLU 49 HA GLU 49 48.367 24.444 29.769
394 HB2 GLU 49 HB2 GLU 49 48.290 25.822 32.459
395 HB3 GLU 49 HB1 GLU 49 49.425 24.529 32.066
396 HG2 GLU 49 HG2 GLU 49 50.365 25.823 30.246
397 HG3 GLU 49 HG1 GLU 49 49.139 27.074 30.447
398 H HIS 50 HN HIS 50 45.855 24.749 32.244
399 HA HIS 50 HA HIS 50 46.033 22.162 33.325
400 HB2 HIS 50 HB2 HIS 50 44.728 23.923 34.397
401 HB3 HIS 50 HB1 HIS 50 43.618 23.964 33.028
402 HD2 HIS 50 HD2 HIS 50 41.501 22.202 33.285
403 HE1 HIS 50 HE1 HIS 50 43.134 19.758 36.316
404 HE2 HIS 50 HE2 HIS 50 41.070 20.197 34.902
405 H LEU 51 HN LEU 51 44.020 23.407 30.659
406 HA LEU 51 HA LEU 51 42.743 20.943 30.088
407 HB2 LEU 51 HB2 LEU 51 43.251 23.381 28.380
408 HB3 LEU 51 HB1 LEU 51 42.313 22.001 27.822
409 HG LEU 51 HG LEU 51 41.673 23.578 30.339
410 HD11 LEU 51 HD11 LEU 51 41.472 24.867 28.151
411 HD12 LEU 51 HD12 LEU 51 39.989 24.733 29.093
412 HD13 LEU 51 HD13 LEU 51 40.232 23.705 27.681
413 HD21 LEU 51 HD21 LEU 51 40.591 21.535 30.645
414 HD22 LEU 51 HD22 LEU 51 40.415 21.241 28.915
415 HD23 LEU 51 HD23 LEU 51 39.360 22.396 29.727
416 H ASP 52 HN ASP 52 45.716 22.428 28.888
417 HA ASP 52 HA ASP 52 46.275 20.573 26.843
418 HB2 ASP 52 HB2 ASP 52 47.452 22.737 27.114
419 HB3 ASP 52 HB1 ASP 52 48.241 22.109 28.560
420 H GLY 53 HN GLY 53 47.154 20.612 30.280
421 HA2 GLY 53 HA2 GLY 53 47.536 18.799 31.687
422 HA3 GLY 53 HA1 GLY 53 47.372 17.721 30.304
423 H ALA 54 HN ALA 54 49.438 20.108 29.368
424 HA ALA 54 HA ALA 54 51.717 18.412 29.343
425 HB1 ALA 54 HB1 ALA 54 52.869 20.246 28.341
426 HB2 ALA 54 HB2 ALA 54 51.732 21.415 29.012
427 HB3 ALA 54 HB3 ALA 54 51.214 20.313 27.737
428 H LEU 55 HN LEU 55 53.526 18.365 30.620
429 HA LEU 55 HA LEU 55 53.352 19.819 33.195
430 HB2 LEU 55 HB2 LEU 55 54.958 17.342 32.499
431 HB3 LEU 55 HB1 LEU 55 54.780 18.061 34.098
432 HG LEU 55 HG LEU 55 52.516 16.931 32.425
433 HD11 LEU 55 HD11 LEU 55 53.970 15.162 33.263
434 HD12 LEU 55 HD12 LEU 55 52.475 15.172 34.199
435 HD13 LEU 55 HD13 LEU 55 53.946 15.868 34.880
436 HD21 LEU 55 HD21 LEU 55 52.651 18.336 35.093
437 HD22 LEU 55 HD22 LEU 55 51.394 17.133 34.802
438 HD23 LEU 55 HD23 LEU 55 51.498 18.560 33.776
439 H ARG 56 HN ARG 56 55.887 19.818 34.116
440 HA ARG 56 HA ARG 56 57.835 21.036 33.991
441 HB2 ARG 56 HB2 ARG 56 57.842 19.983 31.151
442 HB3 ARG 56 HB1 ARG 56 59.238 20.586 32.037
443 HG2 ARG 56 HG2 ARG 56 57.586 18.228 32.981
444 HG3 ARG 56 HG1 ARG 56 59.002 18.051 31.950
445 HD2 ARG 56 HD2 ARG 56 60.349 19.253 33.694
446 HD3 ARG 56 HD1 ARG 56 58.934 19.241 34.741
447 HE ARG 56 HE ARG 56 60.607 16.959 34.068
448 HH11 ARG 56 HH11 ARG 56 60.148 15.070 35.242
449 HH12 ARG 56 HH12 ARG 56 58.691 14.968 36.173
450 HH21 ARG 56 HH21 ARG 56 57.610 18.150 35.322
451 HH22 ARG 56 HH22 ARG 56 57.254 16.711 36.219
452 H TYR 57 HN TYR 57 55.447 22.490 33.494
453 HA TYR 57 HA TYR 57 56.523 24.874 32.406
454 HB2 TYR 57 HB2 TYR 57 56.239 23.777 30.254
455 HB3 TYR 57 HB1 TYR 57 54.568 23.378 30.644
456 HD1 TYR 57 HD1 TYR 57 56.910 26.248 30.180
457 HD2 TYR 57 HD2 TYR 57 52.823 24.926 30.229
458 HE1 TYR 57 HE1 TYR 57 56.186 28.456 29.313
459 HE2 TYR 57 HE2 TYR 57 52.099 27.135 29.360
460 HH TYR 57 HH TYR 57 54.467 29.731 28.739
Start of MODEL 11
1 H1 GLY 1 HT1 GLY 1 11.827 37.045 74.366
2 H2 GLY 1 HT2 GLY 1 11.110 38.186 73.331
3 H3 GLY 1 HT3 GLY 1 12.669 38.457 73.948
4 HA2 GLY 1 HA2 GLY 1 13.198 37.729 71.865
5 HA3 GLY 1 HA1 GLY 1 13.203 36.212 72.766
6 H SER 2 HN SER 2 10.852 38.362 71.145
7 HA SER 2 HA SER 2 8.931 36.350 70.653
8 HB2 SER 2 HB2 SER 2 7.926 37.951 69.111
9 HB3 SER 2 HB1 SER 2 8.443 38.777 70.578
10 HG SER 2 HG SER 2 9.985 38.579 68.200
11 H ALA 3 HN ALA 3 11.887 37.190 69.064
12 HA ALA 3 HA ALA 3 11.381 36.189 66.481
13 HB1 ALA 3 HB1 ALA 3 13.945 36.344 68.078
14 HB2 ALA 3 HB2 ALA 3 13.354 37.512 66.897
15 HB3 ALA 3 HB3 ALA 3 13.872 35.911 66.370
16 H GLY 4 HN GLY 4 12.494 34.606 69.446
17 HA2 GLY 4 HA2 GLY 4 12.238 32.376 70.063
18 HA3 GLY 4 HA1 GLY 4 11.569 32.037 68.470
19 H LEU 5 HN LEU 5 14.360 33.757 67.993
20 HA LEU 5 HA LEU 5 16.411 33.178 67.133
21 HB2 LEU 5 HB2 LEU 5 16.067 31.418 69.543
22 HB3 LEU 5 HB1 LEU 5 17.455 31.134 68.495
23 HG LEU 5 HG LEU 5 18.090 33.526 68.720
24 HD11 LEU 5 HD11 LEU 5 15.673 33.537 70.541
25 HD12 LEU 5 HD12 LEU 5 15.993 34.585 69.158
26 HD13 LEU 5 HD13 LEU 5 16.936 34.763 70.638
27 HD21 LEU 5 HD21 LEU 5 17.734 31.895 71.248
28 HD22 LEU 5 HD22 LEU 5 18.680 33.383 71.194
29 HD23 LEU 5 HD23 LEU 5 19.166 31.991 70.224
30 H GLN 6 HN GLN 6 14.297 32.261 65.652
31 HA GLN 6 HA GLN 6 14.336 29.488 65.086
32 HB2 GLN 6 HB2 GLN 6 13.473 31.876 63.449
33 HB3 GLN 6 HB1 GLN 6 13.300 30.214 62.893
34 HG2 GLN 6 HG2 GLN 6 11.866 29.661 64.751
35 HG3 GLN 6 HG1 GLN 6 12.168 31.215 65.518
36 HE21 GLN 6 HE21 GLN 6 9.543 30.103 64.604
37 HE22 GLN 6 HE22 GLN 6 8.937 31.229 63.488
38 H GLU 7 HN GLU 7 16.141 32.230 63.771
39 HA GLU 7 HA GLU 7 17.978 32.338 62.398
40 HB2 GLU 7 HB2 GLU 7 18.416 29.595 63.597
41 HB3 GLU 7 HB1 GLU 7 19.616 30.467 62.645
42 HG2 GLU 7 HG2 GLU 7 19.574 32.321 64.253
43 HG3 GLU 7 HG1 GLU 7 18.339 31.488 65.199
44 H LYS 8 HN LYS 8 15.769 31.835 60.955
45 HA LYS 8 HA LYS 8 15.775 29.470 59.404
46 HB2 LYS 8 HB2 LYS 8 14.703 32.244 58.857
47 HB3 LYS 8 HB1 LYS 8 14.495 30.897 57.738
48 HG2 LYS 8 HG2 LYS 8 13.260 29.627 59.360
49 HG3 LYS 8 HG1 LYS 8 13.673 30.749 60.651
50 HD2 LYS 8 HD2 LYS 8 11.420 31.254 60.011
51 HD3 LYS 8 HD1 LYS 8 12.426 32.538 59.345
52 HE2 LYS 8 HE2 LYS 8 12.376 31.513 57.145
53 HE3 LYS 8 HE1 LYS 8 11.546 30.094 57.784
54 HZ1 LYS 8 HZ1 LYS 8 10.385 32.782 58.101
55 HZ2 LYS 8 HZ2 LYS 8 9.605 31.273 58.103
56 HZ3 LYS 8 HZ3 LYS 8 10.183 31.931 56.648
57 H GLU 9 HN GLU 9 17.353 32.600 58.986
58 HA GLU 9 HA GLU 9 18.820 33.367 57.368
59 HB2 GLU 9 HB2 GLU 9 19.931 30.679 58.200
60 HB3 GLU 9 HB1 GLU 9 20.834 31.824 57.212
61 HG2 GLU 9 HG2 GLU 9 20.696 33.516 58.951
62 HG3 GLU 9 HG1 GLU 9 19.663 32.475 59.928
63 H ARG 10 HN ARG 10 20.421 31.951 55.510
64 HA ARG 10 HA ARG 10 18.571 31.644 53.353
65 HB2 ARG 10 HB2 ARG 10 20.525 31.265 51.986
66 HB3 ARG 10 HB1 ARG 10 20.881 32.569 53.117
67 HG2 ARG 10 HG2 ARG 10 21.912 30.828 54.645
68 HG3 ARG 10 HG1 ARG 10 21.754 29.676 53.318
69 HD2 ARG 10 HD2 ARG 10 23.251 32.306 53.162
70 HD3 ARG 10 HD1 ARG 10 24.005 30.729 53.379
71 HE ARG 10 HE ARG 10 22.823 31.774 50.923
72 HH11 ARG 10 HH11 ARG 10 23.211 30.513 49.076
73 HH12 ARG 10 HH12 ARG 10 23.856 28.915 49.246
74 HH21 ARG 10 HH21 ARG 10 24.009 29.053 52.707
75 HH22 ARG 10 HH22 ARG 10 24.308 28.089 51.299
76 H GLU 11 HN GLU 11 19.273 29.584 55.806
77 HA GLU 11 HA GLU 11 19.758 27.116 54.540
78 HB2 GLU 11 HB2 GLU 11 18.410 27.791 57.156
79 HB3 GLU 11 HB1 GLU 11 18.686 26.133 56.627
80 HG2 GLU 11 HG2 GLU 11 21.077 26.480 56.555
81 HG3 GLU 11 HG1 GLU 11 20.889 28.205 56.856
82 H LEU 12 HN LEU 12 16.739 28.827 55.248
83 HA LEU 12 HA LEU 12 14.959 26.761 54.556
84 HB2 LEU 12 HB2 LEU 12 14.226 28.800 55.706
85 HB3 LEU 12 HB1 LEU 12 14.618 29.761 54.282
86 HG LEU 12 HG LEU 12 12.930 28.507 52.969
87 HD11 LEU 12 HD11 LEU 12 11.294 27.119 54.493
88 HD12 LEU 12 HD12 LEU 12 12.692 26.979 55.558
89 HD13 LEU 12 HD13 LEU 12 12.772 26.364 53.906
90 HD21 LEU 12 HD21 LEU 12 11.026 29.583 53.901
91 HD22 LEU 12 HD22 LEU 12 12.395 30.576 54.403
92 HD23 LEU 12 HD23 LEU 12 11.655 29.449 55.542
93 H GLU 13 HN GLU 13 16.455 29.319 52.599
94 HA GLU 13 HA GLU 13 15.153 28.731 50.170
95 HB2 GLU 13 HB2 GLU 13 16.429 30.809 50.579
96 HB3 GLU 13 HB1 GLU 13 17.925 29.876 50.592
97 HG2 GLU 13 HG2 GLU 13 17.538 29.167 48.278
98 HG3 GLU 13 HG1 GLU 13 15.996 30.022 48.256
99 H ASP 14 HN ASP 14 18.175 27.510 51.577
100 HA ASP 14 HA ASP 14 19.026 25.988 49.365
101 HB2 ASP 14 HB2 ASP 14 19.503 25.681 52.331
102 HB3 ASP 14 HB1 ASP 14 20.273 24.651 51.126
103 H LEU 15 HN LEU 15 16.882 25.200 52.073
104 HA LEU 15 HA LEU 15 16.588 22.446 51.506
105 HB2 LEU 15 HB2 LEU 15 14.759 24.416 52.888
106 HB3 LEU 15 HB1 LEU 15 14.435 22.688 52.808
107 HG LEU 15 HG LEU 15 16.985 23.879 53.940
108 HD11 LEU 15 HD11 LEU 15 14.396 23.055 55.265
109 HD12 LEU 15 HD12 LEU 15 15.248 24.592 55.401
110 HD13 LEU 15 HD13 LEU 15 15.917 23.146 56.153
111 HD21 LEU 15 HD21 LEU 15 15.877 21.090 53.661
112 HD22 LEU 15 HD22 LEU 15 16.866 21.468 55.070
113 HD23 LEU 15 HD23 LEU 15 17.531 21.662 53.453
114 H LYS 16 HN LYS 16 14.854 25.311 50.382
115 HA LYS 16 HA LYS 16 12.762 24.010 49.022
116 HB2 LYS 16 HB2 LYS 16 12.764 26.426 49.475
117 HB3 LYS 16 HB1 LYS 16 14.116 26.632 48.364
118 HG2 LYS 16 HG2 LYS 16 12.789 25.925 46.486
119 HG3 LYS 16 HG1 LYS 16 11.477 25.402 47.538
120 HD2 LYS 16 HD2 LYS 16 10.812 27.518 46.635
121 HD3 LYS 16 HD1 LYS 16 11.283 27.819 48.306
122 HE2 LYS 16 HE2 LYS 16 13.438 28.681 47.609
123 HE3 LYS 16 HE1 LYS 16 13.138 28.204 45.939
124 HZ1 LYS 16 HZ1 LYS 16 11.740 30.289 47.512
125 HZ2 LYS 16 HZ2 LYS 16 11.162 29.711 46.022
126 HZ3 LYS 16 HZ3 LYS 16 12.666 30.496 46.106
127 H ASP 17 HN ASP 17 15.985 25.016 47.928
128 HA ASP 17 HA ASP 17 15.724 24.292 45.225
129 HB2 ASP 17 HB2 ASP 17 17.580 25.659 46.141
130 HB3 ASP 17 HB1 ASP 17 18.225 24.220 46.928
131 H ALA 18 HN ALA 18 16.671 22.422 48.062
132 HA ALA 18 HA ALA 18 17.564 20.097 46.772
133 HB1 ALA 18 HB1 ALA 18 16.090 20.115 49.402
134 HB2 ALA 18 HB2 ALA 18 17.743 20.708 49.245
135 HB3 ALA 18 HB3 ALA 18 17.371 19.024 48.876
136 H GLU 19 HN GLU 19 14.295 21.121 47.681
137 HA GLU 19 HA GLU 19 12.968 18.691 47.238
138 HB2 GLU 19 HB2 GLU 19 11.925 20.644 48.324
139 HB3 GLU 19 HB1 GLU 19 11.927 21.498 46.781
140 HG2 GLU 19 HG2 GLU 19 10.467 19.791 45.802
141 HG3 GLU 19 HG1 GLU 19 10.514 18.866 47.300
142 H LEU 20 HN LEU 20 13.691 21.352 44.973
143 HA LEU 20 HA LEU 20 12.379 20.206 42.741
144 HB2 LEU 20 HB2 LEU 20 14.581 22.241 43.022
145 HB3 LEU 20 HB1 LEU 20 14.042 21.704 41.436
146 HG LEU 20 HG LEU 20 12.922 23.814 42.340
147 HD11 LEU 20 HD11 LEU 20 11.947 22.098 40.603
148 HD12 LEU 20 HD12 LEU 20 10.898 23.335 41.283
149 HD13 LEU 20 HD13 LEU 20 10.830 21.690 41.904
150 HD21 LEU 20 HD21 LEU 20 12.738 22.855 44.684
151 HD22 LEU 20 HD22 LEU 20 11.411 21.861 44.091
152 HD23 LEU 20 HD23 LEU 20 11.276 23.619 44.069
153 H LYS 21 HN LYS 21 15.672 19.920 43.986
154 HA LYS 21 HA LYS 21 16.780 18.480 41.831
155 HB2 LYS 21 HB2 LYS 21 17.442 18.552 44.780
156 HB3 LYS 21 HB1 LYS 21 18.396 17.644 43.610
157 HG2 LYS 21 HG2 LYS 21 17.791 20.542 43.056
158 HG3 LYS 21 HG1 LYS 21 19.047 20.149 44.224
159 HD2 LYS 21 HD2 LYS 21 19.068 18.792 41.531
160 HD3 LYS 21 HD1 LYS 21 19.670 20.441 41.673
161 HE2 LYS 21 HE2 LYS 21 20.638 18.139 43.399
162 HE3 LYS 21 HE1 LYS 21 21.457 18.695 41.942
163 HZ1 LYS 21 HZ1 LYS 21 20.860 20.885 43.626
164 HZ2 LYS 21 HZ2 LYS 21 22.371 20.347 43.066
165 HZ3 LYS 21 HZ3 LYS 21 21.717 19.708 44.498
166 H ARG 22 HN ARG 22 15.041 17.436 44.726
167 HA ARG 22 HA ARG 22 15.416 14.661 44.438
168 HB2 ARG 22 HB2 ARG 22 14.551 15.707 46.494
169 HB3 ARG 22 HB1 ARG 22 13.066 16.138 45.646
170 HG2 ARG 22 HG2 ARG 22 12.537 13.792 45.273
171 HG3 ARG 22 HG1 ARG 22 14.084 13.300 45.965
172 HD2 ARG 22 HD2 ARG 22 12.320 13.041 47.636
173 HD3 ARG 22 HD1 ARG 22 13.415 14.331 48.125
174 HE ARG 22 HE ARG 22 11.229 15.381 46.624
175 HH11 ARG 22 HH11 ARG 22 9.625 16.509 47.772
176 HH12 ARG 22 HH12 ARG 22 9.490 16.306 49.486
177 HH21 ARG 22 HH21 ARG 22 12.129 14.066 49.696
178 HH22 ARG 22 HH22 ARG 22 10.907 14.924 50.576
179 H LEU 23 HN LEU 23 12.883 16.823 43.215
180 HA LEU 23 HA LEU 23 11.250 14.839 42.051
181 HB2 LEU 23 HB2 LEU 23 11.623 17.766 41.405
182 HB3 LEU 23 HB1 LEU 23 10.389 16.758 40.655
183 HG LEU 23 HG LEU 23 10.680 17.125 43.652
184 HD11 LEU 23 HD11 LEU 23 10.105 19.266 42.718
185 HD12 LEU 23 HD12 LEU 23 8.624 18.573 43.378
186 HD13 LEU 23 HD13 LEU 23 8.915 18.538 41.639
187 HD21 LEU 23 HD21 LEU 23 8.141 16.366 43.359
188 HD22 LEU 23 HD22 LEU 23 9.427 15.169 43.413
189 HD23 LEU 23 HD23 LEU 23 8.750 15.658 41.862
190 H ASN 24 HN ASN 24 13.992 16.678 40.771
191 HA ASN 24 HA ASN 24 13.750 15.909 38.076
192 HB2 ASN 24 HB2 ASN 24 16.152 16.678 39.734
193 HB3 ASN 24 HB1 ASN 24 16.229 16.402 37.994
194 HD21 ASN 24 HD21 ASN 24 14.213 17.663 36.838
195 HD22 ASN 24 HD22 ASN 24 14.074 19.286 37.315
196 H GLU 25 HN GLU 25 15.391 14.347 40.801
197 HA GLU 25 HA GLU 25 16.312 12.255 41.035
198 HB2 GLU 25 HB2 GLU 25 14.310 11.617 38.853
199 HB3 GLU 25 HB1 GLU 25 15.141 10.427 39.852
200 HG2 GLU 25 HG2 GLU 25 14.141 11.446 41.876
201 HG3 GLU 25 HG1 GLU 25 13.288 12.603 40.858
202 H GLU 26 HN GLU 26 15.917 10.751 38.154
203 HA GLU 26 HA GLU 26 18.674 10.725 37.510
204 HB2 GLU 26 HB2 GLU 26 16.228 9.821 35.987
205 HB3 GLU 26 HB1 GLU 26 17.876 9.562 35.414
206 HG2 GLU 26 HG2 GLU 26 18.423 8.276 37.398
207 HG3 GLU 26 HG1 GLU 26 16.855 8.644 38.116
208 H ARG 27 HN ARG 27 16.037 12.761 36.500
209 HA ARG 27 HA ARG 27 17.015 13.697 34.049
210 HB2 ARG 27 HB2 ARG 27 14.747 14.175 34.882
211 HB3 ARG 27 HB1 ARG 27 15.429 15.222 36.127
212 HG2 ARG 27 HG2 ARG 27 16.338 16.723 34.451
213 HG3 ARG 27 HG1 ARG 27 15.851 15.630 33.154
214 HD2 ARG 27 HD2 ARG 27 13.917 16.932 35.088
215 HD3 ARG 27 HD1 ARG 27 14.282 17.565 33.486
216 HE ARG 27 HE ARG 27 13.532 14.886 33.172
217 HH11 ARG 27 HH11 ARG 27 11.403 14.377 32.564
218 HH12 ARG 27 HH12 ARG 27 10.131 15.518 32.843
219 HH21 ARG 27 HH21 ARG 27 12.216 17.893 34.270
220 HH22 ARG 27 HH22 ARG 27 10.592 17.508 33.810
221 H HIS 28 HN HIS 28 17.642 14.864 37.355
222 HA HIS 28 HA HIS 28 19.181 17.109 36.649
223 HB2 HIS 28 HB2 HIS 28 18.353 16.740 38.931
224 HB3 HIS 28 HB1 HIS 28 19.430 15.353 39.104
225 HD2 HIS 28 HD2 HIS 28 19.665 19.280 38.977
226 HE1 HIS 28 HE1 HIS 28 23.474 17.761 39.981
227 HE2 HIS 28 HE2 HIS 28 22.091 19.877 39.735
228 H ASP 29 HN ASP 29 20.160 13.754 37.328
229 HA ASP 29 HA ASP 29 22.935 14.132 37.038
