Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
18096 | 2df0 RC | 7005 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ILE 1 HT1 ILE 1 23.915 5.786 9.928
2 2H ILE 1 HT2 ILE 1 23.484 4.817 8.605
3 3H ILE 1 HT3 ILE 1 22.465 6.076 9.103
4 HA ILE 1 HA ILE 1 23.535 7.590 7.944
5 HB ILE 1 HB ILE 1 26.089 7.615 7.843
6 1HG1 ILE 1 HG12 ILE 1 26.344 6.059 10.286
7 2HG1 ILE 1 HG11 ILE 1 25.802 5.063 8.937
8 1HG2 ILE 1 HG21 ILE 1 24.519 8.897 9.420
9 2HG2 ILE 1 HG22 ILE 1 26.230 8.800 9.838
10 3HG2 ILE 1 HG23 ILE 1 25.063 7.757 10.653
11 1HD1 ILE 1 HD11 ILE 1 28.353 5.437 9.455
12 2HD1 ILE 1 HD12 ILE 1 28.095 6.898 8.500
13 3HD1 ILE 1 HD13 ILE 1 27.759 5.315 7.798
14 H LYS 2 HN LYS 2 23.839 7.755 5.801
15 HA LYS 2 HA LYS 2 24.811 5.377 4.357
16 1HB LYS 2 HB2 LYS 2 22.576 7.066 3.261
17 2HB LYS 2 HB1 LYS 2 23.047 5.436 2.807
18 1HG LYS 2 HG2 LYS 2 22.326 5.244 5.485
19 2HG LYS 2 HG1 LYS 2 21.129 6.322 4.761
20 1HD LYS 2 HD2 LYS 2 20.228 4.681 3.502
21 2HD LYS 2 HD1 LYS 2 21.797 3.942 3.168
22 1HE LYS 2 HE2 LYS 2 21.812 2.877 5.324
23 2HE LYS 2 HE1 LYS 2 20.344 3.729 5.800
24 1HZ LYS 2 HZ1 LYS 2 20.605 1.632 3.718
25 2HZ LYS 2 HZ2 LYS 2 19.204 2.563 3.938
26 3HZ LYS 2 HZ3 LYS 2 19.744 1.533 5.175
27 HA PRO 3 HA PRO 3 27.157 8.436 2.134
28 1HB PRO 3 HB2 PRO 3 27.972 6.993 0.038
29 2HB PRO 3 HB1 PRO 3 28.534 6.624 1.674
30 1HG PRO 3 HG2 PRO 3 26.415 5.285 0.049
31 2HG PRO 3 HG1 PRO 3 27.657 4.558 1.084
32 1HD PRO 3 HD2 PRO 3 25.037 4.961 1.839
33 2HD PRO 3 HD1 PRO 3 26.395 4.817 2.970
34 H GLU 4 HN GLU 4 24.146 7.809 1.474
35 HA GLU 4 HA GLU 4 22.562 8.295 -0.050
36 1HB GLU 4 HB2 GLU 4 24.569 10.439 -0.762
37 2HB GLU 4 HB1 GLU 4 22.923 10.393 -1.380
38 1HG GLU 4 HG2 GLU 4 23.916 11.047 1.336
39 2HG GLU 4 HG1 GLU 4 22.645 11.807 0.378
40 H ALA 5 HN ALA 5 23.180 6.204 -0.895
41 HA ALA 5 HA ALA 5 24.573 6.224 -3.449
42 1HB ALA 5 HB1 ALA 5 23.797 3.612 -2.728
43 2HB ALA 5 HB2 ALA 5 24.380 4.424 -1.272
44 3HB ALA 5 HB3 ALA 5 25.408 4.329 -2.704
45 HA PRO 6 HA PRO 6 20.237 4.368 -4.655
46 1HB PRO 6 HB2 PRO 6 18.370 5.594 -2.755
47 2HB PRO 6 HB1 PRO 6 18.514 3.907 -3.256
48 1HG PRO 6 HG2 PRO 6 19.210 4.726 -0.789
49 2HG PRO 6 HG1 PRO 6 20.060 3.413 -1.626
50 1HD PRO 6 HD2 PRO 6 20.852 6.287 -1.312
51 2HD PRO 6 HD1 PRO 6 21.847 4.823 -1.155
52 H GLY 7 HN GLY 7 21.419 6.435 -5.675
53 1HA GLY 7 HA2 GLY 7 19.340 8.517 -5.997
54 2HA GLY 7 HA1 GLY 7 21.064 8.871 -6.029
55 H GLU 8 HN GLU 8 20.474 5.938 -7.464
56 HA GLU 8 HA GLU 8 20.471 7.130 -10.146
57 1HB GLU 8 HB2 GLU 8 22.329 5.471 -9.174
58 2HB GLU 8 HB1 GLU 8 21.173 4.273 -9.737
59 1HG GLU 8 HG2 GLU 8 23.089 5.091 -11.291
60 2HG GLU 8 HG1 GLU 8 21.475 4.812 -11.941
61 H ASP 9 HN ASP 9 19.801 3.799 -9.535
62 HA ASP 9 HA ASP 9 16.931 4.287 -9.790
63 1HB ASP 9 HB2 ASP 9 18.198 3.274 -11.875
64 2HB ASP 9 HB1 ASP 9 18.030 1.782 -10.949
65 H ALA 10 HN ALA 10 19.109 1.544 -9.188
66 HA ALA 10 HA ALA 10 19.525 0.396 -7.267
67 1HB ALA 10 HB1 ALA 10 17.388 1.948 -5.818
68 2HB ALA 10 HB2 ALA 10 19.027 2.568 -6.042
69 3HB ALA 10 HB3 ALA 10 18.760 1.075 -5.136
70 H SER 11 HN SER 11 17.505 -0.018 -9.342
71 HA SER 11 HA SER 11 15.898 -2.037 -7.954
72 1HB SER 11 HB2 SER 11 15.141 -0.916 -10.612
73 2HB SER 11 HB1 SER 11 14.103 -1.686 -9.405
74 HG SER 11 HG SER 11 14.906 0.945 -9.657
75 HA PRO 12 HA PRO 12 17.258 -4.101 -12.080
76 1HB PRO 12 HB2 PRO 12 19.115 -2.753 -13.562
77 2HB PRO 12 HB1 PRO 12 17.375 -2.672 -13.862
78 1HG PRO 12 HG2 PRO 12 19.124 -0.768 -12.357
79 2HG PRO 12 HG1 PRO 12 17.852 -0.418 -13.544
80 1HD PRO 12 HD2 PRO 12 17.410 -0.192 -10.920
81 2HD PRO 12 HD1 PRO 12 16.154 -0.813 -12.013
82 H GLU 13 HN GLU 13 19.714 -1.910 -10.677
83 HA GLU 13 HA GLU 13 21.007 -4.013 -9.352
84 1HB GLU 13 HB2 GLU 13 21.583 -4.209 -11.968
85 2HB GLU 13 HB1 GLU 13 22.875 -3.131 -11.463
86 1HG GLU 13 HG2 GLU 13 22.862 -5.141 -9.552
87 2HG GLU 13 HG1 GLU 13 22.582 -5.973 -11.083
88 H GLU 14 HN GLU 14 20.448 -0.879 -9.446
89 HA GLU 14 HA GLU 14 23.087 0.021 -8.694
90 1HB GLU 14 HB2 GLU 14 20.437 1.454 -8.529
91 2HB GLU 14 HB1 GLU 14 22.003 2.180 -8.190
92 1HG GLU 14 HG2 GLU 14 21.546 2.838 -10.363
93 2HG GLU 14 HG1 GLU 14 22.640 1.468 -10.559
94 H LEU 15 HN LEU 15 20.812 -1.774 -7.150
95 HA LEU 15 HA LEU 15 21.439 -0.726 -4.501
96 1HB LEU 15 HB2 LEU 15 19.139 -1.702 -5.278
97 2HB LEU 15 HB1 LEU 15 19.900 -3.253 -4.966
98 HG LEU 15 HG LEU 15 20.436 -1.741 -2.683
99 1HD1 LEU 15 HD11 LEU 15 17.887 -0.943 -3.917
100 2HD1 LEU 15 HD12 LEU 15 18.895 -0.110 -2.733
101 3HD1 LEU 15 HD13 LEU 15 17.801 -1.391 -2.213
102 1HD2 LEU 15 HD21 LEU 15 19.997 -4.115 -2.718
103 2HD2 LEU 15 HD22 LEU 15 18.325 -3.832 -3.207
104 3HD2 LEU 15 HD23 LEU 15 18.879 -3.321 -1.613
105 H ASN 16 HN ASN 16 22.035 -3.553 -6.544
106 HA ASN 16 HA ASN 16 23.716 -4.950 -4.791
107 1HB ASN 16 HB2 ASN 16 22.988 -5.136 -7.517
108 2HB ASN 16 HB1 ASN 16 24.749 -5.064 -7.481
109 1HD2 ASN 16 HD21 ASN 16 22.021 -6.680 -5.916
110 2HD2 ASN 16 HD22 ASN 16 22.812 -8.203 -5.724
111 H ARG 17 HN ARG 17 24.467 -2.453 -7.209
112 HA ARG 17 HA ARG 17 27.146 -2.190 -6.214
113 1HB ARG 17 HB2 ARG 17 25.556 -0.655 -8.234
114 2HB ARG 17 HB1 ARG 17 27.124 -0.086 -7.666
115 1HG ARG 17 HG2 ARG 17 28.228 -2.006 -8.520
116 2HG ARG 17 HG1 ARG 17 26.697 -2.819 -8.849
117 1HD ARG 17 HD2 ARG 17 27.104 -0.195 -10.142
118 2HD ARG 17 HD1 ARG 17 28.112 -1.523 -10.718
119 HE ARG 17 HE ARG 17 25.961 -2.755 -11.074
120 1HH1 ARG 17 HH11 ARG 17 26.045 0.757 -11.075
121 2HH1 ARG 17 HH12 ARG 17 24.634 0.908 -12.090
122 1HH2 ARG 17 HH21 ARG 17 24.128 -2.562 -12.370
123 2HH2 ARG 17 HH22 ARG 17 23.533 -0.987 -12.827
124 H TYR 18 HN TYR 18 24.222 -1.224 -5.000
125 HA TYR 18 HA TYR 18 25.028 1.240 -3.797
126 1HB TYR 18 HB2 TYR 18 22.702 0.891 -3.735
127 2HB TYR 18 HB1 TYR 18 22.868 -0.784 -3.239
128 HD1 TYR 18 HD1 TYR 18 23.603 -1.249 -0.818
129 HD2 TYR 18 HD2 TYR 18 22.322 2.579 -2.169
130 HE1 TYR 18 HE1 TYR 18 23.167 -0.580 1.503
131 HE2 TYR 18 HE2 TYR 18 21.878 3.252 0.150
132 HH TYR 18 HH TYR 18 22.173 0.950 2.814
133 H TYR 19 HN TYR 19 24.985 -2.159 -2.833
134 HA TYR 19 HA TYR 19 26.498 -1.708 -0.437
135 1HB TYR 19 HB2 TYR 19 25.914 -4.279 -1.919
136 2HB TYR 19 HB1 TYR 19 26.590 -4.170 -0.297
137 HD1 TYR 19 HD1 TYR 19 23.597 -4.213 -2.274
138 HD2 TYR 19 HD2 TYR 19 25.178 -3.124 1.526
139 HE1 TYR 19 HE1 TYR 19 21.325 -4.169 -1.343
140 HE2 TYR 19 HE2 TYR 19 22.905 -3.077 2.466
141 HH TYR 19 HH TYR 19 20.350 -2.694 1.071
142 H ALA 20 HN ALA 20 27.255 -2.134 -3.718
143 HA ALA 20 HA ALA 20 29.908 -3.157 -3.322
144 1HB ALA 20 HB1 ALA 20 30.082 -3.056 -5.720
145 2HB ALA 20 HB2 ALA 20 28.611 -2.086 -5.812
146 3HB ALA 20 HB3 ALA 20 28.530 -3.761 -5.270
147 H SER 21 HN SER 21 28.434 -0.073 -4.366
148 HA SER 21 HA SER 21 30.919 1.305 -4.489
149 1HB SER 21 HB2 SER 21 29.530 3.351 -4.535
150 2HB SER 21 HB1 SER 21 28.922 2.133 -5.665
151 HG SER 21 HG SER 21 27.207 1.800 -4.421
152 H LEU 22 HN LEU 22 28.487 0.725 -2.049
153 HA LEU 22 HA LEU 22 29.591 2.259 0.056
154 1HB LEU 22 HB2 LEU 22 27.349 0.887 -0.172
155 2HB LEU 22 HB1 LEU 22 28.301 -0.404 0.526
156 HG LEU 22 HG LEU 22 28.112 0.435 2.591
157 1HD1 LEU 22 HD11 LEU 22 29.274 2.248 3.124
158 2HD1 LEU 22 HD12 LEU 22 28.091 3.287 2.331
159 3HD1 LEU 22 HD13 LEU 22 29.437 2.617 1.407
160 1HD2 LEU 22 HD21 LEU 22 26.250 2.581 1.765
161 2HD2 LEU 22 HD22 LEU 22 26.072 1.329 2.993
162 3HD2 LEU 22 HD23 LEU 22 25.843 0.931 1.291
163 H ARG 23 HN ARG 23 30.123 -1.101 -1.025
164 HA ARG 23 HA ARG 23 32.005 -1.659 1.055
165 1HB ARG 23 HB2 ARG 23 30.963 -3.531 0.079
166 2HB ARG 23 HB1 ARG 23 31.377 -3.021 -1.553
167 1HG ARG 23 HG2 ARG 23 33.137 -4.379 -1.438
168 2HG ARG 23 HG1 ARG 23 33.826 -3.280 -0.233
169 1HD ARG 23 HD2 ARG 23 31.846 -5.068 0.917
170 2HD ARG 23 HD1 ARG 23 33.159 -5.950 0.138
171 HE ARG 23 HE ARG 23 33.318 -4.324 2.517
172 1HH1 ARG 23 HH11 ARG 23 35.096 -5.901 -0.058
173 2HH1 ARG 23 HH12 ARG 23 36.618 -5.832 0.783
174 1HH2 ARG 23 HH21 ARG 23 35.299 -4.262 3.634
175 2HH2 ARG 23 HH22 ARG 23 36.732 -4.890 2.875
176 H HIS 24 HN HIS 24 32.358 -0.547 -2.289
177 HA HIS 24 HA HIS 24 35.168 -0.708 -2.402
178 1HB HIS 24 HB2 HIS 24 33.349 -0.184 -4.266
179 2HB HIS 24 HB1 HIS 24 33.739 1.482 -3.850
180 HD1 HIS 24 HD1 HIS 24 35.020 2.124 -5.938
181 HD2 HIS 24 HD2 HIS 24 36.434 -1.367 -4.165
182 HE1 HIS 24 HE1 HIS 24 37.153 1.560 -7.149
183 HE2 HIS 24 HE2 HIS 24 37.842 -0.683 -6.223
184 H TYR 25 HN TYR 25 32.980 1.927 -1.531
185 HA TYR 25 HA TYR 25 34.941 3.815 -0.841
186 1HB TYR 25 HB2 TYR 25 32.811 4.730 -1.051
187 2HB TYR 25 HB1 TYR 25 32.052 3.415 -0.163
188 HD1 TYR 25 HD1 TYR 25 31.306 3.830 1.957
189 HD2 TYR 25 HD2 TYR 25 34.482 6.200 0.412
190 HE1 TYR 25 HE1 TYR 25 31.257 5.200 3.989
191 HE2 TYR 25 HE2 TYR 25 34.458 7.573 2.445
192 HH TYR 25 HH TYR 25 33.667 7.754 4.540
193 H LEU 26 HN LEU 26 33.279 1.317 1.043
194 HA LEU 26 HA LEU 26 34.328 1.899 3.552
195 1HB LEU 26 HB2 LEU 26 32.712 -0.060 2.451
196 2HB LEU 26 HB1 LEU 26 34.094 -0.951 3.064
197 HG LEU 26 HG LEU 26 33.621 0.596 5.183
198 1HD1 LEU 26 HD11 LEU 26 31.009 0.370 5.397
199 2HD1 LEU 26 HD12 LEU 26 31.083 0.510 3.640
200 3HD1 LEU 26 HD13 LEU 26 31.745 1.792 4.656
201 1HD2 LEU 26 HD21 LEU 26 33.267 -1.378 6.144
202 2HD2 LEU 26 HD22 LEU 26 33.352 -2.074 4.526
203 3HD2 LEU 26 HD23 LEU 26 31.789 -1.644 5.220
204 H ASN 27 HN ASN 27 35.420 -0.585 1.298
205 HA ASN 27 HA ASN 27 37.786 -1.347 2.470
206 1HB ASN 27 HB2 ASN 27 36.513 -1.738 -0.008
207 2HB ASN 27 HB1 ASN 27 38.136 -1.176 -0.391
208 1HD2 ASN 27 HD21 ASN 27 37.666 -3.561 -1.248
209 2HD2 ASN 27 HD22 ASN 27 38.372 -4.793 -0.247
210 H LEU 28 HN LEU 28 37.172 1.523 0.514
211 HA LEU 28 HA LEU 28 39.927 2.259 0.298
212 1HB LEU 28 HB2 LEU 28 38.316 3.070 -1.348
213 2HB LEU 28 HB1 LEU 28 37.445 3.913 -0.063
214 HG LEU 28 HG LEU 28 39.938 4.891 0.292
215 1HD1 LEU 28 HD11 LEU 28 40.992 4.004 -1.603
216 2HD1 LEU 28 HD12 LEU 28 40.569 5.650 -2.080
217 3HD1 LEU 28 HD13 LEU 28 39.591 4.291 -2.637
218 1HD2 LEU 28 HD21 LEU 28 39.084 6.936 -0.637
219 2HD2 LEU 28 HD22 LEU 28 37.766 6.092 0.181
220 3HD2 LEU 28 HD23 LEU 28 37.877 6.060 -1.579
221 H VAL 29 HN VAL 29 37.222 3.592 2.047
222 HA VAL 29 HA VAL 29 38.532 5.707 3.208
223 HB VAL 29 HB VAL 29 36.093 5.551 3.129
224 1HG1 VAL 29 HG11 VAL 29 35.358 4.186 5.416
225 2HG1 VAL 29 HG12 VAL 29 36.561 3.138 4.659
226 3HG1 VAL 29 HG13 VAL 29 35.137 3.647 3.747
227 1HG2 VAL 29 HG21 VAL 29 37.017 7.171 4.626
228 2HG2 VAL 29 HG22 VAL 29 37.247 5.953 5.881
229 3HG2 VAL 29 HG23 VAL 29 35.617 6.432 5.402
230 H THR 30 HN THR 30 38.327 2.391 4.349
231 HA THR 30 HA THR 30 39.589 2.995 6.863
232 HB THR 30 HB THR 30 38.076 1.021 6.478
233 HG1 THR 30 HG1 THR 30 39.577 1.121 8.264
234 1HG2 THR 30 HG21 THR 30 38.589 -0.701 5.114
235 2HG2 THR 30 HG22 THR 30 40.321 -0.585 5.445
236 3HG2 THR 30 HG23 THR 30 39.562 0.521 4.290
237 H ARG 31 HN ARG 31 40.843 3.805 4.262
238 HA ARG 31 HA ARG 31 43.087 2.351 3.570
239 1HB ARG 31 HB2 ARG 31 42.028 4.846 2.929
240 2HB ARG 31 HB1 ARG 31 43.632 5.194 3.558
241 1HG ARG 31 HG2 ARG 31 44.613 3.652 1.950
242 2HG ARG 31 HG1 ARG 31 43.005 3.268 1.330
243 1HD ARG 31 HD2 ARG 31 42.860 5.873 1.023
244 2HD ARG 31 HD1 ARG 31 44.618 5.759 1.039
245 HE ARG 31 HE ARG 31 43.257 3.955 -0.788
246 1HH1 ARG 31 HH11 ARG 31 44.873 7.039 -0.337
247 2HH1 ARG 31 HH12 ARG 31 45.186 7.258 -2.041
248 1HH2 ARG 31 HH21 ARG 31 43.674 4.267 -3.035
249 2HH2 ARG 31 HH22 ARG 31 44.506 5.704 -3.551
250 H GLN 32 HN GLN 32 42.676 4.814 6.064
251 HA GLN 32 HA GLN 32 45.438 4.563 6.913
252 1HB GLN 32 HB2 GLN 32 44.441 6.087 8.847
253 2HB GLN 32 HB1 GLN 32 44.842 6.743 7.270
254 1HG GLN 32 HG2 GLN 32 42.702 7.587 8.028
255 2HG GLN 32 HG1 GLN 32 42.497 6.576 6.596
256 1HE2 GLN 32 HE21 GLN 32 42.440 6.363 10.137
257 2HE2 GLN 32 HE22 GLN 32 41.162 5.204 10.209
258 H ARG 33 HN ARG 33 42.343 3.309 7.761
259 HA ARG 33 HA ARG 33 41.565 1.852 9.287
260 1HB ARG 33 HB2 ARG 33 44.484 1.229 9.759
261 2HB ARG 33 HB1 ARG 33 43.131 0.277 10.365
262 1HG ARG 33 HG2 ARG 33 42.765 0.645 7.580