230 HB2 ASP 29 HB2 ASP 29 21.904 12.101 38.011
231 HB3 ASP 29 HB1 ASP 29 21.314 11.653 36.411
232 H HIS 30 HN HIS 30 20.429 13.272 34.676
233 HA HIS 30 HA HIS 30 22.116 12.850 32.467
234 HB2 HIS 30 HB2 HIS 30 19.771 12.183 32.435
235 HB3 HIS 30 HB1 HIS 30 19.265 13.869 32.548
236 HD2 HIS 30 HD2 HIS 30 18.982 15.093 30.081
237 HE1 HIS 30 HE1 HIS 30 21.163 12.299 27.787
238 HE2 HIS 30 HE2 HIS 30 19.741 14.400 27.682
239 H ASP 31 HN ASP 31 20.465 15.796 33.593
240 HA ASP 31 HA ASP 31 21.321 17.493 31.515
241 HB2 ASP 31 HB2 ASP 31 20.537 18.042 34.379
242 HB3 ASP 31 HB1 ASP 31 20.914 19.322 33.227
243 H LYS 32 HN LYS 32 22.804 16.620 34.605
244 HA LYS 32 HA LYS 32 24.922 18.470 34.571
245 HB2 LYS 32 HB2 LYS 32 24.314 17.130 36.553
246 HB3 LYS 32 HB1 LYS 32 24.874 15.672 35.734
247 HG2 LYS 32 HG2 LYS 32 27.149 16.606 35.595
248 HG3 LYS 32 HG1 LYS 32 26.594 18.089 36.374
249 HD2 LYS 32 HD2 LYS 32 25.964 16.803 38.381
250 HD3 LYS 32 HD1 LYS 32 26.511 15.316 37.602
251 HE2 LYS 32 HE2 LYS 32 28.793 16.234 37.437
252 HE3 LYS 32 HE1 LYS 32 28.251 17.726 38.205
253 HZ1 LYS 32 HZ1 LYS 32 27.453 15.517 39.761
254 HZ2 LYS 32 HZ2 LYS 32 28.491 16.795 40.181
255 HZ3 LYS 32 HZ3 LYS 32 29.114 15.397 39.445
256 H ARG 33 HN ARG 33 24.667 15.181 33.259
257 HA ARG 33 HA ARG 33 27.332 14.984 32.336
258 HB2 ARG 33 HB2 ARG 33 24.784 13.628 31.440
259 HB3 ARG 33 HB1 ARG 33 26.363 13.233 30.767
260 HG2 ARG 33 HG2 ARG 33 25.960 13.195 33.757
261 HG3 ARG 33 HG1 ARG 33 25.433 11.825 32.784
262 HD2 ARG 33 HD2 ARG 33 27.722 11.627 31.851
263 HD3 ARG 33 HD1 ARG 33 28.246 12.962 32.868
264 HE ARG 33 HE ARG 33 27.060 11.025 34.521
265 HH11 ARG 33 HH11 ARG 33 28.392 9.595 35.679
266 HH12 ARG 33 HH12 ARG 33 30.021 9.322 35.157
267 HH21 ARG 33 HH21 ARG 33 29.793 11.476 32.448
268 HH22 ARG 33 HH22 ARG 33 30.814 10.387 33.326
269 H GLU 34 HN GLU 34 24.379 16.216 30.847
270 HA GLU 34 HA GLU 34 25.385 16.595 28.241
271 HB2 GLU 34 HB2 GLU 34 22.982 16.704 28.816
272 HB3 GLU 34 HB1 GLU 34 23.269 18.202 29.698
273 HG2 GLU 34 HG2 GLU 34 24.038 19.296 27.643
274 HG3 GLU 34 HG1 GLU 34 23.839 17.791 26.747
275 H ALA 35 HN ALA 35 25.360 18.711 31.089
276 HA ALA 35 HA ALA 35 26.418 21.011 29.857
277 HB1 ALA 35 HB1 ALA 35 26.983 21.745 32.108
278 HB2 ALA 35 HB2 ALA 35 26.808 20.099 32.717
279 HB3 ALA 35 HB3 ALA 35 25.398 20.974 32.121
280 H GLU 36 HN GLU 36 27.985 18.210 31.346
281 HA GLU 36 HA GLU 36 30.635 19.166 31.275
282 HB2 GLU 36 HB2 GLU 36 29.929 17.167 32.547
283 HB3 GLU 36 HB1 GLU 36 29.655 16.311 31.032
284 HG2 GLU 36 HG2 GLU 36 32.021 16.553 30.434
285 HG3 GLU 36 HG1 GLU 36 32.312 17.483 31.903
286 H ARG 37 HN ARG 37 28.711 17.371 28.895
287 HA ARG 37 HA ARG 37 30.767 16.967 27.005
288 HB2 ARG 37 HB2 ARG 37 27.767 17.178 26.700
289 HB3 ARG 37 HB1 ARG 37 28.848 16.749 25.375
290 HG2 ARG 37 HG2 ARG 37 29.693 14.833 26.671
291 HG3 ARG 37 HG1 ARG 37 28.629 15.265 28.011
292 HD2 ARG 37 HD2 ARG 37 26.664 14.958 26.547
293 HD3 ARG 37 HD1 ARG 37 27.728 14.515 25.215
294 HE ARG 37 HE ARG 37 27.015 12.858 27.493
295 HH11 ARG 37 HH11 ARG 37 27.783 10.722 27.404
296 HH12 ARG 37 HH12 ARG 37 28.995 10.291 26.243
297 HH21 ARG 37 HH21 ARG 37 29.217 13.479 24.897
298 HH22 ARG 37 HH22 ARG 37 29.806 11.851 24.823
299 H LYS 38 HN LYS 38 28.488 19.628 27.497
300 HA LYS 38 HA LYS 38 29.060 21.079 25.153
301 HB2 LYS 38 HB2 LYS 38 27.141 21.533 26.651
302 HB3 LYS 38 HB1 LYS 38 28.252 22.158 27.867
303 HG2 LYS 38 HG2 LYS 38 29.043 23.866 26.221
304 HG3 LYS 38 HG1 LYS 38 27.843 23.276 25.074
305 HD2 LYS 38 HD2 LYS 38 27.090 24.239 27.841
306 HD3 LYS 38 HD1 LYS 38 27.192 25.333 26.464
307 HE2 LYS 38 HE2 LYS 38 25.569 23.816 25.251
308 HE3 LYS 38 HE1 LYS 38 25.356 22.939 26.765
309 HZ1 LYS 38 HZ1 LYS 38 24.821 25.820 26.322
310 HZ2 LYS 38 HZ2 LYS 38 24.703 25.029 27.820
311 HZ3 LYS 38 HZ3 LYS 38 23.662 24.605 26.546
312 H ALA 39 HN ALA 39 30.528 21.161 28.385
313 HA ALA 39 HA ALA 39 32.302 23.300 27.933
314 HB1 ALA 39 HB1 ALA 39 31.731 22.204 30.154
315 HB2 ALA 39 HB2 ALA 39 33.435 22.582 29.903
316 HB3 ALA 39 HB3 ALA 39 32.863 20.926 29.712
317 H LEU 40 HN LEU 40 32.615 19.822 27.359
318 HA LEU 40 HA LEU 40 35.345 19.786 26.678
319 HB2 LEU 40 HB2 LEU 40 34.065 17.743 27.136
320 HB3 LEU 40 HB1 LEU 40 33.093 18.014 25.694
321 HG LEU 40 HG LEU 40 35.119 17.811 24.285
322 HD11 LEU 40 HD11 LEU 40 37.154 16.769 25.590
323 HD12 LEU 40 HD12 LEU 40 36.440 17.575 26.985
324 HD13 LEU 40 HD13 LEU 40 36.941 18.517 25.581
325 HD21 LEU 40 HD21 LEU 40 35.464 15.399 24.623
326 HD22 LEU 40 HD22 LEU 40 33.761 15.809 24.826
327 HD23 LEU 40 HD23 LEU 40 34.772 15.516 26.241
328 H GLU 41 HN GLU 41 32.439 20.234 24.682
329 HA GLU 41 HA GLU 41 33.751 20.380 22.187
330 HB2 GLU 41 HB2 GLU 41 31.131 21.532 23.159
331 HB3 GLU 41 HB1 GLU 41 31.669 21.635 21.483
332 HG2 GLU 41 HG2 GLU 41 31.756 19.219 21.299
333 HG3 GLU 41 HG1 GLU 41 31.413 19.035 23.019
334 H ASP 42 HN ASP 42 32.962 22.845 24.601
335 HA ASP 42 HA ASP 42 33.680 25.114 23.098
336 HB2 ASP 42 HB2 ASP 42 32.439 25.201 25.239
337 HB3 ASP 42 HB1 ASP 42 33.903 24.710 26.088
338 H LYS 43 HN LYS 43 35.590 23.021 25.235
339 HA LYS 43 HA LYS 43 37.991 24.490 25.148
340 HB2 LYS 43 HB2 LYS 43 37.531 22.651 26.741
341 HB3 LYS 43 HB1 LYS 43 37.643 21.492 25.421
342 HG2 LYS 43 HG2 LYS 43 39.972 22.221 24.980
343 HG3 LYS 43 HG1 LYS 43 39.865 23.356 26.324
344 HD2 LYS 43 HD2 LYS 43 39.328 20.414 26.730
345 HD3 LYS 43 HD1 LYS 43 40.972 21.043 26.750
346 HE2 LYS 43 HE2 LYS 43 38.708 21.970 28.552
347 HE3 LYS 43 HE1 LYS 43 40.054 20.944 29.030
348 HZ1 LYS 43 HZ1 LYS 43 41.220 23.103 27.822
349 HZ2 LYS 43 HZ2 LYS 43 41.138 22.801 29.493
350 HZ3 LYS 43 HZ3 LYS 43 39.965 23.775 28.745
351 H LEU 44 HN LEU 44 36.759 21.883 23.076
352 HA LEU 44 HA LEU 44 39.048 21.616 21.445
353 HB2 LEU 44 HB2 LEU 44 36.124 21.071 20.901
354 HB3 LEU 44 HB1 LEU 44 37.415 20.640 19.783
355 HG LEU 44 HG LEU 44 37.303 19.718 22.671
356 HD11 LEU 44 HD11 LEU 44 36.353 18.408 20.114
357 HD12 LEU 44 HD12 LEU 44 35.424 18.724 21.580
358 HD13 LEU 44 HD13 LEU 44 36.687 17.493 21.586
359 HD21 LEU 44 HD21 LEU 44 39.537 19.448 22.046
360 HD22 LEU 44 HD22 LEU 44 39.149 19.214 20.343
361 HD23 LEU 44 HD23 LEU 44 38.874 17.912 21.499
362 H ALA 45 HN ALA 45 36.205 23.708 21.220
363 HA ALA 45 HA ALA 45 36.708 24.774 18.662
364 HB1 ALA 45 HB1 ALA 45 35.213 26.582 19.315
365 HB2 ALA 45 HB2 ALA 45 35.387 26.145 21.014
366 HB3 ALA 45 HB3 ALA 45 34.574 25.047 19.901
367 H ASP 46 HN ASP 46 37.813 25.756 21.878
368 HA ASP 46 HA ASP 46 39.063 28.171 21.132
369 HB2 ASP 46 HB2 ASP 46 39.599 26.240 23.391
370 HB3 ASP 46 HB1 ASP 46 40.431 27.785 23.227
371 H LYS 47 HN LYS 47 40.222 24.834 21.194
372 HA LYS 47 HA LYS 47 42.943 25.345 20.687
373 HB2 LYS 47 HB2 LYS 47 41.183 22.972 20.039
374 HB3 LYS 47 HB1 LYS 47 42.924 22.976 19.780
375 HG2 LYS 47 HG2 LYS 47 41.808 23.726 22.480
376 HG3 LYS 47 HG1 LYS 47 41.965 22.028 22.034
377 HD2 LYS 47 HD2 LYS 47 44.382 22.422 21.530
378 HD3 LYS 47 HD1 LYS 47 44.205 24.075 22.113
379 HE2 LYS 47 HE2 LYS 47 45.078 22.660 23.907
380 HE3 LYS 47 HE1 LYS 47 43.449 23.201 24.310
381 HZ1 LYS 47 HZ1 LYS 47 43.932 20.770 24.654
382 HZ2 LYS 47 HZ2 LYS 47 43.978 20.619 22.961
383 HZ3 LYS 47 HZ3 LYS 47 42.552 21.125 23.735
384 H GLN 48 HN GLN 48 40.189 24.919 18.519
385 HA GLN 48 HA GLN 48 39.916 25.308 16.274
386 HB2 GLN 48 HB2 GLN 48 42.272 27.157 16.728
387 HB3 GLN 48 HB1 GLN 48 41.228 27.166 15.310
388 HG2 GLN 48 HG2 GLN 48 39.278 27.646 16.749
389 HG3 GLN 48 HG1 GLN 48 40.332 27.651 18.164
390 HE21 GLN 48 HE21 GLN 48 38.825 29.752 16.108
391 HE22 GLN 48 HE22 GLN 48 39.917 31.049 16.173
392 H GLU 49 HN GLU 49 42.222 23.449 17.411
393 HA GLU 49 HA GLU 49 44.142 23.258 15.334
394 HB2 GLU 49 HB2 GLU 49 43.204 21.287 17.420
395 HB3 GLU 49 HB1 GLU 49 44.508 20.936 16.284
396 HG2 GLU 49 HG2 GLU 49 45.818 22.787 17.102
397 HG3 GLU 49 HG1 GLU 49 44.480 23.366 18.090
398 H HIS 50 HN HIS 50 41.019 21.678 15.865
399 HA HIS 50 HA HIS 50 41.201 19.805 13.763
400 HB2 HIS 50 HB2 HIS 50 38.817 19.543 14.008
401 HB3 HIS 50 HB1 HIS 50 39.511 19.767 15.613
402 HD2 HIS 50 HD2 HIS 50 36.944 21.484 13.282
403 HE1 HIS 50 HE1 HIS 50 37.555 24.079 16.557
404 HE2 HIS 50 HE2 HIS 50 36.114 23.631 14.513
405 H LEU 51 HN LEU 51 40.426 23.211 13.787
406 HA LEU 51 HA LEU 51 39.138 23.338 11.260
407 HB2 LEU 51 HB2 LEU 51 40.660 25.408 12.850
408 HB3 LEU 51 HB1 LEU 51 39.858 25.772 11.326
409 HG LEU 51 HG LEU 51 38.448 24.556 13.726
410 HD11 LEU 51 HD11 LEU 51 38.801 27.426 12.850
411 HD12 LEU 51 HD12 LEU 51 39.101 26.722 14.439
412 HD13 LEU 51 HD13 LEU 51 37.447 26.921 13.862
413 HD21 LEU 51 HD21 LEU 51 37.059 24.075 11.914
414 HD22 LEU 51 HD22 LEU 51 37.590 25.478 10.988
415 HD23 LEU 51 HD23 LEU 51 36.471 25.679 12.333
416 H ASP 52 HN ASP 52 42.520 23.533 12.249
417 HA ASP 52 HA ASP 52 44.471 23.540 11.039
418 HB2 ASP 52 HB2 ASP 52 43.340 21.298 10.451
419 HB3 ASP 52 HB1 ASP 52 42.934 22.049 8.911
420 H GLY 53 HN GLY 53 44.803 23.507 8.164
421 HA2 GLY 53 HA2 GLY 53 44.627 24.857 6.279
422 HA3 GLY 53 HA1 GLY 53 43.368 25.784 7.090
423 H ALA 54 HN ALA 54 45.866 25.497 9.228
424 HA ALA 54 HA ALA 54 46.569 28.237 9.115
425 HB1 ALA 54 HB1 ALA 54 48.448 27.478 10.682
426 HB2 ALA 54 HB2 ALA 54 47.771 25.858 10.527
427 HB3 ALA 54 HB3 ALA 54 46.798 27.158 11.213
428 H LEU 55 HN LEU 55 48.329 29.285 8.275
429 HA LEU 55 HA LEU 55 49.547 28.234 5.954
430 HB2 LEU 55 HB2 LEU 55 50.252 30.605 7.693
431 HB3 LEU 55 HB1 LEU 55 51.056 30.249 6.168
432 HG LEU 55 HG LEU 55 48.058 30.617 6.453
433 HD11 LEU 55 HD11 LEU 55 48.394 32.857 5.529
434 HD12 LEU 55 HD12 LEU 55 50.135 32.590 5.455
435 HD13 LEU 55 HD13 LEU 55 49.323 32.683 7.017
436 HD21 LEU 55 HD21 LEU 55 49.936 30.125 4.146
437 HD22 LEU 55 HD22 LEU 55 48.507 31.121 3.874
438 HD23 LEU 55 HD23 LEU 55 48.326 29.465 4.439
439 H ARG 56 HN ARG 56 50.670 28.525 9.298
440 HA ARG 56 HA ARG 56 53.344 27.760 8.874
441 HB2 ARG 56 HB2 ARG 56 52.559 28.749 10.981
442 HB3 ARG 56 HB1 ARG 56 51.605 27.303 11.311
443 HG2 ARG 56 HG2 ARG 56 53.585 25.937 11.459
444 HG3 ARG 56 HG1 ARG 56 54.602 27.256 10.877
445 HD2 ARG 56 HD2 ARG 56 54.797 27.058 13.312
446 HD3 ARG 56 HD1 ARG 56 54.019 28.579 12.886
447 HE ARG 56 HE ARG 56 52.078 26.534 13.343
448 HH11 ARG 56 HH11 ARG 56 50.885 26.663 15.276
449 HH12 ARG 56 HH12 ARG 56 51.470 27.637 16.585
450 HH21 ARG 56 HH21 ARG 56 54.312 28.673 14.894
451 HH22 ARG 56 HH22 ARG 56 53.409 28.774 16.368
452 H TYR 57 HN TYR 57 50.458 25.814 9.601
453 HA TYR 57 HA TYR 57 51.970 23.329 9.428
454 HB2 TYR 57 HB2 TYR 57 49.051 23.961 9.893
455 HB3 TYR 57 HB1 TYR 57 49.656 22.313 9.718
456 HD1 TYR 57 HD1 TYR 57 49.633 25.320 11.840
457 HD2 TYR 57 HD2 TYR 57 51.138 21.322 11.394
458 HE1 TYR 57 HE1 TYR 57 50.332 25.317 14.218
459 HE2 TYR 57 HE2 TYR 57 51.839 21.320 13.773
460 HH TYR 57 HH TYR 57 50.729 23.284 16.015
Start of MODEL 12
1 H1 GLY 1 HT1 GLY 1 -14.334 0.741 49.986
2 H2 GLY 1 HT2 GLY 1 -12.991 1.387 49.170
3 H3 GLY 1 HT3 GLY 1 -12.957 -0.216 49.735
4 HA2 GLY 1 HA2 GLY 1 -13.312 -0.209 47.364
5 HA3 GLY 1 HA1 GLY 1 -14.750 -0.800 48.198
6 H SER 2 HN SER 2 -14.285 2.482 48.765
7 HA SER 2 HA SER 2 -16.661 3.276 47.479
8 HB2 SER 2 HB2 SER 2 -15.699 4.527 49.355
9 HB3 SER 2 HB1 SER 2 -14.307 4.962 48.366
10 HG SER 2 HG SER 2 -16.747 5.502 47.217
11 H ALA 3 HN ALA 3 -13.259 3.591 46.511
12 HA ALA 3 HA ALA 3 -13.689 5.074 44.155
13 HB1 ALA 3 HB1 ALA 3 -11.454 4.585 43.610
14 HB2 ALA 3 HB2 ALA 3 -11.493 3.031 44.444
15 HB3 ALA 3 HB3 ALA 3 -11.476 4.531 45.372
16 H GLY 4 HN GLY 4 -13.670 1.592 44.778
17 HA2 GLY 4 HA2 GLY 4 -14.793 -0.080 43.610
18 HA3 GLY 4 HA1 GLY 4 -15.274 1.114 42.409
19 H LEU 5 HN LEU 5 -12.029 1.525 42.859
20 HA LEU 5 HA LEU 5 -11.380 0.336 40.325
21 HB2 LEU 5 HB2 LEU 5 -9.849 1.843 42.431
22 HB3 LEU 5 HB1 LEU 5 -8.981 1.033 41.132
23 HG LEU 5 HG LEU 5 -9.550 3.466 40.695
24 HD11 LEU 5 HD11 LEU 5 -9.812 3.124 38.417
25 HD12 LEU 5 HD12 LEU 5 -10.990 1.833 38.623
26 HD13 LEU 5 HD13 LEU 5 -9.279 1.519 38.906
27 HD21 LEU 5 HD21 LEU 5 -12.366 2.463 40.250
28 HD22 LEU 5 HD22 LEU 5 -11.795 4.131 40.299
29 HD23 LEU 5 HD23 LEU 5 -11.866 3.180 41.782
30 H GLN 6 HN GLN 6 -10.167 -1.463 39.894
31 HA GLN 6 HA GLN 6 -10.300 -3.629 41.698
32 HB2 GLN 6 HB2 GLN 6 -10.187 -3.864 39.227
33 HB3 GLN 6 HB1 GLN 6 -8.506 -3.332 39.278
34 HG2 GLN 6 HG2 GLN 6 -7.912 -5.234 40.696
35 HG3 GLN 6 HG1 GLN 6 -9.597 -5.745 40.750
36 HE21 GLN 6 HE21 GLN 6 -8.008 -7.689 39.784
37 HE22 GLN 6 HE22 GLN 6 -8.078 -7.793 38.092
38 H GLU 7 HN GLU 7 -7.683 -1.409 40.851
39 HA GLU 7 HA GLU 7 -5.614 -2.719 42.264
40 HB2 GLU 7 HB2 GLU 7 -5.999 0.182 41.490
41 HB3 GLU 7 HB1 GLU 7 -4.537 -0.415 42.269
42 HG2 GLU 7 HG2 GLU 7 -5.647 -1.416 39.623
43 HG3 GLU 7 HG1 GLU 7 -4.283 -0.321 39.808
44 H LYS 8 HN LYS 8 -7.985 -0.294 43.249
45 HA LYS 8 HA LYS 8 -8.610 0.491 45.310
46 HB2 LYS 8 HB2 LYS 8 -7.410 -2.129 46.247
47 HB3 LYS 8 HB1 LYS 8 -8.477 -1.089 47.188
48 HG2 LYS 8 HG2 LYS 8 -10.248 -1.361 45.491
49 HG3 LYS 8 HG1 LYS 8 -9.183 -2.417 44.559
50 HD2 LYS 8 HD2 LYS 8 -9.067 -3.985 46.461
51 HD3 LYS 8 HD1 LYS 8 -10.139 -2.937 47.388
52 HE2 LYS 8 HE2 LYS 8 -11.905 -3.229 45.693
53 HE3 LYS 8 HE1 LYS 8 -10.835 -4.273 44.757
54 HZ1 LYS 8 HZ1 LYS 8 -12.044 -4.777 47.402
55 HZ2 LYS 8 HZ2 LYS 8 -10.673 -5.635 46.883
56 HZ3 LYS 8 HZ3 LYS 8 -12.124 -5.731 46.003
57 H GLU 9 HN GLU 9 -6.435 -0.981 47.384
58 HA GLU 9 HA GLU 9 -5.024 1.521 47.808
59 HB2 GLU 9 HB2 GLU 9 -4.809 -1.152 49.219
60 HB3 GLU 9 HB1 GLU 9 -3.979 0.321 49.712
61 HG2 GLU 9 HG2 GLU 9 -5.887 0.386 51.062
62 HG3 GLU 9 HG1 GLU 9 -6.383 1.383 49.698
63 H ARG 10 HN ARG 10 -4.527 -1.205 45.884
64 HA ARG 10 HA ARG 10 -1.731 -1.558 46.084
65 HB2 ARG 10 HB2 ARG 10 -3.569 -1.981 43.714
66 HB3 ARG 10 HB1 ARG 10 -1.916 -2.569 43.819
67 HG2 ARG 10 HG2 ARG 10 -4.047 -3.312 45.839
68 HG3 ARG 10 HG1 ARG 10 -3.735 -4.263 44.392
69 HD2 ARG 10 HD2 ARG 10 -1.349 -4.502 45.133
70 HD3 ARG 10 HD1 ARG 10 -1.770 -3.691 46.634
71 HE ARG 10 HE ARG 10 -2.506 -6.398 45.871
72 HH11 ARG 10 HH11 ARG 10 -3.491 -7.610 47.519
73 HH12 ARG 10 HH12 ARG 10 -4.045 -6.819 48.955
74 HH21 ARG 10 HH21 ARG 10 -3.035 -3.664 47.929
75 HH22 ARG 10 HH22 ARG 10 -3.787 -4.586 49.189
76 H GLU 11 HN GLU 11 -3.699 0.647 44.164
77 HA GLU 11 HA GLU 11 -1.711 1.623 42.454
78 HB2 GLU 11 HB2 GLU 11 -3.149 3.486 42.035
79 HB3 GLU 11 HB1 GLU 11 -4.189 2.093 42.309
80 HG2 GLU 11 HG2 GLU 11 -4.398 2.837 44.723
81 HG3 GLU 11 HG1 GLU 11 -3.547 4.311 44.274
82 H LEU 12 HN LEU 12 -2.145 2.139 45.839
83 HA LEU 12 HA LEU 12 -0.851 4.649 46.101
84 HB2 LEU 12 HB2 LEU 12 -1.088 2.344 48.047
85 HB3 LEU 12 HB1 LEU 12 -0.468 3.935 48.467
86 HG LEU 12 HG LEU 12 -3.221 3.440 47.296
87 HD11 LEU 12 HD11 LEU 12 -2.398 3.981 50.165
88 HD12 LEU 12 HD12 LEU 12 -2.982 2.438 49.543
89 HD13 LEU 12 HD13 LEU 12 -4.054 3.838 49.578
90 HD21 LEU 12 HD21 LEU 12 -2.779 5.684 46.825
91 HD22 LEU 12 HD22 LEU 12 -1.712 5.883 48.214
92 HD23 LEU 12 HD23 LEU 12 -3.458 5.832 48.442
93 H GLU 13 HN GLU 13 0.315 1.388 45.743
94 HA GLU 13 HA GLU 13 2.965 1.745 46.634
95 HB2 GLU 13 HB2 GLU 13 1.779 -0.157 44.610
96 HB3 GLU 13 HB1 GLU 13 3.470 -0.209 45.101
97 HG2 GLU 13 HG2 GLU 13 1.164 -0.364 47.063
98 HG3 GLU 13 HG1 GLU 13 1.964 -1.779 46.386
99 H ASP 14 HN ASP 14 1.438 2.356 43.507
100 HA ASP 14 HA ASP 14 3.763 2.792 41.992
101 HB2 ASP 14 HB2 ASP 14 0.973 3.923 41.762
102 HB3 ASP 14 HB1 ASP 14 2.238 4.247 40.577
103 H LEU 15 HN LEU 15 1.883 4.991 44.050
104 HA LEU 15 HA LEU 15 3.269 7.362 43.375
105 HB2 LEU 15 HB2 LEU 15 1.703 6.533 45.817
106 HB3 LEU 15 HB1 LEU 15 2.465 8.116 45.695
107 HG LEU 15 HG LEU 15 1.229 8.496 43.551
108 HD11 LEU 15 HD11 LEU 15 0.096 5.796 44.284
109 HD12 LEU 15 HD12 LEU 15 0.748 6.328 42.735
110 HD13 LEU 15 HD13 LEU 15 -0.816 6.925 43.283
111 HD21 LEU 15 HD21 LEU 15 -0.858 9.039 44.615
112 HD22 LEU 15 HD22 LEU 15 0.398 9.220 45.840
113 HD23 LEU 15 HD23 LEU 15 -0.631 7.786 45.834
114 H LYS 16 HN LYS 16 3.855 4.858 45.796
115 HA LYS 16 HA LYS 16 5.928 6.122 47.211
116 HB2 LYS 16 HB2 LYS 16 4.795 4.075 47.993
117 HB3 LYS 16 HB1 LYS 16 5.533 3.167 46.674
118 HG2 LYS 16 HG2 LYS 16 7.774 3.674 47.551
119 HG3 LYS 16 HG1 LYS 16 7.060 4.635 48.847
120 HD2 LYS 16 HD2 LYS 16 5.912 2.650 49.717
121 HD3 LYS 16 HD1 LYS 16 6.556 1.679 48.394
122 HE2 LYS 16 HE2 LYS 16 7.918 1.353 50.406
123 HE3 LYS 16 HE1 LYS 16 8.860 2.183 49.169
124 HZ1 LYS 16 HZ1 LYS 16 8.789 4.150 50.297
125 HZ2 LYS 16 HZ2 LYS 16 8.790 3.067 51.606
126 HZ3 LYS 16 HZ3 LYS 16 7.337 3.786 51.095
127 H ASP 17 HN ASP 17 5.994 4.043 44.332
128 HA ASP 17 HA ASP 17 8.791 3.880 44.060
129 HB2 ASP 17 HB2 ASP 17 6.555 3.718 42.037
130 HB3 ASP 17 HB1 ASP 17 8.244 3.445 41.619
131 H ALA 18 HN ALA 18 6.442 6.254 42.891
132 HA ALA 18 HA ALA 18 8.177 7.748 41.249
133 HB1 ALA 18 HB1 ALA 18 5.768 8.060 41.149
134 HB2 ALA 18 HB2 ALA 18 6.535 9.589 41.573
135 HB3 ALA 18 HB3 ALA 18 5.742 8.625 42.819
136 H GLU 19 HN GLU 19 7.449 7.939 44.707
137 HA GLU 19 HA GLU 19 8.861 10.313 45.268
138 HB2 GLU 19 HB2 GLU 19 7.272 9.254 46.839
139 HB3 GLU 19 HB1 GLU 19 8.406 7.923 47.070
140 HG2 GLU 19 HG2 GLU 19 10.087 9.472 47.956
141 HG3 GLU 19 HG1 GLU 19 9.008 10.836 47.665
142 H LEU 20 HN LEU 20 9.875 6.918 45.216
143 HA LEU 20 HA LEU 20 12.483 7.287 46.203
144 HB2 LEU 20 HB2 LEU 20 11.434 5.076 46.016
145 HB3 LEU 20 HB1 LEU 20 11.438 5.209 44.260
146 HG LEU 20 HG LEU 20 13.912 5.317 44.272
147 HD11 LEU 20 HD11 LEU 20 14.561 6.272 46.313
148 HD12 LEU 20 HD12 LEU 20 14.944 4.574 46.576
149 HD13 LEU 20 HD13 LEU 20 13.466 5.258 47.253
150 HD21 LEU 20 HD21 LEU 20 14.281 2.994 44.767
151 HD22 LEU 20 HD22 LEU 20 12.616 3.132 44.199
152 HD23 LEU 20 HD23 LEU 20 12.948 2.966 45.923
153 H LYS 21 HN LYS 21 11.196 7.334 42.894
154 HA LYS 21 HA LYS 21 13.654 7.669 41.556
155 HB2 LYS 21 HB2 LYS 21 10.838 8.483 40.820
156 HB3 LYS 21 HB1 LYS 21 12.211 8.652 39.726
157 HG2 LYS 21 HG2 LYS 21 12.658 6.230 39.909
158 HG3 LYS 21 HG1 LYS 21 11.280 6.060 40.997
159 HD2 LYS 21 HD2 LYS 21 9.761 6.837 39.236
160 HD3 LYS 21 HD1 LYS 21 11.126 7.082 38.147
161 HE2 LYS 21 HE2 LYS 21 10.046 4.938 37.655
162 HE3 LYS 21 HE1 LYS 21 11.662 4.662 38.307
163 HZ1 LYS 21 HZ1 LYS 21 10.723 3.421 39.862
164 HZ2 LYS 21 HZ2 LYS 21 9.159 3.838 39.340
165 HZ3 LYS 21 HZ3 LYS 21 9.966 4.806 40.481
166 H ARG 22 HN ARG 22 11.384 9.999 42.952
167 HA ARG 22 HA ARG 22 12.574 12.353 41.968
168 HB2 ARG 22 HB2 ARG 22 10.352 12.301 43.033
169 HB3 ARG 22 HB1 ARG 22 11.107 11.928 44.583
170 HG2 ARG 22 HG2 ARG 22 12.297 14.047 44.575
171 HG3 ARG 22 HG1 ARG 22 11.711 14.411 42.951
172 HD2 ARG 22 HD2 ARG 22 10.359 15.610 44.597
173 HD3 ARG 22 HD1 ARG 22 9.381 14.375 43.809
174 HE ARG 22 HE ARG 22 10.570 13.349 46.191
175 HH11 ARG 22 HH11 ARG 22 9.213 13.063 47.989
176 HH12 ARG 22 HH12 ARG 22 7.687 13.882 48.055
177 HH21 ARG 22 HH21 ARG 22 8.090 15.442 44.986
178 HH22 ARG 22 HH22 ARG 22 7.052 15.227 46.354
179 H LEU 23 HN LEU 23 13.149 10.501 44.940
180 HA LEU 23 HA LEU 23 15.056 12.237 46.080
181 HB2 LEU 23 HB2 LEU 23 13.945 10.456 47.357
182 HB3 LEU 23 HB1 LEU 23 14.758 9.237 46.380
183 HG LEU 23 HG LEU 23 16.953 10.047 47.190
184 HD11 LEU 23 HD11 LEU 23 16.719 12.326 47.687
185 HD12 LEU 23 HD12 LEU 23 16.734 11.612 49.295
186 HD13 LEU 23 HD13 LEU 23 15.203 12.086 48.557
187 HD21 LEU 23 HD21 LEU 23 16.731 9.226 49.489
188 HD22 LEU 23 HD22 LEU 23 15.725 8.261 48.408
189 HD23 LEU 23 HD23 LEU 23 14.988 9.492 49.435
190 H ASN 24 HN ASN 24 15.386 9.466 43.896
191 HA ASN 24 HA ASN 24 18.198 9.340 43.863
192 HB2 ASN 24 HB2 ASN 24 16.136 8.554 41.796
193 HB3 ASN 24 HB1 ASN 24 17.858 8.206 41.640
194 HD21 ASN 24 HD21 ASN 24 18.747 7.213 43.920
195 HD22 ASN 24 HD22 ASN 24 17.797 5.939 44.514
196 H GLU 25 HN GLU 25 15.906 11.249 41.965
197 HA GLU 25 HA GLU 25 16.186 13.050 40.565
198 HB2 GLU 25 HB2 GLU 25 18.814 13.296 42.053
199 HB3 GLU 25 HB1 GLU 25 18.086 14.539 41.040
200 HG2 GLU 25 HG2 GLU 25 16.098 14.574 42.496
201 HG3 GLU 25 HG1 GLU 25 16.830 13.338 43.518
202 H GLU 26 HN GLU 26 16.767 10.606 39.361
203 HA GLU 26 HA GLU 26 19.296 10.413 38.140
204 HB2 GLU 26 HB2 GLU 26 16.568 9.441 37.274
205 HB3 GLU 26 HB1 GLU 26 18.057 9.043 36.414
206 HG2 GLU 26 HG2 GLU 26 18.978 7.985 38.399
207 HG3 GLU 26 HG1 GLU 26 17.585 8.488 39.351
208 H ARG 27 HN ARG 27 16.359 12.137 37.190
209 HA ARG 27 HA ARG 27 17.123 12.834 34.580
210 HB2 ARG 27 HB2 ARG 27 15.349 14.281 36.561
211 HB3 ARG 27 HB1 ARG 27 15.484 14.716 34.861
212 HG2 ARG 27 HG2 ARG 27 14.776 11.898 35.669
213 HG3 ARG 27 HG1 ARG 27 13.536 13.145 35.589
214 HD2 ARG 27 HD2 ARG 27 14.213 13.605 33.225
215 HD3 ARG 27 HD1 ARG 27 15.340 12.258 33.315
216 HE ARG 27 HE ARG 27 12.802 11.329 34.086
217 HH11 ARG 27 HH11 ARG 27 11.551 10.179 32.579
218 HH12 ARG 27 HH12 ARG 27 11.876 10.345 30.886
219 HH21 ARG 27 HH21 ARG 27 14.490 12.577 31.335
220 HH22 ARG 27 HH22 ARG 27 13.539 11.703 30.182
221 H HIS 28 HN HIS 28 17.761 14.418 37.684
222 HA HIS 28 HA HIS 28 18.900 16.789 36.645
223 HB2 HIS 28 HB2 HIS 28 19.352 15.329 39.251
224 HB3 HIS 28 HB1 HIS 28 20.043 16.907 38.889
225 HD2 HIS 28 HD2 HIS 28 16.727 17.243 37.302
226 HE1 HIS 28 HE1 HIS 28 15.939 18.101 41.359
227 HE2 HIS 28 HE2 HIS 28 15.019 18.250 38.996
228 H ASP 29 HN ASP 29 20.286 13.634 37.436
229 HA ASP 29 HA ASP 29 23.000 14.300 37.083
230 HB2 ASP 29 HB2 ASP 29 21.499 11.698 36.764
231 HB3 ASP 29 HB1 ASP 29 23.251 11.819 36.605
232 H HIS 30 HN HIS 30 20.514 13.239 34.800
233 HA HIS 30 HA HIS 30 22.164 12.840 32.559
234 HB2 HIS 30 HB2 HIS 30 19.843 12.089 32.599
235 HB3 HIS 30 HB1 HIS 30 19.281 13.759 32.689
236 HD2 HIS 30 HD2 HIS 30 18.899 14.919 30.205
237 HE1 HIS 30 HE1 HIS 30 21.123 12.153 27.917
238 HE2 HIS 30 HE2 HIS 30 19.626 14.201 27.801
239 H ASP 31 HN ASP 31 20.436 15.747 33.673
240 HA ASP 31 HA ASP 31 21.178 17.431 31.540
241 HB2 ASP 31 HB2 ASP 31 20.452 18.010 34.414
242 HB3 ASP 31 HB1 ASP 31 20.754 19.280 33.229
243 H LYS 32 HN LYS 32 22.770 16.669 34.605
244 HA LYS 32 HA LYS 32 24.839 18.589 34.422
245 HB2 LYS 32 HB2 LYS 32 24.690 15.926 35.844
246 HB3 LYS 32 HB1 LYS 32 26.076 17.008 35.975
247 HG2 LYS 32 HG2 LYS 32 24.600 18.803 36.812
248 HG3 LYS 32 HG1 LYS 32 23.213 17.722 36.694
249 HD2 LYS 32 HD2 LYS 32 24.289 16.170 38.291
250 HD3 LYS 32 HD1 LYS 32 25.659 17.274 38.427
251 HE2 LYS 32 HE2 LYS 32 22.789 17.980 39.107
252 HE3 LYS 32 HE1 LYS 32 24.037 17.576 40.285
253 HZ1 LYS 32 HZ1 LYS 32 25.341 19.447 39.501
254 HZ2 LYS 32 HZ2 LYS 32 23.806 19.967 40.015
255 HZ3 LYS 32 HZ3 LYS 32 24.149 19.832 38.357
256 H ARG 33 HN ARG 33 24.549 15.282 33.213
257 HA ARG 33 HA ARG 33 27.221 14.989 32.329
258 HB2 ARG 33 HB2 ARG 33 24.649 13.688 31.427
259 HB3 ARG 33 HB1 ARG 33 26.225 13.251 30.769
260 HG2 ARG 33 HG2 ARG 33 27.027 12.644 32.998
261 HG3 ARG 33 HG1 ARG 33 25.500 13.156 33.717
262 HD2 ARG 33 HD2 ARG 33 25.513 10.724 33.427
263 HD3 ARG 33 HD1 ARG 33 24.307 11.456 32.373
264 HE ARG 33 HE ARG 33 25.575 10.795 30.529
265 HH11 ARG 33 HH11 ARG 33 27.287 9.648 29.575
266 HH12 ARG 33 HH12 ARG 33 28.625 9.130 30.548
267 HH21 ARG 33 HH21 ARG 33 27.350 10.470 33.483
268 HH22 ARG 33 HH22 ARG 33 28.660 9.595 32.760
269 H GLU 34 HN GLU 34 24.327 16.298 30.782
270 HA GLU 34 HA GLU 34 25.435 16.628 28.195
271 HB2 GLU 34 HB2 GLU 34 23.174 18.052 29.609
272 HB3 GLU 34 HB1 GLU 34 23.609 18.366 27.930
273 HG2 GLU 34 HG2 GLU 34 22.942 15.604 28.988
274 HG3 GLU 34 HG1 GLU 34 21.761 16.667 28.229
275 H ALA 35 HN ALA 35 25.365 18.708 31.051
276 HA ALA 35 HA ALA 35 26.412 21.038 29.867
277 HB1 ALA 35 HB1 ALA 35 25.390 20.783 32.190
278 HB2 ALA 35 HB2 ALA 35 26.827 21.802 32.079
279 HB3 ALA 35 HB3 ALA 35 26.957 20.156 32.701
280 H GLU 36 HN GLU 36 27.989 18.212 31.302
281 HA GLU 36 HA GLU 36 30.638 19.191 31.225
282 HB2 GLU 36 HB2 GLU 36 29.547 16.371 31.114
283 HB3 GLU 36 HB1 GLU 36 31.262 16.756 31.276
284 HG2 GLU 36 HG2 GLU 36 29.132 17.783 33.169
285 HG3 GLU 36 HG1 GLU 36 30.079 16.326 33.468
286 H ARG 37 HN ARG 37 28.673 17.458 28.848
287 HA ARG 37 HA ARG 37 30.709 16.988 26.951
288 HB2 ARG 37 HB2 ARG 37 27.719 17.314 26.654
289 HB3 ARG 37 HB1 ARG 37 28.780 16.853 25.322
290 HG2 ARG 37 HG2 ARG 37 29.553 14.896 26.598
291 HG3 ARG 37 HG1 ARG 37 28.514 15.358 27.947
292 HD2 ARG 37 HD2 ARG 37 26.531 15.131 26.503
293 HD3 ARG 37 HD1 ARG 37 27.562 14.679 25.151
294 HE ARG 37 HE ARG 37 28.097 12.936 27.299
295 HH11 ARG 37 HH11 ARG 37 27.171 10.863 27.286
296 HH12 ARG 37 HH12 ARG 37 25.771 10.551 26.315
297 HH21 ARG 37 HH21 ARG 37 25.583 13.784 25.078
298 HH22 ARG 37 HH22 ARG 37 24.873 12.205 25.066
299 H LYS 38 HN LYS 38 28.532 19.727 27.465
300 HA LYS 38 HA LYS 38 29.152 21.172 25.132
301 HB2 LYS 38 HB2 LYS 38 27.247 21.712 26.602
302 HB3 LYS 38 HB1 LYS 38 28.367 22.228 27.861
303 HG2 LYS 38 HG2 LYS 38 29.249 23.986 26.379
304 HG3 LYS 38 HG1 LYS 38 28.165 23.455 25.093
305 HD2 LYS 38 HD2 LYS 38 26.218 23.972 26.517
306 HD3 LYS 38 HD1 LYS 38 27.301 24.498 27.808
307 HE2 LYS 38 HE2 LYS 38 28.209 26.257 26.340
308 HE3 LYS 38 HE1 LYS 38 27.139 25.731 25.041
309 HZ1 LYS 38 HZ1 LYS 38 26.084 27.532 26.102
310 HZ2 LYS 38 HZ2 LYS 38 26.380 26.905 27.653
311 HZ3 LYS 38 HZ3 LYS 38 25.262 26.143 26.625
312 H ALA 39 HN ALA 39 30.623 21.209 28.368
313 HA ALA 39 HA ALA 39 32.471 23.282 27.900
314 HB1 ALA 39 HB1 ALA 39 32.640 20.898 29.758
315 HB2 ALA 39 HB2 ALA 39 32.009 22.497 30.150
316 HB3 ALA 39 HB3 ALA 39 33.726 22.285 29.807
317 H LEU 40 HN LEU 40 32.688 19.782 27.383
318 HA LEU 40 HA LEU 40 35.422 19.699 26.668
319 HB2 LEU 40 HB2 LEU 40 33.100 17.908 25.928
320 HB3 LEU 40 HB1 LEU 40 34.773 17.549 25.512
321 HG LEU 40 HG LEU 40 33.798 18.040 28.343
322 HD11 LEU 40 HD11 LEU 40 34.453 15.393 27.019
323 HD12 LEU 40 HD12 LEU 40 32.812 15.996 27.254
324 HD13 LEU 40 HD13 LEU 40 33.829 15.640 28.650
325 HD21 LEU 40 HD21 LEU 40 36.058 16.663 28.686
326 HD22 LEU 40 HD22 LEU 40 36.100 18.405 28.449
327 HD23 LEU 40 HD23 LEU 40 36.448 17.325 27.098
328 H GLU 41 HN GLU 41 32.482 20.234 24.781
329 HA GLU 41 HA GLU 41 33.846 20.264 22.263
330 HB2 GLU 41 HB2 GLU 41 31.086 21.192 23.097
331 HB3 GLU 41 HB1 GLU 41 31.659 21.215 21.429
332 HG2 GLU 41 HG2 GLU 41 32.039 18.800 21.493
333 HG3 GLU 41 HG1 GLU 41 31.559 18.748 23.187
334 H ASP 42 HN ASP 42 33.787 22.337 20.816
335 HA ASP 42 HA ASP 42 34.546 24.475 20.474
336 HB2 ASP 42 HB2 ASP 42 32.233 24.839 21.493
337 HB3 ASP 42 HB1 ASP 42 33.066 25.177 23.009
338 H LYS 43 HN LYS 43 36.307 22.747 21.939
339 HA LYS 43 HA LYS 43 37.371 23.926 24.267
340 HB2 LYS 43 HB2 LYS 43 37.878 21.627 23.489
341 HB3 LYS 43 HB1 LYS 43 38.827 22.299 22.166
342 HG2 LYS 43 HG2 LYS 43 40.274 23.464 23.846
343 HG3 LYS 43 HG1 LYS 43 39.368 22.669 25.130
344 HD2 LYS 43 HD2 LYS 43 40.750 21.119 22.931
345 HD3 LYS 43 HD1 LYS 43 41.569 21.559 24.428
346 HE2 LYS 43 HE2 LYS 43 39.695 20.413 25.684
347 HE3 LYS 43 HE1 LYS 43 39.103 19.820 24.134
348 HZ1 LYS 43 HZ1 LYS 43 41.570 19.066 23.880
349 HZ2 LYS 43 HZ2 LYS 43 40.454 18.116 24.740
350 HZ3 LYS 43 HZ3 LYS 43 41.548 19.112 25.576
351 H LEU 44 HN LEU 44 38.148 24.359 20.835
352 HA LEU 44 HA LEU 44 40.387 25.970 21.012
353 HB2 LEU 44 HB2 LEU 44 39.706 26.903 18.831
354 HB3 LEU 44 HB1 LEU 44 39.527 25.152 18.889
355 HG LEU 44 HG LEU 44 37.030 25.947 19.762
356 HD11 LEU 44 HD11 LEU 44 37.765 28.355 19.216
357 HD12 LEU 44 HD12 LEU 44 36.237 27.814 18.526
358 HD13 LEU 44 HD13 LEU 44 37.685 27.871 17.522
359 HD21 LEU 44 HD21 LEU 44 36.314 25.559 17.348
360 HD22 LEU 44 HD22 LEU 44 37.294 24.279 18.061
361 HD23 LEU 44 HD23 LEU 44 38.029 25.432 16.948