263 2HG ARG 33 HG1 ARG 33 44.424 0.110 7.850
264 1HD ARG 33 HD2 ARG 33 43.724 -1.967 8.213
265 2HD ARG 33 HD1 ARG 33 42.684 -1.409 9.520
266 HE ARG 33 HE ARG 33 40.912 -1.144 7.904
267 1HH1 ARG 33 HH11 ARG 33 43.768 -2.780 6.705
268 2HH1 ARG 33 HH12 ARG 33 42.890 -3.711 5.530
269 1HH2 ARG 33 HH21 ARG 33 39.746 -2.436 6.420
270 2HH2 ARG 33 HH22 ARG 33 40.615 -3.530 5.375
271 H TYR 34 HN TYR 34 44.497 3.189 10.821
272 HA TYR 34 HA TYR 34 42.763 4.153 13.000
273 1HB TYR 34 HB2 TYR 34 44.400 2.478 13.760
274 2HB TYR 34 HB1 TYR 34 45.709 3.456 13.104
275 HD1 TYR 34 HD1 TYR 34 46.932 4.589 14.685
276 HD2 TYR 34 HD2 TYR 34 42.768 4.020 15.373
277 HE1 TYR 34 HE1 TYR 34 47.127 5.769 16.826
278 HE2 TYR 34 HE2 TYR 34 42.960 5.208 17.520
279 HH TYR 34 HH TYR 34 44.353 6.691 18.687
280 1HN NH2 35 H1 NH2 35 45.734 6.690 11.740
281 2HN NH2 35 H2 NH2 35 46.084 5.023 12.041
Start of MODEL 2
1 1H ILE 1 HT1 ILE 1 26.317 3.108 8.412
2 2H ILE 1 HT2 ILE 1 24.888 3.383 9.285
3 3H ILE 1 HT3 ILE 1 26.359 4.006 9.854
4 HA ILE 1 HA ILE 1 24.785 5.611 8.724
5 HB ILE 1 HB ILE 1 26.705 6.594 7.293
6 1HG1 ILE 1 HG12 ILE 1 28.595 4.949 8.842
7 2HG1 ILE 1 HG11 ILE 1 27.760 4.085 7.552
8 1HG2 ILE 1 HG21 ILE 1 27.589 7.627 9.171
9 2HG2 ILE 1 HG22 ILE 1 27.433 6.178 10.166
10 3HG2 ILE 1 HG23 ILE 1 25.996 7.099 9.714
11 1HD1 ILE 1 HD11 ILE 1 29.110 4.973 6.048
12 2HD1 ILE 1 HD12 ILE 1 30.005 5.758 7.348
13 3HD1 ILE 1 HD13 ILE 1 28.670 6.602 6.561
14 H LYS 2 HN LYS 2 24.305 6.530 6.595
15 HA LYS 2 HA LYS 2 24.329 4.498 4.473
16 1HB LYS 2 HB2 LYS 2 22.082 5.020 5.789
17 2HB LYS 2 HB1 LYS 2 22.023 6.379 4.676
18 1HG LYS 2 HG2 LYS 2 20.803 4.247 4.007
19 2HG LYS 2 HG1 LYS 2 21.851 4.999 2.805
20 1HD LYS 2 HD2 LYS 2 22.218 2.620 2.779
21 2HD LYS 2 HD1 LYS 2 23.646 3.408 3.450
22 1HE LYS 2 HE2 LYS 2 23.474 2.076 5.219
23 2HE LYS 2 HE1 LYS 2 21.966 2.892 5.627
24 1HZ LYS 2 HZ1 LYS 2 21.789 0.820 3.602
25 2HZ LYS 2 HZ2 LYS 2 20.734 1.186 4.878
26 3HZ LYS 2 HZ3 LYS 2 22.141 0.286 5.170
27 HA PRO 3 HA PRO 3 26.079 8.180 2.439
28 1HB PRO 3 HB2 PRO 3 27.184 6.166 0.629
29 2HB PRO 3 HB1 PRO 3 28.034 7.362 1.608
30 1HG PRO 3 HG2 PRO 3 28.125 4.712 2.144
31 2HG PRO 3 HG1 PRO 3 28.221 5.946 3.413
32 1HD PRO 3 HD2 PRO 3 25.889 4.266 2.571
33 2HD PRO 3 HD1 PRO 3 26.410 4.736 4.203
34 H GLU 4 HN GLU 4 25.646 8.996 0.309
35 HA GLU 4 HA GLU 4 23.134 8.017 -0.710
36 1HB GLU 4 HB2 GLU 4 24.821 10.435 -1.219
37 2HB GLU 4 HB1 GLU 4 23.554 10.009 -2.360
38 1HG GLU 4 HG2 GLU 4 22.187 11.185 -1.069
39 2HG GLU 4 HG1 GLU 4 22.280 9.843 0.069
40 H ALA 5 HN ALA 5 24.415 6.005 -1.174
41 HA ALA 5 HA ALA 5 25.710 5.988 -3.765
42 1HB ALA 5 HB1 ALA 5 25.559 4.257 -1.473
43 2HB ALA 5 HB2 ALA 5 26.752 4.301 -2.774
44 3HB ALA 5 HB3 ALA 5 25.268 3.363 -2.967
45 HA PRO 6 HA PRO 6 21.600 3.825 -4.945
46 1HB PRO 6 HB2 PRO 6 19.532 3.799 -3.238
47 2HB PRO 6 HB1 PRO 6 20.796 2.563 -3.177
48 1HG PRO 6 HG2 PRO 6 20.429 4.989 -1.460
49 2HG PRO 6 HG1 PRO 6 20.899 3.345 -0.989
50 1HD PRO 6 HD2 PRO 6 22.675 5.406 -1.329
51 2HD PRO 6 HD1 PRO 6 23.097 3.693 -1.518
52 H GLY 7 HN GLY 7 18.941 4.738 -4.624
53 1HA GLY 7 HA2 GLY 7 17.605 6.669 -4.740
54 2HA GLY 7 HA1 GLY 7 19.061 7.652 -4.663
55 H GLU 8 HN GLU 8 20.512 6.430 -6.724
56 HA GLU 8 HA GLU 8 19.700 7.733 -9.009
57 1HB GLU 8 HB2 GLU 8 21.956 6.877 -8.747
58 2HB GLU 8 HB1 GLU 8 21.358 5.225 -8.748
59 1HG GLU 8 HG2 GLU 8 22.037 5.333 -10.897
60 2HG GLU 8 HG1 GLU 8 20.416 5.989 -11.113
61 H ASP 9 HN ASP 9 19.405 4.287 -8.391
62 HA ASP 9 HA ASP 9 16.808 4.241 -9.647
63 1HB ASP 9 HB2 ASP 9 18.896 3.752 -11.295
64 2HB ASP 9 HB1 ASP 9 18.567 2.127 -10.700
65 H ALA 10 HN ALA 10 19.023 1.568 -9.185
66 HA ALA 10 HA ALA 10 19.209 -0.050 -7.599
67 1HB ALA 10 HB1 ALA 10 18.996 0.826 -5.555
68 2HB ALA 10 HB2 ALA 10 17.299 0.343 -5.627
69 3HB ALA 10 HB3 ALA 10 17.771 1.977 -6.097
70 H SER 11 HN SER 11 17.172 0.292 -9.779
71 HA SER 11 HA SER 11 15.262 -1.750 -8.984
72 1HB SER 11 HB2 SER 11 15.365 -0.321 -11.610
73 2HB SER 11 HB1 SER 11 13.976 -1.136 -10.876
74 HG SER 11 HG SER 11 14.977 1.407 -10.475
75 HA PRO 12 HA PRO 12 17.388 -3.872 -12.755
76 1HB PRO 12 HB2 PRO 12 19.686 -2.680 -13.654
77 2HB PRO 12 HB1 PRO 12 18.098 -2.457 -14.399
78 1HG PRO 12 HG2 PRO 12 19.533 -0.703 -12.450
79 2HG PRO 12 HG1 PRO 12 18.627 -0.247 -13.903
80 1HD PRO 12 HD2 PRO 12 17.574 -0.009 -11.462
81 2HD PRO 12 HD1 PRO 12 16.585 -0.504 -12.849
82 H GLU 13 HN GLU 13 19.729 -1.925 -10.861
83 HA GLU 13 HA GLU 13 20.373 -3.989 -9.096
84 1HB GLU 13 HB2 GLU 13 22.761 -4.452 -9.963
85 2HB GLU 13 HB1 GLU 13 21.416 -5.299 -10.716
86 1HG GLU 13 HG2 GLU 13 21.542 -4.025 -12.655
87 2HG GLU 13 HG1 GLU 13 22.448 -2.738 -11.866
88 H GLU 14 HN GLU 14 20.347 -0.870 -9.541
89 HA GLU 14 HA GLU 14 22.936 -0.049 -8.703
90 1HB GLU 14 HB2 GLU 14 20.254 1.293 -8.497
91 2HB GLU 14 HB1 GLU 14 21.706 2.022 -7.830
92 1HG GLU 14 HG2 GLU 14 21.342 2.961 -9.969
93 2HG GLU 14 HG1 GLU 14 22.727 1.874 -10.097
94 H LEU 15 HN LEU 15 20.331 -1.496 -7.009
95 HA LEU 15 HA LEU 15 20.960 -0.628 -4.394
96 1HB LEU 15 HB2 LEU 15 18.850 -1.803 -5.166
97 2HB LEU 15 HB1 LEU 15 19.768 -3.295 -5.149
98 HG LEU 15 HG LEU 15 20.192 -2.976 -2.727
99 1HD1 LEU 15 HD11 LEU 15 18.830 -0.429 -3.288
100 2HD1 LEU 15 HD12 LEU 15 20.021 -0.838 -2.052
101 3HD1 LEU 15 HD13 LEU 15 18.324 -1.255 -1.814
102 1HD2 LEU 15 HD21 LEU 15 17.377 -3.122 -3.759
103 2HD2 LEU 15 HD22 LEU 15 17.749 -3.303 -2.044
104 3HD2 LEU 15 HD23 LEU 15 18.425 -4.432 -3.218
105 H ASN 16 HN ASN 16 21.810 -3.584 -6.169
106 HA ASN 16 HA ASN 16 23.453 -4.688 -4.191
107 1HB ASN 16 HB2 ASN 16 22.759 -5.262 -6.923
108 2HB ASN 16 HB1 ASN 16 24.488 -5.495 -6.682
109 1HD2 ASN 16 HD21 ASN 16 21.323 -6.318 -5.394
110 2HD2 ASN 16 HD22 ASN 16 21.785 -7.858 -4.740
111 H ARG 17 HN ARG 17 24.279 -2.619 -6.985
112 HA ARG 17 HA ARG 17 27.041 -2.606 -6.240
113 1HB ARG 17 HB2 ARG 17 27.301 -0.803 -7.904
114 2HB ARG 17 HB1 ARG 17 26.636 -2.304 -8.540
115 1HG ARG 17 HG2 ARG 17 24.419 -1.351 -8.588
116 2HG ARG 17 HG1 ARG 17 25.008 0.123 -7.813
117 1HD ARG 17 HD2 ARG 17 24.879 0.648 -10.101
118 2HD ARG 17 HD1 ARG 17 26.588 0.338 -9.786
119 HE ARG 17 HE ARG 17 24.739 -1.384 -11.274
120 1HH1 ARG 17 HH11 ARG 17 27.985 -0.598 -10.242
121 2HH1 ARG 17 HH12 ARG 17 28.738 -1.856 -11.173
122 1HH2 ARG 17 HH21 ARG 17 25.709 -3.061 -12.494
123 2HH2 ARG 17 HH22 ARG 17 27.442 -3.266 -12.444
124 H TYR 18 HN TYR 18 24.353 -0.917 -5.040
125 HA TYR 18 HA TYR 18 25.892 1.333 -4.136
126 1HB TYR 18 HB2 TYR 18 23.844 2.104 -3.608
127 2HB TYR 18 HB1 TYR 18 23.141 0.535 -3.982
128 HD1 TYR 18 HD1 TYR 18 24.941 2.286 -1.186
129 HD2 TYR 18 HD2 TYR 18 22.039 -0.597 -2.327
130 HE1 TYR 18 HE1 TYR 18 24.369 1.940 1.176
131 HE2 TYR 18 HE2 TYR 18 21.457 -0.953 0.016
132 HH TYR 18 HH TYR 18 21.883 -0.411 2.140
133 H TYR 19 HN TYR 19 24.887 -1.801 -2.843
134 HA TYR 19 HA TYR 19 26.262 -1.633 -0.386
135 1HB TYR 19 HB2 TYR 19 25.406 -3.955 -2.107
136 2HB TYR 19 HB1 TYR 19 26.281 -4.202 -0.603
137 HD1 TYR 19 HD1 TYR 19 23.096 -3.454 -2.129
138 HD2 TYR 19 HD2 TYR 19 25.225 -3.501 1.553
139 HE1 TYR 19 HE1 TYR 19 20.967 -3.424 -0.904
140 HE2 TYR 19 HE2 TYR 19 23.101 -3.457 2.791
141 HH TYR 19 HH TYR 19 20.209 -4.221 1.532
142 H ALA 20 HN ALA 20 27.281 -2.261 -3.605
143 HA ALA 20 HA ALA 20 29.796 -3.471 -2.903
144 1HB ALA 20 HB1 ALA 20 28.842 -2.568 -5.601
145 2HB ALA 20 HB2 ALA 20 28.406 -4.117 -4.880
146 3HB ALA 20 HB3 ALA 20 30.097 -3.756 -5.245
147 H SER 21 HN SER 21 28.677 -0.464 -4.419
148 HA SER 21 HA SER 21 31.261 0.679 -4.668
149 1HB SER 21 HB2 SER 21 30.055 2.780 -5.134
150 2HB SER 21 HB1 SER 21 29.331 1.435 -6.027
151 HG SER 21 HG SER 21 27.579 1.559 -4.840
152 H LEU 22 HN LEU 22 28.767 0.668 -2.203
153 HA LEU 22 HA LEU 22 30.110 2.486 -0.439
154 1HB LEU 22 HB2 LEU 22 27.941 2.384 0.207
155 2HB LEU 22 HB1 LEU 22 27.740 0.730 -0.332
156 HG LEU 22 HG LEU 22 29.153 0.154 1.790
157 1HD1 LEU 22 HD11 LEU 22 29.685 2.523 2.290
158 2HD1 LEU 22 HD12 LEU 22 28.894 1.679 3.620
159 3HD1 LEU 22 HD13 LEU 22 27.973 2.796 2.616
160 1HD2 LEU 22 HD21 LEU 22 26.623 -0.163 1.202
161 2HD2 LEU 22 HD22 LEU 22 26.398 1.101 2.410
162 3HD2 LEU 22 HD23 LEU 22 27.196 -0.408 2.851
163 H ARG 23 HN ARG 23 30.153 -1.021 -0.993
164 HA ARG 23 HA ARG 23 31.889 -1.566 1.212
165 1HB ARG 23 HB2 ARG 23 31.061 -3.543 0.418
166 2HB ARG 23 HB1 ARG 23 31.136 -3.033 -1.267
167 1HG ARG 23 HG2 ARG 23 32.954 -4.310 -1.448
168 2HG ARG 23 HG1 ARG 23 33.788 -3.096 -0.462
169 1HD ARG 23 HD2 ARG 23 32.610 -4.528 1.481
170 2HD ARG 23 HD1 ARG 23 32.809 -5.791 0.261
171 HE ARG 23 HE ARG 23 34.967 -4.245 1.532
172 1HH1 ARG 23 HH11 ARG 23 33.886 -7.029 -0.295
173 2HH1 ARG 23 HH12 ARG 23 35.484 -7.686 -0.478
174 1HH2 ARG 23 HH21 ARG 23 37.075 -5.122 1.298
175 2HH2 ARG 23 HH22 ARG 23 37.292 -6.606 0.416
176 H HIS 24 HN HIS 24 32.504 -0.682 -2.179
177 HA HIS 24 HA HIS 24 35.325 -0.834 -1.986
178 1HB HIS 24 HB2 HIS 24 33.766 -0.577 -4.106
179 2HB HIS 24 HB1 HIS 24 34.035 1.142 -3.834
180 HD1 HIS 24 HD1 HIS 24 35.239 -1.145 -6.047
181 HD2 HIS 24 HD2 HIS 24 37.192 1.191 -3.209
182 HE1 HIS 24 HE1 HIS 24 37.635 -1.014 -6.797
183 HE2 HIS 24 HE2 HIS 24 38.830 0.251 -4.975
184 H TYR 25 HN TYR 25 32.985 1.753 -1.454
185 HA TYR 25 HA TYR 25 34.744 3.800 -0.747
186 1HB TYR 25 HB2 TYR 25 32.528 4.494 -0.901
187 2HB TYR 25 HB1 TYR 25 31.925 3.103 -0.007
188 HD1 TYR 25 HD1 TYR 25 31.206 3.423 2.154
189 HD2 TYR 25 HD2 TYR 25 34.059 6.119 0.518
190 HE1 TYR 25 HE1 TYR 25 31.092 4.772 4.197
191 HE2 TYR 25 HE2 TYR 25 33.962 7.473 2.558
192 HH TYR 25 HH TYR 25 31.903 7.745 4.495
193 H LEU 26 HN LEU 26 33.331 1.197 1.200
194 HA LEU 26 HA LEU 26 34.488 1.854 3.647
195 1HB LEU 26 HB2 LEU 26 32.886 -0.166 2.689
196 2HB LEU 26 HB1 LEU 26 34.365 -1.012 3.110
197 HG LEU 26 HG LEU 26 34.026 0.505 5.309
198 1HD1 LEU 26 HD11 LEU 26 31.279 -0.420 5.178
199 2HD1 LEU 26 HD12 LEU 26 31.625 0.852 4.004
200 3HD1 LEU 26 HD13 LEU 26 31.930 1.128 5.719
201 1HD2 LEU 26 HD21 LEU 26 34.397 -1.993 5.015
202 2HD2 LEU 26 HD22 LEU 26 32.639 -2.140 5.016
203 3HD2 LEU 26 HD23 LEU 26 33.472 -1.481 6.426
204 H ASN 27 HN ASN 27 35.606 -0.531 1.279
205 HA ASN 27 HA ASN 27 38.083 -1.138 2.330
206 1HB ASN 27 HB2 ASN 27 36.733 -1.790 0.052
207 2HB ASN 27 HB1 ASN 27 38.077 -0.858 -0.597
208 1HD2 ASN 27 HD21 ASN 27 39.907 -1.912 -0.958
209 2HD2 ASN 27 HD22 ASN 27 40.328 -3.459 -0.293
210 H LEU 28 HN LEU 28 37.148 1.797 0.664
211 HA LEU 28 HA LEU 28 39.887 2.676 0.330
212 1HB LEU 28 HB2 LEU 28 38.216 3.386 -1.300
213 2HB LEU 28 HB1 LEU 28 37.304 4.170 -0.012
214 HG LEU 28 HG LEU 28 39.659 5.384 0.343
215 1HD1 LEU 28 HD11 LEU 28 40.269 4.023 -1.896
216 2HD1 LEU 28 HD12 LEU 28 40.970 5.589 -1.487
217 3HD1 LEU 28 HD13 LEU 28 39.613 5.496 -2.609
218 1HD2 LEU 28 HD21 LEU 28 37.462 6.146 -1.581
219 2HD2 LEU 28 HD22 LEU 28 38.709 7.255 -1.013
220 3HD2 LEU 28 HD23 LEU 28 37.573 6.545 0.131
221 H VAL 29 HN VAL 29 37.101 3.800 2.064
222 HA VAL 29 HA VAL 29 38.173 5.971 3.318
223 HB VAL 29 HB VAL 29 35.756 5.476 3.173
224 1HG1 VAL 29 HG11 VAL 29 34.944 3.570 3.932
225 2HG1 VAL 29 HG12 VAL 29 35.297 4.101 5.582
226 3HG1 VAL 29 HG13 VAL 29 36.493 3.166 4.678
227 1HG2 VAL 29 HG21 VAL 29 36.950 7.080 4.875
228 2HG2 VAL 29 HG22 VAL 29 36.287 5.957 6.062
229 3HG2 VAL 29 HG23 VAL 29 35.210 6.804 4.950
230 H THR 30 HN THR 30 38.431 2.616 4.274
231 HA THR 30 HA THR 30 39.604 3.138 6.824
232 HB THR 30 HB THR 30 38.600 0.961 6.276
233 HG1 THR 30 HG1 THR 30 40.213 1.034 7.901
234 1HG2 THR 30 HG21 THR 30 40.916 0.690 4.363
235 2HG2 THR 30 HG22 THR 30 39.198 0.717 3.966
236 3HG2 THR 30 HG23 THR 30 39.871 -0.642 4.863
237 H ARG 31 HN ARG 31 40.629 4.653 4.534
238 HA ARG 31 HA ARG 31 43.218 3.858 3.784
239 1HB ARG 31 HB2 ARG 31 41.496 5.961 3.206
240 2HB ARG 31 HB1 ARG 31 42.854 6.741 3.997
241 1HG ARG 31 HG2 ARG 31 44.377 5.938 2.374
242 2HG ARG 31 HG1 ARG 31 43.173 4.845 1.687
243 1HD ARG 31 HD2 ARG 31 41.817 6.909 1.138
244 2HD ARG 31 HD1 ARG 31 43.248 7.851 1.552
245 HE ARG 31 HE ARG 31 43.288 5.784 -0.557
246 1HH1 ARG 31 HH11 ARG 31 43.908 9.071 0.522