362 H ALA 45 HN ALA 45 37.306 26.616 22.227
363 HA ALA 45 HA ALA 45 37.079 29.401 21.882
364 HB1 ALA 45 HB1 ALA 45 35.617 29.301 23.902
365 HB2 ALA 45 HB2 ALA 45 36.103 27.621 24.125
366 HB3 ALA 45 HB3 ALA 45 35.204 28.094 22.683
367 H ASP 46 HN ASP 46 38.744 27.469 24.333
368 HA ASP 46 HA ASP 46 39.420 29.558 26.091
369 HB2 ASP 46 HB2 ASP 46 40.756 26.917 25.493
370 HB3 ASP 46 HB1 ASP 46 41.308 28.007 26.764
371 H LYS 47 HN LYS 47 41.038 28.318 23.198
372 HA LYS 47 HA LYS 47 42.777 29.139 21.942
373 HB2 LYS 47 HB2 LYS 47 41.900 31.750 23.202
374 HB3 LYS 47 HB1 LYS 47 42.970 31.598 21.809
375 HG2 LYS 47 HG2 LYS 47 41.182 30.421 20.570
376 HG3 LYS 47 HG1 LYS 47 40.110 30.602 21.958
377 HD2 LYS 47 HD2 LYS 47 40.337 33.068 21.790
378 HD3 LYS 47 HD1 LYS 47 41.353 32.861 20.363
379 HE2 LYS 47 HE2 LYS 47 38.496 31.878 20.617
380 HE3 LYS 47 HE1 LYS 47 38.993 33.332 19.752
381 HZ1 LYS 47 HZ1 LYS 47 40.040 30.626 19.142
382 HZ2 LYS 47 HZ2 LYS 47 40.250 32.045 18.231
383 HZ3 LYS 47 HZ3 LYS 47 38.718 31.319 18.337
384 H GLN 48 HN GLN 48 43.662 27.919 24.201
385 HA GLN 48 HA GLN 48 45.280 29.474 25.914
386 HB2 GLN 48 HB2 GLN 48 45.490 26.577 25.056
387 HB3 GLN 48 HB1 GLN 48 46.495 27.297 26.312
388 HG2 GLN 48 HG2 GLN 48 43.464 27.220 26.348
389 HG3 GLN 48 HG1 GLN 48 44.509 26.123 27.244
390 HE21 GLN 48 HE21 GLN 48 42.592 28.609 27.908
391 HE22 GLN 48 HE22 GLN 48 43.504 29.435 29.078
392 H GLU 49 HN GLU 49 45.949 27.899 22.814
393 HA GLU 49 HA GLU 49 48.741 28.540 22.814
394 HB2 GLU 49 HB2 GLU 49 46.839 27.708 20.614
395 HB3 GLU 49 HB1 GLU 49 48.571 27.945 20.370
396 HG2 GLU 49 HG2 GLU 49 49.082 26.234 22.027
397 HG3 GLU 49 HG1 GLU 49 47.371 26.049 22.409
398 H HIS 50 HN HIS 50 49.806 30.245 21.909
399 HA HIS 50 HA HIS 50 48.396 32.705 21.610
400 HB2 HIS 50 HB2 HIS 50 50.558 33.664 21.083
401 HB3 HIS 50 HB1 HIS 50 50.752 32.520 22.412
402 HD2 HIS 50 HD2 HIS 50 52.051 33.043 18.808
403 HE1 HIS 50 HE1 HIS 50 53.350 29.217 20.034
404 HE2 HIS 50 HE2 HIS 50 53.585 31.004 18.246
405 H LEU 51 HN LEU 51 49.138 30.140 19.462
406 HA LEU 51 HA LEU 51 49.324 31.517 17.014
407 HB2 LEU 51 HB2 LEU 51 49.913 29.148 17.247
408 HB3 LEU 51 HB1 LEU 51 48.233 28.750 17.590
409 HG LEU 51 HG LEU 51 47.579 29.556 15.344
410 HD11 LEU 51 HD11 LEU 51 49.643 29.863 13.740
411 HD12 LEU 51 HD12 LEU 51 50.507 30.264 15.224
412 HD13 LEU 51 HD13 LEU 51 49.111 31.220 14.728
413 HD21 LEU 51 HD21 LEU 51 49.796 27.505 15.516
414 HD22 LEU 51 HD22 LEU 51 48.872 27.784 14.040
415 HD23 LEU 51 HD23 LEU 51 48.056 27.218 15.496
416 H ASP 52 HN ASP 52 46.523 30.190 18.753
417 HA ASP 52 HA ASP 52 44.261 30.534 18.502
418 HB2 ASP 52 HB2 ASP 52 45.346 33.190 17.546
419 HB3 ASP 52 HB1 ASP 52 43.632 32.874 17.807
420 H GLY 53 HN GLY 53 45.621 29.186 16.334
421 HA2 GLY 53 HA2 GLY 53 44.560 30.227 13.847
422 HA3 GLY 53 HA1 GLY 53 45.436 28.712 14.066
423 H ALA 54 HN ALA 54 43.399 28.429 12.417
424 HA ALA 54 HA ALA 54 40.835 28.029 13.514
425 HB1 ALA 54 HB1 ALA 54 40.499 26.550 11.494
426 HB2 ALA 54 HB2 ALA 54 42.197 26.815 11.103
427 HB3 ALA 54 HB3 ALA 54 41.075 28.177 11.130
428 H LEU 55 HN LEU 55 43.610 25.866 13.145
429 HA LEU 55 HA LEU 55 44.068 23.789 14.020
430 HB2 LEU 55 HB2 LEU 55 42.050 24.634 16.116
431 HB3 LEU 55 HB1 LEU 55 43.247 23.351 16.280
432 HG LEU 55 HG LEU 55 43.881 26.281 15.818
433 HD11 LEU 55 HD11 LEU 55 44.540 26.352 18.130
434 HD12 LEU 55 HD12 LEU 55 44.324 24.611 18.304
435 HD13 LEU 55 HD13 LEU 55 42.920 25.654 18.081
436 HD21 LEU 55 HD21 LEU 55 45.556 23.781 16.041
437 HD22 LEU 55 HD22 LEU 55 46.213 25.319 16.600
438 HD23 LEU 55 HD23 LEU 55 45.720 25.134 14.921
439 H ARG 56 HN ARG 56 40.710 23.922 15.135
440 HA ARG 56 HA ARG 56 40.139 21.338 14.038
441 HB2 ARG 56 HB2 ARG 56 38.268 23.437 15.170
442 HB3 ARG 56 HB1 ARG 56 37.849 21.755 14.858
443 HG2 ARG 56 HG2 ARG 56 40.178 22.441 16.649
444 HG3 ARG 56 HG1 ARG 56 38.534 22.446 17.281
445 HD2 ARG 56 HD2 ARG 56 39.854 20.085 15.901
446 HD3 ARG 56 HD1 ARG 56 39.662 20.266 17.638
447 HE ARG 56 HE ARG 56 37.122 20.551 16.543
448 HH11 ARG 56 HH11 ARG 56 35.705 18.778 16.436
449 HH12 ARG 56 HH12 ARG 56 36.339 17.166 16.460
450 HH21 ARG 56 HH21 ARG 56 39.646 18.188 16.680
451 HH22 ARG 56 HH22 ARG 56 38.570 16.833 16.599
452 H TYR 57 HN TYR 57 38.849 20.790 12.296
453 HA TYR 57 HA TYR 57 37.542 22.780 10.680
454 HB2 TYR 57 HB2 TYR 57 39.816 23.191 9.930
455 HB3 TYR 57 HB1 TYR 57 40.070 21.468 9.651
456 HD1 TYR 57 HD1 TYR 57 37.999 24.388 8.598
457 HD2 TYR 57 HD2 TYR 57 39.412 20.454 7.607
458 HE1 TYR 57 HE1 TYR 57 37.055 24.623 6.318
459 HE2 TYR 57 HE2 TYR 57 38.467 20.689 5.327
460 HH TYR 57 HH TYR 57 37.343 23.699 4.106
Start of MODEL 13
1 H1 GLY 1 HT1 GLY 1 10.006 19.556 75.306
2 H2 GLY 1 HT2 GLY 1 11.639 19.469 74.842
3 H3 GLY 1 HT3 GLY 1 10.887 20.980 75.035
4 HA2 GLY 1 HA2 GLY 1 11.744 21.003 77.075
5 HA3 GLY 1 HA1 GLY 1 10.494 19.815 77.450
6 H SER 2 HN SER 2 12.212 19.156 79.048
7 HA SER 2 HA SER 2 14.636 17.958 78.224
8 HB2 SER 2 HB2 SER 2 14.685 16.970 80.452
9 HB3 SER 2 HB1 SER 2 14.149 18.644 80.556
10 HG SER 2 HG SER 2 12.036 17.915 80.730
11 H ALA 3 HN ALA 3 11.357 16.864 78.174
12 HA ALA 3 HA ALA 3 11.746 14.074 78.224
13 HB1 ALA 3 HB1 ALA 3 9.633 15.657 76.742
14 HB2 ALA 3 HB2 ALA 3 9.532 15.146 78.426
15 HB3 ALA 3 HB3 ALA 3 9.553 13.940 77.137
16 H GLY 4 HN GLY 4 11.850 16.421 75.576
17 HA2 GLY 4 HA2 GLY 4 13.031 16.271 73.572
18 HA3 GLY 4 HA1 GLY 4 13.481 14.619 73.992
19 H LEU 5 HN LEU 5 10.213 14.893 74.469
20 HA LEU 5 HA LEU 5 9.539 13.198 72.306
21 HB2 LEU 5 HB2 LEU 5 7.839 14.869 74.163
22 HB3 LEU 5 HB1 LEU 5 7.154 13.792 72.952
23 HG LEU 5 HG LEU 5 9.114 12.885 75.089
24 HD11 LEU 5 HD11 LEU 5 7.131 13.631 76.225
25 HD12 LEU 5 HD12 LEU 5 7.043 11.872 76.135
26 HD13 LEU 5 HD13 LEU 5 6.088 12.861 75.031
27 HD21 LEU 5 HD21 LEU 5 9.182 11.228 73.438
28 HD22 LEU 5 HD22 LEU 5 7.521 11.513 72.927
29 HD23 LEU 5 HD23 LEU 5 7.848 10.647 74.426
30 H GLN 6 HN GLN 6 9.257 16.688 72.780
31 HA GLN 6 HA GLN 6 7.773 17.257 70.444
32 HB2 GLN 6 HB2 GLN 6 9.693 18.919 72.086
33 HB3 GLN 6 HB1 GLN 6 8.772 19.567 70.731
34 HG2 GLN 6 HG2 GLN 6 7.496 20.036 72.704
35 HG3 GLN 6 HG1 GLN 6 6.676 18.709 71.886
36 HE21 GLN 6 HE21 GLN 6 5.882 17.401 73.557
37 HE22 GLN 6 HE22 GLN 6 6.811 16.843 74.863
38 H GLU 7 HN GLU 7 11.241 16.988 71.057
39 HA GLU 7 HA GLU 7 12.134 17.943 68.553
40 HB2 GLU 7 HB2 GLU 7 13.397 16.055 70.543
41 HB3 GLU 7 HB1 GLU 7 14.218 16.601 69.081
42 HG2 GLU 7 HG2 GLU 7 13.057 18.495 71.145
43 HG3 GLU 7 HG1 GLU 7 14.736 17.969 71.142
44 H LYS 8 HN LYS 8 11.183 14.730 69.662
45 HA LYS 8 HA LYS 8 10.766 12.772 68.530
46 HB2 LYS 8 HB2 LYS 8 10.330 14.691 66.225
47 HB3 LYS 8 HB1 LYS 8 9.836 13.000 66.254
48 HG2 LYS 8 HG2 LYS 8 8.410 13.450 68.222
49 HG3 LYS 8 HG1 LYS 8 8.895 15.146 68.175
50 HD2 LYS 8 HD2 LYS 8 7.943 15.362 65.909
51 HD3 LYS 8 HD1 LYS 8 7.450 13.669 65.957
52 HE2 LYS 8 HE2 LYS 8 6.021 14.132 67.912
53 HE3 LYS 8 HE1 LYS 8 6.516 15.825 67.876
54 HZ1 LYS 8 HZ1 LYS 8 5.262 14.484 65.554
55 HZ2 LYS 8 HZ2 LYS 8 5.468 16.150 65.818
56 HZ3 LYS 8 HZ3 LYS 8 4.351 15.271 66.748
57 H GLU 9 HN GLU 9 13.510 13.618 68.742
58 HA GLU 9 HA GLU 9 15.596 13.276 67.822
59 HB2 GLU 9 HB2 GLU 9 14.063 10.904 66.728
60 HB3 GLU 9 HB1 GLU 9 15.816 11.058 66.684
61 HG2 GLU 9 HG2 GLU 9 15.453 9.815 68.644
62 HG3 GLU 9 HG1 GLU 9 15.630 11.457 69.253
63 H ARG 10 HN ARG 10 13.740 14.963 66.271
64 HA ARG 10 HA ARG 10 13.598 15.980 64.217
65 HB2 ARG 10 HB2 ARG 10 16.404 14.864 64.041
66 HB3 ARG 10 HB1 ARG 10 15.733 16.071 62.944
67 HG2 ARG 10 HG2 ARG 10 15.235 17.500 64.974
68 HG3 ARG 10 HG1 ARG 10 16.171 16.348 65.927
69 HD2 ARG 10 HD2 ARG 10 17.211 17.870 63.521
70 HD3 ARG 10 HD1 ARG 10 17.547 18.283 65.199
71 HE ARG 10 HE ARG 10 18.672 16.048 63.696
72 HH11 ARG 10 HH11 ARG 10 20.363 14.959 64.747
73 HH12 ARG 10 HH12 ARG 10 20.665 15.255 66.427
74 HH21 ARG 10 HH21 ARG 10 18.086 17.549 66.760
75 HH22 ARG 10 HH22 ARG 10 19.377 16.722 67.567
76 H GLU 11 HN GLU 11 12.542 13.299 64.366
77 HA GLU 11 HA GLU 11 13.313 11.725 62.140
78 HB2 GLU 11 HB2 GLU 11 10.783 11.874 63.775
79 HB3 GLU 11 HB1 GLU 11 10.940 10.771 62.408
80 HG2 GLU 11 HG2 GLU 11 12.937 10.863 64.681
81 HG3 GLU 11 HG1 GLU 11 11.546 9.781 64.670
82 H LEU 12 HN LEU 12 10.940 14.312 62.537
83 HA LEU 12 HA LEU 12 9.698 14.075 60.018
84 HB2 LEU 12 HB2 LEU 12 10.039 16.394 61.918
85 HB3 LEU 12 HB1 LEU 12 9.168 16.561 60.397
86 HG LEU 12 HG LEU 12 7.674 16.068 62.340
87 HD11 LEU 12 HD11 LEU 12 6.247 14.731 61.113
88 HD12 LEU 12 HD12 LEU 12 7.517 13.620 60.610
89 HD13 LEU 12 HD13 LEU 12 7.365 15.197 59.836
90 HD21 LEU 12 HD21 LEU 12 8.877 13.297 62.339
91 HD22 LEU 12 HD22 LEU 12 7.767 14.006 63.508
92 HD23 LEU 12 HD23 LEU 12 9.439 14.557 63.437
93 H GLU 13 HN GLU 13 12.557 15.876 61.079
94 HA GLU 13 HA GLU 13 12.994 17.304 58.687
95 HB2 GLU 13 HB2 GLU 13 14.128 17.831 60.819
96 HB3 GLU 13 HB1 GLU 13 15.041 16.327 60.694
97 HG2 GLU 13 HG2 GLU 13 16.059 17.085 58.598
98 HG3 GLU 13 HG1 GLU 13 15.097 18.560 58.643
99 H ASP 14 HN ASP 14 14.098 14.115 59.775
100 HA ASP 14 HA ASP 14 15.805 13.544 57.610
101 HB2 ASP 14 HB2 ASP 14 15.742 12.234 59.709
102 HB3 ASP 14 HB1 ASP 14 14.158 11.607 59.253
103 H LEU 15 HN LEU 15 12.340 12.931 58.087
104 HA LEU 15 HA LEU 15 11.908 11.504 55.687
105 HB2 LEU 15 HB2 LEU 15 10.056 13.195 57.377
106 HB3 LEU 15 HB1 LEU 15 9.510 12.231 56.009
107 HG LEU 15 HG LEU 15 11.032 11.098 58.376
108 HD11 LEU 15 HD11 LEU 15 8.941 11.858 59.240
109 HD12 LEU 15 HD12 LEU 15 8.736 10.132 58.948
110 HD13 LEU 15 HD13 LEU 15 8.067 11.303 57.812
111 HD21 LEU 15 HD21 LEU 15 9.780 8.973 57.362
112 HD22 LEU 15 HD22 LEU 15 11.307 9.515 56.678
113 HD23 LEU 15 HD23 LEU 15 9.789 9.937 55.886
114 H LYS 16 HN LYS 16 11.815 14.956 56.448
115 HA LYS 16 HA LYS 16 10.766 15.866 54.009
116 HB2 LYS 16 HB2 LYS 16 10.941 17.301 55.984
117 HB3 LYS 16 HB1 LYS 16 12.698 17.225 55.904
118 HG2 LYS 16 HG2 LYS 16 11.868 19.328 54.932
119 HG3 LYS 16 HG1 LYS 16 12.647 18.346 53.697
120 HD2 LYS 16 HD2 LYS 16 10.593 17.740 52.704
121 HD3 LYS 16 HD1 LYS 16 9.666 18.167 54.144
122 HE2 LYS 16 HE2 LYS 16 9.367 19.861 52.385
123 HE3 LYS 16 HE1 LYS 16 10.217 20.554 53.766
124 HZ1 LYS 16 HZ1 LYS 16 12.298 20.264 52.632
125 HZ2 LYS 16 HZ2 LYS 16 11.238 21.130 51.626
126 HZ3 LYS 16 HZ3 LYS 16 11.538 19.485 51.332
127 H ASP 17 HN ASP 17 14.118 15.313 55.043
128 HA ASP 17 HA ASP 17 15.378 16.249 52.702
129 HB2 ASP 17 HB2 ASP 17 16.212 14.211 54.768
130 HB3 ASP 17 HB1 ASP 17 17.262 14.719 53.446
131 H ALA 18 HN ALA 18 14.100 13.069 53.583
132 HA ALA 18 HA ALA 18 15.087 11.626 51.373
133 HB1 ALA 18 HB1 ALA 18 13.524 9.934 51.966
134 HB2 ALA 18 HB2 ALA 18 12.447 11.097 52.742
135 HB3 ALA 18 HB3 ALA 18 13.997 10.699 53.483
136 H GLU 19 HN GLU 19 12.133 13.521 51.824
137 HA GLU 19 HA GLU 19 10.866 12.828 49.399
138 HB2 GLU 19 HB2 GLU 19 10.685 15.295 51.136
139 HB3 GLU 19 HB1 GLU 19 9.658 15.028 49.727
140 HG2 GLU 19 HG2 GLU 19 8.758 12.996 50.689
141 HG3 GLU 19 HG1 GLU 19 9.895 13.079 52.034
142 H LEU 20 HN LEU 20 13.195 15.365 50.216
143 HA LEU 20 HA LEU 20 13.103 16.771 47.779
144 HB2 LEU 20 HB2 LEU 20 14.186 17.670 49.788
145 HB3 LEU 20 HB1 LEU 20 15.412 16.409 49.708
146 HG LEU 20 HG LEU 20 16.162 17.273 47.512
147 HD11 LEU 20 HD11 LEU 20 15.223 19.679 47.000
148 HD12 LEU 20 HD12 LEU 20 13.834 19.141 47.943
149 HD13 LEU 20 HD13 LEU 20 14.303 18.268 46.485
150 HD21 LEU 20 HD21 LEU 20 17.072 19.448 48.358
151 HD22 LEU 20 HD22 LEU 20 17.253 18.129 49.513
152 HD23 LEU 20 HD23 LEU 20 15.979 19.327 49.737
153 H LYS 21 HN LYS 21 15.123 14.047 48.839
154 HA LYS 21 HA LYS 21 16.737 13.865 46.542
155 HB2 LYS 21 HB2 LYS 21 17.231 12.683 48.649
156 HB3 LYS 21 HB1 LYS 21 15.826 11.647 48.395
157 HG2 LYS 21 HG2 LYS 21 16.811 10.790 46.310
158 HG3 LYS 21 HG1 LYS 21 18.199 11.859 46.515
159 HD2 LYS 21 HD2 LYS 21 18.790 10.729 48.607
160 HD3 LYS 21 HD1 LYS 21 17.373 9.689 48.463
161 HE2 LYS 21 HE2 LYS 21 19.363 8.503 47.658
162 HE3 LYS 21 HE1 LYS 21 18.260 8.810 46.316
163 HZ1 LYS 21 HZ1 LYS 21 20.652 10.426 47.019
164 HZ2 LYS 21 HZ2 LYS 21 19.571 10.774 45.756
165 HZ3 LYS 21 HZ3 LYS 21 20.516 9.363 45.704
166 H ARG 22 HN ARG 22 13.631 12.339 47.346
167 HA ARG 22 HA ARG 22 13.397 10.732 45.048
168 HB2 ARG 22 HB2 ARG 22 11.954 10.486 47.036
169 HB3 ARG 22 HB1 ARG 22 11.194 12.036 46.668
170 HG2 ARG 22 HG2 ARG 22 10.350 11.178 44.556
171 HG3 ARG 22 HG1 ARG 22 11.225 9.665 44.779
172 HD2 ARG 22 HD2 ARG 22 9.088 10.684 46.666
173 HD3 ARG 22 HD1 ARG 22 8.794 9.516 45.382
174 HE ARG 22 HE ARG 22 10.917 8.539 46.921
175 HH11 ARG 22 HH11 ARG 22 10.524 6.988 48.535
176 HH12 ARG 22 HH12 ARG 22 8.935 6.827 49.206
177 HH21 ARG 22 HH21 ARG 22 7.566 9.338 47.246
178 HH22 ARG 22 HH22 ARG 22 7.261 8.158 48.475
179 H LEU 23 HN LEU 23 12.332 14.056 45.692
180 HA LEU 23 HA LEU 23 11.033 14.492 43.222
181 HB2 LEU 23 HB2 LEU 23 12.342 16.401 45.167
182 HB3 LEU 23 HB1 LEU 23 11.420 16.931 43.763
183 HG LEU 23 HG LEU 23 10.319 15.099 45.916
184 HD11 LEU 23 HD11 LEU 23 9.857 18.073 45.543
185 HD12 LEU 23 HD12 LEU 23 10.913 17.372 46.771
186 HD13 LEU 23 HD13 LEU 23 9.179 17.053 46.815
187 HD21 LEU 23 HD21 LEU 23 9.197 16.381 43.430
188 HD22 LEU 23 HD22 LEU 23 8.133 16.159 44.816
189 HD23 LEU 23 HD23 LEU 23 8.915 14.767 44.080
190 H ASN 24 HN ASN 24 14.381 14.921 44.254
191 HA ASN 24 HA ASN 24 15.342 16.300 42.005
192 HB2 ASN 24 HB2 ASN 24 16.561 15.905 44.181
193 HB3 ASN 24 HB1 ASN 24 16.887 14.267 43.619
194 HD21 ASN 24 HD21 ASN 24 19.178 14.535 43.330
195 HD22 ASN 24 HD22 ASN 24 19.831 15.585 42.166
196 H GLU 25 HN GLU 25 14.949 12.842 42.626
197 HA GLU 25 HA GLU 25 15.053 11.009 41.257
198 HB2 GLU 25 HB2 GLU 25 14.389 13.094 39.158
199 HB3 GLU 25 HB1 GLU 25 14.305 11.351 38.910
200 HG2 GLU 25 HG2 GLU 25 12.656 11.169 40.736
201 HG3 GLU 25 HG1 GLU 25 12.737 12.913 40.979
202 H GLU 26 HN GLU 26 15.966 10.692 38.610
203 HA GLU 26 HA GLU 26 18.854 11.218 38.964
204 HB2 GLU 26 HB2 GLU 26 17.417 9.250 37.166
205 HB3 GLU 26 HB1 GLU 26 19.165 9.399 37.344
206 HG2 GLU 26 HG2 GLU 26 17.267 8.780 39.623
207 HG3 GLU 26 HG1 GLU 26 18.190 7.565 38.741
208 H ARG 27 HN ARG 27 16.259 12.550 37.404
209 HA ARG 27 HA ARG 27 17.199 12.947 34.775
210 HB2 ARG 27 HB2 ARG 27 15.559 14.726 34.632
211 HB3 ARG 27 HB1 ARG 27 14.865 13.377 35.532
212 HG2 ARG 27 HG2 ARG 27 15.484 14.533 37.661
213 HG3 ARG 27 HG1 ARG 27 16.042 15.912 36.715
214 HD2 ARG 27 HD2 ARG 27 13.787 16.146 35.732
215 HD3 ARG 27 HD1 ARG 27 13.228 14.789 36.707
216 HE ARG 27 HE ARG 27 14.381 16.724 38.411
217 HH11 ARG 27 HH11 ARG 27 13.005 18.101 39.582
218 HH12 ARG 27 HH12 ARG 27 11.369 18.332 39.057
219 HH21 ARG 27 HH21 ARG 27 11.667 16.218 36.325
220 HH22 ARG 27 HH22 ARG 27 10.613 17.265 37.214
221 H HIS 28 HN HIS 28 17.946 14.550 37.792
222 HA HIS 28 HA HIS 28 19.120 16.895 36.722
223 HB2 HIS 28 HB2 HIS 28 19.487 15.423 39.333
224 HB3 HIS 28 HB1 HIS 28 20.353 16.915 38.962
225 HD2 HIS 28 HD2 HIS 28 18.833 19.240 39.257
226 HE1 HIS 28 HE1 HIS 28 15.109 17.372 39.935
227 HE2 HIS 28 HE2 HIS 28 16.330 19.598 39.905
228 H ASP 29 HN ASP 29 20.408 13.689 37.469
229 HA ASP 29 HA ASP 29 23.137 14.254 37.055
230 HB2 ASP 29 HB2 ASP 29 22.286 12.171 38.098
231 HB3 ASP 29 HB1 ASP 29 21.670 11.658 36.528
232 H HIS 30 HN HIS 30 20.584 13.219 34.826
233 HA HIS 30 HA HIS 30 22.179 12.849 32.543
234 HB2 HIS 30 HB2 HIS 30 19.865 12.076 32.642
235 HB3 HIS 30 HB1 HIS 30 19.292 13.740 32.748
236 HD2 HIS 30 HD2 HIS 30 18.847 14.903 30.274
237 HE1 HIS 30 HE1 HIS 30 21.031 12.153 27.931
238 HE2 HIS 30 HE2 HIS 30 19.519 14.192 27.853
239 H ASP 31 HN ASP 31 20.457 15.734 33.722
240 HA ASP 31 HA ASP 31 21.111 17.435 31.577
241 HB2 ASP 31 HB2 ASP 31 20.490 17.994 34.480
242 HB3 ASP 31 HB1 ASP 31 20.736 19.271 33.290
243 H LYS 32 HN LYS 32 22.822 16.676 34.578
244 HA LYS 32 HA LYS 32 24.873 18.608 34.314
245 HB2 LYS 32 HB2 LYS 32 24.786 15.952 35.751
246 HB3 LYS 32 HB1 LYS 32 26.173 17.038 35.825
247 HG2 LYS 32 HG2 LYS 32 24.730 18.832 36.711
248 HG3 LYS 32 HG1 LYS 32 23.337 17.756 36.641
249 HD2 LYS 32 HD2 LYS 32 24.443 16.210 38.214
250 HD3 LYS 32 HD1 LYS 32 25.839 17.286 38.288
251 HE2 LYS 32 HE2 LYS 32 24.413 19.089 39.179
252 HE3 LYS 32 HE1 LYS 32 23.010 18.022 39.097
253 HZ1 LYS 32 HZ1 LYS 32 25.039 18.175 41.083
254 HZ2 LYS 32 HZ2 LYS 32 24.925 16.601 40.457
255 HZ3 LYS 32 HZ3 LYS 32 23.557 17.353 41.125
256 H ARG 33 HN ARG 33 24.548 15.295 33.130
257 HA ARG 33 HA ARG 33 27.168 14.948 32.165
258 HB2 ARG 33 HB2 ARG 33 25.549 13.103 32.374
259 HB3 ARG 33 HB1 ARG 33 24.586 13.802 31.074
260 HG2 ARG 33 HG2 ARG 33 26.403 13.506 29.492
261 HG3 ARG 33 HG1 ARG 33 27.485 12.974 30.777
262 HD2 ARG 33 HD2 ARG 33 26.082 11.010 31.183
263 HD3 ARG 33 HD1 ARG 33 24.935 11.554 29.961
264 HE ARG 33 HE ARG 33 27.414 11.390 28.700
265 HH11 ARG 33 HH11 ARG 33 27.988 9.536 27.523
266 HH12 ARG 33 HH12 ARG 33 27.211 8.025 27.863
267 HH21 ARG 33 HH21 ARG 33 25.197 9.322 30.370
268 HH22 ARG 33 HH22 ARG 33 25.631 7.904 29.474
269 H GLU 34 HN GLU 34 24.262 16.272 30.610
270 HA GLU 34 HA GLU 34 25.365 16.656 28.047
271 HB2 GLU 34 HB2 GLU 34 22.945 16.778 28.524
272 HB3 GLU 34 HB1 GLU 34 23.204 18.257 29.447
273 HG2 GLU 34 HG2 GLU 34 22.443 18.807 27.187
274 HG3 GLU 34 HG1 GLU 34 24.101 19.355 27.403
275 H ALA 35 HN ALA 35 25.253 18.757 30.904
276 HA ALA 35 HA ALA 35 26.385 21.052 29.729
277 HB1 ALA 35 HB1 ALA 35 25.352 21.284 31.864
278 HB2 ALA 35 HB2 ALA 35 27.070 21.585 32.119
279 HB3 ALA 35 HB3 ALA 35 26.372 20.029 32.570
280 H GLU 36 HN GLU 36 27.856 18.223 31.265
281 HA GLU 36 HA GLU 36 30.519 19.146 31.297
282 HB2 GLU 36 HB2 GLU 36 29.748 17.156 32.544
283 HB3 GLU 36 HB1 GLU 36 29.494 16.306 31.021
284 HG2 GLU 36 HG2 GLU 36 31.650 15.661 31.985
285 HG3 GLU 36 HG1 GLU 36 31.914 16.563 30.497
286 H ARG 37 HN ARG 37 28.651 17.392 28.846
287 HA ARG 37 HA ARG 37 30.757 16.969 27.020
288 HB2 ARG 37 HB2 ARG 37 27.770 17.241 26.632
289 HB3 ARG 37 HB1 ARG 37 28.870 16.820 25.322
290 HG2 ARG 37 HG2 ARG 37 28.930 15.239 27.890
291 HG3 ARG 37 HG1 ARG 37 27.689 14.904 26.685
292 HD2 ARG 37 HD2 ARG 37 30.672 14.896 26.110
293 HD3 ARG 37 HD1 ARG 37 29.710 13.461 26.426
294 HE ARG 37 HE ARG 37 28.428 14.796 24.360
295 HH11 ARG 37 HH11 ARG 37 28.824 14.241 22.194
296 HH12 ARG 37 HH12 ARG 37 30.307 13.455 21.765
297 HH21 ARG 37 HH21 ARG 37 31.531 13.410 25.009
298 HH22 ARG 37 HH22 ARG 37 31.839 12.984 23.358
299 H LYS 38 HN LYS 38 28.513 19.663 27.463
300 HA LYS 38 HA LYS 38 29.188 21.127 25.154
301 HB2 LYS 38 HB2 LYS 38 27.229 21.637 26.565
302 HB3 LYS 38 HB1 LYS 38 28.302 22.164 27.860
303 HG2 LYS 38 HG2 LYS 38 29.209 23.937 26.411
304 HG3 LYS 38 HG1 LYS 38 28.169 23.397 25.090
305 HD2 LYS 38 HD2 LYS 38 26.175 23.887 26.455
306 HD3 LYS 38 HD1 LYS 38 27.211 24.421 27.779
307 HE2 LYS 38 HE2 LYS 38 28.145 26.193 26.345
308 HE3 LYS 38 HE1 LYS 38 27.120 25.659 25.012
309 HZ1 LYS 38 HZ1 LYS 38 25.733 26.170 27.499
310 HZ2 LYS 38 HZ2 LYS 38 25.314 26.603 25.909
311 HZ3 LYS 38 HZ3 LYS 38 26.428 27.542 26.784
312 H ALA 39 HN ALA 39 30.549 21.154 28.431
313 HA ALA 39 HA ALA 39 32.393 23.247 28.052
314 HB1 ALA 39 HB1 ALA 39 33.631 22.114 29.961
315 HB2 ALA 39 HB2 ALA 39 32.385 20.867 29.911
316 HB3 ALA 39 HB3 ALA 39 31.950 22.534 30.282
317 H LEU 40 HN LEU 40 32.629 19.765 27.467
318 HA LEU 40 HA LEU 40 35.378 19.636 26.909
319 HB2 LEU 40 HB2 LEU 40 34.000 17.638 27.262
320 HB3 LEU 40 HB1 LEU 40 33.105 17.977 25.783
321 HG LEU 40 HG LEU 40 35.187 17.718 24.463
322 HD11 LEU 40 HD11 LEU 40 36.966 18.316 25.876
323 HD12 LEU 40 HD12 LEU 40 37.112 16.562 25.819
324 HD13 LEU 40 HD13 LEU 40 36.364 17.338 27.214
325 HD21 LEU 40 HD21 LEU 40 35.283 15.333 24.597
326 HD22 LEU 40 HD22 LEU 40 33.646 15.777 25.079
327 HD23 LEU 40 HD23 LEU 40 34.837 15.342 26.304
328 H GLU 41 HN GLU 41 32.598 20.185 24.759
329 HA GLU 41 HA GLU 41 34.071 20.370 22.354
330 HB2 GLU 41 HB2 GLU 41 31.619 20.052 22.438
331 HB3 GLU 41 HB1 GLU 41 31.439 21.690 23.062
332 HG2 GLU 41 HG2 GLU 41 32.444 22.609 21.024
333 HG3 GLU 41 HG1 GLU 41 32.717 20.981 20.405
334 H ASP 42 HN ASP 42 33.095 22.781 24.746
335 HA ASP 42 HA ASP 42 33.938 25.079 23.343
336 HB2 ASP 42 HB2 ASP 42 33.596 24.511 26.286
337 HB3 ASP 42 HB1 ASP 42 34.035 26.101 25.665
338 H LYS 43 HN LYS 43 35.717 22.644 25.030
339 HA LYS 43 HA LYS 43 37.992 24.035 25.846
340 HB2 LYS 43 HB2 LYS 43 37.513 21.652 26.364
341 HB3 LYS 43 HB1 LYS 43 37.894 21.245 24.691
342 HG2 LYS 43 HG2 LYS 43 40.166 21.992 24.940
343 HG3 LYS 43 HG1 LYS 43 39.824 22.695 26.519
344 HD2 LYS 43 HD2 LYS 43 40.922 20.628 26.969
345 HD3 LYS 43 HD1 LYS 43 39.213 20.325 27.278
346 HE2 LYS 43 HE2 LYS 43 38.959 19.259 25.104
347 HE3 LYS 43 HE1 LYS 43 40.609 19.690 24.661
348 HZ1 LYS 43 HZ1 LYS 43 41.466 18.059 25.927
349 HZ2 LYS 43 HZ2 LYS 43 39.934 17.354 25.725
350 HZ3 LYS 43 HZ3 LYS 43 40.293 18.217 27.142
351 H LEU 44 HN LEU 44 39.618 25.006 24.819
352 HA LEU 44 HA LEU 44 40.904 25.863 23.114
353 HB2 LEU 44 HB2 LEU 44 40.536 23.007 22.215
354 HB3 LEU 44 HB1 LEU 44 41.606 24.136 21.390
355 HG LEU 44 HG LEU 44 41.798 23.544 24.357
356 HD11 LEU 44 HD11 LEU 44 43.375 22.328 22.075
357 HD12 LEU 44 HD12 LEU 44 42.138 21.493 23.013
358 HD13 LEU 44 HD13 LEU 44 43.630 22.018 23.792
359 HD21 LEU 44 HD21 LEU 44 44.252 24.322 23.740
360 HD22 LEU 44 HD22 LEU 44 42.998 25.528 23.997
361 HD23 LEU 44 HD23 LEU 44 43.462 25.077 22.357
362 H ALA 45 HN ALA 45 37.759 25.342 22.750
363 HA ALA 45 HA ALA 45 37.279 25.365 19.975
364 HB1 ALA 45 HB1 ALA 45 35.509 24.953 21.623
365 HB2 ALA 45 HB2 ALA 45 35.071 26.280 20.550
366 HB3 ALA 45 HB3 ALA 45 35.636 26.619 22.186
367 H ASP 46 HN ASP 46 37.862 27.993 22.274
368 HA ASP 46 HA ASP 46 37.586 30.024 20.194
369 HB2 ASP 46 HB2 ASP 46 36.774 30.473 22.480
370 HB3 ASP 46 HB1 ASP 46 38.415 30.275 23.095
371 H LYS 47 HN LYS 47 39.232 30.055 18.770
372 HA LYS 47 HA LYS 47 41.890 29.289 19.286
373 HB2 LYS 47 HB2 LYS 47 40.935 29.449 17.016
374 HB3 LYS 47 HB1 LYS 47 40.847 31.201 17.179
375 HG2 LYS 47 HG2 LYS 47 43.289 31.321 17.436
376 HG3 LYS 47 HG1 LYS 47 43.397 29.563 17.332
377 HD2 LYS 47 HD2 LYS 47 42.429 29.644 15.059
378 HD3 LYS 47 HD1 LYS 47 42.348 31.404 15.163
379 HE2 LYS 47 HE2 LYS 47 44.894 29.771 15.390
380 HE3 LYS 47 HE1 LYS 47 44.373 30.630 13.940
381 HZ1 LYS 47 HZ1 LYS 47 44.202 32.580 15.711
382 HZ2 LYS 47 HZ2 LYS 47 45.628 32.248 14.852
383 HZ3 LYS 47 HZ3 LYS 47 45.437 31.677 16.441
384 H GLN 48 HN GLN 48 40.326 32.478 19.288
385 HA GLN 48 HA GLN 48 42.332 33.485 21.140
386 HB2 GLN 48 HB2 GLN 48 42.935 35.409 19.735
387 HB3 GLN 48 HB1 GLN 48 43.393 33.894 18.958
388 HG2 GLN 48 HG2 GLN 48 41.279 33.971 17.638
389 HG3 GLN 48 HG1 GLN 48 40.915 35.537 18.360
390 HE21 GLN 48 HE21 GLN 48 42.160 34.231 15.587
391 HE22 GLN 48 HE22 GLN 48 43.202 35.487 15.123
392 H GLU 49 HN GLU 49 41.743 35.569 22.036
393 HA GLU 49 HA GLU 49 38.923 35.794 22.465
394 HB2 GLU 49 HB2 GLU 49 41.175 37.660 23.253
395 HB3 GLU 49 HB1 GLU 49 39.523 37.725 23.870
396 HG2 GLU 49 HG2 GLU 49 41.342 35.314 24.121
397 HG3 GLU 49 HG1 GLU 49 41.098 36.509 25.394
398 H HIS 50 HN HIS 50 37.506 37.394 21.804
399 HA HIS 50 HA HIS 50 37.961 38.514 19.223
400 HB2 HIS 50 HB2 HIS 50 35.759 39.503 19.475
401 HB3 HIS 50 HB1 HIS 50 35.720 37.850 20.089
402 HD2 HIS 50 HD2 HIS 50 35.102 41.448 21.366
403 HE1 HIS 50 HE1 HIS 50 35.053 38.922 24.750
404 HE2 HIS 50 HE2 HIS 50 34.566 41.271 23.916
405 H LEU 51 HN LEU 51 38.740 39.550 22.375
406 HA LEU 51 HA LEU 51 38.545 42.345 22.124
407 HB2 LEU 51 HB2 LEU 51 38.927 41.230 24.275
408 HB3 LEU 51 HB1 LEU 51 40.510 40.686 23.728
409 HG LEU 51 HG LEU 51 41.246 43.039 23.506
410 HD11 LEU 51 HD11 LEU 51 38.380 43.553 24.292
411 HD12 LEU 51 HD12 LEU 51 39.340 44.322 23.029
412 HD13 LEU 51 HD13 LEU 51 39.629 44.724 24.718
413 HD21 LEU 51 HD21 LEU 51 41.547 41.809 25.646
414 HD22 LEU 51 HD22 LEU 51 39.997 42.435 26.205
415 HD23 LEU 51 HD23 LEU 51 41.337 43.542 25.906
416 H ASP 52 HN ASP 52 41.191 40.102 21.359
417 HA ASP 52 HA ASP 52 43.113 40.363 20.119
418 HB2 ASP 52 HB2 ASP 52 41.297 42.363 18.762
419 HB3 ASP 52 HB1 ASP 52 42.887 41.915 18.148
420 H GLY 53 HN GLY 53 42.972 41.837 22.590
421 HA2 GLY 53 HA2 GLY 53 44.008 44.495 22.116
422 HA3 GLY 53 HA1 GLY 53 43.850 43.690 23.676
423 H ALA 54 HN ALA 54 46.114 45.015 23.515
424 HA ALA 54 HA ALA 54 48.285 43.774 22.199
425 HB1 ALA 54 HB1 ALA 54 48.379 46.073 23.078
426 HB2 ALA 54 HB2 ALA 54 49.694 45.088 23.718
427 HB3 ALA 54 HB3 ALA 54 48.290 45.445 24.723
428 H LEU 55 HN LEU 55 49.767 42.260 22.865
429 HA LEU 55 HA LEU 55 48.860 40.402 24.907
430 HB2 LEU 55 HB2 LEU 55 51.343 40.315 23.168
431 HB3 LEU 55 HB1 LEU 55 50.690 38.985 24.125
432 HG LEU 55 HG LEU 55 49.254 40.366 21.837
433 HD11 LEU 55 HD11 LEU 55 51.167 38.977 21.108
434 HD12 LEU 55 HD12 LEU 55 49.633 38.249 20.635
435 HD13 LEU 55 HD13 LEU 55 50.520 37.614 22.019
436 HD21 LEU 55 HD21 LEU 55 47.810 38.181 22.159
437 HD22 LEU 55 HD22 LEU 55 47.528 39.564 23.210
438 HD23 LEU 55 HD23 LEU 55 48.482 38.199 23.790
439 H ARG 56 HN ARG 56 51.201 39.402 25.978
440 HA ARG 56 HA ARG 56 51.731 41.186 28.087
441 HB2 ARG 56 HB2 ARG 56 52.020 38.753 28.283
442 HB3 ARG 56 HB1 ARG 56 53.367 38.819 27.147
443 HG2 ARG 56 HG2 ARG 56 54.662 40.192 28.662
444 HG3 ARG 56 HG1 ARG 56 53.288 40.360 29.755
445 HD2 ARG 56 HD2 ARG 56 54.830 38.666 30.616
446 HD3 ARG 56 HD1 ARG 56 53.315 37.908 30.134
447 HE ARG 56 HE ARG 56 55.190 37.871 27.984
448 HH11 ARG 56 HH11 ARG 56 56.168 35.879 27.494
449 HH12 ARG 56 HH12 ARG 56 56.149 34.600 28.663
450 HH21 ARG 56 HH21 ARG 56 54.412 36.438 31.035
451 HH22 ARG 56 HH22 ARG 56 55.155 34.917 30.667
452 H TYR 57 HN TYR 57 53.587 40.412 25.158
453 HA TYR 57 HA TYR 57 54.927 43.003 25.327
454 HB2 TYR 57 HB2 TYR 57 57.169 42.085 25.196
455 HB3 TYR 57 HB1 TYR 57 56.376 41.449 26.638
456 HD1 TYR 57 HD1 TYR 57 57.588 40.662 23.252
457 HD2 TYR 57 HD2 TYR 57 55.659 39.117 26.763
458 HE1 TYR 57 HE1 TYR 57 57.955 38.350 22.434
459 HE2 TYR 57 HE2 TYR 57 56.024 36.804 25.945
460 HH TYR 57 HH TYR 57 58.051 36.121 23.209
Start of MODEL 14
1 H1 GLY 1 HT1 GLY 1 12.652 -25.261 24.320
2 H2 GLY 1 HT2 GLY 1 12.148 -24.154 25.504
3 H3 GLY 1 HT3 GLY 1 11.464 -24.109 23.950
4 HA2 GLY 1 HA2 GLY 1 9.810 -25.266 24.909
5 HA3 GLY 1 HA1 GLY 1 10.903 -26.619 24.614
6 H SER 2 HN SER 2 12.876 -25.594 26.567
7 HA SER 2 HA SER 2 11.826 -26.892 28.898
8 HB2 SER 2 HB2 SER 2 14.408 -25.382 28.439
9 HB3 SER 2 HB1 SER 2 14.029 -26.305 29.890
10 HG SER 2 HG SER 2 15.207 -27.546 28.379
11 H ALA 3 HN ALA 3 11.772 -25.907 31.029
12 HA ALA 3 HA ALA 3 10.225 -23.563 31.122
13 HB1 ALA 3 HB1 ALA 3 11.894 -24.781 33.338
14 HB2 ALA 3 HB2 ALA 3 10.255 -25.277 32.915
15 HB3 ALA 3 HB3 ALA 3 10.552 -23.657 33.543
16 H GLY 4 HN GLY 4 13.686 -24.127 31.463
17 HA2 GLY 4 HA2 GLY 4 15.431 -22.632 31.094
18 HA3 GLY 4 HA1 GLY 4 14.247 -21.347 30.870
19 H LEU 5 HN LEU 5 13.464 -22.952 33.672
20 HA LEU 5 HA LEU 5 14.146 -20.773 35.347
21 HB2 LEU 5 HB2 LEU 5 13.306 -23.608 35.972
22 HB3 LEU 5 HB1 LEU 5 13.563 -22.391 37.216
23 HG LEU 5 HG LEU 5 11.646 -22.035 34.887
24 HD11 LEU 5 HD11 LEU 5 9.904 -22.411 36.723
25 HD12 LEU 5 HD12 LEU 5 11.218 -23.082 37.689
26 HD13 LEU 5 HD13 LEU 5 10.769 -23.843 36.163
27 HD21 LEU 5 HD21 LEU 5 12.056 -19.874 35.684
28 HD22 LEU 5 HD22 LEU 5 12.365 -20.420 37.331
29 HD23 LEU 5 HD23 LEU 5 10.714 -20.349 36.719
30 H GLN 6 HN GLN 6 15.685 -23.906 34.767
31 HA GLN 6 HA GLN 6 17.666 -23.598 36.789
32 HB2 GLN 6 HB2 GLN 6 18.792 -25.492 35.692
33 HB3 GLN 6 HB1 GLN 6 17.080 -25.809 35.954
34 HG2 GLN 6 HG2 GLN 6 17.874 -24.608 33.314