247 2HH1 ARG 31 HH12 ARG 31 44.826 9.485 -0.893
248 1HH2 ARG 31 HH21 ARG 31 44.455 6.346 -2.426
249 2HH2 ARG 31 HH22 ARG 31 45.110 7.950 -2.593
250 H GLN 32 HN GLN 32 41.887 5.382 6.585
251 HA GLN 32 HA GLN 32 44.487 6.245 7.569
252 1HB GLN 32 HB2 GLN 32 42.887 6.928 9.586
253 2HB GLN 32 HB1 GLN 32 43.055 7.921 8.145
254 1HG GLN 32 HG2 GLN 32 40.738 7.773 8.696
255 2HG GLN 32 HG1 GLN 32 41.017 6.844 7.225
256 1HE2 GLN 32 HE21 GLN 32 41.079 6.322 10.744
257 2HE2 GLN 32 HE22 GLN 32 40.256 4.805 10.700
258 H ARG 33 HN ARG 33 42.085 3.765 8.123
259 HA ARG 33 HA ARG 33 41.915 2.013 9.551
260 1HB ARG 33 HB2 ARG 33 44.861 2.319 10.118
261 2HB ARG 33 HB1 ARG 33 43.883 0.860 10.229
262 1HG ARG 33 HG2 ARG 33 43.965 2.176 7.598
263 2HG ARG 33 HG1 ARG 33 45.466 1.427 8.149
264 1HD ARG 33 HD2 ARG 33 43.712 -0.527 8.750
265 2HD ARG 33 HD1 ARG 33 42.900 0.195 7.362
266 HE ARG 33 HE ARG 33 45.565 -1.054 7.365
267 1HH1 ARG 33 HH11 ARG 33 42.847 0.298 5.616
268 2HH1 ARG 33 HH12 ARG 33 43.371 -0.322 4.080
269 1HH2 ARG 33 HH21 ARG 33 46.241 -1.873 5.364
270 2HH2 ARG 33 HH22 ARG 33 45.297 -1.574 3.931
271 H TYR 34 HN TYR 34 44.556 3.564 11.348
272 HA TYR 34 HA TYR 34 43.040 3.678 13.759
273 1HB TYR 34 HB2 TYR 34 45.357 3.543 14.096
274 2HB TYR 34 HB1 TYR 34 45.705 4.761 12.878
275 HD1 TYR 34 HD1 TYR 34 44.257 4.311 16.273
276 HD2 TYR 34 HD2 TYR 34 46.036 6.994 13.493
277 HE1 TYR 34 HE1 TYR 34 44.426 6.018 18.034
278 HE2 TYR 34 HE2 TYR 34 46.210 8.708 15.243
279 HH TYR 34 HH TYR 34 45.865 8.052 18.502
280 1HN NH2 35 H1 NH2 35 42.917 7.347 11.912
281 2HN NH2 35 H2 NH2 35 44.118 6.190 11.457
Start of MODEL 3
1 1H ILE 1 HT1 ILE 1 28.981 8.416 6.505
2 2H ILE 1 HT2 ILE 1 29.303 8.499 4.841
3 3H ILE 1 HT3 ILE 1 30.524 8.023 5.910
4 HA ILE 1 HA ILE 1 29.641 6.119 4.745
5 HB ILE 1 HB ILE 1 28.362 5.401 7.212
6 1HG1 ILE 1 HG12 ILE 1 31.087 6.307 7.892
7 2HG1 ILE 1 HG11 ILE 1 29.892 7.587 7.708
8 1HG2 ILE 1 HG21 ILE 1 29.569 3.855 5.803
9 2HG2 ILE 1 HG22 ILE 1 30.299 3.904 7.406
10 3HG2 ILE 1 HG23 ILE 1 31.069 4.746 6.064
11 1HD1 ILE 1 HD11 ILE 1 29.286 7.193 9.797
12 2HD1 ILE 1 HD12 ILE 1 30.284 5.742 9.873
13 3HD1 ILE 1 HD13 ILE 1 28.635 5.647 9.254
14 H LYS 2 HN LYS 2 27.969 5.061 3.855
15 HA LYS 2 HA LYS 2 25.890 4.576 3.106
16 1HB LYS 2 HB2 LYS 2 25.796 4.146 5.716
17 2HB LYS 2 HB1 LYS 2 24.645 5.472 5.654
18 1HG LYS 2 HG2 LYS 2 23.178 4.274 4.252
19 2HG LYS 2 HG1 LYS 2 24.399 3.052 3.893
20 1HD LYS 2 HD2 LYS 2 22.506 2.512 5.586
21 2HD LYS 2 HD1 LYS 2 24.161 2.023 5.956
22 1HE LYS 2 HE2 LYS 2 23.835 3.060 7.915
23 2HE LYS 2 HE1 LYS 2 24.057 4.548 6.995
24 1HZ LYS 2 HZ1 LYS 2 22.055 5.059 7.825
25 2HZ LYS 2 HZ2 LYS 2 21.657 3.444 8.177
26 3HZ LYS 2 HZ3 LYS 2 21.447 4.049 6.607
27 HA PRO 3 HA PRO 3 24.998 9.009 2.031
28 1HB PRO 3 HB2 PRO 3 24.491 7.638 -0.553
29 2HB PRO 3 HB1 PRO 3 25.414 9.106 -0.220
30 1HG PRO 3 HG2 PRO 3 26.645 6.820 -0.824
31 2HG PRO 3 HG1 PRO 3 27.315 7.929 0.390
32 1HD PRO 3 HD2 PRO 3 25.805 5.374 0.781
33 2HD PRO 3 HD1 PRO 3 27.209 5.998 1.672
34 H GLU 4 HN GLU 4 23.324 6.002 1.208
35 HA GLU 4 HA GLU 4 21.148 5.423 1.027
36 1HB GLU 4 HB2 GLU 4 20.723 7.736 2.926
37 2HB GLU 4 HB1 GLU 4 19.559 6.461 2.593
38 1HG GLU 4 HG2 GLU 4 22.108 5.375 3.394
39 2HG GLU 4 HG1 GLU 4 21.475 6.498 4.595
40 H ALA 5 HN ALA 5 21.189 6.033 -1.187
41 HA ALA 5 HA ALA 5 19.165 8.010 -1.811
42 1HB ALA 5 HB1 ALA 5 20.505 9.606 -2.579
43 2HB ALA 5 HB2 ALA 5 21.364 8.453 -3.603
44 3HB ALA 5 HB3 ALA 5 21.872 8.697 -1.931
45 HA PRO 6 HA PRO 6 19.111 4.484 -4.731
46 1HB PRO 6 HB2 PRO 6 16.753 3.401 -3.944
47 2HB PRO 6 HB1 PRO 6 18.293 3.028 -3.165
48 1HG PRO 6 HG2 PRO 6 16.030 4.559 -2.135
49 2HG PRO 6 HG1 PRO 6 17.423 3.900 -1.268
50 1HD PRO 6 HD2 PRO 6 16.967 6.617 -2.214
51 2HD PRO 6 HD1 PRO 6 18.237 6.006 -1.134
52 H GLY 7 HN GLY 7 18.813 6.251 -6.282
53 1HA GLY 7 HA2 GLY 7 15.968 6.723 -6.951
54 2HA GLY 7 HA1 GLY 7 17.297 7.781 -7.413
55 H GLU 8 HN GLU 8 18.242 7.492 -9.336
56 HA GLU 8 HA GLU 8 17.342 5.322 -11.041
57 1HB GLU 8 HB2 GLU 8 18.367 6.489 -12.821
58 2HB GLU 8 HB1 GLU 8 17.697 7.745 -11.788
59 1HG GLU 8 HG2 GLU 8 20.361 7.192 -10.944
60 2HG GLU 8 HG1 GLU 8 20.355 7.437 -12.691
61 H ASP 9 HN ASP 9 19.614 5.749 -8.729
62 HA ASP 9 HA ASP 9 21.733 4.186 -10.002
63 1HB ASP 9 HB2 ASP 9 22.620 4.804 -7.469
64 2HB ASP 9 HB1 ASP 9 22.954 5.749 -8.915
65 H ALA 10 HN ALA 10 19.382 2.781 -9.456
66 HA ALA 10 HA ALA 10 20.302 0.664 -7.853
67 1HB ALA 10 HB1 ALA 10 18.637 2.705 -6.573
68 2HB ALA 10 HB2 ALA 10 19.690 1.480 -5.855
69 3HB ALA 10 HB3 ALA 10 18.052 1.052 -6.366
70 H SER 11 HN SER 11 18.445 1.955 -10.200
71 HA SER 11 HA SER 11 16.134 0.383 -10.229
72 1HB SER 11 HB2 SER 11 17.306 1.194 -12.825
73 2HB SER 11 HB1 SER 11 15.668 1.415 -12.203
74 HG SER 11 HG SER 11 16.318 3.161 -11.053
75 HA PRO 12 HA PRO 12 18.414 -2.914 -12.786
76 1HB PRO 12 HB2 PRO 12 21.197 -2.211 -13.105
77 2HB PRO 12 HB1 PRO 12 19.975 -2.435 -14.358
78 1HG PRO 12 HG2 PRO 12 21.105 -0.019 -13.793
79 2HG PRO 12 HG1 PRO 12 19.468 -0.203 -14.445
80 1HD PRO 12 HD2 PRO 12 20.333 0.245 -11.611
81 2HD PRO 12 HD1 PRO 12 19.013 1.015 -12.525
82 H GLU 13 HN GLU 13 18.605 -2.054 -9.946
83 HA GLU 13 HA GLU 13 19.289 -2.787 -7.941
84 1HB GLU 13 HB2 GLU 13 20.381 -5.063 -9.591
85 2HB GLU 13 HB1 GLU 13 20.569 -4.993 -7.845
86 1HG GLU 13 HG2 GLU 13 18.245 -5.154 -7.490
87 2HG GLU 13 HG1 GLU 13 17.891 -4.868 -9.195
88 H GLU 14 HN GLU 14 20.799 -0.963 -9.517
89 HA GLU 14 HA GLU 14 23.538 -1.271 -9.001
90 1HB GLU 14 HB2 GLU 14 21.895 0.670 -10.178
91 2HB GLU 14 HB1 GLU 14 22.710 1.490 -8.854
92 1HG GLU 14 HG2 GLU 14 24.079 1.810 -10.725
93 2HG GLU 14 HG1 GLU 14 24.864 0.544 -9.785
94 H LEU 15 HN LEU 15 20.882 -0.717 -7.013
95 HA LEU 15 HA LEU 15 21.973 0.609 -4.810
96 1HB LEU 15 HB2 LEU 15 19.591 0.164 -5.084
97 2HB LEU 15 HB1 LEU 15 19.879 -1.560 -4.965
98 HG LEU 15 HG LEU 15 20.874 -0.847 -2.601
99 1HD1 LEU 15 HD11 LEU 15 19.060 0.872 -1.778
100 2HD1 LEU 15 HD12 LEU 15 19.150 1.414 -3.454
101 3HD1 LEU 15 HD13 LEU 15 20.601 1.406 -2.451
102 1HD2 LEU 15 HD21 LEU 15 18.165 -1.601 -3.529
103 2HD2 LEU 15 HD22 LEU 15 18.315 -1.049 -1.858
104 3HD2 LEU 15 HD23 LEU 15 19.261 -2.425 -2.418
105 H ASN 16 HN ASN 16 22.020 -2.789 -5.757
106 HA ASN 16 HA ASN 16 23.044 -3.804 -3.338
107 1HB ASN 16 HB2 ASN 16 22.319 -4.823 -5.903
108 2HB ASN 16 HB1 ASN 16 23.929 -5.433 -5.502
109 1HD2 ASN 16 HD21 ASN 16 20.577 -5.385 -4.617
110 2HD2 ASN 16 HD22 ASN 16 20.641 -6.690 -3.484
111 H ARG 17 HN ARG 17 24.698 -2.994 -6.404
112 HA ARG 17 HA ARG 17 27.263 -3.279 -5.161
113 1HB ARG 17 HB2 ARG 17 28.248 -2.552 -7.157
114 2HB ARG 17 HB1 ARG 17 26.889 -3.567 -7.631
115 1HG ARG 17 HG2 ARG 17 25.765 -1.073 -7.577
116 2HG ARG 17 HG1 ARG 17 27.404 -0.734 -8.132
117 1HD ARG 17 HD2 ARG 17 26.050 -3.027 -9.403
118 2HD ARG 17 HD1 ARG 17 25.377 -1.440 -9.760
119 HE ARG 17 HE ARG 17 27.704 -2.537 -10.872
120 1HH1 ARG 17 HH11 ARG 17 26.629 0.511 -9.497
121 2HH1 ARG 17 HH12 ARG 17 27.712 1.469 -10.453
122 1HH2 ARG 17 HH21 ARG 17 29.136 -1.256 -12.129
123 2HH2 ARG 17 HH22 ARG 17 29.123 0.478 -11.938
124 H TYR 18 HN TYR 18 24.907 -0.967 -4.848
125 HA TYR 18 HA TYR 18 26.668 1.280 -4.594
126 1HB TYR 18 HB2 TYR 18 24.605 2.218 -4.729
127 2HB TYR 18 HB1 TYR 18 23.803 0.762 -4.158
128 HD1 TYR 18 HD1 TYR 18 25.971 3.506 -2.808
129 HD2 TYR 18 HD2 TYR 18 22.674 0.888 -2.162
130 HE1 TYR 18 HE1 TYR 18 25.550 4.580 -0.641
131 HE2 TYR 18 HE2 TYR 18 22.244 1.960 -0.008
132 HH TYR 18 HH TYR 18 22.837 3.533 1.422
133 H TYR 19 HN TYR 19 25.128 -1.047 -2.410
134 HA TYR 19 HA TYR 19 26.510 -0.222 -0.088
135 1HB TYR 19 HB2 TYR 19 25.510 -3.001 -0.716
136 2HB TYR 19 HB1 TYR 19 25.870 -2.350 0.875
137 HD1 TYR 19 HD1 TYR 19 23.345 -2.947 -1.523
138 HD2 TYR 19 HD2 TYR 19 24.440 -0.274 1.604
139 HE1 TYR 19 HE1 TYR 19 20.997 -2.276 -1.267
140 HE2 TYR 19 HE2 TYR 19 22.097 0.402 1.856
141 HH TYR 19 HH TYR 19 19.896 -0.346 1.379
142 H ALA 20 HN ALA 20 27.395 -2.247 -2.754
143 HA ALA 20 HA ALA 20 29.549 -3.546 -1.328
144 1HB ALA 20 HB1 ALA 20 29.777 -4.890 -3.277
145 2HB ALA 20 HB2 ALA 20 28.829 -3.751 -4.240
146 3HB ALA 20 HB3 ALA 20 28.052 -4.695 -2.965
147 H SER 21 HN SER 21 29.188 -1.265 -4.026
148 HA SER 21 HA SER 21 32.030 -1.010 -4.347
149 1HB SER 21 HB2 SER 21 29.647 0.361 -5.561
150 2HB SER 21 HB1 SER 21 31.273 0.986 -5.825
151 HG SER 21 HG SER 21 30.080 -0.948 -7.122
152 H LEU 22 HN LEU 22 29.517 0.555 -2.527
153 HA LEU 22 HA LEU 22 31.259 2.699 -1.659
154 1HB LEU 22 HB2 LEU 22 29.159 3.484 -1.353
155 2HB LEU 22 HB1 LEU 22 28.475 1.885 -1.149
156 HG LEU 22 HG LEU 22 29.755 2.104 1.202
157 1HD1 LEU 22 HD11 LEU 22 29.315 4.425 2.034
158 2HD1 LEU 22 HD12 LEU 22 29.079 4.909 0.357
159 3HD1 LEU 22 HD13 LEU 22 30.644 4.291 0.883
160 1HD2 LEU 22 HD21 LEU 22 27.596 2.788 2.157
161 2HD2 LEU 22 HD22 LEU 22 27.416 1.542 0.920
162 3HD2 LEU 22 HD23 LEU 22 27.041 3.222 0.539
163 H ARG 23 HN ARG 23 30.413 -0.564 -0.661
164 HA ARG 23 HA ARG 23 31.923 -0.356 1.779
165 1HB ARG 23 HB2 ARG 23 30.153 -2.159 1.098
166 2HB ARG 23 HB1 ARG 23 31.552 -2.982 0.416
167 1HG ARG 23 HG2 ARG 23 32.646 -2.538 2.711
168 2HG ARG 23 HG1 ARG 23 30.987 -2.275 3.255
169 1HD ARG 23 HD2 ARG 23 30.450 -4.545 2.255
170 2HD ARG 23 HD1 ARG 23 32.192 -4.780 2.114
171 HE ARG 23 HE ARG 23 32.193 -4.332 4.624
172 1HH1 ARG 23 HH11 ARG 23 29.490 -5.796 2.944
173 2HH1 ARG 23 HH12 ARG 23 28.918 -6.653 4.345
174 1HH2 ARG 23 HH21 ARG 23 31.460 -5.472 6.460
175 2HH2 ARG 23 HH22 ARG 23 30.052 -6.491 6.334
176 H HIS 24 HN HIS 24 32.678 -1.275 -1.529
177 HA HIS 24 HA HIS 24 35.372 -2.023 -1.002
178 1HB HIS 24 HB2 HIS 24 33.898 -2.368 -3.168
179 2HB HIS 24 HB1 HIS 24 34.564 -0.803 -3.622
180 HD1 HIS 24 HD1 HIS 24 35.159 -3.574 -5.071
181 HD2 HIS 24 HD2 HIS 24 37.640 -1.628 -2.349
182 HE1 HIS 24 HE1 HIS 24 37.486 -4.415 -5.548
183 HE2 HIS 24 HE2 HIS 24 38.945 -3.339 -3.794
184 H TYR 25 HN TYR 25 33.685 0.952 -1.604
185 HA TYR 25 HA TYR 25 35.896 2.680 -1.772
186 1HB TYR 25 HB2 TYR 25 33.916 3.710 -2.396
187 2HB TYR 25 HB1 TYR 25 32.995 2.953 -1.104
188 HD1 TYR 25 HD1 TYR 25 32.154 4.405 0.456
189 HD2 TYR 25 HD2 TYR 25 35.882 5.304 -1.373
190 HE1 TYR 25 HE1 TYR 25 32.283 6.489 1.753
191 HE2 TYR 25 HE2 TYR 25 36.038 7.374 -0.080
192 HH TYR 25 HH TYR 25 35.069 8.709 1.391
193 H LEU 26 HN LEU 26 33.896 1.634 0.968
194 HA LEU 26 HA LEU 26 35.292 2.858 3.043
195 1HB LEU 26 HB2 LEU 26 33.220 0.957 2.757
196 2HB LEU 26 HB1 LEU 26 34.408 0.249 3.836
197 HG LEU 26 HG LEU 26 34.212 2.711 4.890
198 1HD1 LEU 26 HD11 LEU 26 31.459 2.650 4.905
199 2HD1 LEU 26 HD12 LEU 26 31.869 2.342 3.218
200 3HD1 LEU 26 HD13 LEU 26 32.469 3.794 4.021
201 1HD2 LEU 26 HD21 LEU 26 32.281 1.454 6.288
202 2HD2 LEU 26 HD22 LEU 26 34.002 1.115 6.472
203 3HD2 LEU 26 HD23 LEU 26 33.004 0.085 5.447
204 H ASN 27 HN ASN 27 35.495 -0.504 2.070
205 HA ASN 27 HA ASN 27 37.740 -1.394 3.310
206 1HB ASN 27 HB2 ASN 27 36.165 -2.594 1.659
207 2HB ASN 27 HB1 ASN 27 37.270 -2.033 0.408
208 1HD2 ASN 27 HD21 ASN 27 36.926 -4.061 3.230
209 2HD2 ASN 27 HD22 ASN 27 38.312 -5.054 2.923
210 H LEU 28 HN LEU 28 37.650 0.730 0.482
211 HA LEU 28 HA LEU 28 40.471 0.617 0.049
212 1HB LEU 28 HB2 LEU 28 39.052 1.310 -1.793
213 2HB LEU 28 HB1 LEU 28 38.486 2.684 -0.839
214 HG LEU 28 HG LEU 28 41.143 3.087 -0.693
215 1HD1 LEU 28 HD11 LEU 28 41.585 1.191 -2.219
216 2HD1 LEU 28 HD12 LEU 28 42.150 2.729 -2.866
217 3HD1 LEU 28 HD13 LEU 28 40.665 2.005 -3.479
218 1HD2 LEU 28 HD21 LEU 28 40.516 5.025 -1.600
219 2HD2 LEU 28 HD22 LEU 28 38.920 4.316 -1.849
220 3HD2 LEU 28 HD23 LEU 28 40.121 4.264 -3.139
221 H VAL 29 HN VAL 29 38.334 3.078 1.334
222 HA VAL 29 HA VAL 29 40.255 4.999 1.760
223 HB VAL 29 HB VAL 29 38.748 6.105 3.350
224 1HG1 VAL 29 HG11 VAL 29 38.580 6.219 0.843
225 2HG1 VAL 29 HG12 VAL 29 37.142 6.685 1.746
226 3HG1 VAL 29 HG13 VAL 29 37.224 5.101 0.974
227 1HG2 VAL 29 HG21 VAL 29 36.474 4.356 2.936
228 2HG2 VAL 29 HG22 VAL 29 37.078 5.099 4.417
229 3HG2 VAL 29 HG23 VAL 29 37.758 3.571 3.857