35 HG3 GLN 6 HG1 GLN 6 18.262 -26.300 33.588
36 HE21 GLN 6 HE21 GLN 6 16.660 -27.087 32.078
37 HE22 GLN 6 HE22 GLN 6 14.997 -26.961 32.390
38 H GLU 7 HN GLU 7 17.394 -22.470 33.515
39 HA GLU 7 HA GLU 7 20.147 -22.023 32.993
40 HB2 GLU 7 HB2 GLU 7 17.643 -20.740 31.893
41 HB3 GLU 7 HB1 GLU 7 19.257 -20.324 31.327
42 HG2 GLU 7 HG2 GLU 7 19.670 -22.597 30.618
43 HG3 GLU 7 HG1 GLU 7 18.171 -23.154 31.356
44 H LYS 8 HN LYS 8 17.635 -20.056 34.503
45 HA LYS 8 HA LYS 8 17.722 -18.118 35.728
46 HB2 LYS 8 HB2 LYS 8 20.549 -19.075 36.236
47 HB3 LYS 8 HB1 LYS 8 19.704 -17.828 37.154
48 HG2 LYS 8 HG2 LYS 8 18.039 -19.404 37.908
49 HG3 LYS 8 HG1 LYS 8 18.655 -20.649 36.824
50 HD2 LYS 8 HD2 LYS 8 19.499 -21.170 39.008
51 HD3 LYS 8 HD1 LYS 8 20.853 -20.515 38.091
52 HE2 LYS 8 HE2 LYS 8 20.628 -18.360 39.169
53 HE3 LYS 8 HE1 LYS 8 19.124 -18.852 39.945
54 HZ1 LYS 8 HZ1 LYS 8 20.716 -19.149 41.580
55 HZ2 LYS 8 HZ2 LYS 8 21.879 -19.749 40.498
56 HZ3 LYS 8 HZ3 LYS 8 20.550 -20.711 40.941
57 H GLU 9 HN GLU 9 18.923 -18.286 32.841
58 HA GLU 9 HA GLU 9 20.867 -16.219 32.671
59 HB2 GLU 9 HB2 GLU 9 18.973 -17.403 30.641
60 HB3 GLU 9 HB1 GLU 9 20.122 -16.127 30.238
61 HG2 GLU 9 HG2 GLU 9 21.992 -17.508 30.856
62 HG3 GLU 9 HG1 GLU 9 20.938 -18.736 31.545
63 H ARG 10 HN ARG 10 17.338 -16.233 32.500
64 HA ARG 10 HA ARG 10 16.985 -13.554 31.694
65 HB2 ARG 10 HB2 ARG 10 15.227 -15.413 33.306
66 HB3 ARG 10 HB1 ARG 10 14.711 -13.816 32.761
67 HG2 ARG 10 HG2 ARG 10 15.020 -14.433 30.443
68 HG3 ARG 10 HG1 ARG 10 15.749 -15.972 30.903
69 HD2 ARG 10 HD2 ARG 10 12.919 -15.160 31.612
70 HD3 ARG 10 HD1 ARG 10 13.338 -16.163 30.227
71 HE ARG 10 HE ARG 10 14.500 -17.338 32.486
72 HH11 ARG 10 HH11 ARG 10 13.457 -19.071 33.519
73 HH12 ARG 10 HH12 ARG 10 11.752 -19.299 33.308
74 HH21 ARG 10 HH21 ARG 10 11.375 -16.555 31.222
75 HH22 ARG 10 HH22 ARG 10 10.574 -17.874 32.008
76 H GLU 11 HN GLU 11 17.348 -15.035 34.890
77 HA GLU 11 HA GLU 11 16.766 -12.751 36.436
78 HB2 GLU 11 HB2 GLU 11 16.911 -15.029 37.375
79 HB3 GLU 11 HB1 GLU 11 18.644 -15.046 37.061
80 HG2 GLU 11 HG2 GLU 11 18.224 -14.472 39.404
81 HG3 GLU 11 HG1 GLU 11 18.920 -13.087 38.570
82 H LEU 12 HN LEU 12 19.807 -13.963 35.068
83 HA LEU 12 HA LEU 12 21.513 -12.037 36.208
84 HB2 LEU 12 HB2 LEU 12 22.350 -14.087 35.154
85 HB3 LEU 12 HB1 LEU 12 21.771 -13.532 33.587
86 HG LEU 12 HG LEU 12 23.304 -11.593 33.703
87 HD11 LEU 12 HD11 LEU 12 23.611 -11.081 35.972
88 HD12 LEU 12 HD12 LEU 12 25.136 -11.863 35.573
89 HD13 LEU 12 HD13 LEU 12 23.881 -12.766 36.421
90 HD21 LEU 12 HD21 LEU 12 24.015 -13.796 32.725
91 HD22 LEU 12 HD22 LEU 12 24.748 -14.197 34.278
92 HD23 LEU 12 HD23 LEU 12 25.358 -12.834 33.341
93 H GLU 13 HN GLU 13 19.754 -12.085 33.125
94 HA GLU 13 HA GLU 13 20.737 -9.643 32.115
95 HB2 GLU 13 HB2 GLU 13 19.507 -11.350 30.778
96 HB3 GLU 13 HB1 GLU 13 18.025 -10.891 31.612
97 HG2 GLU 13 HG2 GLU 13 19.712 -8.827 30.190
98 HG3 GLU 13 HG1 GLU 13 18.522 -9.786 29.316
99 H ASP 14 HN ASP 14 17.960 -10.409 34.164
100 HA ASP 14 HA ASP 14 16.760 -7.867 34.192
101 HB2 ASP 14 HB2 ASP 14 15.687 -9.929 35.051
102 HB3 ASP 14 HB1 ASP 14 16.808 -9.925 36.411
103 H LEU 15 HN LEU 15 19.308 -9.268 36.223
104 HA LEU 15 HA LEU 15 19.497 -7.159 38.083
105 HB2 LEU 15 HB2 LEU 15 21.551 -9.149 37.099
106 HB3 LEU 15 HB1 LEU 15 21.842 -8.034 38.430
107 HG LEU 15 HG LEU 15 19.534 -10.001 38.347
108 HD11 LEU 15 HD11 LEU 15 20.844 -11.388 39.868
109 HD12 LEU 15 HD12 LEU 15 22.165 -10.221 39.838
110 HD13 LEU 15 HD13 LEU 15 21.758 -11.127 38.383
111 HD21 LEU 15 HD21 LEU 15 19.825 -9.487 40.948
112 HD22 LEU 15 HD22 LEU 15 18.895 -8.401 39.924
113 HD23 LEU 15 HD23 LEU 15 20.556 -7.997 40.354
114 H LYS 16 HN LYS 16 21.055 -7.673 34.943
115 HA LYS 16 HA LYS 16 22.835 -5.486 35.064
116 HB2 LYS 16 HB2 LYS 16 21.555 -6.909 32.725
117 HB3 LYS 16 HB1 LYS 16 22.770 -5.643 32.540
118 HG2 LYS 16 HG2 LYS 16 24.348 -6.953 33.915
119 HG3 LYS 16 HG1 LYS 16 23.136 -8.222 34.096
120 HD2 LYS 16 HD2 LYS 16 23.108 -8.556 31.654
121 HD3 LYS 16 HD1 LYS 16 24.310 -7.280 31.462
122 HE2 LYS 16 HE2 LYS 16 25.909 -8.571 32.823
123 HE3 LYS 16 HE1 LYS 16 24.710 -9.846 33.029
124 HZ1 LYS 16 HZ1 LYS 16 24.992 -10.579 30.934
125 HZ2 LYS 16 HZ2 LYS 16 26.516 -9.843 31.089
126 HZ3 LYS 16 HZ3 LYS 16 25.253 -9.030 30.295
127 H ASP 17 HN ASP 17 19.479 -5.754 33.979
128 HA ASP 17 HA ASP 17 19.217 -3.183 32.862
129 HB2 ASP 17 HB2 ASP 17 17.561 -5.000 32.566
130 HB3 ASP 17 HB1 ASP 17 17.100 -4.835 34.260
131 H ALA 18 HN ALA 18 18.696 -4.366 36.168
132 HA ALA 18 HA ALA 18 17.716 -1.967 37.269
133 HB1 ALA 18 HB1 ALA 18 18.300 -2.929 39.430
134 HB2 ALA 18 HB2 ALA 18 19.348 -4.113 38.648
135 HB3 ALA 18 HB3 ALA 18 17.603 -4.176 38.396
136 H GLU 19 HN GLU 19 21.009 -3.193 36.848
137 HA GLU 19 HA GLU 19 22.347 -1.194 38.320
138 HB2 GLU 19 HB2 GLU 19 23.229 -2.918 35.999
139 HB3 GLU 19 HB1 GLU 19 24.318 -1.832 36.865
140 HG2 GLU 19 HG2 GLU 19 23.915 -2.997 38.952
141 HG3 GLU 19 HG1 GLU 19 22.669 -3.994 38.203
142 H LEU 20 HN LEU 20 21.337 -1.356 34.930
143 HA LEU 20 HA LEU 20 22.634 0.992 34.049
144 HB2 LEU 20 HB2 LEU 20 20.136 -0.403 33.073
145 HB3 LEU 20 HB1 LEU 20 20.873 0.961 32.238
146 HG LEU 20 HG LEU 20 22.339 -1.610 32.905
147 HD11 LEU 20 HD11 LEU 20 20.427 -1.915 31.302
148 HD12 LEU 20 HD12 LEU 20 22.004 -2.265 30.597
149 HD13 LEU 20 HD13 LEU 20 21.195 -0.740 30.236
150 HD21 LEU 20 HD21 LEU 20 23.757 -0.584 30.893
151 HD22 LEU 20 HD22 LEU 20 24.032 -0.043 32.544
152 HD23 LEU 20 HD23 LEU 20 23.051 0.932 31.452
153 H LYS 21 HN LYS 21 19.464 0.432 35.509
154 HA LYS 21 HA LYS 21 18.427 3.034 35.174
155 HB2 LYS 21 HB2 LYS 21 17.886 0.904 37.252
156 HB3 LYS 21 HB1 LYS 21 16.969 2.404 37.150
157 HG2 LYS 21 HG2 LYS 21 17.280 0.656 34.710
158 HG3 LYS 21 HG1 LYS 21 16.063 0.268 35.924
159 HD2 LYS 21 HD2 LYS 21 15.164 2.603 35.685
160 HD3 LYS 21 HD1 LYS 21 16.293 2.858 34.356
161 HE2 LYS 21 HE2 LYS 21 14.239 0.635 34.434
162 HE3 LYS 21 HE1 LYS 21 14.012 2.165 33.589
163 HZ1 LYS 21 HZ1 LYS 21 15.246 1.455 31.908
164 HZ2 LYS 21 HZ2 LYS 21 15.242 -0.091 32.614
165 HZ3 LYS 21 HZ3 LYS 21 16.515 0.988 32.933
166 H ARG 22 HN ARG 22 20.413 1.586 37.711
167 HA ARG 22 HA ARG 22 20.328 3.712 39.551
168 HB2 ARG 22 HB2 ARG 22 21.211 1.477 40.100
169 HB3 ARG 22 HB1 ARG 22 22.583 1.759 39.028
170 HG2 ARG 22 HG2 ARG 22 23.337 3.621 40.392
171 HG3 ARG 22 HG1 ARG 22 21.895 3.515 41.401
172 HD2 ARG 22 HD2 ARG 22 23.916 1.280 41.096
173 HD3 ARG 22 HD1 ARG 22 23.920 2.437 42.423
174 HE ARG 22 HE ARG 22 21.357 1.318 42.306
175 HH11 ARG 22 HH11 ARG 22 20.807 -0.389 43.699
176 HH12 ARG 22 HH12 ARG 22 22.055 -1.364 44.400
177 HH21 ARG 22 HH21 ARG 22 24.638 0.368 42.865
178 HH22 ARG 22 HH22 ARG 22 24.224 -0.935 43.927
179 H LEU 23 HN LEU 23 22.523 3.052 36.842
180 HA LEU 23 HA LEU 23 24.280 5.218 37.268
181 HB2 LEU 23 HB2 LEU 23 23.522 3.715 34.756
182 HB3 LEU 23 HB1 LEU 23 24.806 4.920 34.816
183 HG LEU 23 HG LEU 23 24.700 2.472 36.606
184 HD11 LEU 23 HD11 LEU 23 24.963 1.662 34.371
185 HD12 LEU 23 HD12 LEU 23 26.580 1.683 35.077
186 HD13 LEU 23 HD13 LEU 23 26.089 2.957 33.962
187 HD21 LEU 23 HD21 LEU 23 26.148 3.942 37.696
188 HD22 LEU 23 HD22 LEU 23 26.649 4.736 36.204
189 HD23 LEU 23 HD23 LEU 23 27.280 3.142 36.612
190 H ASN 24 HN ASN 24 21.259 4.945 35.453
191 HA ASN 24 HA ASN 24 21.341 7.453 34.179
192 HB2 ASN 24 HB2 ASN 24 19.026 5.717 35.047
193 HB3 ASN 24 HB1 ASN 24 18.825 7.192 34.103
194 HD21 ASN 24 HD21 ASN 24 20.583 7.191 32.130
195 HD22 ASN 24 HD22 ASN 24 20.593 5.747 31.237
196 H GLU 25 HN GLU 25 20.156 6.472 37.364
197 HA GLU 25 HA GLU 25 19.509 7.683 39.202
198 HB2 GLU 25 HB2 GLU 25 21.248 9.803 37.907
199 HB3 GLU 25 HB1 GLU 25 20.701 9.806 39.583
200 HG2 GLU 25 HG2 GLU 25 21.864 7.663 39.969
201 HG3 GLU 25 HG1 GLU 25 22.428 7.676 38.299
202 H GLU 26 HN GLU 26 19.182 10.627 39.245
203 HA GLU 26 HA GLU 26 16.489 10.701 38.188
204 HB2 GLU 26 HB2 GLU 26 18.121 12.779 39.682
205 HB3 GLU 26 HB1 GLU 26 16.421 12.952 39.256
206 HG2 GLU 26 HG2 GLU 26 16.303 12.129 41.449
207 HG3 GLU 26 HG1 GLU 26 16.115 10.666 40.489
208 H ARG 27 HN ARG 27 15.890 13.017 37.120
209 HA ARG 27 HA ARG 27 17.186 13.070 34.600
210 HB2 ARG 27 HB2 ARG 27 15.737 14.941 34.099
211 HB3 ARG 27 HB1 ARG 27 14.815 13.746 35.010
212 HG2 ARG 27 HG2 ARG 27 15.335 15.053 37.105
213 HG3 ARG 27 HG1 ARG 27 16.042 16.304 36.081
214 HD2 ARG 27 HD2 ARG 27 13.754 16.930 36.533
215 HD3 ARG 27 HD1 ARG 27 13.860 16.436 34.845
216 HE ARG 27 HE ARG 27 12.506 14.605 35.342
217 HH11 ARG 27 HH11 ARG 27 11.174 13.402 36.735
218 HH12 ARG 27 HH12 ARG 27 11.256 13.668 38.443
219 HH21 ARG 27 HH21 ARG 27 13.696 16.119 38.217
220 HH22 ARG 27 HH22 ARG 27 12.683 15.205 39.283
221 H HIS 28 HN HIS 28 17.835 14.636 37.604
222 HA HIS 28 HA HIS 28 19.185 16.941 36.688
223 HB2 HIS 28 HB2 HIS 28 19.444 15.304 39.214
224 HB3 HIS 28 HB1 HIS 28 20.352 16.792 38.943
225 HD2 HIS 28 HD2 HIS 28 18.877 19.141 39.318
226 HE1 HIS 28 HE1 HIS 28 15.117 17.314 39.912
227 HE2 HIS 28 HE2 HIS 28 16.379 19.517 39.978
228 H ASP 29 HN ASP 29 20.287 13.633 37.299
229 HA ASP 29 HA ASP 29 23.048 14.078 36.969
230 HB2 ASP 29 HB2 ASP 29 22.078 11.997 37.897
231 HB3 ASP 29 HB1 ASP 29 21.465 11.588 36.295
232 H HIS 30 HN HIS 30 20.507 13.254 34.633
233 HA HIS 30 HA HIS 30 22.153 12.929 32.377
234 HB2 HIS 30 HB2 HIS 30 19.815 12.232 32.374
235 HB3 HIS 30 HB1 HIS 30 19.292 13.907 32.550
236 HD2 HIS 30 HD2 HIS 30 18.944 15.204 30.129
237 HE1 HIS 30 HE1 HIS 30 21.108 12.510 27.704
238 HE2 HIS 30 HE2 HIS 30 19.659 14.596 27.694
239 H ASP 31 HN ASP 31 20.486 15.818 33.629
240 HA ASP 31 HA ASP 31 21.291 17.583 31.585
241 HB2 ASP 31 HB2 ASP 31 20.549 18.042 34.477
242 HB3 ASP 31 HB1 ASP 31 20.895 19.359 33.357
243 H LYS 32 HN LYS 32 22.825 16.644 34.633
244 HA LYS 32 HA LYS 32 24.936 18.508 34.601
245 HB2 LYS 32 HB2 LYS 32 24.360 17.137 36.570
246 HB3 LYS 32 HB1 LYS 32 24.915 15.694 35.723
247 HG2 LYS 32 HG2 LYS 32 27.182 16.631 35.565
248 HG3 LYS 32 HG1 LYS 32 26.638 18.109 36.359
249 HD2 LYS 32 HD2 LYS 32 26.023 16.797 38.364
250 HD3 LYS 32 HD1 LYS 32 26.596 15.329 37.571
251 HE2 LYS 32 HE2 LYS 32 28.306 17.768 38.135
252 HE3 LYS 32 HE1 LYS 32 28.304 16.293 39.102
253 HZ1 LYS 32 HZ1 LYS 32 29.629 15.305 37.648
254 HZ2 LYS 32 HZ2 LYS 32 29.808 16.796 36.853
255 HZ3 LYS 32 HZ3 LYS 32 28.615 15.699 36.346
256 H ARG 33 HN ARG 33 24.685 15.227 33.262
257 HA ARG 33 HA ARG 33 27.338 15.079 32.284
258 HB2 ARG 33 HB2 ARG 33 24.803 13.651 31.472
259 HB3 ARG 33 HB1 ARG 33 26.370 13.310 30.737
260 HG2 ARG 33 HG2 ARG 33 27.306 12.691 32.894
261 HG3 ARG 33 HG1 ARG 33 25.825 13.168 33.719
262 HD2 ARG 33 HD2 ARG 33 25.940 11.014 31.597
263 HD3 ARG 33 HD1 ARG 33 26.036 10.686 33.324
264 HE ARG 33 HE ARG 33 23.746 12.237 32.896
265 HH11 ARG 33 HH11 ARG 33 21.715 11.220 32.758
266 HH12 ARG 33 HH12 ARG 33 21.620 9.543 32.335
267 HH21 ARG 33 HH21 ARG 33 25.052 9.150 32.038
268 HH22 ARG 33 HH22 ARG 33 23.508 8.371 31.929
269 H GLU 34 HN GLU 34 24.328 16.262 30.862
270 HA GLU 34 HA GLU 34 25.258 16.647 28.232
271 HB2 GLU 34 HB2 GLU 34 22.875 16.737 28.850
272 HB3 GLU 34 HB1 GLU 34 23.165 18.212 29.769
273 HG2 GLU 34 HG2 GLU 34 22.253 18.759 27.561
274 HG3 GLU 34 HG1 GLU 34 23.906 19.348 27.687
275 H ALA 35 HN ALA 35 25.270 18.790 31.062
276 HA ALA 35 HA ALA 35 26.317 21.072 29.784
277 HB1 ALA 35 HB1 ALA 35 26.768 20.241 32.658
278 HB2 ALA 35 HB2 ALA 35 25.294 21.016 32.073
279 HB3 ALA 35 HB3 ALA 35 26.832 21.876 32.000
280 H GLU 36 HN GLU 36 27.893 18.303 31.327
281 HA GLU 36 HA GLU 36 30.538 19.278 31.218
282 HB2 GLU 36 HB2 GLU 36 29.449 16.457 31.224
283 HB3 GLU 36 HB1 GLU 36 31.163 16.846 31.371
284 HG2 GLU 36 HG2 GLU 36 29.036 17.959 33.217
285 HG3 GLU 36 HG1 GLU 36 29.976 16.512 33.577
286 H ARG 37 HN ARG 37 28.601 17.434 28.891
287 HA ARG 37 HA ARG 37 30.657 16.873 27.053
288 HB2 ARG 37 HB2 ARG 37 28.436 15.802 26.969
289 HB3 ARG 37 HB1 ARG 37 27.720 17.340 26.487
290 HG2 ARG 37 HG2 ARG 37 29.020 17.377 24.443
291 HG3 ARG 37 HG1 ARG 37 29.928 15.951 24.946
292 HD2 ARG 37 HD2 ARG 37 28.203 15.280 23.361
293 HD3 ARG 37 HD1 ARG 37 27.806 14.647 24.955
294 HE ARG 37 HE ARG 37 26.572 17.183 24.562
295 HH11 ARG 37 HH11 ARG 37 24.341 17.210 24.132
296 HH12 ARG 37 HH12 ARG 37 23.551 15.765 23.593
297 HH21 ARG 37 HH21 ARG 37 26.439 13.850 23.639
298 HH22 ARG 37 HH22 ARG 37 24.739 13.863 23.313
299 H LYS 38 HN LYS 38 28.440 19.637 27.303
300 HA LYS 38 HA LYS 38 29.275 20.967 24.959
301 HB2 LYS 38 HB2 LYS 38 28.072 21.997 27.534
302 HB3 LYS 38 HB1 LYS 38 28.358 23.015 26.122
303 HG2 LYS 38 HG2 LYS 38 26.944 21.525 24.755
304 HG3 LYS 38 HG1 LYS 38 26.654 20.507 26.165
305 HD2 LYS 38 HD2 LYS 38 25.614 22.411 27.336
306 HD3 LYS 38 HD1 LYS 38 25.904 23.436 25.930
307 HE2 LYS 38 HE2 LYS 38 24.490 21.960 24.552
308 HE3 LYS 38 HE1 LYS 38 24.202 20.927 25.951
309 HZ1 LYS 38 HZ1 LYS 38 23.449 23.789 25.702
310 HZ2 LYS 38 HZ2 LYS 38 23.221 22.837 27.090
311 HZ3 LYS 38 HZ3 LYS 38 22.386 22.468 25.657
312 H ALA 39 HN ALA 39 30.463 21.073 28.290
313 HA ALA 39 HA ALA 39 32.265 23.216 27.994
314 HB1 ALA 39 HB1 ALA 39 33.312 22.401 30.016
315 HB2 ALA 39 HB2 ALA 39 32.581 20.811 29.801
316 HB3 ALA 39 HB3 ALA 39 31.566 22.204 30.171
317 H LEU 40 HN LEU 40 32.631 19.740 27.428
318 HA LEU 40 HA LEU 40 35.411 19.741 26.928
319 HB2 LEU 40 HB2 LEU 40 33.200 17.922 25.958
320 HB3 LEU 40 HB1 LEU 40 34.907 17.611 25.666
321 HG LEU 40 HG LEU 40 33.707 18.005 28.425
322 HD11 LEU 40 HD11 LEU 40 34.479 15.416 27.050
323 HD12 LEU 40 HD12 LEU 40 32.823 15.984 27.246
324 HD13 LEU 40 HD13 LEU 40 33.791 15.585 28.664
325 HD21 LEU 40 HD21 LEU 40 36.454 17.353 27.369
326 HD22 LEU 40 HD22 LEU 40 35.953 16.654 28.908
327 HD23 LEU 40 HD23 LEU 40 35.990 18.402 28.709
328 H GLU 41 HN GLU 41 32.619 20.253 24.823