230 H THR 30 HN THR 30 39.613 2.172 3.632
231 HA THR 30 HA THR 30 40.853 2.707 6.040
232 HB THR 30 HB THR 30 41.492 0.406 6.152
233 HG1 THR 30 HG1 THR 30 40.943 -0.236 3.502
234 1HG2 THR 30 HG21 THR 30 39.051 0.569 4.384
235 2HG2 THR 30 HG22 THR 30 39.063 0.839 6.127
236 3HG2 THR 30 HG23 THR 30 39.468 -0.751 5.481
237 H ARG 31 HN ARG 31 42.189 2.701 2.864
238 HA ARG 31 HA ARG 31 44.848 2.446 2.990
239 1HB ARG 31 HB2 ARG 31 43.104 3.631 1.251
240 2HB ARG 31 HB1 ARG 31 44.091 4.998 1.756
241 1HG ARG 31 HG2 ARG 31 45.062 4.075 -0.214
242 2HG ARG 31 HG1 ARG 31 46.115 3.678 1.144
243 1HD ARG 31 HD2 ARG 31 44.049 1.674 0.583
244 2HD ARG 31 HD1 ARG 31 45.215 1.899 -0.721
245 HE ARG 31 HE ARG 31 45.753 0.881 1.954
246 1HH1 ARG 31 HH11 ARG 31 46.963 1.758 -1.215
247 2HH1 ARG 31 HH12 ARG 31 48.544 1.088 -0.935
248 1HH2 ARG 31 HH21 ARG 31 47.803 -0.047 2.310
249 2HH2 ARG 31 HH22 ARG 31 49.032 0.093 1.084
250 H GLN 32 HN GLN 32 43.211 5.503 3.755
251 HA GLN 32 HA GLN 32 45.517 6.315 5.378
252 1HB GLN 32 HB2 GLN 32 43.736 8.451 5.324
253 2HB GLN 32 HB1 GLN 32 45.197 8.289 4.362
254 1HG GLN 32 HG2 GLN 32 43.677 8.722 2.726
255 2HG GLN 32 HG1 GLN 32 43.612 6.964 2.747
256 1HE2 GLN 32 HE21 GLN 32 42.196 8.219 5.523
257 2HE2 GLN 32 HE22 GLN 32 40.544 8.140 5.015
258 H ARG 33 HN ARG 33 42.244 5.335 5.499
259 HA ARG 33 HA ARG 33 40.806 4.837 7.161
260 1HB ARG 33 HB2 ARG 33 43.053 4.201 8.352
261 2HB ARG 33 HB1 ARG 33 42.734 5.651 9.297
262 1HG ARG 33 HG2 ARG 33 41.478 4.389 10.616
263 2HG ARG 33 HG1 ARG 33 40.318 4.309 9.288
264 1HD ARG 33 HD2 ARG 33 41.022 2.220 8.617
265 2HD ARG 33 HD1 ARG 33 42.623 2.414 9.333
266 HE ARG 33 HE ARG 33 40.145 1.857 10.845
267 1HH1 ARG 33 HH11 ARG 33 43.632 1.703 10.491
268 2HH1 ARG 33 HH12 ARG 33 43.866 0.793 11.954
269 1HH2 ARG 33 HH21 ARG 33 40.452 0.614 12.734
270 2HH2 ARG 33 HH22 ARG 33 42.056 0.137 13.207
271 H TYR 34 HN TYR 34 42.717 7.643 8.260
272 HA TYR 34 HA TYR 34 40.176 9.123 8.462
273 1HB TYR 34 HB2 TYR 34 40.686 9.889 10.532
274 2HB TYR 34 HB1 TYR 34 41.756 8.498 10.591
275 HD1 TYR 34 HD1 TYR 34 41.525 12.057 10.743
276 HD2 TYR 34 HD2 TYR 34 44.212 8.856 9.960
277 HE1 TYR 34 HE1 TYR 34 43.421 13.567 11.135
278 HE2 TYR 34 HE2 TYR 34 46.120 10.359 10.353
279 HH TYR 34 HH TYR 34 46.695 12.395 11.353
280 1HN NH2 35 H1 NH2 35 41.676 12.041 7.020
281 2HN NH2 35 H2 NH2 35 40.515 11.549 8.200
Start of MODEL 4
1 1H ILE 1 HT1 ILE 1 28.982 6.756 7.366
2 2H ILE 1 HT2 ILE 1 29.083 7.196 5.734
3 3H ILE 1 HT3 ILE 1 30.499 7.055 6.663
4 HA ILE 1 HA ILE 1 30.649 5.065 5.704
5 HB ILE 1 HB ILE 1 28.469 4.412 7.698
6 1HG1 ILE 1 HG12 ILE 1 31.408 4.207 8.260
7 2HG1 ILE 1 HG11 ILE 1 30.588 5.754 8.449
8 1HG2 ILE 1 HG21 ILE 1 29.421 2.713 5.895
9 2HG2 ILE 1 HG22 ILE 1 29.040 2.214 7.542
10 3HG2 ILE 1 HG23 ILE 1 30.709 2.563 7.090
11 1HD1 ILE 1 HD11 ILE 1 29.533 5.108 10.319
12 2HD1 ILE 1 HD12 ILE 1 30.842 3.930 10.404
13 3HD1 ILE 1 HD13 ILE 1 29.279 3.461 9.739
14 H LYS 2 HN LYS 2 27.170 4.774 6.427
15 HA LYS 2 HA LYS 2 26.742 4.106 3.596
16 1HB LYS 2 HB2 LYS 2 25.339 3.298 6.123
17 2HB LYS 2 HB1 LYS 2 24.547 3.157 4.561
18 1HG LYS 2 HG2 LYS 2 26.918 1.956 4.036
19 2HG LYS 2 HG1 LYS 2 26.697 1.544 5.737
20 1HD LYS 2 HD2 LYS 2 24.807 0.989 3.457
21 2HD LYS 2 HD1 LYS 2 25.714 -0.190 4.409
22 1HE LYS 2 HE2 LYS 2 24.341 0.032 6.238
23 2HE LYS 2 HE1 LYS 2 23.858 1.672 5.802
24 1HZ LYS 2 HZ1 LYS 2 23.034 -0.725 4.262
25 2HZ LYS 2 HZ2 LYS 2 22.420 0.853 4.134
26 3HZ LYS 2 HZ3 LYS 2 22.110 -0.072 5.523
27 HA PRO 3 HA PRO 3 24.797 8.168 3.563
28 1HB PRO 3 HB2 PRO 3 24.396 7.562 0.713
29 2HB PRO 3 HB1 PRO 3 25.302 8.880 1.460
30 1HG PRO 3 HG2 PRO 3 26.527 6.848 0.197
31 2HG PRO 3 HG1 PRO 3 27.236 7.637 1.619
32 1HD PRO 3 HD2 PRO 3 25.767 5.030 1.429
33 2HD PRO 3 HD1 PRO 3 27.226 5.437 2.358
34 H GLU 4 HN GLU 4 23.529 5.215 2.164
35 HA GLU 4 HA GLU 4 21.451 4.457 1.720
36 1HB GLU 4 HB2 GLU 4 20.617 6.240 4.009
37 2HB GLU 4 HB1 GLU 4 19.768 4.819 3.416
38 1HG GLU 4 HG2 GLU 4 22.545 4.719 4.550
39 2HG GLU 4 HG1 GLU 4 21.093 4.501 5.523
40 H ALA 5 HN ALA 5 21.579 5.606 -0.272
41 HA ALA 5 HA ALA 5 19.341 7.416 -0.613
42 1HB ALA 5 HB1 ALA 5 21.565 8.527 -2.038
43 2HB ALA 5 HB2 ALA 5 21.944 8.410 -0.318
44 3HB ALA 5 HB3 ALA 5 20.507 9.290 -0.848
45 HA PRO 6 HA PRO 6 20.064 4.517 -4.142
46 1HB PRO 6 HB2 PRO 6 17.423 3.475 -3.777
47 2HB PRO 6 HB1 PRO 6 18.955 2.655 -3.481
48 1HG PRO 6 HG2 PRO 6 17.142 3.358 -1.521
49 2HG PRO 6 HG1 PRO 6 18.865 3.048 -1.245
50 1HD PRO 6 HD2 PRO 6 17.428 5.654 -1.523
51 2HD PRO 6 HD1 PRO 6 18.770 5.216 -0.444
52 H GLY 7 HN GLY 7 19.899 6.665 -5.214
53 1HA GLY 7 HA2 GLY 7 17.158 7.242 -6.158
54 2HA GLY 7 HA1 GLY 7 18.432 8.439 -6.011
55 H GLU 8 HN GLU 8 20.541 7.342 -7.264
56 HA GLU 8 HA GLU 8 19.546 7.259 -10.031
57 1HB GLU 8 HB2 GLU 8 21.875 8.460 -8.687
58 2HB GLU 8 HB1 GLU 8 22.222 7.711 -10.240
59 1HG GLU 8 HG2 GLU 8 21.758 9.927 -10.753
60 2HG GLU 8 HG1 GLU 8 20.273 9.067 -11.147
61 H ASP 9 HN ASP 9 20.698 5.203 -7.706
62 HA ASP 9 HA ASP 9 21.621 3.269 -9.648
63 1HB ASP 9 HB2 ASP 9 23.683 2.802 -8.249
64 2HB ASP 9 HB1 ASP 9 23.709 4.269 -9.212
65 H ALA 10 HN ALA 10 19.713 2.203 -9.020
66 HA ALA 10 HA ALA 10 20.124 0.146 -7.210
67 1HB ALA 10 HB1 ALA 10 19.478 2.317 -5.771
68 2HB ALA 10 HB2 ALA 10 19.096 0.666 -5.288
69 3HB ALA 10 HB3 ALA 10 17.870 1.659 -6.083
70 H SER 11 HN SER 11 18.187 1.995 -9.265
71 HA SER 11 HA SER 11 15.820 0.574 -9.382
72 1HB SER 11 HB2 SER 11 16.608 1.474 -11.996
73 2HB SER 11 HB1 SER 11 15.374 2.136 -10.921
74 HG SER 11 HG SER 11 16.739 3.770 -10.845
75 HA PRO 12 HA PRO 12 17.621 -2.533 -12.468
76 1HB PRO 12 HB2 PRO 12 20.305 -1.913 -13.253
77 2HB PRO 12 HB1 PRO 12 18.849 -1.868 -14.247
78 1HG PRO 12 HG2 PRO 12 20.312 0.350 -13.549
79 2HG PRO 12 HG1 PRO 12 18.592 0.385 -13.980
80 1HD PRO 12 HD2 PRO 12 19.869 0.368 -11.266
81 2HD PRO 12 HD1 PRO 12 18.491 1.325 -11.857
82 H GLU 13 HN GLU 13 18.120 -2.257 -9.681
83 HA GLU 13 HA GLU 13 19.005 -3.397 -7.939
84 1HB GLU 13 HB2 GLU 13 18.921 -5.270 -9.920
85 2HB GLU 13 HB1 GLU 13 20.636 -5.261 -9.538
86 1HG GLU 13 HG2 GLU 13 19.759 -5.432 -7.066
87 2HG GLU 13 HG1 GLU 13 18.325 -6.078 -7.860
88 H GLU 14 HN GLU 14 20.368 -1.216 -9.338
89 HA GLU 14 HA GLU 14 23.141 -1.664 -9.009
90 1HB GLU 14 HB2 GLU 14 21.636 0.937 -9.127
91 2HB GLU 14 HB1 GLU 14 23.383 0.768 -9.243
92 1HG GLU 14 HG2 GLU 14 22.186 -0.945 -11.163
93 2HG GLU 14 HG1 GLU 14 21.460 0.656 -11.305
94 H LEU 15 HN LEU 15 20.674 -1.346 -6.826
95 HA LEU 15 HA LEU 15 21.977 -0.090 -4.656
96 1HB LEU 15 HB2 LEU 15 19.645 -0.390 -4.460
97 2HB LEU 15 HB1 LEU 15 19.739 -2.090 -4.874
98 HG LEU 15 HG LEU 15 21.242 -1.743 -2.502
99 1HD1 LEU 15 HD11 LEU 15 19.012 0.103 -2.698
100 2HD1 LEU 15 HD12 LEU 15 20.290 -0.006 -1.487
101 3HD1 LEU 15 HD13 LEU 15 18.847 -1.010 -1.339
102 1HD2 LEU 15 HD21 LEU 15 20.233 -3.694 -2.208
103 2HD2 LEU 15 HD22 LEU 15 19.163 -3.365 -3.572
104 3HD2 LEU 15 HD23 LEU 15 18.703 -2.859 -1.945
105 H ASN 16 HN ASN 16 22.060 -3.280 -6.038
106 HA ASN 16 HA ASN 16 23.369 -4.602 -3.903
107 1HB ASN 16 HB2 ASN 16 22.503 -5.231 -6.588
108 2HB ASN 16 HB1 ASN 16 24.131 -5.859 -6.309
109 1HD2 ASN 16 HD21 ASN 16 21.092 -5.555 -4.513
110 2HD2 ASN 16 HD22 ASN 16 21.091 -7.170 -3.893
111 H ARG 17 HN ARG 17 24.533 -3.040 -6.867
112 HA ARG 17 HA ARG 17 27.269 -3.355 -6.025
113 1HB ARG 17 HB2 ARG 17 27.912 -2.235 -8.009
114 2HB ARG 17 HB1 ARG 17 26.630 -3.361 -8.430
115 1HG ARG 17 HG2 ARG 17 25.404 -1.721 -9.280
116 2HG ARG 17 HG1 ARG 17 25.525 -0.789 -7.785
117 1HD ARG 17 HD2 ARG 17 27.624 0.155 -8.494
118 2HD ARG 17 HD1 ARG 17 27.642 -0.869 -9.930
119 HE ARG 17 HE ARG 17 25.642 0.377 -10.681
120 1HH1 ARG 17 HH11 ARG 17 27.711 1.818 -8.252
121 2HH1 ARG 17 HH12 ARG 17 27.239 3.446 -8.621
122 1HH2 ARG 17 HH21 ARG 17 25.010 2.519 -11.174
123 2HH2 ARG 17 HH22 ARG 17 25.743 3.849 -10.318
124 H TYR 18 HN TYR 18 24.799 -1.276 -5.169
125 HA TYR 18 HA TYR 18 26.480 0.979 -4.562
126 1HB TYR 18 HB2 TYR 18 24.260 1.663 -4.653
127 2HB TYR 18 HB1 TYR 18 23.658 0.161 -3.968
128 HD1 TYR 18 HD1 TYR 18 25.762 3.083 -2.907
129 HD2 TYR 18 HD2 TYR 18 22.734 0.276 -1.878
130 HE1 TYR 18 HE1 TYR 18 25.482 4.194 -0.732
131 HE2 TYR 18 HE2 TYR 18 22.439 1.378 0.297
132 HH TYR 18 HH TYR 18 23.232 2.929 1.720
133 H TYR 19 HN TYR 19 25.091 -1.809 -2.938
134 HA TYR 19 HA TYR 19 26.372 -1.608 -0.476
135 1HB TYR 19 HB2 TYR 19 25.543 -4.001 -2.124
136 2HB TYR 19 HB1 TYR 19 26.204 -4.156 -0.501
137 HD1 TYR 19 HD1 TYR 19 24.001 -5.387 -0.127
138 HD2 TYR 19 HD2 TYR 19 24.199 -1.212 -0.945
139 HE1 TYR 19 HE1 TYR 19 21.770 -5.093 0.857
140 HE2 TYR 19 HE2 TYR 19 21.962 -0.915 0.039
141 HH TYR 19 HH TYR 19 19.913 -3.557 0.788
142 H ALA 20 HN ALA 20 27.522 -2.717 -3.563
143 HA ALA 20 HA ALA 20 29.869 -4.000 -2.511
144 1HB ALA 20 HB1 ALA 20 28.510 -4.857 -4.427
145 2HB ALA 20 HB2 ALA 20 30.243 -4.733 -4.739
146 3HB ALA 20 HB3 ALA 20 29.137 -3.514 -5.381
147 H SER 21 HN SER 21 29.286 -1.347 -4.862
148 HA SER 21 HA SER 21 32.020 -0.644 -5.014
149 1HB SER 21 HB2 SER 21 31.310 1.266 -6.309
150 2HB SER 21 HB1 SER 21 30.312 -0.110 -6.773
151 HG SER 21 HG SER 21 28.621 0.727 -5.620
152 H LEU 22 HN LEU 22 29.349 0.429 -2.989
153 HA LEU 22 HA LEU 22 30.906 2.524 -1.770
154 1HB LEU 22 HB2 LEU 22 28.619 2.940 -1.636
155 2HB LEU 22 HB1 LEU 22 28.240 1.291 -1.178
156 HG LEU 22 HG LEU 22 29.732 2.091 0.955
157 1HD1 LEU 22 HD11 LEU 22 29.955 4.360 0.240
158 2HD1 LEU 22 HD12 LEU 22 28.813 4.319 1.581
159 3HD1 LEU 22 HD13 LEU 22 28.224 4.486 -0.072
160 1HD2 LEU 22 HD21 LEU 22 27.051 2.832 1.481
161 2HD2 LEU 22 HD22 LEU 22 27.869 1.323 1.887
162 3HD2 LEU 22 HD23 LEU 22 27.020 1.480 0.349
163 H ARG 23 HN ARG 23 30.262 -0.921 -1.133
164 HA ARG 23 HA ARG 23 31.611 -0.895 1.383
165 1HB ARG 23 HB2 ARG 23 30.241 -2.802 0.617
166 2HB ARG 23 HB1 ARG 23 31.468 -3.176 -0.585
167 1HG ARG 23 HG2 ARG 23 32.279 -4.552 0.989
168 2HG ARG 23 HG1 ARG 23 32.971 -3.073 1.673
169 1HD ARG 23 HD2 ARG 23 31.652 -3.188 3.472
170 2HD ARG 23 HD1 ARG 23 30.216 -3.473 2.490
171 HE ARG 23 HE ARG 23 31.907 -5.779 2.726
172 1HH1 ARG 23 HH11 ARG 23 29.345 -3.958 4.269
173 2HH1 ARG 23 HH12 ARG 23 28.744 -5.317 5.172
174 1HH2 ARG 23 HH21 ARG 23 31.133 -7.555 3.888
175 2HH2 ARG 23 HH22 ARG 23 29.767 -7.373 4.954
176 H HIS 24 HN HIS 24 32.742 -1.208 -1.943
177 HA HIS 24 HA HIS 24 35.458 -1.698 -1.194
178 1HB HIS 24 HB2 HIS 24 34.016 -1.686 -3.601
179 2HB HIS 24 HB1 HIS 24 35.220 -0.413 -3.775
180 HD1 HIS 24 HD1 HIS 24 35.073 -4.073 -2.771
181 HD2 HIS 24 HD2 HIS 24 37.662 -1.334 -4.539
182 HE1 HIS 24 HE1 HIS 24 37.103 -5.397 -3.456
183 HE2 HIS 24 HE2 HIS 24 38.716 -3.695 -4.383
184 H TYR 25 HN TYR 25 33.546 1.136 -1.934
185 HA TYR 25 HA TYR 25 35.563 3.076 -1.694
186 1HB TYR 25 HB2 TYR 25 33.520 3.809 -2.585
187 2HB TYR 25 HB1 TYR 25 32.580 3.060 -1.303
188 HD1 TYR 25 HD1 TYR 25 31.653 4.427 0.282
189 HD2 TYR 25 HD2 TYR 25 35.158 5.736 -1.742
190 HE1 TYR 25 HE1 TYR 25 31.486 6.595 1.416
191 HE2 TYR 25 HE2 TYR 25 35.017 7.904 -0.592
192 HH TYR 25 HH TYR 25 33.682 8.598 1.915
193 H LEU 26 HN LEU 26 33.480 1.504 0.675
194 HA LEU 26 HA LEU 26 34.374 2.792 2.990
195 1HB LEU 26 HB2 LEU 26 32.707 0.604 2.334
196 2HB LEU 26 HB1 LEU 26 33.871 0.025 3.509
197 HG LEU 26 HG LEU 26 33.153 2.309 4.693
198 1HD1 LEU 26 HD11 LEU 26 30.727 1.388 3.160
199 2HD1 LEU 26 HD12 LEU 26 31.524 2.958 3.050
200 3HD1 LEU 26 HD13 LEU 26 30.682 2.498 4.530
201 1HD2 LEU 26 HD21 LEU 26 31.578 -0.246 4.923
202 2HD2 LEU 26 HD22 LEU 26 31.818 0.977 6.171
203 3HD2 LEU 26 HD23 LEU 26 33.180 0.005 5.619
204 H ASN 27 HN ASN 27 35.262 -0.414 1.828
205 HA ASN 27 HA ASN 27 37.515 -1.038 3.165
206 1HB ASN 27 HB2 ASN 27 36.880 -2.589 1.541
207 2HB ASN 27 HB1 ASN 27 36.771 -1.375 0.275
208 1HD2 ASN 27 HD21 ASN 27 38.764 -3.658 1.874
209 2HD2 ASN 27 HD22 ASN 27 40.176 -3.436 0.894
210 H LEU 28 HN LEU 28 37.320 1.369 0.555
211 HA LEU 28 HA LEU 28 40.106 1.944 0.592
212 1HB LEU 28 HB2 LEU 28 38.859 2.554 -1.379
213 2HB LEU 28 HB1 LEU 28 37.819 3.601 -0.410
214 HG LEU 28 HG LEU 28 40.276 4.579 0.221
215 1HD1 LEU 28 HD11 LEU 28 40.473 4.323 -2.753
216 2HD1 LEU 28 HD12 LEU 28 41.017 2.979 -1.749
217 3HD1 LEU 28 HD13 LEU 28 41.738 4.575 -1.549
218 1HD2 LEU 28 HD21 LEU 28 37.965 5.382 -1.301
219 2HD2 LEU 28 HD22 LEU 28 39.425 6.057 -2.026
220 3HD2 LEU 28 HD23 LEU 28 39.060 6.362 -0.327
221 H VAL 29 HN VAL 29 37.317 3.748 1.765
222 HA VAL 29 HA VAL 29 38.679 5.968 2.623
223 HB VAL 29 HB VAL 29 36.789 6.541 4.088
224 1HG1 VAL 29 HG11 VAL 29 35.731 5.468 1.503
225 2HG1 VAL 29 HG12 VAL 29 36.867 6.816 1.559
226 3HG1 VAL 29 HG13 VAL 29 35.297 6.951 2.352
227 1HG2 VAL 29 HG21 VAL 29 34.770 4.970 3.892
228 2HG2 VAL 29 HG22 VAL 29 36.039 4.550 5.041
229 3HG2 VAL 29 HG23 VAL 29 35.948 3.726 3.485
230 H THR 30 HN THR 30 38.519 2.891 4.161
231 HA THR 30 HA THR 30 39.367 3.433 6.737
232 HB THR 30 HB THR 30 40.494 1.311 6.731
233 HG1 THR 30 HG1 THR 30 40.253 1.033 3.930
234 1HG2 THR 30 HG21 THR 30 38.797 -0.153 5.797
235 2HG2 THR 30 HG22 THR 30 38.198 1.157 4.777
236 3HG2 THR 30 HG23 THR 30 38.030 1.259 6.531
237 H ARG 31 HN ARG 31 40.945 4.112 3.769
238 HA ARG 31 HA ARG 31 43.619 4.089 4.270
239 1HB ARG 31 HB2 ARG 31 41.899 5.862 2.593
240 2HB ARG 31 HB1 ARG 31 43.624 6.177 2.715
241 1HG ARG 31 HG2 ARG 31 43.544 3.483 2.199
242 2HG ARG 31 HG1 ARG 31 42.199 4.112 1.246
243 1HD ARG 31 HD2 ARG 31 44.661 4.019 0.282
244 2HD ARG 31 HD1 ARG 31 43.549 5.323 -0.126
245 HE ARG 31 HE ARG 31 45.645 5.540 1.943
246 1HH1 ARG 31 HH11 ARG 31 43.730 6.896 -0.656
247 2HH1 ARG 31 HH12 ARG 31 44.455 8.470 -0.545
248 1HH2 ARG 31 HH21 ARG 31 46.614 7.596 2.092
249 2HH2 ARG 31 HH22 ARG 31 46.122 8.862 0.995
250 H GLN 32 HN GLN 32 41.636 7.037 4.596
251 HA GLN 32 HA GLN 32 43.631 8.157 6.388
252 1HB GLN 32 HB2 GLN 32 41.398 9.874 6.324
253 2HB GLN 32 HB1 GLN 32 42.946 10.091 5.525
254 1HG GLN 32 HG2 GLN 32 41.292 10.368 3.879
255 2HG GLN 32 HG1 GLN 32 42.009 8.786 3.592
256 1HE2 GLN 32 HE21 GLN 32 39.614 9.673 6.050
257 2HE2 GLN 32 HE22 GLN 32 38.378 8.619 5.455
258 H ARG 33 HN ARG 33 40.303 7.051 6.453
259 HA ARG 33 HA ARG 33 38.913 6.408 8.102
260 1HB ARG 33 HB2 ARG 33 41.423 5.919 9.234
261 2HB ARG 33 HB1 ARG 33 40.521 6.794 10.465
262 1HG ARG 33 HG2 ARG 33 39.610 4.844 11.011
263 2HG ARG 33 HG1 ARG 33 38.695 4.966 9.507
264 1HD ARG 33 HD2 ARG 33 39.643 2.943 9.134
265 2HD ARG 33 HD1 ARG 33 40.960 3.948 8.530
266 HE ARG 33 HE ARG 33 40.902 2.852 11.276
267 1HH1 ARG 33 HH11 ARG 33 42.579 3.525 8.266
268 2HH1 ARG 33 HH12 ARG 33 44.114 2.944 8.844
269 1HH2 ARG 33 HH21 ARG 33 42.951 2.128 12.048
270 2HH2 ARG 33 HH22 ARG 33 44.327 2.165 10.980
271 H TYR 34 HN TYR 34 40.966 9.121 9.170
272 HA TYR 34 HA TYR 34 38.764 10.418 10.488
273 1HB TYR 34 HB2 TYR 34 40.295 12.247 10.900
274 2HB TYR 34 HB1 TYR 34 41.126 10.731 11.222
275 HD1 TYR 34 HD1 TYR 34 40.940 13.654 9.016
276 HD2 TYR 34 HD2 TYR 34 42.948 9.988 9.799
277 HE1 TYR 34 HE1 TYR 34 42.752 14.333 7.498
278 HE2 TYR 34 HE2 TYR 34 44.765 10.649 8.283
279 HH TYR 34 HH TYR 34 44.610 12.712 6.021
280 1HN NH2 35 H1 NH2 35 37.834 12.934 8.130
281 2HN NH2 35 H2 NH2 35 38.013 12.623 9.820
Start of MODEL 5
1 1H ILE 1 HT1 ILE 1 21.122 3.716 3.830
2 2H ILE 1 HT2 ILE 1 21.110 2.030 3.979
3 3H ILE 1 HT3 ILE 1 21.925 2.761 2.683
4 HA ILE 1 HA ILE 1 22.725 2.410 5.445
5 HB ILE 1 HB ILE 1 23.673 1.343 3.262
6 1HG1 ILE 1 HG12 ILE 1 26.041 2.185 4.671
7 2HG1 ILE 1 HG11 ILE 1 24.739 1.858 5.809
8 1HG2 ILE 1 HG21 ILE 1 24.144 3.171 1.895
9 2HG2 ILE 1 HG22 ILE 1 25.719 2.653 2.491
10 3HG2 ILE 1 HG23 ILE 1 24.931 4.061 3.198
11 1HD1 ILE 1 HD11 ILE 1 25.643 -0.054 3.671
12 2HD1 ILE 1 HD12 ILE 1 24.481 -0.368 4.961
13 3HD1 ILE 1 HD13 ILE 1 26.182 -0.098 5.349
14 H LYS 2 HN LYS 2 24.946 3.845 5.754
15 HA LYS 2 HA LYS 2 23.985 6.215 6.748
16 1HB LYS 2 HB2 LYS 2 26.139 4.994 7.341
17 2HB LYS 2 HB1 LYS 2 26.877 5.874 6.009
18 1HG LYS 2 HG2 LYS 2 27.178 7.640 7.303
19 2HG LYS 2 HG1 LYS 2 25.451 7.718 7.653
20 1HD LYS 2 HD2 LYS 2 27.178 5.729 9.075
21 2HD LYS 2 HD1 LYS 2 27.150 7.411 9.606
22 1HE LYS 2 HE2 LYS 2 25.278 6.994 10.735
23 2HE LYS 2 HE1 LYS 2 24.469 6.622 9.213
24 1HZ LYS 2 HZ1 LYS 2 24.796 4.376 9.479
25 2HZ LYS 2 HZ2 LYS 2 24.546 4.861 11.085
26 3HZ LYS 2 HZ3 LYS 2 26.119 4.565 10.525
27 HA PRO 3 HA PRO 3 25.728 8.882 3.165
28 1HB PRO 3 HB2 PRO 3 26.736 7.751 0.943
29 2HB PRO 3 HB1 PRO 3 27.720 8.011 2.390
30 1HG PRO 3 HG2 PRO 3 26.337 5.517 1.468
31 2HG PRO 3 HG1 PRO 3 27.995 5.713 2.069
32 1HD PRO 3 HD2 PRO 3 25.985 4.814 3.637
33 2HD PRO 3 HD1 PRO 3 27.323 5.794 4.270
34 H GLU 4 HN GLU 4 23.171 7.980 3.436
35 HA GLU 4 HA GLU 4 21.136 8.103 2.464
36 1HB GLU 4 HB2 GLU 4 22.525 9.141 -0.006
37 2HB GLU 4 HB1 GLU 4 20.863 9.426 0.491
38 1HG GLU 4 HG2 GLU 4 22.409 10.341 2.614
39 2HG GLU 4 HG1 GLU 4 23.266 10.867 1.166
40 H ALA 5 HN ALA 5 20.433 7.785 -0.310
41 HA ALA 5 HA ALA 5 21.390 5.173 -1.100
42 1HB ALA 5 HB1 ALA 5 18.920 5.509 0.404
43 2HB ALA 5 HB2 ALA 5 19.825 4.043 0.027
44 3HB ALA 5 HB3 ALA 5 18.676 4.696 -1.140
45 HA PRO 6 HA PRO 6 20.467 7.100 -5.058
46 1HB PRO 6 HB2 PRO 6 20.849 4.302 -5.977
47 2HB PRO 6 HB1 PRO 6 21.640 5.784 -6.525
48 1HG PRO 6 HG2 PRO 6 22.954 4.031 -5.008
49 2HG PRO 6 HG1 PRO 6 23.165 5.778 -4.781
50 1HD PRO 6 HD2 PRO 6 21.547 3.839 -3.175
51 2HD PRO 6 HD1 PRO 6 22.570 5.182 -2.623
52 H GLY 7 HN GLY 7 18.811 6.949 -6.641
53 1HA GLY 7 HA2 GLY 7 16.625 5.085 -6.005
54 2HA GLY 7 HA1 GLY 7 16.303 6.808 -6.142
55 H GLU 8 HN GLU 8 15.840 4.105 -7.707
56 HA GLU 8 HA GLU 8 15.196 3.579 -9.800
57 1HB GLU 8 HB2 GLU 8 15.707 6.503 -10.283
58 2HB GLU 8 HB1 GLU 8 15.214 5.419 -11.577
59 1HG GLU 8 HG2 GLU 8 13.678 5.981 -9.048
60 2HG GLU 8 HG1 GLU 8 13.308 6.604 -10.657
61 H ASP 9 HN ASP 9 18.232 4.396 -8.907
62 HA ASP 9 HA ASP 9 19.234 2.785 -11.141
63 1HB ASP 9 HB2 ASP 9 21.412 3.917 -10.985
64 2HB ASP 9 HB1 ASP 9 20.139 5.051 -11.403
65 H ALA 10 HN ALA 10 18.260 1.387 -9.349
66 HA ALA 10 HA ALA 10 19.948 -0.059 -7.804
67 1HB ALA 10 HB1 ALA 10 18.884 1.289 -5.586
68 2HB ALA 10 HB2 ALA 10 19.518 2.555 -6.635
69 3HB ALA 10 HB3 ALA 10 20.574 1.250 -6.093
70 H SER 11 HN SER 11 17.588 -0.176 -9.380
71 HA SER 11 HA SER 11 15.413 -0.538 -7.456
72 1HB SER 11 HB2 SER 11 14.785 -0.472 -10.323
73 2HB SER 11 HB1 SER 11 13.975 0.333 -8.974
74 HG SER 11 HG SER 11 15.723 1.349 -10.715
75 HA PRO 12 HA PRO 12 15.171 -4.664 -9.956
76 1HB PRO 12 HB2 PRO 12 17.174 -4.971 -11.821
77 2HB PRO 12 HB1 PRO 12 15.513 -4.519 -12.216
78 1HG PRO 12 HG2 PRO 12 17.919 -2.778 -11.875
79 2HG PRO 12 HG1 PRO 12 16.650 -2.696 -13.113
80 1HD PRO 12 HD2 PRO 12 16.675 -1.030 -11.041
81 2HD PRO 12 HD1 PRO 12 15.144 -1.695 -11.656
82 H GLU 13 HN GLU 13 18.485 -3.363 -10.218
83 HA GLU 13 HA GLU 13 19.315 -4.123 -7.696
84 1HB GLU 13 HB2 GLU 13 20.938 -6.048 -8.540
85 2HB GLU 13 HB1 GLU 13 19.325 -6.397 -7.941
86 1HG GLU 13 HG2 GLU 13 19.690 -7.691 -9.896
87 2HG GLU 13 HG1 GLU 13 18.528 -6.431 -10.301
88 H GLU 14 HN GLU 14 19.801 -2.044 -9.793
89 HA GLU 14 HA GLU 14 22.660 -2.056 -10.020
90 1HB GLU 14 HB2 GLU 14 20.964 0.432 -9.803
91 2HB GLU 14 HB1 GLU 14 22.514 0.247 -10.610
92 1HG GLU 14 HG2 GLU 14 21.246 0.171 -12.454
93 2HG GLU 14 HG1 GLU 14 21.034 -1.522 -11.999
94 H LEU 15 HN LEU 15 20.458 -1.793 -7.554
95 HA LEU 15 HA LEU 15 21.687 -0.263 -5.577
96 1HB LEU 15 HB2 LEU 15 19.424 -1.082 -5.399
97 2HB LEU 15 HB1 LEU 15 19.974 -2.745 -5.450
98 HG LEU 15 HG LEU 15 21.266 -1.586 -3.245
99 1HD1 LEU 15 HD11 LEU 15 18.365 -0.802 -3.439
100 2HD1 LEU 15 HD12 LEU 15 19.751 0.265 -3.226
101 3HD1 LEU 15 HD13 LEU 15 19.277 -0.836 -1.933
102 1HD2 LEU 15 HD21 LEU 15 18.864 -3.093 -2.629
103 2HD2 LEU 15 HD22 LEU 15 20.557 -3.498 -2.337
104 3HD2 LEU 15 HD23 LEU 15 19.818 -3.848 -3.903
105 H ASN 16 HN ASN 16 22.392 -3.431 -6.815
106 HA ASN 16 HA ASN 16 23.964 -4.421 -4.720
107 1HB ASN 16 HB2 ASN 16 23.261 -5.240 -7.317
108 2HB ASN 16 HB1 ASN 16 25.024 -5.202 -7.287
109 1HD2 ASN 16 HD21 ASN 16 22.380 -6.146 -5.108
110 2HD2 ASN 16 HD22 ASN 16 23.097 -7.649 -4.629
111 H ARG 17 HN ARG 17 24.789 -2.410 -7.522
112 HA ARG 17 HA ARG 17 27.546 -2.215 -6.725
113 1HB ARG 17 HB2 ARG 17 26.128 -0.424 -8.675
114 2HB ARG 17 HB1 ARG 17 27.855 -0.711 -8.526
115 1HG ARG 17 HG2 ARG 17 27.757 -2.431 -9.913
116 2HG ARG 17 HG1 ARG 17 26.453 -3.177 -8.989
117 1HD ARG 17 HD2 ARG 17 24.917 -1.485 -10.138
118 2HD ARG 17 HD1 ARG 17 26.262 -1.199 -11.241
119 HE ARG 17 HE ARG 17 24.617 -3.595 -11.060
120 1HH1 ARG 17 HH11 ARG 17 27.485 -2.064 -12.390
121 2HH1 ARG 17 HH12 ARG 17 27.658 -3.238 -13.664
122 1HH2 ARG 17 HH21 ARG 17 24.837 -5.105 -12.712
123 2HH2 ARG 17 HH22 ARG 17 26.153 -4.979 -13.842
124 H TYR 18 HN TYR 18 24.647 -0.708 -5.799
125 HA TYR 18 HA TYR 18 25.654 1.817 -5.024
126 1HB TYR 18 HB2 TYR 18 23.344 1.776 -4.899
127 2HB TYR 18 HB1 TYR 18 23.294 0.117 -4.351
128 HD1 TYR 18 HD1 TYR 18 21.334 1.228 -3.099
129 HD2 TYR 18 HD2 TYR 18 25.407 2.009 -2.153
130 HE1 TYR 18 HE1 TYR 18 20.659 2.043 -0.886
131 HE2 TYR 18 HE2 TYR 18 24.755 2.770 0.082
132 HH TYR 18 HH TYR 18 22.233 3.898 0.946
133 H TYR 19 HN TYR 19 25.280 -1.282 -3.350
134 HA TYR 19 HA TYR 19 26.905 -0.355 -1.153
135 1HB TYR 19 HB2 TYR 19 25.821 -3.111 -1.691
136 2HB TYR 19 HB1 TYR 19 26.500 -2.536 -0.173
137 HD1 TYR 19 HD1 TYR 19 23.571 -2.702 -2.263
138 HD2 TYR 19 HD2 TYR 19 25.279 -0.734 1.108
139 HE1 TYR 19 HE1 TYR 19 21.328 -1.993 -1.523
140 HE2 TYR 19 HE2 TYR 19 23.045 -0.045 1.853
141 HH TYR 19 HH TYR 19 20.257 -0.367 -0.134
142 H ALA 20 HN ALA 20 27.557 -1.722 -4.151
143 HA ALA 20 HA ALA 20 29.957 -3.126 -3.366
144 1HB ALA 20 HB1 ALA 20 28.976 -2.355 -6.111
145 2HB ALA 20 HB2 ALA 20 28.594 -3.863 -5.282
146 3HB ALA 20 HB3 ALA 20 30.261 -3.507 -5.743
147 H SER 21 HN SER 21 29.192 -0.243 -5.312
148 HA SER 21 HA SER 21 31.839 0.728 -5.414
149 1HB SER 21 HB2 SER 21 29.163 1.674 -6.152
150 2HB SER 21 HB1 SER 21 30.214 2.976 -5.581
151 HG SER 21 HG SER 21 31.025 2.897 -7.513
152 H LEU 22 HN LEU 22 29.150 1.161 -3.170
153 HA LEU 22 HA LEU 22 30.478 3.002 -1.462
154 1HB LEU 22 HB2 LEU 22 28.258 2.996 -0.966
155 2HB LEU 22 HB1 LEU 22 28.073 1.286 -1.297
156 HG LEU 22 HG LEU 22 29.460 1.057 0.950
157 1HD1 LEU 22 HD11 LEU 22 28.713 2.797 2.553
158 2HD1 LEU 22 HD12 LEU 22 28.130 3.748 1.188
159 3HD1 LEU 22 HD13 LEU 22 29.852 3.388 1.342
160 1HD2 LEU 22 HD21 LEU 22 26.670 1.811 1.476
161 2HD2 LEU 22 HD22 LEU 22 27.536 0.316 1.835
162 3HD2 LEU 22 HD23 LEU 22 26.913 0.605 0.211
163 H ARG 23 HN ARG 23 30.408 -0.528 -1.688
164 HA ARG 23 HA ARG 23 31.855 -0.950 0.723
165 1HB ARG 23 HB2 ARG 23 30.570 -2.716 -0.503
166 2HB ARG 23 HB1 ARG 23 31.880 -2.767 -1.676
167 1HG ARG 23 HG2 ARG 23 33.244 -3.001 0.664
168 2HG ARG 23 HG1 ARG 23 31.740 -3.857 1.033
169 1HD ARG 23 HD2 ARG 23 32.051 -5.210 -1.012
170 2HD ARG 23 HD1 ARG 23 33.589 -4.393 -1.288
171 HE ARG 23 HE ARG 23 33.657 -5.458 1.281
172 1HH1 ARG 23 HH11 ARG 23 33.523 -6.611 -2.029
173 2HH1 ARG 23 HH12 ARG 23 34.305 -8.124 -1.660
174 1HH2 ARG 23 HH21 ARG 23 34.682 -7.415 1.767
175 2HH2 ARG 23 HH22 ARG 23 34.979 -8.574 0.501
176 H HIS 24 HN HIS 24 32.888 -0.343 -2.603
177 HA HIS 24 HA HIS 24 35.647 -0.801 -2.111
178 1HB HIS 24 HB2 HIS 24 34.285 -0.333 -4.369
179 2HB HIS 24 HB1 HIS 24 34.868 1.303 -4.070
180 HD1 HIS 24 HD1 HIS 24 35.793 -0.757 -6.405
181 HD2 HIS 24 HD2 HIS 24 37.891 0.268 -2.954
182 HE1 HIS 24 HE1 HIS 24 38.211 -1.229 -6.905
183 HE2 HIS 24 HE2 HIS 24 39.430 -0.778 -4.748
184 H TYR 25 HN TYR 25 33.532 1.979 -1.781
185 HA TYR 25 HA TYR 25 35.466 3.845 -0.942
186 1HB TYR 25 HB2 TYR 25 33.494 4.886 -1.482
187 2HB TYR 25 HB1 TYR 25 32.503 3.600 -0.813
188 HD1 TYR 25 HD1 TYR 25 31.246 4.124 1.035
189 HD2 TYR 25 HD2 TYR 25 34.898 6.209 0.400
190 HE1 TYR 25 HE1 TYR 25 30.799 5.495 3.015
191 HE2 TYR 25 HE2 TYR 25 34.467 7.576 2.395
192 HH TYR 25 HH TYR 25 32.711 8.278 3.794
193 H LEU 26 HN LEU 26 33.418 1.569 0.857
194 HA LEU 26 HA LEU 26 34.299 2.224 3.441
195 1HB LEU 26 HB2 LEU 26 33.238 -0.359 2.311
196 2HB LEU 26 HB1 LEU 26 33.557 -0.114 4.017
197 HG LEU 26 HG LEU 26 31.616 1.536 2.406