329 HA GLU 41 HA GLU 41 34.004 20.281 22.364
330 HB2 GLU 41 HB2 GLU 41 31.432 21.602 23.244
331 HB3 GLU 41 HB1 GLU 41 32.020 21.643 21.583
332 HG2 GLU 41 HG2 GLU 41 31.970 19.225 21.440
333 HG3 GLU 41 HG1 GLU 41 31.568 19.092 23.150
334 H ASP 42 HN ASP 42 33.298 22.828 24.718
335 HA ASP 42 HA ASP 42 34.443 24.910 23.089
336 HB2 ASP 42 HB2 ASP 42 32.630 25.163 24.903
337 HB3 ASP 42 HB1 ASP 42 33.953 25.075 26.063
338 H LYS 43 HN LYS 43 36.018 26.357 24.873
339 HA LYS 43 HA LYS 43 38.219 26.565 25.495
340 HB2 LYS 43 HB2 LYS 43 37.697 23.771 26.540
341 HB3 LYS 43 HB1 LYS 43 39.087 24.770 26.968
342 HG2 LYS 43 HG2 LYS 43 37.570 26.502 27.862
343 HG3 LYS 43 HG1 LYS 43 36.182 25.495 27.447
344 HD2 LYS 43 HD2 LYS 43 37.047 23.713 28.940
345 HD3 LYS 43 HD1 LYS 43 38.397 24.759 29.385
346 HE2 LYS 43 HE2 LYS 43 35.467 25.432 29.798
347 HE3 LYS 43 HE1 LYS 43 36.562 24.855 31.057
348 HZ1 LYS 43 HZ1 LYS 43 37.092 27.282 29.440
349 HZ2 LYS 43 HZ2 LYS 43 37.884 26.783 30.857
350 HZ3 LYS 43 HZ3 LYS 43 36.274 27.324 30.927
351 H LEU 44 HN LEU 44 37.774 25.761 22.822
352 HA LEU 44 HA LEU 44 40.318 24.394 22.282
353 HB2 LEU 44 HB2 LEU 44 38.615 22.625 22.186
354 HB3 LEU 44 HB1 LEU 44 37.666 23.587 21.055
355 HG LEU 44 HG LEU 44 39.524 23.496 19.419
356 HD11 LEU 44 HD11 LEU 44 41.520 23.299 20.634
357 HD12 LEU 44 HD12 LEU 44 41.313 21.660 20.026
358 HD13 LEU 44 HD13 LEU 44 40.873 22.043 21.691
359 HD21 LEU 44 HD21 LEU 44 37.864 21.788 19.188
360 HD22 LEU 44 HD22 LEU 44 38.512 20.879 20.554
361 HD23 LEU 44 HD23 LEU 44 39.423 20.972 19.046
362 H ALA 45 HN ALA 45 37.500 26.096 20.948
363 HA ALA 45 HA ALA 45 38.667 26.863 18.502
364 HB1 ALA 45 HB1 ALA 45 36.504 28.191 20.147
365 HB2 ALA 45 HB2 ALA 45 36.276 27.035 18.835
366 HB3 ALA 45 HB3 ALA 45 36.916 28.643 18.493
367 H ASP 46 HN ASP 46 38.646 28.406 21.686
368 HA ASP 46 HA ASP 46 40.153 30.706 20.726
369 HB2 ASP 46 HB2 ASP 46 38.431 30.982 22.469
370 HB3 ASP 46 HB1 ASP 46 39.343 29.911 23.532
371 H LYS 47 HN LYS 47 42.230 30.297 20.230
372 HA LYS 47 HA LYS 47 43.812 28.318 21.574
373 HB2 LYS 47 HB2 LYS 47 44.554 30.528 19.645
374 HB3 LYS 47 HB1 LYS 47 45.677 29.297 20.225
375 HG2 LYS 47 HG2 LYS 47 44.218 27.529 19.310
376 HG3 LYS 47 HG1 LYS 47 43.098 28.760 18.722
377 HD2 LYS 47 HD2 LYS 47 44.901 29.716 17.319
378 HD3 LYS 47 HD1 LYS 47 45.997 28.455 17.883
379 HE2 LYS 47 HE2 LYS 47 43.391 27.958 16.414
380 HE3 LYS 47 HE1 LYS 47 44.993 27.895 15.678
381 HZ1 LYS 47 HZ1 LYS 47 44.080 26.208 17.947
382 HZ2 LYS 47 HZ2 LYS 47 45.599 26.130 17.189
383 HZ3 LYS 47 HZ3 LYS 47 44.196 25.698 16.334
384 H GLN 48 HN GLN 48 45.428 28.583 23.076
385 HA GLN 48 HA GLN 48 45.257 30.970 24.732
386 HB2 GLN 48 HB2 GLN 48 46.777 28.370 25.017
387 HB3 GLN 48 HB1 GLN 48 46.865 29.688 26.187
388 HG2 GLN 48 HG2 GLN 48 44.499 29.545 26.633
389 HG3 GLN 48 HG1 GLN 48 44.271 28.390 25.320
390 HE21 GLN 48 HE21 GLN 48 43.720 27.999 28.247
391 HE22 GLN 48 HE22 GLN 48 44.658 26.662 28.707
392 H GLU 49 HN GLU 49 47.228 32.074 25.473
393 HA GLU 49 HA GLU 49 49.083 33.346 25.026
394 HB2 GLU 49 HB2 GLU 49 49.935 30.816 23.595
395 HB3 GLU 49 HB1 GLU 49 50.993 32.185 23.920
396 HG2 GLU 49 HG2 GLU 49 51.429 30.750 25.727
397 HG3 GLU 49 HG1 GLU 49 50.267 31.888 26.402
398 H HIS 50 HN HIS 50 47.157 34.255 23.543
399 HA HIS 50 HA HIS 50 47.375 34.057 20.742
400 HB2 HIS 50 HB2 HIS 50 46.322 36.258 22.526
401 HB3 HIS 50 HB1 HIS 50 46.186 36.285 20.770
402 HD2 HIS 50 HD2 HIS 50 44.312 34.816 23.771
403 HE1 HIS 50 HE1 HIS 50 42.864 32.783 20.367
404 HE2 HIS 50 HE2 HIS 50 42.479 33.208 22.841
405 H LEU 51 HN LEU 51 48.908 36.225 23.087
406 HA LEU 51 HA LEU 51 50.281 37.732 21.028
407 HB2 LEU 51 HB2 LEU 51 50.177 37.771 24.031
408 HB3 LEU 51 HB1 LEU 51 51.526 38.570 23.233
409 HG LEU 51 HG LEU 51 49.561 40.076 23.711
410 HD11 LEU 51 HD11 LEU 51 49.771 39.954 20.720
411 HD12 LEU 51 HD12 LEU 51 51.252 40.219 21.639
412 HD13 LEU 51 HD13 LEU 51 49.901 41.333 21.806
413 HD21 LEU 51 HD21 LEU 51 47.495 39.799 22.590
414 HD22 LEU 51 HD22 LEU 51 47.905 38.176 23.143
415 HD23 LEU 51 HD23 LEU 51 48.165 38.625 21.458
416 H ASP 52 HN ASP 52 52.854 38.032 21.994
417 HA ASP 52 HA ASP 52 54.168 35.760 20.969
418 HB2 ASP 52 HB2 ASP 52 55.152 38.072 22.647
419 HB3 ASP 52 HB1 ASP 52 56.220 36.834 21.986
420 H GLY 53 HN GLY 53 53.468 36.791 24.280
421 HA2 GLY 53 HA2 GLY 53 53.236 35.462 26.177
422 HA3 GLY 53 HA1 GLY 53 53.747 34.067 25.232
423 H ALA 54 HN ALA 54 55.915 36.482 24.628
424 HA ALA 54 HA ALA 54 58.065 35.218 25.933
425 HB1 ALA 54 HB1 ALA 54 59.401 37.040 25.181
426 HB2 ALA 54 HB2 ALA 54 58.008 38.119 25.098
427 HB3 ALA 54 HB3 ALA 54 58.169 36.798 23.942
428 H LEU 55 HN LEU 55 56.064 37.991 26.841
429 HA LEU 55 HA LEU 55 57.538 38.815 29.089
430 HB2 LEU 55 HB2 LEU 55 55.771 40.190 28.087
431 HB3 LEU 55 HB1 LEU 55 54.559 39.004 28.569
432 HG LEU 55 HG LEU 55 55.115 39.400 30.949
433 HD11 LEU 55 HD11 LEU 55 56.540 41.583 31.304
434 HD12 LEU 55 HD12 LEU 55 57.195 41.197 29.712
435 HD13 LEU 55 HD13 LEU 55 57.365 40.049 31.041
436 HD21 LEU 55 HD21 LEU 55 54.063 41.558 31.120
437 HD22 LEU 55 HD22 LEU 55 53.399 40.775 29.686
438 HD23 LEU 55 HD23 LEU 55 54.632 42.025 29.516
439 H ARG 56 HN ARG 56 54.863 36.500 28.765
440 HA ARG 56 HA ARG 56 54.650 35.888 31.527
441 HB2 ARG 56 HB2 ARG 56 52.883 35.363 29.879
442 HB3 ARG 56 HB1 ARG 56 53.944 34.164 29.140
443 HG2 ARG 56 HG2 ARG 56 54.001 32.868 31.193
444 HG3 ARG 56 HG1 ARG 56 53.086 34.111 32.046
445 HD2 ARG 56 HD2 ARG 56 52.054 32.596 29.633
446 HD3 ARG 56 HD1 ARG 56 51.682 32.169 31.302
447 HE ARG 56 HE ARG 56 51.030 34.869 30.973
448 HH11 ARG 56 HH11 ARG 56 48.879 35.472 30.562
449 HH12 ARG 56 HH12 ARG 56 47.774 34.318 29.893
450 HH21 ARG 56 HH21 ARG 56 50.117 31.765 29.747
451 HH22 ARG 56 HH22 ARG 56 48.476 32.219 29.431
452 H TYR 57 HN TYR 57 55.814 34.580 32.806
453 HA TYR 57 HA TYR 57 57.562 33.261 33.507
454 HB2 TYR 57 HB2 TYR 57 56.171 31.489 32.602
455 HB3 TYR 57 HB1 TYR 57 56.780 31.796 30.975
456 HD1 TYR 57 HD1 TYR 57 57.827 30.761 34.406
457 HD2 TYR 57 HD2 TYR 57 58.795 30.796 30.220
458 HE1 TYR 57 HE1 TYR 57 59.730 29.230 34.832
459 HE2 TYR 57 HE2 TYR 57 60.698 29.265 30.647
460 HH TYR 57 HH TYR 57 62.182 28.832 33.147
Start of MODEL 15
1 H1 GLY 1 HT1 GLY 1 6.138 -4.762 41.538
2 H2 GLY 1 HT2 GLY 1 5.440 -3.574 40.543
3 H3 GLY 1 HT3 GLY 1 6.530 -4.700 39.889
4 HA2 GLY 1 HA2 GLY 1 4.020 -5.587 41.161
5 HA3 GLY 1 HA1 GLY 1 4.052 -5.071 39.474
6 H SER 2 HN SER 2 7.066 -6.203 40.124
7 HA SER 2 HA SER 2 6.831 -8.494 38.497
8 HB2 SER 2 HB2 SER 2 8.981 -7.679 40.461
9 HB3 SER 2 HB1 SER 2 9.130 -9.027 39.337
10 HG SER 2 HG SER 2 9.249 -7.660 37.694
11 H ALA 3 HN ALA 3 6.882 -8.087 42.014
12 HA ALA 3 HA ALA 3 6.994 -10.811 42.723
13 HB1 ALA 3 HB1 ALA 3 5.930 -8.351 44.098
14 HB2 ALA 3 HB2 ALA 3 7.391 -9.269 44.462
15 HB3 ALA 3 HB3 ALA 3 5.808 -9.941 44.850
16 H GLY 4 HN GLY 4 4.265 -8.667 42.028
17 HA2 GLY 4 HA2 GLY 4 2.165 -9.226 41.200
18 HA3 GLY 4 HA1 GLY 4 2.599 -10.930 41.323
19 H LEU 5 HN LEU 5 3.410 -9.626 44.230
20 HA LEU 5 HA LEU 5 0.721 -9.808 45.418
21 HB2 LEU 5 HB2 LEU 5 1.651 -12.080 45.552
22 HB3 LEU 5 HB1 LEU 5 3.104 -11.449 46.323
23 HG LEU 5 HG LEU 5 1.747 -10.643 48.229
24 HD11 LEU 5 HD11 LEU 5 -0.501 -11.665 46.502
25 HD12 LEU 5 HD12 LEU 5 -0.396 -10.160 47.414
26 HD13 LEU 5 HD13 LEU 5 -0.675 -11.678 48.258
27 HD21 LEU 5 HD21 LEU 5 1.493 -13.545 47.422
28 HD22 LEU 5 HD22 LEU 5 0.968 -12.964 49.001
29 HD23 LEU 5 HD23 LEU 5 2.659 -12.821 48.529
30 H GLN 6 HN GLN 6 0.418 -8.165 46.750
31 HA GLN 6 HA GLN 6 2.424 -6.279 47.376
32 HB2 GLN 6 HB2 GLN 6 -0.005 -5.770 47.286
33 HB3 GLN 6 HB1 GLN 6 -0.234 -6.705 48.764
34 HG2 GLN 6 HG2 GLN 6 1.265 -5.205 49.983
35 HG3 GLN 6 HG1 GLN 6 1.597 -4.302 48.506
36 HE21 GLN 6 HE21 GLN 6 0.612 -2.703 50.429
37 HE22 GLN 6 HE22 GLN 6 -1.038 -2.372 50.209
38 H GLU 7 HN GLU 7 1.035 -8.961 49.221
39 HA GLU 7 HA GLU 7 2.251 -8.370 51.697
40 HB2 GLU 7 HB2 GLU 7 1.274 -10.965 50.504
41 HB3 GLU 7 HB1 GLU 7 1.922 -10.853 52.139
42 HG2 GLU 7 HG2 GLU 7 0.206 -9.278 52.785
43 HG3 GLU 7 HG1 GLU 7 -0.372 -9.146 51.127
44 H LYS 8 HN LYS 8 3.393 -10.269 48.924
45 HA LYS 8 HA LYS 8 5.689 -11.345 50.149
46 HB2 LYS 8 HB2 LYS 8 4.824 -12.128 47.973
47 HB3 LYS 8 HB1 LYS 8 5.299 -10.596 47.239
48 HG2 LYS 8 HG2 LYS 8 7.650 -11.031 47.805
49 HG3 LYS 8 HG1 LYS 8 7.193 -12.537 48.600
50 HD2 LYS 8 HD2 LYS 8 6.325 -13.406 46.462
51 HD3 LYS 8 HD1 LYS 8 6.778 -11.900 45.665
52 HE2 LYS 8 HE2 LYS 8 9.140 -12.294 46.247
53 HE3 LYS 8 HE1 LYS 8 8.694 -13.794 47.058
54 HZ1 LYS 8 HZ1 LYS 8 9.379 -13.562 44.449
55 HZ2 LYS 8 HZ2 LYS 8 7.682 -13.600 44.377
56 HZ3 LYS 8 HZ3 LYS 8 8.531 -14.866 45.128
57 H GLU 9 HN GLU 9 5.177 -8.299 48.400
58 HA GLU 9 HA GLU 9 7.926 -7.480 48.693
59 HB2 GLU 9 HB2 GLU 9 5.431 -6.039 47.773
60 HB3 GLU 9 HB1 GLU 9 7.009 -5.258 47.867
61 HG2 GLU 9 HG2 GLU 9 7.957 -6.838 46.299
62 HG3 GLU 9 HG1 GLU 9 6.482 -7.803 46.312
63 H ARG 10 HN ARG 10 7.917 -4.890 49.543
64 HA ARG 10 HA ARG 10 6.682 -4.915 52.238
65 HB2 ARG 10 HB2 ARG 10 9.540 -4.206 51.528
66 HB3 ARG 10 HB1 ARG 10 8.792 -3.894 53.096
67 HG2 ARG 10 HG2 ARG 10 8.256 -6.366 53.220
68 HG3 ARG 10 HG1 ARG 10 9.264 -6.586 51.789
69 HD2 ARG 10 HD2 ARG 10 10.191 -5.335 54.390
70 HD3 ARG 10 HD1 ARG 10 10.524 -6.992 53.894
71 HE ARG 10 HE ARG 10 11.746 -4.570 52.814
72 HH11 ARG 10 HH11 ARG 10 13.501 -4.939 51.424
73 HH12 ARG 10 HH12 ARG 10 13.810 -6.536 50.829
74 HH21 ARG 10 HH21 ARG 10 11.126 -7.963 52.497
75 HH22 ARG 10 HH22 ARG 10 12.466 -8.246 51.436
76 H GLU 11 HN GLU 11 6.168 -2.889 53.082
77 HA GLU 11 HA GLU 11 5.380 -0.919 51.206
78 HB2 GLU 11 HB2 GLU 11 5.607 -0.846 54.218
79 HB3 GLU 11 HB1 GLU 11 4.975 0.497 53.268
80 HG2 GLU 11 HG2 GLU 11 3.865 -2.322 53.110
81 HG3 GLU 11 HG1 GLU 11 3.207 -1.073 54.163
82 H LEU 12 HN LEU 12 8.160 -1.181 53.374
83 HA LEU 12 HA LEU 12 9.197 1.412 52.965
84 HB2 LEU 12 HB2 LEU 12 10.548 -1.198 53.679
85 HB3 LEU 12 HB1 LEU 12 11.382 0.354 53.668
86 HG LEU 12 HG LEU 12 8.882 -0.211 55.294
87 HD11 LEU 12 HD11 LEU 12 11.777 -0.150 56.202
88 HD12 LEU 12 HD12 LEU 12 10.813 -1.613 56.002
89 HD13 LEU 12 HD13 LEU 12 10.367 -0.424 57.225
90 HD21 LEU 12 HD21 LEU 12 8.984 2.118 55.145
91 HD22 LEU 12 HD22 LEU 12 10.738 2.144 54.987
92 HD23 LEU 12 HD23 LEU 12 9.998 1.854 56.558
93 H GLU 13 HN GLU 13 9.651 -1.630 51.219
94 HA GLU 13 HA GLU 13 11.702 -0.773 49.485
95 HB2 GLU 13 HB2 GLU 13 11.052 -3.141 49.776
96 HB3 GLU 13 HB1 GLU 13 9.523 -2.810 48.965
97 HG2 GLU 13 HG2 GLU 13 10.715 -2.158 46.924
98 HG3 GLU 13 HG1 GLU 13 12.263 -2.399 47.732
99 H ASP 14 HN ASP 14 8.168 -0.649 49.210
100 HA ASP 14 HA ASP 14 8.033 0.337 46.575
101 HB2 ASP 14 HB2 ASP 14 6.164 0.605 48.931
102 HB3 ASP 14 HB1 ASP 14 5.775 1.221 47.325
103 H LEU 15 HN LEU 15 8.337 1.977 49.694
104 HA LEU 15 HA LEU 15 7.990 4.615 48.783
105 HB2 LEU 15 HB2 LEU 15 7.955 4.020 51.161
106 HB3 LEU 15 HB1 LEU 15 9.659 3.580 51.090
107 HG LEU 15 HG LEU 15 10.239 5.912 50.495
108 HD11 LEU 15 HD11 LEU 15 8.257 7.589 50.937
109 HD12 LEU 15 HD12 LEU 15 7.237 6.208 50.535
110 HD13 LEU 15 HD13 LEU 15 8.400 6.820 49.358
111 HD21 LEU 15 HD21 LEU 15 10.268 5.337 52.844
112 HD22 LEU 15 HD22 LEU 15 8.520 5.534 52.964
113 HD23 LEU 15 HD23 LEU 15 9.550 6.940 52.696
114 H LYS 16 HN LYS 16 10.908 2.618 49.120
115 HA LYS 16 HA LYS 16 12.782 4.569 48.343
116 HB2 LYS 16 HB2 LYS 16 13.407 2.426 49.394
117 HB3 LYS 16 HB1 LYS 16 12.897 1.567 47.940
118 HG2 LYS 16 HG2 LYS 16 14.589 2.762 46.616
119 HG3 LYS 16 HG1 LYS 16 15.079 3.674 48.044
120 HD2 LYS 16 HD2 LYS 16 15.757 1.601 49.164
121 HD3 LYS 16 HD1 LYS 16 15.213 0.656 47.777
122 HE2 LYS 16 HE2 LYS 16 17.640 0.987 47.661
123 HE3 LYS 16 HE1 LYS 16 16.850 1.853 46.344
124 HZ1 LYS 16 HZ1 LYS 16 18.625 3.000 47.892
125 HZ2 LYS 16 HZ2 LYS 16 17.256 3.286 48.856
126 HZ3 LYS 16 HZ3 LYS 16 17.309 3.861 47.257
127 H ASP 17 HN ASP 17 10.953 2.188 46.447
128 HA ASP 17 HA ASP 17 12.118 2.744 43.943
129 HB2 ASP 17 HB2 ASP 17 9.402 1.675 44.716
130 HB3 ASP 17 HB1 ASP 17 9.937 1.808 43.042
131 H ALA 18 HN ALA 18 9.372 4.187 45.641
132 HA ALA 18 HA ALA 18 8.426 5.814 43.547
133 HB1 ALA 18 HB1 ALA 18 8.349 6.492 46.491
134 HB2 ALA 18 HB2 ALA 18 7.255 5.337 45.733
135 HB3 ALA 18 HB3 ALA 18 7.233 7.029 45.235
136 H GLU 19 HN GLU 19 10.911 6.353 46.008
137 HA GLU 19 HA GLU 19 11.387 9.081 45.464
138 HB2 GLU 19 HB2 GLU 19 13.194 6.924 46.573
139 HB3 GLU 19 HB1 GLU 19 13.626 8.633 46.519
140 HG2 GLU 19 HG2 GLU 19 11.119 7.584 47.855
141 HG3 GLU 19 HG1 GLU 19 12.628 7.880 48.714
142 H LEU 20 HN LEU 20 12.743 6.117 44.081
143 HA LEU 20 HA LEU 20 14.747 7.338 42.505
144 HB2 LEU 20 HB2 LEU 20 13.224 4.749 42.158
145 HB3 LEU 20 HB1 LEU 20 14.581 5.219 41.138
146 HG LEU 20 HG LEU 20 14.727 5.004 44.161
147 HD11 LEU 20 HD11 LEU 20 15.810 2.863 43.845
148 HD12 LEU 20 HD12 LEU 20 15.760 3.047 42.090
149 HD13 LEU 20 HD13 LEU 20 14.264 2.821 42.997
150 HD21 LEU 20 HD21 LEU 20 16.533 6.365 43.583
151 HD22 LEU 20 HD22 LEU 20 16.695 5.659 41.976
152 HD23 LEU 20 HD23 LEU 20 17.272 4.779 43.389
153 H LYS 21 HN LYS 21 11.343 6.614 41.883
154 HA LYS 21 HA LYS 21 11.295 7.251 39.143
155 HB2 LYS 21 HB2 LYS 21 9.451 6.095 40.306
156 HB3 LYS 21 HB1 LYS 21 9.093 7.574 41.198
157 HG2 LYS 21 HG2 LYS 21 8.607 8.750 39.090
158 HG3 LYS 21 HG1 LYS 21 9.005 7.293 38.178
159 HD2 LYS 21 HD2 LYS 21 7.176 6.082 39.305
160 HD3 LYS 21 HD1 LYS 21 6.780 7.536 40.224
161 HE2 LYS 21 HE2 LYS 21 6.302 8.742 38.128
162 HE3 LYS 21 HE1 LYS 21 6.709 7.296 37.201
163 HZ1 LYS 21 HZ1 LYS 21 4.932 6.272 38.848
164 HZ2 LYS 21 HZ2 LYS 21 4.490 6.990 37.373
165 HZ3 LYS 21 HZ3 LYS 21 4.353 7.866 38.823
166 H ARG 22 HN ARG 22 10.780 9.265 42.024
167 HA ARG 22 HA ARG 22 10.108 11.652 40.695
168 HB2 ARG 22 HB2 ARG 22 9.801 11.316 43.119
169 HB3 ARG 22 HB1 ARG 22 11.552 11.306 43.335
170 HG2 ARG 22 HG2 ARG 22 11.719 13.595 42.541
171 HG3 ARG 22 HG1 ARG 22 10.005 13.617 42.127
172 HD2 ARG 22 HD2 ARG 22 11.066 13.177 44.930
173 HD3 ARG 22 HD1 ARG 22 10.529 14.736 44.314
174 HE ARG 22 HE ARG 22 8.457 12.910 43.869
175 HH11 ARG 22 HH11 ARG 22 6.716 12.801 45.324
176 HH12 ARG 22 HH12 ARG 22 6.912 13.384 46.944
177 HH21 ARG 22 HH21 ARG 22 10.218 14.327 46.489
178 HH22 ARG 22 HH22 ARG 22 8.893 14.248 47.605
179 H LEU 23 HN LEU 23 13.250 10.361 41.730
180 HA LEU 23 HA LEU 23 14.812 12.578 40.941
181 HB2 LEU 23 HB2 LEU 23 15.486 9.643 41.212
182 HB3 LEU 23 HB1 LEU 23 16.689 10.887 40.889
183 HG LEU 23 HG LEU 23 14.813 10.928 43.273
184 HD11 LEU 23 HD11 LEU 23 16.958 10.313 44.525
185 HD12 LEU 23 HD12 LEU 23 17.630 9.874 42.956
186 HD13 LEU 23 HD13 LEU 23 16.218 9.024 43.578
187 HD21 LEU 23 HD21 LEU 23 17.075 12.673 42.310
188 HD22 LEU 23 HD22 LEU 23 16.838 12.479 44.046
189 HD23 LEU 23 HD23 LEU 23 15.544 13.135 43.051
190 H ASN 24 HN ASN 24 13.741 9.688 39.212
191 HA ASN 24 HA ASN 24 15.267 10.042 36.871
192 HB2 ASN 24 HB2 ASN 24 13.955 7.987 37.512
193 HB3 ASN 24 HB1 ASN 24 12.495 8.848 37.024
194 HD21 ASN 24 HD21 ASN 24 12.043 7.531 35.158
195 HD22 ASN 24 HD22 ASN 24 13.058 7.510 33.797
196 H GLU 25 HN GLU 25 12.079 11.273 37.806
197 HA GLU 25 HA GLU 25 11.391 12.445 35.335
198 HB2 GLU 25 HB2 GLU 25 9.784 12.088 37.181
199 HB3 GLU 25 HB1 GLU 25 10.608 13.329 38.124
200 HG2 GLU 25 HG2 GLU 25 10.087 15.011 36.418
201 HG3 GLU 25 HG1 GLU 25 9.329 13.779 35.410
202 H GLU 26 HN GLU 26 13.162 13.703 38.134
203 HA GLU 26 HA GLU 26 13.409 16.370 37.253
204 HB2 GLU 26 HB2 GLU 26 15.131 14.682 39.075
205 HB3 GLU 26 HB1 GLU 26 15.413 16.401 38.799
206 HG2 GLU 26 HG2 GLU 26 13.213 16.959 39.647
207 HG3 GLU 26 HG1 GLU 26 12.782 15.254 39.768
208 H ARG 27 HN ARG 27 15.390 13.499 36.677
209 HA ARG 27 HA ARG 27 17.112 13.087 35.210
210 HB2 ARG 27 HB2 ARG 27 15.794 15.370 33.715
211 HB3 ARG 27 HB1 ARG 27 17.001 14.277 33.041
212 HG2 ARG 27 HG2 ARG 27 15.461 12.359 33.652
213 HG3 ARG 27 HG1 ARG 27 14.232 13.567 34.031
214 HD2 ARG 27 HD2 ARG 27 15.625 13.279 31.355
215 HD3 ARG 27 HD1 ARG 27 13.996 12.710 31.715
216 HE ARG 27 HE ARG 27 14.829 15.482 31.328
217 HH11 ARG 27 HH11 ARG 27 13.120 16.969 31.187
218 HH12 ARG 27 HH12 ARG 27 11.517 16.484 31.628
219 HH21 ARG 27 HH21 ARG 27 12.436 13.243 32.449
220 HH22 ARG 27 HH22 ARG 27 11.129 14.375 32.342
221 H HIS 28 HN HIS 28 17.503 15.005 37.416
222 HA HIS 28 HA HIS 28 19.032 17.230 36.628
223 HB2 HIS 28 HB2 HIS 28 18.174 16.993 38.898
224 HB3 HIS 28 HB1 HIS 28 19.194 15.579 39.161
225 HD2 HIS 28 HD2 HIS 28 21.708 16.210 40.135
226 HE1 HIS 28 HE1 HIS 28 21.701 20.318 39.160
227 HE2 HIS 28 HE2 HIS 28 23.007 18.467 40.311
228 H ASP 29 HN ASP 29 20.033 13.921 37.486
229 HA ASP 29 HA ASP 29 22.807 14.321 37.242
230 HB2 ASP 29 HB2 ASP 29 21.086 11.861 36.915
231 HB3 ASP 29 HB1 ASP 29 22.847 11.814 36.842
232 H HIS 30 HN HIS 30 20.360 13.405 34.848
233 HA HIS 30 HA HIS 30 22.142 12.839 32.726
234 HB2 HIS 30 HB2 HIS 30 19.257 13.731 32.775
235 HB3 HIS 30 HB1 HIS 30 20.113 13.348 31.282
236 HD2 HIS 30 HD2 HIS 30 20.398 10.610 30.771
237 HE1 HIS 30 HE1 HIS 30 18.812 9.224 34.430
238 HE2 HIS 30 HE2 HIS 30 19.634 8.517 32.134
239 H ASP 31 HN ASP 31 20.586 15.827 33.802
240 HA ASP 31 HA ASP 31 21.340 17.462 31.636
241 HB2 ASP 31 HB2 ASP 31 20.768 18.086 34.535
242 HB3 ASP 31 HB1 ASP 31 21.096 19.334 33.334
243 H LYS 32 HN LYS 32 23.004 16.614 34.642
244 HA LYS 32 HA LYS 32 25.166 18.404 34.418
245 HB2 LYS 32 HB2 LYS 32 24.654 17.134 36.472
246 HB3 LYS 32 HB1 LYS 32 25.118 15.641 35.660
247 HG2 LYS 32 HG2 LYS 32 27.404 16.503 35.342
248 HG3 LYS 32 HG1 LYS 32 26.943 18.021 36.113
249 HD2 LYS 32 HD2 LYS 32 26.415 16.809 38.193
250 HD3 LYS 32 HD1 LYS 32 26.868 15.288 37.424
251 HE2 LYS 32 HE2 LYS 32 29.158 16.133 37.082
252 HE3 LYS 32 HE1 LYS 32 28.709 17.662 37.840
253 HZ1 LYS 32 HZ1 LYS 32 28.584 14.999 39.150
254 HZ2 LYS 32 HZ2 LYS 32 28.213 16.489 39.876
255 HZ3 LYS 32 HZ3 LYS 32 29.806 16.150 39.393
256 H ARG 33 HN ARG 33 24.738 15.085 33.225
257 HA ARG 33 HA ARG 33 27.318 14.738 32.155
258 HB2 ARG 33 HB2 ARG 33 25.720 12.888 32.461
259 HB3 ARG 33 HB1 ARG 33 24.694 13.564 31.197
260 HG2 ARG 33 HG2 ARG 33 26.466 13.270 29.543
261 HG3 ARG 33 HG1 ARG 33 27.574 12.704 30.793
262 HD2 ARG 33 HD2 ARG 33 26.620 10.798 29.577
263 HD3 ARG 33 HD1 ARG 33 26.069 10.795 31.250
264 HE ARG 33 HE ARG 33 23.904 11.225 30.496
265 HH11 ARG 33 HH11 ARG 33 22.352 11.423 28.849
266 HH12 ARG 33 HH12 ARG 33 22.860 11.687 27.214
267 HH21 ARG 33 HH21 ARG 33 26.241 11.680 27.984
268 HH22 ARG 33 HH22 ARG 33 25.062 11.833 26.725
269 H GLU 34 HN GLU 34 24.336 16.009 30.699
270 HA GLU 34 HA GLU 34 25.354 16.398 28.097
271 HB2 GLU 34 HB2 GLU 34 22.944 16.456 28.654
272 HB3 GLU 34 HB1 GLU 34 23.195 17.965 29.533
273 HG2 GLU 34 HG2 GLU 34 23.961 19.062 27.479
274 HG3 GLU 34 HG1 GLU 34 23.795 17.551 26.589
275 H ALA 35 HN ALA 35 25.275 18.488 30.951
276 HA ALA 35 HA ALA 35 26.286 20.828 29.759
277 HB1 ALA 35 HB1 ALA 35 26.657 19.864 32.606
278 HB2 ALA 35 HB2 ALA 35 25.259 20.758 32.009
279 HB3 ALA 35 HB3 ALA 35 26.849 21.522 32.036
280 H GLU 36 HN GLU 36 27.899 18.022 31.176
281 HA GLU 36 HA GLU 36 30.525 19.017 31.198
282 HB2 GLU 36 HB2 GLU 36 29.829 16.934 32.331
283 HB3 GLU 36 HB1 GLU 36 29.608 16.164 30.760
284 HG2 GLU 36 HG2 GLU 36 31.982 16.485 30.238
285 HG3 GLU 36 HG1 GLU 36 32.220 17.332 31.765
286 H ARG 37 HN ARG 37 28.683 17.363 28.649
287 HA ARG 37 HA ARG 37 30.798 17.086 26.806
288 HB2 ARG 37 HB2 ARG 37 27.813 17.328 26.411
289 HB3 ARG 37 HB1 ARG 37 28.939 17.002 25.093
290 HG2 ARG 37 HG2 ARG 37 29.746 14.992 26.273
291 HG3 ARG 37 HG1 ARG 37 28.625 15.315 27.594
292 HD2 ARG 37 HD2 ARG 37 26.724 15.105 26.045
293 HD3 ARG 37 HD1 ARG 37 27.834 14.809 24.712
294 HE ARG 37 HE ARG 37 28.352 12.928 26.750
295 HH11 ARG 37 HH11 ARG 37 27.542 10.819 26.517
296 HH12 ARG 37 HH12 ARG 37 26.217 10.519 25.443
297 HH21 ARG 37 HH21 ARG 37 25.920 13.831 24.460
298 HH22 ARG 37 HH22 ARG 37 25.298 12.225 24.279
299 H LYS 38 HN LYS 38 28.519 19.730 27.398
300 HA LYS 38 HA LYS 38 29.225 21.327 25.180
301 HB2 LYS 38 HB2 LYS 38 28.111 22.040 27.897
302 HB3 LYS 38 HB1 LYS 38 28.327 23.217 26.602
303 HG2 LYS 38 HG2 LYS 38 26.884 21.864 25.125
304 HG3 LYS 38 HG1 LYS 38 26.662 20.689 26.424
305 HD2 LYS 38 HD2 LYS 38 25.638 22.430 27.836
306 HD3 LYS 38 HD1 LYS 38 25.867 23.613 26.548
307 HE2 LYS 38 HE2 LYS 38 24.423 22.284 25.058
308 HE3 LYS 38 HE1 LYS 38 24.196 21.093 26.336
309 HZ1 LYS 38 HZ1 LYS 38 23.302 22.935 27.725
310 HZ2 LYS 38 HZ2 LYS 38 22.347 22.553 26.373
311 HZ3 LYS 38 HZ3 LYS 38 23.340 23.931 26.353
312 H ALA 39 HN ALA 39 30.556 21.075 28.445
313 HA ALA 39 HA ALA 39 32.317 23.271 28.333
314 HB1 ALA 39 HB1 ALA 39 31.790 22.102 30.425
315 HB2 ALA 39 HB2 ALA 39 33.532 22.132 30.150
316 HB3 ALA 39 HB3 ALA 39 32.616 20.658 29.836
317 H LEU 40 HN LEU 40 32.667 19.909 27.310
318 HA LEU 40 HA LEU 40 35.415 19.946 26.724
319 HB2 LEU 40 HB2 LEU 40 34.107 17.873 26.850
320 HB3 LEU 40 HB1 LEU 40 33.197 18.348 25.419
321 HG LEU 40 HG LEU 40 35.281 18.320 24.081
322 HD11 LEU 40 HD11 LEU 40 37.052 18.822 25.533
323 HD12 LEU 40 HD12 LEU 40 37.255 17.086 25.314
324 HD13 LEU 40 HD13 LEU 40 36.486 17.705 26.776
325 HD21 LEU 40 HD21 LEU 40 34.813 15.789 25.689
326 HD22 LEU 40 HD22 LEU 40 35.616 15.873 24.121
327 HD23 LEU 40 HD23 LEU 40 33.905 16.278 24.258
328 H GLU 41 HN GLU 41 32.587 20.778 24.749
329 HA GLU 41 HA GLU 41 33.939 21.179 22.312
330 HB2 GLU 41 HB2 GLU 41 31.407 22.416 23.410
331 HB3 GLU 41 HB1 GLU 41 31.966 22.636 21.751
332 HG2 GLU 41 HG2 GLU 41 31.505 19.922 23.012
333 HG3 GLU 41 HG1 GLU 41 30.293 20.765 22.051
334 H ASP 42 HN ASP 42 33.302 23.371 25.029
335 HA ASP 42 HA ASP 42 34.000 25.538 25.426
336 HB2 ASP 42 HB2 ASP 42 36.053 24.020 25.674
337 HB3 ASP 42 HB1 ASP 42 36.558 24.629 24.100
338 H LYS 43 HN LYS 43 36.069 26.965 23.863
339 HA LYS 43 HA LYS 43 36.184 28.450 22.120
340 HB2 LYS 43 HB2 LYS 43 34.523 26.448 20.580
341 HB3 LYS 43 HB1 LYS 43 35.617 27.661 19.927
342 HG2 LYS 43 HG2 LYS 43 36.452 25.316 21.660
343 HG3 LYS 43 HG1 LYS 43 36.637 25.400 19.910
344 HD2 LYS 43 HD2 LYS 43 38.004 27.525 20.288
345 HD3 LYS 43 HD1 LYS 43 38.013 27.102 22.001
346 HE2 LYS 43 HE2 LYS 43 38.989 25.287 19.782
347 HE3 LYS 43 HE1 LYS 43 40.031 26.262 20.818
348 HZ1 LYS 43 HZ1 LYS 43 38.734 25.071 22.701
349 HZ2 LYS 43 HZ2 LYS 43 40.012 24.270 21.919
350 HZ3 LYS 43 HZ3 LYS 43 38.404 23.915 21.504
351 H LEU 44 HN LEU 44 34.300 29.065 23.968
352 HA LEU 44 HA LEU 44 32.467 30.410 24.310
353 HB2 LEU 44 HB2 LEU 44 32.524 30.875 21.324
354 HB3 LEU 44 HB1 LEU 44 31.856 31.931 22.566
355 HG LEU 44 HG LEU 44 34.785 31.183 22.318
356 HD11 LEU 44 HD11 LEU 44 33.807 32.673 20.507
357 HD12 LEU 44 HD12 LEU 44 35.125 33.386 21.437
358 HD13 LEU 44 HD13 LEU 44 33.458 33.849 21.775
359 HD21 LEU 44 HD21 LEU 44 33.202 32.918 24.223
360 HD22 LEU 44 HD22 LEU 44 34.914 33.223 23.933
361 HD23 LEU 44 HD23 LEU 44 34.397 31.678 24.600
362 H ALA 45 HN ALA 45 32.344 27.569 22.761
363 HA ALA 45 HA ALA 45 29.802 27.481 21.549
364 HB1 ALA 45 HB1 ALA 45 29.928 25.060 21.855
365 HB2 ALA 45 HB2 ALA 45 31.240 25.256 23.018
366 HB3 ALA 45 HB3 ALA 45 31.489 25.684 21.325
367 H ASP 46 HN ASP 46 30.835 27.064 24.896
368 HA ASP 46 HA ASP 46 28.405 26.162 25.983
369 HB2 ASP 46 HB2 ASP 46 30.688 27.736 27.176
370 HB3 ASP 46 HB1 ASP 46 29.321 27.158 28.128
371 H LYS 47 HN LYS 47 29.618 29.441 25.389
372 HA LYS 47 HA LYS 47 28.578 31.496 25.472
373 HB2 LYS 47 HB2 LYS 47 26.061 29.845 25.111
374 HB3 LYS 47 HB1 LYS 47 26.222 31.571 24.810
375 HG2 LYS 47 HG2 LYS 47 27.870 29.484 23.359
376 HG3 LYS 47 HG1 LYS 47 26.336 30.094 22.746
377 HD2 LYS 47 HD2 LYS 47 27.300 32.422 22.864
378 HD3 LYS 47 HD1 LYS 47 28.859 31.700 23.255
379 HE2 LYS 47 HE2 LYS 47 28.804 30.412 21.158
380 HE3 LYS 47 HE1 LYS 47 27.247 31.137 20.755
381 HZ1 LYS 47 HZ1 LYS 47 28.481 32.683 19.747
382 HZ2 LYS 47 HZ2 LYS 47 29.899 32.254 20.580
383 HZ3 LYS 47 HZ3 LYS 47 28.765 33.291 21.305
384 H GLN 48 HN GLN 48 29.113 30.168 27.931
385 HA GLN 48 HA GLN 48 26.812 30.805 29.654
386 HB2 GLN 48 HB2 GLN 48 28.098 29.688 31.416
387 HB3 GLN 48 HB1 GLN 48 27.958 28.649 29.998
388 HG2 GLN 48 HG2 GLN 48 30.212 29.428 29.256
389 HG3 GLN 48 HG1 GLN 48 30.354 30.350 30.752
390 HE21 GLN 48 HE21 GLN 48 31.315 27.477 29.417
391 HE22 GLN 48 HE22 GLN 48 31.432 26.536 30.825
392 H GLU 49 HN GLU 49 29.271 32.468 28.312
393 HA GLU 49 HA GLU 49 30.511 33.814 30.450
394 HB2 GLU 49 HB2 GLU 49 29.984 34.664 27.598
395 HB3 GLU 49 HB1 GLU 49 30.983 35.583 28.723
396 HG2 GLU 49 HG2 GLU 49 31.467 32.667 28.058
397 HG3 GLU 49 HG1 GLU 49 32.271 33.999 27.230
398 H HIS 50 HN HIS 50 27.516 34.532 28.678
399 HA HIS 50 HA HIS 50 27.082 37.082 29.821
400 HB2 HIS 50 HB2 HIS 50 24.761 36.816 29.049
401 HB3 HIS 50 HB1 HIS 50 25.916 36.349 27.803
402 HD2 HIS 50 HD2 HIS 50 25.739 33.683 26.987
403 HE1 HIS 50 HE1 HIS 50 22.855 32.455 29.813
404 HE2 HIS 50 HE2 HIS 50 24.157 31.751 27.751
405 H LEU 51 HN LEU 51 26.633 33.892 31.091
406 HA LEU 51 HA LEU 51 25.597 33.113 33.020
407 HB2 LEU 51 HB2 LEU 51 26.803 35.727 33.953
408 HB3 LEU 51 HB1 LEU 51 26.224 34.461 35.030
409 HG LEU 51 HG LEU 51 28.364 34.041 32.919
410 HD11 LEU 51 HD11 LEU 51 29.880 33.971 34.975
411 HD12 LEU 51 HD12 LEU 51 28.547 34.709 35.865
412 HD13 LEU 51 HD13 LEU 51 29.286 35.566 34.512
413 HD21 LEU 51 HD21 LEU 51 28.812 32.052 34.592
414 HD22 LEU 51 HD22 LEU 51 27.504 31.905 33.425
415 HD23 LEU 51 HD23 LEU 51 27.146 32.334 35.097
416 H ASP 52 HN ASP 52 24.040 35.129 31.270
417 HA ASP 52 HA ASP 52 22.397 36.696 32.933
418 HB2 ASP 52 HB2 ASP 52 21.931 35.487 30.207
419 HB3 ASP 52 HB1 ASP 52 20.772 36.558 30.991
420 H GLY 53 HN GLY 53 22.081 33.349 31.810
421 HA2 GLY 53 HA2 GLY 53 20.770 32.343 34.011
422 HA3 GLY 53 HA1 GLY 53 19.488 32.952 32.964
423 H ALA 54 HN ALA 54 19.053 30.468 33.158
424 HA ALA 54 HA ALA 54 18.943 28.430 32.114
425 HB1 ALA 54 HB1 ALA 54 19.065 28.421 29.747
426 HB2 ALA 54 HB2 ALA 54 20.197 29.773 29.722
427 HB3 ALA 54 HB3 ALA 54 18.512 30.040 30.173
428 H LEU 55 HN LEU 55 21.234 28.905 33.699
429 HA LEU 55 HA LEU 55 23.663 28.222 32.430
430 HB2 LEU 55 HB2 LEU 55 22.711 27.842 35.276
431 HB3 LEU 55 HB1 LEU 55 24.360 27.511 34.751
432 HG LEU 55 HG LEU 55 22.973 30.186 34.393
433 HD11 LEU 55 HD11 LEU 55 24.903 29.241 36.534
434 HD12 LEU 55 HD12 LEU 55 23.224 29.723 36.770
435 HD13 LEU 55 HD13 LEU 55 24.424 30.921 36.289
436 HD21 LEU 55 HD21 LEU 55 25.730 29.118 33.803
437 HD22 LEU 55 HD22 LEU 55 25.564 30.805 34.285
438 HD23 LEU 55 HD23 LEU 55 24.730 30.216 32.853
439 H ARG 56 HN ARG 56 21.101 26.265 33.880
440 HA ARG 56 HA ARG 56 22.496 23.785 33.089
441 HB2 ARG 56 HB2 ARG 56 21.652 23.921 35.402
442 HB3 ARG 56 HB1 ARG 56 20.021 24.194 34.787
443 HG2 ARG 56 HG2 ARG 56 20.002 22.013 33.717
444 HG3 ARG 56 HG1 ARG 56 21.693 21.747 34.144
445 HD2 ARG 56 HD2 ARG 56 20.250 20.558 35.719
446 HD3 ARG 56 HD1 ARG 56 21.082 21.871 36.547
447 HE ARG 56 HE ARG 56 18.548 22.742 35.570
448 HH11 ARG 56 HH11 ARG 56 16.889 23.033 37.096
449 HH12 ARG 56 HH12 ARG 56 17.019 22.297 38.659
450 HH21 ARG 56 HH21 ARG 56 20.095 20.833 38.007
451 HH22 ARG 56 HH22 ARG 56 18.834 21.051 39.175
452 H TYR 57 HN TYR 57 21.916 22.742 31.301
453 HA TYR 57 HA TYR 57 19.239 22.440 30.418
454 HB2 TYR 57 HB2 TYR 57 19.414 24.766 29.741
455 HB3 TYR 57 HB1 TYR 57 20.927 24.440 28.896
456 HD1 TYR 57 HD1 TYR 57 17.303 23.550 28.970
457 HD2 TYR 57 HD2 TYR 57 20.927 23.639 26.663
458 HE1 TYR 57 HE1 TYR 57 16.028 22.908 26.941
459 HE2 TYR 57 HE2 TYR 57 19.651 22.997 24.636
460 HH TYR 57 HH TYR 57 17.415 21.730 24.196