198 1HD1 LEU 26 HD11 LEU 26 31.079 -0.952 2.735
199 2HD1 LEU 26 HD12 LEU 26 29.860 0.233 3.201
200 3HD1 LEU 26 HD13 LEU 26 30.859 -0.533 4.435
201 1HD2 LEU 26 HD21 LEU 26 30.804 2.024 4.800
202 2HD2 LEU 26 HD22 LEU 26 32.255 2.840 4.223
203 3HD2 LEU 26 HD23 LEU 26 32.396 1.449 5.297
204 H ASN 27 HN ASN 27 35.371 -0.248 1.175
205 HA ASN 27 HA ASN 27 37.459 -1.346 2.659
206 1HB ASN 27 HB2 ASN 27 36.401 -1.743 0.144
207 2HB ASN 27 HB1 ASN 27 38.021 -1.144 -0.208
208 1HD2 ASN 27 HD21 ASN 27 39.768 -2.396 0.239
209 2HD2 ASN 27 HD22 ASN 27 39.663 -4.037 0.782
210 H LEU 28 HN LEU 28 37.313 1.613 0.780
211 HA LEU 28 HA LEU 28 40.113 2.127 0.853
212 1HB LEU 28 HB2 LEU 28 38.697 3.250 -0.789
213 2HB LEU 28 HB1 LEU 28 37.810 4.025 0.521
214 HG LEU 28 HG LEU 28 40.292 4.814 1.143
215 1HD1 LEU 28 HD11 LEU 28 41.438 5.515 -0.916
216 2HD1 LEU 28 HD12 LEU 28 40.236 4.645 -1.873
217 3HD1 LEU 28 HD13 LEU 28 41.314 3.761 -0.793
218 1HD2 LEU 28 HD21 LEU 28 39.542 6.813 -0.553
219 2HD2 LEU 28 HD22 LEU 28 38.919 6.585 1.081
220 3HD2 LEU 28 HD23 LEU 28 38.016 5.968 -0.301
221 H VAL 29 HN VAL 29 37.418 3.613 2.527
222 HA VAL 29 HA VAL 29 38.879 5.357 4.055
223 HB VAL 29 HB VAL 29 36.954 5.497 5.609
224 1HG1 VAL 29 HG11 VAL 29 35.767 6.749 4.130
225 2HG1 VAL 29 HG12 VAL 29 35.797 5.501 2.884
226 3HG1 VAL 29 HG13 VAL 29 37.225 6.492 3.174
227 1HG2 VAL 29 HG21 VAL 29 35.372 3.930 5.746
228 2HG2 VAL 29 HG22 VAL 29 36.417 2.911 4.752
229 3HG2 VAL 29 HG23 VAL 29 35.163 3.896 3.994
230 H THR 30 HN THR 30 38.134 1.998 4.694
231 HA THR 30 HA THR 30 38.892 2.042 7.436
232 HB THR 30 HB THR 30 37.389 0.327 6.421
233 HG1 THR 30 HG1 THR 30 39.711 -0.736 7.704
234 1HG2 THR 30 HG21 THR 30 39.944 -0.869 5.355
235 2HG2 THR 30 HG22 THR 30 38.748 -0.024 4.369
236 3HG2 THR 30 HG23 THR 30 38.313 -1.524 5.192
237 H ARG 31 HN ARG 31 40.749 2.302 4.648
238 HA ARG 31 HA ARG 31 43.050 0.826 5.313
239 1HB ARG 31 HB2 ARG 31 42.448 3.142 3.562
240 2HB ARG 31 HB1 ARG 31 44.130 2.905 4.011
241 1HG ARG 31 HG2 ARG 31 44.268 0.871 2.904
242 2HG ARG 31 HG1 ARG 31 42.518 0.649 2.890
243 1HD ARG 31 HD2 ARG 31 42.226 1.971 1.072
244 2HD ARG 31 HD1 ARG 31 43.567 3.033 1.497
245 HE ARG 31 HE ARG 31 43.805 0.422 0.145
246 1HH1 ARG 31 HH11 ARG 31 45.216 3.487 1.114
247 2HH1 ARG 31 HH12 ARG 31 46.533 3.374 -0.017
248 1HH2 ARG 31 HH21 ARG 31 45.546 0.260 -1.309
249 2HH2 ARG 31 HH22 ARG 31 46.731 1.527 -1.376
250 H GLN 32 HN GLN 32 41.986 4.070 6.150
251 HA GLN 32 HA GLN 32 44.215 4.234 8.070
252 1HB GLN 32 HB2 GLN 32 43.272 6.853 7.553
253 2HB GLN 32 HB1 GLN 32 44.839 6.168 7.158
254 1HG GLN 32 HG2 GLN 32 43.980 7.077 5.169
255 2HG GLN 32 HG1 GLN 32 43.822 5.330 5.021
256 1HE2 GLN 32 HE21 GLN 32 41.709 7.419 6.920
257 2HE2 GLN 32 HE22 GLN 32 40.304 7.173 5.939
258 H ARG 33 HN ARG 33 40.828 4.895 7.435
259 HA ARG 33 HA ARG 33 39.126 5.710 8.686
260 1HB ARG 33 HB2 ARG 33 40.750 4.247 10.745
261 2HB ARG 33 HB1 ARG 33 39.361 5.198 11.246
262 1HG ARG 33 HG2 ARG 33 38.223 3.304 10.917
263 2HG ARG 33 HG1 ARG 33 38.303 3.748 9.210
264 1HD ARG 33 HD2 ARG 33 39.015 1.495 9.350
265 2HD ARG 33 HD1 ARG 33 40.465 2.462 9.093
266 HE ARG 33 HE ARG 33 39.694 1.632 11.812
267 1HH1 ARG 33 HH11 ARG 33 41.971 1.532 9.142
268 2HH1 ARG 33 HH12 ARG 33 43.246 0.847 10.096
269 1HH2 ARG 33 HH21 ARG 33 41.361 0.699 13.050
270 2HH2 ARG 33 HH22 ARG 33 42.904 0.356 12.310
271 H TYR 34 HN TYR 34 40.262 6.414 11.661
272 HA TYR 34 HA TYR 34 42.057 8.532 11.285
273 1HB TYR 34 HB2 TYR 34 39.332 9.247 10.774
274 2HB TYR 34 HB1 TYR 34 39.859 10.050 12.249
275 HD1 TYR 34 HD1 TYR 34 42.691 10.568 11.705
276 HD2 TYR 34 HD2 TYR 34 39.320 10.901 9.130
277 HE1 TYR 34 HE1 TYR 34 43.892 12.240 10.360
278 HE2 TYR 34 HE2 TYR 34 40.510 12.577 7.784
279 HH TYR 34 HH TYR 34 43.898 13.378 8.415
280 1HN NH2 35 H1 NH2 35 42.101 7.203 14.627
281 2HN NH2 35 H2 NH2 35 42.579 6.824 13.009
Start of MODEL 6
1 1H ILE 1 HT1 ILE 1 21.160 2.162 5.933
2 2H ILE 1 HT2 ILE 1 20.828 1.774 4.314
3 3H ILE 1 HT3 ILE 1 21.086 3.390 4.767
4 HA ILE 1 HA ILE 1 23.173 1.377 5.235
5 HB ILE 1 HB ILE 1 22.328 1.351 2.810
6 1HG1 ILE 1 HG12 ILE 1 24.725 1.447 1.907
7 2HG1 ILE 1 HG11 ILE 1 25.206 1.856 3.552
8 1HG2 ILE 1 HG21 ILE 1 23.971 3.662 2.124
9 2HG2 ILE 1 HG22 ILE 1 22.489 4.057 2.996
10 3HG2 ILE 1 HG23 ILE 1 22.409 3.139 1.492
11 1HD1 ILE 1 HD11 ILE 1 25.328 -0.591 2.829
12 2HD1 ILE 1 HD12 ILE 1 23.570 -0.582 2.963
13 3HD1 ILE 1 HD13 ILE 1 24.565 -0.231 4.378
14 H LYS 2 HN LYS 2 25.310 2.921 4.391
15 HA LYS 2 HA LYS 2 25.460 4.731 6.557
16 1HB LYS 2 HB2 LYS 2 27.309 3.738 4.503
17 2HB LYS 2 HB1 LYS 2 27.649 5.372 5.047
18 1HG LYS 2 HG2 LYS 2 28.288 2.914 6.303
19 2HG LYS 2 HG1 LYS 2 28.678 4.551 6.820
20 1HD LYS 2 HD2 LYS 2 25.930 3.952 7.420
21 2HD LYS 2 HD1 LYS 2 26.982 2.705 8.086
22 1HE LYS 2 HE2 LYS 2 28.023 4.148 9.515
23 2HE LYS 2 HE1 LYS 2 27.772 5.542 8.462
24 1HZ LYS 2 HZ1 LYS 2 25.449 5.567 9.095
25 2HZ LYS 2 HZ2 LYS 2 26.431 5.667 10.473
26 3HZ LYS 2 HZ3 LYS 2 25.669 4.201 10.078
27 HA PRO 3 HA PRO 3 24.914 8.311 3.497
28 1HB PRO 3 HB2 PRO 3 24.917 7.456 0.749
29 2HB PRO 3 HB1 PRO 3 26.081 8.501 1.562
30 1HG PRO 3 HG2 PRO 3 26.651 5.981 0.620
31 2HG PRO 3 HG1 PRO 3 27.547 6.791 1.915
32 1HD PRO 3 HD2 PRO 3 25.402 4.716 2.102
33 2HD PRO 3 HD1 PRO 3 26.895 4.888 3.052
34 H GLU 4 HN GLU 4 23.314 8.638 1.213
35 HA GLU 4 HA GLU 4 20.827 7.412 2.090
36 1HB GLU 4 HB2 GLU 4 21.316 9.435 -0.103
37 2HB GLU 4 HB1 GLU 4 19.746 8.940 0.516
38 1HG GLU 4 HG2 GLU 4 21.358 9.816 2.697
39 2HG GLU 4 HG1 GLU 4 21.404 11.031 1.423
40 H ALA 5 HN ALA 5 19.448 6.223 0.670
41 HA ALA 5 HA ALA 5 20.976 4.680 -1.290
42 1HB ALA 5 HB1 ALA 5 18.760 3.285 -1.198
43 2HB ALA 5 HB2 ALA 5 18.511 4.173 0.306
44 3HB ALA 5 HB3 ALA 5 19.948 3.170 0.100
45 HA PRO 6 HA PRO 6 18.993 6.733 -4.703
46 1HB PRO 6 HB2 PRO 6 19.588 4.296 -6.237
47 2HB PRO 6 HB1 PRO 6 20.181 5.941 -6.474
48 1HG PRO 6 HG2 PRO 6 21.773 3.980 -5.560
49 2HG PRO 6 HG1 PRO 6 21.941 5.659 -5.007
50 1HD PRO 6 HD2 PRO 6 20.627 3.336 -3.644
51 2HD PRO 6 HD1 PRO 6 21.674 4.598 -2.957
52 H GLY 7 HN GLY 7 17.343 6.178 -6.455
53 1HA GLY 7 HA2 GLY 7 15.281 4.491 -5.186
54 2HA GLY 7 HA1 GLY 7 14.949 5.894 -6.184
55 H GLU 8 HN GLU 8 15.417 5.760 -8.459
56 HA GLU 8 HA GLU 8 14.673 3.162 -9.504
57 1HB GLU 8 HB2 GLU 8 14.473 5.904 -10.359
58 2HB GLU 8 HB1 GLU 8 15.198 4.927 -11.630
59 1HG GLU 8 HG2 GLU 8 13.023 3.458 -10.623
60 2HG GLU 8 HG1 GLU 8 12.471 5.119 -10.840
61 H ASP 9 HN ASP 9 17.451 4.951 -8.973
62 HA ASP 9 HA ASP 9 19.093 3.524 -10.906
63 1HB ASP 9 HB2 ASP 9 20.710 5.072 -9.165
64 2HB ASP 9 HB1 ASP 9 20.286 5.438 -10.833
65 H ALA 10 HN ALA 10 18.117 1.644 -9.467
66 HA ALA 10 HA ALA 10 19.990 0.479 -7.819
67 1HB ALA 10 HB1 ALA 10 18.605 2.558 -6.495
68 2HB ALA 10 HB2 ALA 10 19.734 1.392 -5.803
69 3HB ALA 10 HB3 ALA 10 18.006 1.032 -5.844
70 H SER 11 HN SER 11 16.802 0.959 -8.860
71 HA SER 11 HA SER 11 15.374 -1.116 -7.774
72 1HB SER 11 HB2 SER 11 14.963 -0.311 -10.602
73 2HB SER 11 HB1 SER 11 13.752 -0.663 -9.360
74 HG SER 11 HG SER 11 14.460 1.288 -8.306
75 HA PRO 12 HA PRO 12 16.297 -4.001 -11.615
76 1HB PRO 12 HB2 PRO 12 18.757 -3.379 -12.754
77 2HB PRO 12 HB1 PRO 12 17.186 -3.009 -13.465
78 1HG PRO 12 HG2 PRO 12 19.003 -1.261 -11.861
79 2HG PRO 12 HG1 PRO 12 18.047 -0.856 -13.301
80 1HD PRO 12 HD2 PRO 12 17.238 -0.118 -10.885
81 2HD PRO 12 HD1 PRO 12 16.067 -0.716 -12.080
82 H GLU 13 HN GLU 13 19.167 -2.476 -10.308
83 HA GLU 13 HA GLU 13 19.517 -3.881 -8.043
84 1HB GLU 13 HB2 GLU 13 21.007 -5.709 -8.404
85 2HB GLU 13 HB1 GLU 13 19.686 -5.928 -9.542
86 1HG GLU 13 HG2 GLU 13 21.858 -4.397 -10.693
87 2HG GLU 13 HG1 GLU 13 22.394 -5.968 -10.103
88 H GLU 14 HN GLU 14 20.155 -1.373 -9.472
89 HA GLU 14 HA GLU 14 23.010 -1.148 -9.460
90 1HB GLU 14 HB2 GLU 14 20.986 1.088 -9.301
91 2HB GLU 14 HB1 GLU 14 22.660 1.209 -9.829
92 1HG GLU 14 HG2 GLU 14 22.055 -0.350 -11.709
93 2HG GLU 14 HG1 GLU 14 20.371 -0.138 -11.233
94 H LEU 15 HN LEU 15 20.615 -1.283 -7.106
95 HA LEU 15 HA LEU 15 21.829 0.258 -5.054
96 1HB LEU 15 HB2 LEU 15 19.452 -0.493 -5.065
97 2HB LEU 15 HB1 LEU 15 20.005 -2.136 -4.808
98 HG LEU 15 HG LEU 15 21.187 -0.982 -2.703
99 1HD1 LEU 15 HD11 LEU 15 20.355 0.980 -2.056
100 2HD1 LEU 15 HD12 LEU 15 18.698 0.466 -2.369
101 3HD1 LEU 15 HD13 LEU 15 19.679 1.118 -3.679
102 1HD2 LEU 15 HD21 LEU 15 19.379 -2.853 -2.975
103 2HD2 LEU 15 HD22 LEU 15 18.278 -1.578 -2.453
104 3HD2 LEU 15 HD23 LEU 15 19.620 -2.063 -1.417
105 H ASN 16 HN ASN 16 22.093 -3.094 -6.121
106 HA ASN 16 HA ASN 16 23.566 -4.021 -3.898
107 1HB ASN 16 HB2 ASN 16 22.566 -5.139 -6.294
108 2HB ASN 16 HB1 ASN 16 24.295 -5.482 -6.250
109 1HD2 ASN 16 HD21 ASN 16 21.348 -5.645 -4.335
110 2HD2 ASN 16 HD22 ASN 16 21.809 -7.039 -3.413
111 H ARG 17 HN ARG 17 24.593 -2.786 -7.077
112 HA ARG 17 HA ARG 17 27.367 -3.026 -6.365
113 1HB ARG 17 HB2 ARG 17 26.309 -1.288 -8.568
114 2HB ARG 17 HB1 ARG 17 27.920 -1.964 -8.380
115 1HG ARG 17 HG2 ARG 17 26.713 -4.252 -8.546
116 2HG ARG 17 HG1 ARG 17 25.395 -3.314 -9.253
117 1HD ARG 17 HD2 ARG 17 26.452 -3.243 -11.206
118 2HD ARG 17 HD1 ARG 17 27.870 -2.519 -10.448
119 HE ARG 17 HE ARG 17 27.436 -5.439 -10.498
120 1HH1 ARG 17 HH11 ARG 17 29.458 -2.629 -11.079
121 2HH1 ARG 17 HH12 ARG 17 30.885 -3.573 -11.399
122 1HH2 ARG 17 HH21 ARG 17 29.295 -6.671 -10.932
123 2HH2 ARG 17 HH22 ARG 17 30.786 -5.873 -11.345
124 H TYR 18 HN TYR 18 24.912 -0.780 -5.655
125 HA TYR 18 HA TYR 18 26.704 1.419 -5.220
126 1HB TYR 18 HB2 TYR 18 24.515 2.177 -5.460
127 2HB TYR 18 HB1 TYR 18 23.838 0.829 -4.555
128 HD1 TYR 18 HD1 TYR 18 22.843 1.431 -2.598
129 HD2 TYR 18 HD2 TYR 18 26.281 3.593 -3.862
130 HE1 TYR 18 HE1 TYR 18 22.692 2.829 -0.592
131 HE2 TYR 18 HE2 TYR 18 26.143 5.002 -1.849
132 HH TYR 18 HH TYR 18 23.648 5.493 -0.131
133 H TYR 19 HN TYR 19 25.159 -1.130 -3.377
134 HA TYR 19 HA TYR 19 26.410 -0.667 -0.907
135 1HB TYR 19 HB2 TYR 19 25.268 -3.136 -2.211
136 2HB TYR 19 HB1 TYR 19 25.948 -3.173 -0.589
137 HD1 TYR 19 HD1 TYR 19 23.658 -4.020 0.052
138 HD2 TYR 19 HD2 TYR 19 24.285 -0.094 -1.475
139 HE1 TYR 19 HE1 TYR 19 21.505 -3.313 1.005
140 HE2 TYR 19 HE2 TYR 19 22.134 0.623 -0.517
141 HH TYR 19 HH TYR 19 19.761 -1.179 0.274
142 H ALA 20 HN ALA 20 27.520 -2.057 -3.847
143 HA ALA 20 HA ALA 20 29.676 -3.562 -2.647
144 1HB ALA 20 HB1 ALA 20 28.437 -4.501 -4.514
145 2HB ALA 20 HB2 ALA 20 30.128 -4.260 -4.953
146 3HB ALA 20 HB3 ALA 20 28.896 -3.129 -5.527
147 H SER 21 HN SER 21 29.361 -0.983 -5.060
148 HA SER 21 HA SER 21 32.136 -0.423 -5.133
149 1HB SER 21 HB2 SER 21 29.671 0.640 -6.360
150 2HB SER 21 HB1 SER 21 30.969 1.826 -6.156
151 HG SER 21 HG SER 21 31.387 -0.735 -7.319
152 H LEU 22 HN LEU 22 29.455 0.795 -3.210
153 HA LEU 22 HA LEU 22 31.073 2.856 -1.985
154 1HB LEU 22 HB2 LEU 22 28.993 3.582 -1.595
155 2HB LEU 22 HB1 LEU 22 28.298 1.993 -1.825
156 HG LEU 22 HG LEU 22 29.424 1.724 0.638
157 1HD1 LEU 22 HD11 LEU 22 28.332 4.527 0.509
158 2HD1 LEU 22 HD12 LEU 22 30.045 4.118 0.641
159 3HD1 LEU 22 HD13 LEU 22 28.931 3.684 1.938
160 1HD2 LEU 22 HD21 LEU 22 27.275 0.936 0.358
161 2HD2 LEU 22 HD22 LEU 22 26.694 2.458 -0.316
162 3HD2 LEU 22 HD23 LEU 22 27.018 2.327 1.412
163 H ARG 23 HN ARG 23 30.223 -0.536 -1.311
164 HA ARG 23 HA ARG 23 31.568 -0.584 1.195
165 1HB ARG 23 HB2 ARG 23 30.231 -2.461 0.738
166 2HB ARG 23 HB1 ARG 23 30.994 -2.734 -0.823
167 1HG ARG 23 HG2 ARG 23 33.130 -2.983 0.809
168 2HG ARG 23 HG1 ARG 23 31.837 -3.558 1.869
169 1HD ARG 23 HD2 ARG 23 31.711 -4.605 -0.867
170 2HD ARG 23 HD1 ARG 23 33.145 -5.097 0.035
171 HE ARG 23 HE ARG 23 31.651 -6.001 1.734
172 1HH1 ARG 23 HH11 ARG 23 30.278 -5.305 -1.416
173 2HH1 ARG 23 HH12 ARG 23 28.956 -6.415 -1.228
174 1HH2 ARG 23 HH21 ARG 23 29.890 -7.469 1.975
175 2HH2 ARG 23 HH22 ARG 23 28.733 -7.629 0.682
176 H HIS 24 HN HIS 24 32.711 -0.955 -2.121
177 HA HIS 24 HA HIS 24 35.407 -1.538 -1.476
178 1HB HIS 24 HB2 HIS 24 34.071 -1.514 -3.792
179 2HB HIS 24 HB1 HIS 24 34.786 0.092 -3.898
180 HD1 HIS 24 HD1 HIS 24 36.169 -3.316 -2.880
181 HD2 HIS 24 HD2 HIS 24 37.026 -0.097 -5.375
182 HE1 HIS 24 HE1 HIS 24 38.349 -3.882 -4.000
183 HE2 HIS 24 HE2 HIS 24 38.722 -2.033 -5.672
184 H TYR 25 HN TYR 25 33.571 1.416 -1.858
185 HA TYR 25 HA TYR 25 35.648 3.266 -1.515
186 1HB TYR 25 HB2 TYR 25 33.671 4.192 -2.300
187 2HB TYR 25 HB1 TYR 25 32.676 3.281 -1.177
188 HD1 TYR 25 HD1 TYR 25 31.541 4.569 0.340
189 HD2 TYR 25 HD2 TYR 25 35.407 5.841 -0.924
190 HE1 TYR 25 HE1 TYR 25 31.346 6.556 1.752
191 HE2 TYR 25 HE2 TYR 25 35.223 7.831 0.511
192 HH TYR 25 HH TYR 25 34.030 8.828 2.156
193 H LEU 26 HN LEU 26 33.552 1.586 0.804
194 HA LEU 26 HA LEU 26 34.652 2.699 3.152
195 1HB LEU 26 HB2 LEU 26 33.359 0.015 2.683
196 2HB LEU 26 HB1 LEU 26 33.758 0.654 4.267
197 HG LEU 26 HG LEU 26 31.865 2.012 2.347
198 1HD1 LEU 26 HD11 LEU 26 30.573 0.927 4.648
199 2HD1 LEU 26 HD12 LEU 26 31.445 -0.358 3.812
200 3HD1 LEU 26 HD13 LEU 26 30.256 0.614 2.943
201 1HD2 LEU 26 HD21 LEU 26 31.695 2.482 5.240
202 2HD2 LEU 26 HD22 LEU 26 31.590 3.616 3.892
203 3HD2 LEU 26 HD23 LEU 26 33.166 3.080 4.474
204 H ASN 27 HN ASN 27 35.375 -0.281 1.388
205 HA ASN 27 HA ASN 27 37.503 -1.255 2.850
206 1HB ASN 27 HB2 ASN 27 36.336 -1.816 0.382
207 2HB ASN 27 HB1 ASN 27 38.010 -1.438 -0.011
208 1HD2 ASN 27 HD21 ASN 27 39.548 -2.901 0.406
209 2HD2 ASN 27 HD22 ASN 27 39.272 -4.436 1.153
210 H LEU 28 HN LEU 28 37.432 1.502 0.661
211 HA LEU 28 HA LEU 28 40.290 1.822 0.744
212 1HB LEU 28 HB2 LEU 28 39.130 2.703 -1.192
213 2HB LEU 28 HB1 LEU 28 38.181 3.757 -0.139
214 HG LEU 28 HG LEU 28 40.704 4.398 0.620
215 1HD1 LEU 28 HD11 LEU 28 42.209 3.899 -0.936
216 2HD1 LEU 28 HD12 LEU 28 41.283 4.790 -2.144
217 3HD1 LEU 28 HD13 LEU 28 40.970 3.075 -1.886
218 1HD2 LEU 28 HD21 LEU 28 39.596 6.304 0.269
219 2HD2 LEU 28 HD22 LEU 28 38.552 5.567 -0.946
220 3HD2 LEU 28 HD23 LEU 28 40.127 6.206 -1.414
221 H VAL 29 HN VAL 29 37.581 3.637 2.060
222 HA VAL 29 HA VAL 29 39.021 5.663 3.208
223 HB VAL 29 HB VAL 29 37.175 6.029 4.821
224 1HG1 VAL 29 HG11 VAL 29 36.074 5.473 2.091
225 2HG1 VAL 29 HG12 VAL 29 37.212 6.782 2.400
226 3HG1 VAL 29 HG13 VAL 29 35.647 6.768 3.212
227 1HG2 VAL 29 HG21 VAL 29 35.727 4.449 5.385
228 2HG2 VAL 29 HG22 VAL 29 36.681 3.304 4.437
229 3HG2 VAL 29 HG23 VAL 29 35.320 4.149 3.696
230 H THR 30 HN THR 30 38.518 2.434 4.424
231 HA THR 30 HA THR 30 39.565 2.918 7.038
232 HB THR 30 HB THR 30 38.111 0.986 6.509
233 HG1 THR 30 HG1 THR 30 40.693 0.276 7.495
234 1HG2 THR 30 HG21 THR 30 38.931 0.344 4.350
235 2HG2 THR 30 HG22 THR 30 39.158 -1.010 5.458
236 3HG2 THR 30 HG23 THR 30 40.533 -0.001 5.009
237 H ARG 31 HN ARG 31 41.084 3.376 4.249
238 HA ARG 31 HA ARG 31 43.544 2.058 4.504
239 1HB ARG 31 HB2 ARG 31 42.463 3.751 2.657
240 2HB ARG 31 HB1 ARG 31 43.704 4.756 3.395
241 1HG ARG 31 HG2 ARG 31 45.368 2.992 2.940
242 2HG ARG 31 HG1 ARG 31 44.114 2.052 2.132
243 1HD ARG 31 HD2 ARG 31 44.829 3.088 0.276
244 2HD ARG 31 HD1 ARG 31 43.882 4.451 0.871
245 HE ARG 31 HE ARG 31 45.824 5.588 1.306
246 1HH1 ARG 31 HH11 ARG 31 46.578 2.210 0.747
247 2HH1 ARG 31 HH12 ARG 31 48.299 2.452 0.734
248 1HH2 ARG 31 HH21 ARG 31 48.095 5.916 1.287
249 2HH2 ARG 31 HH22 ARG 31 49.159 4.565 1.023
250 H GLN 32 HN GLN 32 42.375 5.160 5.676
251 HA GLN 32 HA GLN 32 44.874 5.537 7.181
252 1HB GLN 32 HB2 GLN 32 43.309 7.874 7.375
253 2HB GLN 32 HB1 GLN 32 44.787 7.649 6.453
254 1HG GLN 32 HG2 GLN 32 43.545 8.229 4.695
255 2HG GLN 32 HG1 GLN 32 42.932 6.581 4.773
256 1HE2 GLN 32 HE21 GLN 32 41.672 7.576 7.464
257 2HE2 GLN 32 HE22 GLN 32 40.201 8.303 6.922
258 H ARG 33 HN ARG 33 41.403 5.297 7.434
259 HA ARG 33 HA ARG 33 39.985 5.004 9.172
260 1HB ARG 33 HB2 ARG 33 42.556 4.088 10.274
261 2HB ARG 33 HB1 ARG 33 41.380 4.589 11.484
262 1HG ARG 33 HG2 ARG 33 40.552 2.539 11.325
263 2HG ARG 33 HG1 ARG 33 39.893 3.043 9.765
264 1HD ARG 33 HD2 ARG 33 41.047 1.080 9.277
265 2HD ARG 33 HD1 ARG 33 42.169 2.355 8.804
266 HE ARG 33 HE ARG 33 42.364 0.769 11.284
267 1HH1 ARG 33 HH11 ARG 33 43.833 2.656 8.727
268 2HH1 ARG 33 HH12 ARG 33 45.457 2.393 9.277
269 1HH2 ARG 33 HH21 ARG 33 44.495 0.404 12.020
270 2HH2 ARG 33 HH22 ARG 33 45.841 1.088 11.144
271 H TYR 34 HN TYR 34 40.091 5.767 11.837
272 HA TYR 34 HA TYR 34 40.982 8.481 12.061
273 1HB TYR 34 HB2 TYR 34 38.731 8.373 10.660
274 2HB TYR 34 HB1 TYR 34 38.010 8.223 12.258
275 HD1 TYR 34 HD1 TYR 34 37.627 10.131 13.557
276 HD2 TYR 34 HD2 TYR 34 40.277 10.374 10.242
277 HE1 TYR 34 HE1 TYR 34 37.750 12.570 13.841
278 HE2 TYR 34 HE2 TYR 34 40.411 12.813 10.516
279 HH TYR 34 HH TYR 34 40.101 14.474 12.379
280 1HN NH2 35 H1 NH2 35 40.717 7.922 15.489
281 2HN NH2 35 H2 NH2 35 41.460 8.761 14.175
Start of MODEL 7
1 1H ILE 1 HT1 ILE 1 24.915 15.736 0.861
2 2H ILE 1 HT2 ILE 1 24.952 14.249 1.664
3 3H ILE 1 HT3 ILE 1 24.990 14.299 -0.031
4 HA ILE 1 HA ILE 1 27.120 15.320 -0.039
5 HB ILE 1 HB ILE 1 26.621 16.500 2.209
6 1HG1 ILE 1 HG12 ILE 1 29.193 16.429 2.727
7 2HG1 ILE 1 HG11 ILE 1 29.264 15.484 1.242
8 1HG2 ILE 1 HG21 ILE 1 27.251 15.517 4.205
9 2HG2 ILE 1 HG22 ILE 1 28.203 14.266 3.404
10 3HG2 ILE 1 HG23 ILE 1 26.441 14.197 3.360
11 1HD1 ILE 1 HD11 ILE 1 27.746 17.582 0.452
12 2HD1 ILE 1 HD12 ILE 1 29.499 17.482 0.268
13 3HD1 ILE 1 HD13 ILE 1 28.803 18.345 1.641
14 H LYS 2 HN LYS 2 25.632 12.631 1.409
15 HA LYS 2 HA LYS 2 28.106 11.049 1.156
16 1HB LYS 2 HB2 LYS 2 25.713 10.762 2.963
17 2HB LYS 2 HB1 LYS 2 26.786 9.406 2.647
18 1HG LYS 2 HG2 LYS 2 28.287 11.754 3.381
19 2HG LYS 2 HG1 LYS 2 27.072 11.368 4.600
20 1HD LYS 2 HD2 LYS 2 29.034 9.374 3.473
21 2HD LYS 2 HD1 LYS 2 29.286 10.275 4.970
22 1HE LYS 2 HE2 LYS 2 26.834 9.285 5.433
23 2HE LYS 2 HE1 LYS 2 27.472 8.017 4.389
24 1HZ LYS 2 HZ1 LYS 2 29.086 7.460 5.899
25 2HZ LYS 2 HZ2 LYS 2 27.817 7.900 6.937
26 3HZ LYS 2 HZ3 LYS 2 29.092 8.982 6.649
27 HA PRO 3 HA PRO 3 26.133 8.728 -2.052
28 1HB PRO 3 HB2 PRO 3 27.160 6.170 -1.176
29 2HB PRO 3 HB1 PRO 3 27.727 7.188 -2.501
30 1HG PRO 3 HG2 PRO 3 29.143 6.716 -0.203
31 2HG PRO 3 HG1 PRO 3 29.354 8.148 -1.225
32 1HD PRO 3 HD2 PRO 3 27.865 7.848 1.347
33 2HD PRO 3 HD1 PRO 3 28.833 9.216 0.754
34 H GLU 4 HN GLU 4 24.953 8.639 0.889
35 HA GLU 4 HA GLU 4 23.402 6.213 0.801
36 1HB GLU 4 HB2 GLU 4 24.227 7.418 2.916
37 2HB GLU 4 HB1 GLU 4 22.926 8.562 2.624
38 1HG GLU 4 HG2 GLU 4 21.979 5.833 2.533
39 2HG GLU 4 HG1 GLU 4 22.779 6.200 4.061
40 H ALA 5 HN ALA 5 22.450 6.529 -1.223
41 HA ALA 5 HA ALA 5 20.127 8.316 -1.141
42 1HB ALA 5 HB1 ALA 5 22.353 8.517 -2.873
43 2HB ALA 5 HB2 ALA 5 20.879 9.489 -2.860
44 3HB ALA 5 HB3 ALA 5 20.963 8.021 -3.838
45 HA PRO 6 HA PRO 6 18.800 4.467 -3.504
46 1HB PRO 6 HB2 PRO 6 20.785 2.801 -4.539
47 2HB PRO 6 HB1 PRO 6 19.935 4.064 -5.430
48 1HG PRO 6 HG2 PRO 6 22.682 4.009 -4.737
49 2HG PRO 6 HG1 PRO 6 21.791 5.354 -5.464
50 1HD PRO 6 HD2 PRO 6 22.554 4.895 -2.629
51 2HD PRO 6 HD1 PRO 6 22.318 6.422 -3.508
52 H GLY 7 HN GLY 7 17.965 2.968 -2.165
53 1HA GLY 7 HA2 GLY 7 19.850 1.357 -0.553
54 2HA GLY 7 HA1 GLY 7 18.193 1.725 -0.076
55 H GLU 8 HN GLU 8 17.197 -0.206 -0.039
56 HA GLU 8 HA GLU 8 17.623 -2.157 -2.126
57 1HB GLU 8 HB2 GLU 8 15.301 -2.810 -0.635
58 2HB GLU 8 HB1 GLU 8 16.892 -3.549 -0.542
59 1HG GLU 8 HG2 GLU 8 17.542 -1.838 1.124
60 2HG GLU 8 HG1 GLU 8 15.889 -1.225 1.082
61 H ASP 9 HN ASP 9 16.279 0.663 -2.296
62 HA ASP 9 HA ASP 9 13.748 -0.069 -3.547
63 1HB ASP 9 HB2 ASP 9 13.194 2.265 -3.456
64 2HB ASP 9 HB1 ASP 9 13.887 1.826 -1.898
65 H ALA 10 HN ALA 10 16.774 -0.123 -4.562
66 HA ALA 10 HA ALA 10 16.566 1.420 -6.981
67 1HB ALA 10 HB1 ALA 10 18.632 -0.481 -7.228
68 2HB ALA 10 HB2 ALA 10 18.639 0.069 -5.550
69 3HB ALA 10 HB3 ALA 10 18.774 1.239 -6.863
70 H SER 11 HN SER 11 15.982 0.700 -8.979
71 HA SER 11 HA SER 11 14.127 -1.447 -8.912
72 1HB SER 11 HB2 SER 11 14.734 -0.432 -11.561
73 2HB SER 11 HB1 SER 11 13.222 -0.371 -10.649
74 HG SER 11 HG SER 11 13.769 1.545 -9.818
75 HA PRO 12 HA PRO 12 16.650 -3.863 -11.987
76 1HB PRO 12 HB2 PRO 12 18.713 -2.585 -13.369
77 2HB PRO 12 HB1 PRO 12 17.040 -2.724 -13.910
78 1HG PRO 12 HG2 PRO 12 18.394 -0.351 -13.189
79 2HG PRO 12 HG1 PRO 12 16.664 -0.533 -13.514
80 1HD PRO 12 HD2 PRO 12 18.105 -0.454 -10.910
81 2HD PRO 12 HD1 PRO 12 16.471 0.113 -11.322
82 H GLU 13 HN GLU 13 17.663 -3.218 -9.318
83 HA GLU 13 HA GLU 13 19.285 -3.871 -7.859
84 1HB GLU 13 HB2 GLU 13 19.106 -6.026 -9.128
85 2HB GLU 13 HB1 GLU 13 20.399 -5.475 -10.181
86 1HG GLU 13 HG2 GLU 13 21.693 -6.631 -8.766
87 2HG GLU 13 HG1 GLU 13 21.585 -5.173 -7.784
88 H GLU 14 HN GLU 14 19.537 -1.480 -9.495
89 HA GLU 14 HA GLU 14 22.267 -1.125 -10.142
90 1HB GLU 14 HB2 GLU 14 21.759 1.090 -10.554
91 2HB GLU 14 HB1 GLU 14 20.169 0.359 -10.702
92 1HG GLU 14 HG2 GLU 14 20.249 0.978 -8.051
93 2HG GLU 14 HG1 GLU 14 21.184 2.292 -8.761
94 H LEU 15 HN LEU 15 20.622 -1.492 -7.264
95 HA LEU 15 HA LEU 15 22.112 0.109 -5.493
96 1HB LEU 15 HB2 LEU 15 21.190 -1.577 -3.784
97 2HB LEU 15 HB1 LEU 15 20.063 -0.566 -4.659
98 HG LEU 15 HG LEU 15 20.014 -2.694 -6.283
99 1HD1 LEU 15 HD11 LEU 15 21.636 -3.684 -4.355
100 2HD1 LEU 15 HD12 LEU 15 20.597 -4.667 -5.391
101 3HD1 LEU 15 HD13 LEU 15 20.056 -4.212 -3.776
102 1HD2 LEU 15 HD21 LEU 15 18.458 -1.892 -3.912
103 2HD2 LEU 15 HD22 LEU 15 18.180 -3.528 -4.511
104 3HD2 LEU 15 HD23 LEU 15 17.941 -2.145 -5.579
105 H ASN 16 HN ASN 16 22.526 -3.224 -6.599
106 HA ASN 16 HA ASN 16 24.153 -4.195 -4.596
107 1HB ASN 16 HB2 ASN 16 24.586 -6.015 -5.962
108 2HB ASN 16 HB1 ASN 16 23.079 -5.376 -6.630
109 1HD2 ASN 16 HD21 ASN 16 23.736 -3.396 -8.089
110 2HD2 ASN 16 HD22 ASN 16 24.826 -3.805 -9.346
111 H ARG 17 HN ARG 17 25.201 -2.281 -7.420
112 HA ARG 17 HA ARG 17 27.962 -2.547 -6.590
113 1HB ARG 17 HB2 ARG 17 28.406 -0.910 -8.453
114 2HB ARG 17 HB1 ARG 17 27.788 -2.492 -8.918
115 1HG ARG 17 HG2 ARG 17 25.805 -1.653 -9.657
116 2HG ARG 17 HG1 ARG 17 25.810 -0.323 -8.495
117 1HD ARG 17 HD2 ARG 17 26.404 0.971 -10.217
118 2HD ARG 17 HD1 ARG 17 27.996 0.225 -10.064
119 HE ARG 17 HE ARG 17 26.450 -1.448 -11.663
120 1HH1 ARG 17 HH11 ARG 17 27.778 1.787 -11.783
121 2HH1 ARG 17 HH12 ARG 17 27.855 1.829 -13.516
122 1HH2 ARG 17 HH21 ARG 17 26.571 -1.409 -13.937
123 2HH2 ARG 17 HH22 ARG 17 27.180 0.002 -14.752
124 H TYR 18 HN TYR 18 25.336 -0.371 -6.073
125 HA TYR 18 HA TYR 18 26.912 1.774 -5.102
126 1HB TYR 18 HB2 TYR 18 24.825 2.621 -4.881
127 2HB TYR 18 HB1 TYR 18 24.105 1.024 -5.017
128 HD1 TYR 18 HD1 TYR 18 23.179 -0.055 -3.130
129 HD2 TYR 18 HD2 TYR 18 25.619 3.408 -2.600
130 HE1 TYR 18 HE1 TYR 18 22.574 0.007 -0.755
131 HE2 TYR 18 HE2 TYR 18 25.010 3.472 -0.219
132 HH TYR 18 HH TYR 18 22.521 2.159 1.067
133 H TYR 19 HN TYR 19 25.606 -1.189 -3.726
134 HA TYR 19 HA TYR 19 26.685 -1.000 -1.150
135 1HB TYR 19 HB2 TYR 19 26.038 -3.397 -2.865
136 2HB TYR 19 HB1 TYR 19 26.532 -3.522 -1.183
137 HD1 TYR 19 HD1 TYR 19 23.786 -3.077 -3.456
138 HD2 TYR 19 HD2 TYR 19 25.075 -2.338 0.557
139 HE1 TYR 19 HE1 TYR 19 21.441 -2.889 -2.693
140 HE2 TYR 19 HE2 TYR 19 22.741 -2.128 1.291
141 HH TYR 19 HH TYR 19 20.498 -2.887 0.555
142 H ALA 20 HN ALA 20 28.059 -2.076 -4.152
143 HA ALA 20 HA ALA 20 30.304 -3.407 -2.960
144 1HB ALA 20 HB1 ALA 20 29.290 -4.312 -4.944
145 2HB ALA 20 HB2 ALA 20 30.940 -3.803 -5.312
146 3HB ALA 20 HB3 ALA 20 29.573 -2.804 -5.812
147 H SER 21 HN SER 21 29.825 -0.588 -5.061
148 HA SER 21 HA SER 21 32.533 0.228 -4.986
149 1HB SER 21 HB2 SER 21 29.982 1.255 -6.060
150 2HB SER 21 HB1 SER 21 31.165 2.506 -5.642
151 HG SER 21 HG SER 21 31.822 1.984 -7.615
152 H LEU 22 HN LEU 22 29.702 0.907 -3.014
153 HA LEU 22 HA LEU 22 31.019 2.859 -1.362
154 1HB LEU 22 HB2 LEU 22 28.607 2.842 -1.406
155 2HB LEU 22 HB1 LEU 22 28.558 1.161 -0.917
156 HG LEU 22 HG LEU 22 29.794 2.120 1.223
157 1HD1 LEU 22 HD11 LEU 22 28.338 4.475 0.069
158 2HD1 LEU 22 HD12 LEU 22 30.018 4.380 0.596
159 3HD1 LEU 22 HD13 LEU 22 28.717 4.323 1.785
160 1HD2 LEU 22 HD21 LEU 22 27.552 0.944 0.953
161 2HD2 LEU 22 HD22 LEU 22 26.844 2.559 0.926
162 3HD2 LEU 22 HD23 LEU 22 27.740 2.011 2.344
163 H ARG 23 HN ARG 23 30.618 -0.663 -1.341
164 HA ARG 23 HA ARG 23 31.864 -1.054 1.185
165 1HB ARG 23 HB2 ARG 23 30.653 -2.872 0.201
166 2HB ARG 23 HB1 ARG 23 31.693 -2.866 -1.218
167 1HG ARG 23 HG2 ARG 23 33.206 -4.159 -0.234
168 2HG ARG 23 HG1 ARG 23 33.202 -3.181 1.236
169 1HD ARG 23 HD2 ARG 23 31.746 -5.664 0.591
170 2HD ARG 23 HD1 ARG 23 32.339 -5.070 2.138
171 HE ARG 23 HE ARG 23 30.290 -3.438 1.811
172 1HH1 ARG 23 HH11 ARG 23 30.469 -6.871 1.126
173 2HH1 ARG 23 HH12 ARG 23 28.789 -7.151 1.444
174 1HH2 ARG 23 HH21 ARG 23 28.085 -3.808 2.237
175 2HH2 ARG 23 HH22 ARG 23 27.429 -5.414 2.081
176 H HIS 24 HN HIS 24 33.148 -0.782 -2.091
177 HA HIS 24 HA HIS 24 35.843 -1.300 -1.442
178 1HB HIS 24 HB2 HIS 24 34.440 -0.692 -3.764
179 2HB HIS 24 HB1 HIS 24 35.504 0.694 -3.550
180 HD1 HIS 24 HD1 HIS 24 38.110 0.170 -3.478
181 HD2 HIS 24 HD2 HIS 24 35.666 -2.986 -4.658
182 HE1 HIS 24 HE1 HIS 24 39.640 -1.519 -4.542
183 HE2 HIS 24 HE2 HIS 24 38.106 -3.298 -5.457
184 H TYR 25 HN TYR 25 33.918 1.656 -1.542
185 HA TYR 25 HA TYR 25 35.887 3.460 -0.711
186 1HB TYR 25 HB2 TYR 25 33.961 4.523 -1.398
187 2HB TYR 25 HB1 TYR 25 32.909 3.360 -0.608
188 HD1 TYR 25 HD1 TYR 25 35.423 5.965 0.342
189 HD2 TYR 25 HD2 TYR 25 31.703 4.090 1.178
190 HE1 TYR 25 HE1 TYR 25 35.046 7.548 2.182
191 HE2 TYR 25 HE2 TYR 25 31.312 5.661 3.014
192 HH TYR 25 HH TYR 25 32.763 8.467 3.389
193 H LEU 26 HN LEU 26 33.670 1.413 1.158
194 HA LEU 26 HA LEU 26 34.452 2.206 3.715
195 1HB LEU 26 HB2 LEU 26 33.451 -0.448 2.704
196 2HB LEU 26 HB1 LEU 26 33.708 -0.107 4.404
197 HG LEU 26 HG LEU 26 31.781 1.350 2.601
198 1HD1 LEU 26 HD11 LEU 26 31.555 -1.125 3.989
199 2HD1 LEU 26 HD12 LEU 26 30.336 -0.269 3.044
200 3HD1 LEU 26 HD13 LEU 26 30.505 0.062 4.768
201 1HD2 LEU 26 HD21 LEU 26 32.891 1.979 5.206
202 2HD2 LEU 26 HD22 LEU 26 31.132 1.844 5.250
203 3HD2 LEU 26 HD23 LEU 26 31.900 2.967 4.132
204 H ASN 27 HN ASN 27 35.591 -0.580 1.816
205 HA ASN 27 HA ASN 27 37.662 -1.307 3.574
206 1HB ASN 27 HB2 ASN 27 36.576 -2.366 1.283
207 2HB ASN 27 HB1 ASN 27 38.189 -1.895 0.752
208 1HD2 ASN 27 HD21 ASN 27 37.496 -4.504 0.755
209 2HD2 ASN 27 HD22 ASN 27 38.352 -5.350 2.010
210 H LEU 28 HN LEU 28 37.473 1.337 1.412
211 HA LEU 28 HA LEU 28 40.349 1.707 1.287
212 1HB LEU 28 HB2 LEU 28 39.009 2.493 -0.599
213 2HB LEU 28 HB1 LEU 28 38.110 3.547 0.496
214 HG LEU 28 HG LEU 28 40.653 4.316 1.019
215 1HD1 LEU 28 HD11 LEU 28 42.067 4.076 -0.700
216 2HD1 LEU 28 HD12 LEU 28 40.824 4.425 -1.901
217 3HD1 LEU 28 HD13 LEU 28 40.978 2.798 -1.241
218 1HD2 LEU 28 HD21 LEU 28 39.847 6.315 0.385
219 2HD2 LEU 28 HD22 LEU 28 38.344 5.448 0.076
220 3HD2 LEU 28 HD23 LEU 28 39.469 5.759 -1.246
221 H VAL 29 HN VAL 29 37.646 3.531 2.509
222 HA VAL 29 HA VAL 29 39.069 5.519 3.786
223 HB VAL 29 HB VAL 29 36.675 5.687 3.246
224 1HG1 VAL 29 HG11 VAL 29 36.496 3.331 4.860
225 2HG1 VAL 29 HG12 VAL 29 35.274 4.076 3.821
226 3HG1 VAL 29 HG13 VAL 29 35.431 4.583 5.508
227 1HG2 VAL 29 HG21 VAL 29 37.641 7.250 4.848
228 2HG2 VAL 29 HG22 VAL 29 37.263 6.145 6.168
229 3HG2 VAL 29 HG23 VAL 29 35.961 6.893 5.246
230 H THR 30 HN THR 30 38.306 2.314 4.823
231 HA THR 30 HA THR 30 39.204 2.768 7.527
232 HB THR 30 HB THR 30 37.492 1.033 6.867
233 HG1 THR 30 HG1 THR 30 38.500 -0.588 8.321
234 1HG2 THR 30 HG21 THR 30 38.344 -1.150 6.101
235 2HG2 THR 30 HG22 THR 30 39.939 -0.435 5.883
236 3HG2 THR 30 HG23 THR 30 38.581 0.122 4.903
237 H ARG 31 HN ARG 31 40.919 3.425 5.207
238 HA ARG 31 HA ARG 31 43.082 1.749 4.856
239 1HB ARG 31 HB2 ARG 31 42.606 3.994 3.724
240 2HB ARG 31 HB1 ARG 31 43.358 4.740 5.128
241 1HG ARG 31 HG2 ARG 31 45.246 4.585 3.954
242 2HG ARG 31 HG1 ARG 31 45.226 2.887 4.431
243 1HD ARG 31 HD2 ARG 31 45.130 2.319 2.290
244 2HD ARG 31 HD1 ARG 31 43.556 3.106 2.176
245 HE ARG 31 HE ARG 31 45.717 4.970 1.954
246 1HH1 ARG 31 HH11 ARG 31 43.959 2.535 0.154
247 2HH1 ARG 31 HH12 ARG 31 44.174 3.318 -1.381
248 1HH2 ARG 31 HH21 ARG 31 46.015 6.010 -0.066
249 2HH2 ARG 31 HH22 ARG 31 45.354 5.300 -1.511
250 H GLN 32 HN GLN 32 42.501 4.199 7.324
251 HA GLN 32 HA GLN 32 44.775 3.216 8.899
252 1HB GLN 32 HB2 GLN 32 44.684 5.226 10.121
253 2HB GLN 32 HB1 GLN 32 44.349 5.710 8.467
254 1HG GLN 32 HG2 GLN 32 42.278 5.280 10.612
255 2HG GLN 32 HG1 GLN 32 42.910 6.842 10.103
256 1HE2 GLN 32 HE21 GLN 32 40.644 4.390 9.525
257 2HE2 GLN 32 HE22 GLN 32 39.936 5.050 8.085
258 H ARG 33 HN ARG 33 42.083 1.943 8.424
259 HA ARG 33 HA ARG 33 40.504 0.737 9.480
260 1HB ARG 33 HB2 ARG 33 42.127 1.187 11.988
261 2HB ARG 33 HB1 ARG 33 40.869 -0.023 11.767
262 1HG ARG 33 HG2 ARG 33 43.487 0.103 10.288
263 2HG ARG 33 HG1 ARG 33 43.080 -1.012 11.596
264 1HD ARG 33 HD2 ARG 33 41.794 -2.317 10.260
265 2HD ARG 33 HD1 ARG 33 41.236 -0.954 9.289
266 HE ARG 33 HE ARG 33 43.781 -1.108 8.520
267 1HH1 ARG 33 HH11 ARG 33 41.346 -3.615 8.841
268 2HH1 ARG 33 HH12 ARG 33 42.077 -4.643 7.648
269 1HH2 ARG 33 HH21 ARG 33 44.719 -2.447 6.948
270 2HH2 ARG 33 HH22 ARG 33 43.990 -3.979 6.576
271 H TYR 34 HN TYR 34 38.635 1.748 9.444
272 HA TYR 34 HA TYR 34 38.201 3.947 11.365
273 1HB TYR 34 HB2 TYR 34 38.059 4.239 8.710
274 2HB TYR 34 HB1 TYR 34 36.422 3.661 8.993
275 HD1 TYR 34 HD1 TYR 34 38.848 6.283 10.055
276 HD2 TYR 34 HD2 TYR 34 34.759 5.137 9.734
277 HE1 TYR 34 HE1 TYR 34 38.164 8.553 10.706
278 HE2 TYR 34 HE2 TYR 34 34.067 7.409 10.378
279 HH TYR 34 HH TYR 34 35.223 9.360 11.790
280 1HN NH2 35 H1 NH2 35 36.052 1.504 12.836
281 2HN NH2 35 H2 NH2 35 37.657 2.143 12.881
Start of MODEL 8
1 1H ILE 1 HT1 ILE 1 23.350 5.219 4.647
2 2H ILE 1 HT2 ILE 1 23.527 6.562 5.664
3 3H ILE 1 HT3 ILE 1 23.509 5.000 6.319
4 HA ILE 1 HA ILE 1 25.668 4.841 6.141
5 HB ILE 1 HB ILE 1 25.926 5.715 3.320
6 1HG1 ILE 1 HG12 ILE 1 23.659 4.526 3.525
7 2HG1 ILE 1 HG11 ILE 1 24.793 3.893 2.339
8 1HG2 ILE 1 HG21 ILE 1 27.738 4.445 3.442
9 2HG2 ILE 1 HG22 ILE 1 26.802 3.051 3.978
10 3HG2 ILE 1 HG23 ILE 1 27.387 4.224 5.156
11 1HD1 ILE 1 HD11 ILE 1 23.933 1.995 3.356
12 2HD1 ILE 1 HD12 ILE 1 23.955 2.722 4.962
13 3HD1 ILE 1 HD13 ILE 1 25.466 2.234 4.191
14 H LYS 2 HN LYS 2 25.477 7.378 3.651
15 HA LYS 2 HA LYS 2 26.205 9.467 5.431
16 1HB LYS 2 HB2 LYS 2 28.343 7.867 4.672
17 2HB LYS 2 HB1 LYS 2 28.442 9.237 3.575
18 1HG LYS 2 HG2 LYS 2 27.940 10.260 6.166
19 2HG LYS 2 HG1 LYS 2 29.240 9.074 6.293
20 1HD LYS 2 HD2 LYS 2 30.669 10.560 5.454
21 2HD LYS 2 HD1 LYS 2 29.714 10.630 3.971
22 1HE LYS 2 HE2 LYS 2 28.318 12.368 4.915
23 2HE LYS 2 HE1 LYS 2 29.177 12.261 6.450
24 1HZ LYS 2 HZ1 LYS 2 31.031 12.689 4.378
25 2HZ LYS 2 HZ2 LYS 2 30.667 13.686 5.697
26 3HZ LYS 2 HZ3 LYS 2 29.795 13.843 4.247
27 HA PRO 3 HA PRO 3 25.928 11.276 1.078
28 1HB PRO 3 HB2 PRO 3 26.328 9.862 -1.144
29 2HB PRO 3 HB1 PRO 3 27.692 10.375 -0.143
30 1HG PRO 3 HG2 PRO 3 26.382 7.699 -0.333
31 2HG PRO 3 HG1 PRO 3 28.101 8.095 -0.167
32 1HD PRO 3 HD2 PRO 3 26.406 7.333 1.906
33 2HD PRO 3 HD1 PRO 3 27.965 8.156 2.100
34 H GLU 4 HN GLU 4 24.617 10.755 -1.265
35 HA GLU 4 HA GLU 4 21.956 10.163 -0.501
36 1HB GLU 4 HB2 GLU 4 23.147 11.324 -2.697
37 2HB GLU 4 HB1 GLU 4 22.558 9.798 -3.345
38 1HG GLU 4 HG2 GLU 4 20.955 11.655 -3.592
39 2HG GLU 4 HG1 GLU 4 20.319 10.301 -2.659
40 H ALA 5 HN ALA 5 21.198 8.220 0.012
41 HA ALA 5 HA ALA 5 22.456 5.877 -1.251
42 1HB ALA 5 HB1 ALA 5 21.248 5.665 1.460
43 2HB ALA 5 HB2 ALA 5 22.824 6.434 1.294
44 3HB ALA 5 HB3 ALA 5 22.593 4.774 0.747
45 HA PRO 6 HA PRO 6 18.140 5.024 -2.403
46 1HB PRO 6 HB2 PRO 6 19.484 3.021 -4.086
47 2HB PRO 6 HB1 PRO 6 18.373 4.309 -4.562
48 1HG PRO 6 HG2 PRO 6 20.994 4.404 -5.161
49 2HG PRO 6 HG1 PRO 6 20.061 5.867 -4.787
50 1HD PRO 6 HD2 PRO 6 21.938 4.314 -3.040
51 2HD PRO 6 HD1 PRO 6 21.759 6.072 -3.214
52 H GLY 7 HN GLY 7 20.819 3.149 -1.385
53 1HA GLY 7 HA2 GLY 7 21.010 1.507 0.193
54 2HA GLY 7 HA1 GLY 7 19.334 1.817 0.607
55 H GLU 8 HN GLU 8 18.105 0.143 0.456
56 HA GLU 8 HA GLU 8 19.026 -2.216 -0.935
57 1HB GLU 8 HB2 GLU 8 16.939 -1.582 1.092
58 2HB GLU 8 HB1 GLU 8 16.724 -3.030 0.117
59 1HG GLU 8 HG2 GLU 8 17.803 -3.665 2.128
60 2HG GLU 8 HG1 GLU 8 19.000 -3.753 0.837
61 H ASP 9 HN ASP 9 17.668 0.333 -2.177
62 HA ASP 9 HA ASP 9 16.196 -1.218 -4.136
63 1HB ASP 9 HB2 ASP 9 14.508 -0.414 -2.450
64 2HB ASP 9 HB1 ASP 9 14.923 1.236 -2.916
65 H ALA 10 HN ALA 10 18.056 -0.711 -5.370
66 HA ALA 10 HA ALA 10 17.692 1.893 -6.678
67 1HB ALA 10 HB1 ALA 10 20.291 0.378 -6.583
68 2HB ALA 10 HB2 ALA 10 19.903 1.718 -5.504
69 3HB ALA 10 HB3 ALA 10 20.016 1.993 -7.242
70 H SER 11 HN SER 11 16.123 0.986 -7.944
71 HA SER 11 HA SER 11 15.160 -0.324 -9.519
72 1HB SER 11 HB2 SER 11 17.911 -0.919 -10.612
73 2HB SER 11 HB1 SER 11 16.399 -0.688 -11.496
74 HG SER 11 HG SER 11 16.889 1.531 -10.106
75 HA PRO 12 HA PRO 12 15.564 -4.565 -8.230
76 1HB PRO 12 HB2 PRO 12 15.772 -6.173 -10.404
77 2HB PRO 12 HB1 PRO 12 14.266 -5.379 -9.935
78 1HG PRO 12 HG2 PRO 12 16.256 -4.578 -12.018
79 2HG PRO 12 HG1 PRO 12 14.484 -4.566 -12.099
80 1HD PRO 12 HD2 PRO 12 15.946 -2.331 -11.635
81 2HD PRO 12 HD1 PRO 12 14.326 -2.573 -10.949
82 H GLU 13 HN GLU 13 18.252 -3.079 -9.558
83 HA GLU 13 HA GLU 13 20.180 -4.923 -8.671
84 1HB GLU 13 HB2 GLU 13 18.968 -6.190 -10.609
85 2HB GLU 13 HB1 GLU 13 19.910 -5.150 -11.667
86 1HG GLU 13 HG2 GLU 13 21.491 -6.691 -11.553
87 2HG GLU 13 HG1 GLU 13 21.776 -6.135 -9.904
88 H GLU 14 HN GLU 14 19.725 -1.958 -9.172
89 HA GLU 14 HA GLU 14 22.360 -1.514 -10.407
90 1HB GLU 14 HB2 GLU 14 20.196 0.485 -9.697
91 2HB GLU 14 HB1 GLU 14 21.763 0.899 -10.381
92 1HG GLU 14 HG2 GLU 14 19.838 -0.944 -11.763
93 2HG GLU 14 HG1 GLU 14 19.800 0.805 -11.974
94 H LEU 15 HN LEU 15 20.823 -2.000 -7.539
95 HA LEU 15 HA LEU 15 22.232 -0.206 -5.833
96 1HB LEU 15 HB2 LEU 15 21.393 -1.949 -4.068
97 2HB LEU 15 HB1 LEU 15 20.267 -0.859 -4.855
98 HG LEU 15 HG LEU 15 20.040 -2.892 -6.552
99 1HD1 LEU 15 HD11 LEU 15 20.223 -4.578 -4.167
100 2HD1 LEU 15 HD12 LEU 15 21.777 -4.012 -4.784
101 3HD1 LEU 15 HD13 LEU 15 20.683 -4.914 -5.836
102 1HD2 LEU 15 HD21 LEU 15 18.703 -2.899 -3.852
103 2HD2 LEU 15 HD22 LEU 15 18.080 -3.594 -5.349
104 3HD2 LEU 15 HD23 LEU 15 18.254 -1.844 -5.193
105 H ASN 16 HN ASN 16 22.870 -3.378 -7.101
106 HA ASN 16 HA ASN 16 24.564 -4.374 -5.109
107 1HB ASN 16 HB2 ASN 16 25.536 -5.594 -7.304
108 2HB ASN 16 HB1 ASN 16 24.020 -6.048 -6.516
109 1HD2 ASN 16 HD21 ASN 16 22.154 -5.640 -7.394
110 2HD2 ASN 16 HD22 ASN 16 21.969 -5.048 -9.004
111 H ARG 17 HN ARG 17 25.332 -2.367 -7.953
112 HA ARG 17 HA ARG 17 28.120 -2.343 -7.203
113 1HB ARG 17 HB2 ARG 17 27.411 -0.168 -8.955
114 2HB ARG 17 HB1 ARG 17 28.536 -1.493 -9.200
115 1HG ARG 17 HG2 ARG 17 26.405 -2.895 -9.674
116 2HG ARG 17 HG1 ARG 17 25.637 -1.326 -9.912
117 1HD ARG 17 HD2 ARG 17 28.190 -1.581 -11.299
118 2HD ARG 17 HD1 ARG 17 26.992 -2.762 -11.822
119 HE ARG 17 HE ARG 17 26.998 0.034 -12.368
120 1HH1 ARG 17 HH11 ARG 17 24.907 -2.768 -11.952
121 2HH1 ARG 17 HH12 ARG 17 23.521 -1.988 -12.682
122 1HH2 ARG 17 HH21 ARG 17 25.195 1.007 -13.389
123 2HH2 ARG 17 HH22 ARG 17 23.691 0.138 -13.487
124 H TYR 18 HN TYR 18 25.317 -0.636 -6.266
125 HA TYR 18 HA TYR 18 26.702 1.647 -5.239
126 1HB TYR 18 HB2 TYR 18 24.519 2.232 -5.010
127 2HB TYR 18 HB1 TYR 18 23.980 0.557 -5.059
128 HD1 TYR 18 HD1 TYR 18 25.405 3.144 -2.788
129 HD2 TYR 18 HD2 TYR 18 23.266 -0.535 -3.086
130 HE1 TYR 18 HE1 TYR 18 24.942 3.220 -0.375
131 HE2 TYR 18 HE2 TYR 18 22.804 -0.459 -0.673
132 HH TYR 18 HH TYR 18 23.219 0.590 1.258
133 H TYR 19 HN TYR 19 25.688 -1.495 -4.018
134 HA TYR 19 HA TYR 19 26.853 -1.365 -1.472
135 1HB TYR 19 HB2 TYR 19 26.286 -3.710 -3.285
136 2HB TYR 19 HB1 TYR 19 26.839 -3.882 -1.627
137 HD1 TYR 19 HD1 TYR 19 25.364 -2.759 0.193
138 HD2 TYR 19 HD2 TYR 19 23.987 -3.623 -3.755
139 HE1 TYR 19 HE1 TYR 19 23.042 -2.716 0.999
140 HE2 TYR 19 HE2 TYR 19 21.674 -3.574 -2.942
141 HH TYR 19 HH TYR 19 20.857 -2.665 0.358
142 H ALA 20 HN ALA 20 28.166 -1.983 -4.597
143 HA ALA 20 HA ALA 20 30.585 -3.228 -3.630
144 1HB ALA 20 HB1 ALA 20 31.134 -3.445 -5.985
145 2HB ALA 20 HB2 ALA 20 29.765 -2.412 -6.407
146 3HB ALA 20 HB3 ALA 20 29.486 -3.994 -5.676
147 H SER 21 HN SER 21 29.768 -0.305 -5.499
148 HA SER 21 HA SER 21 32.347 0.800 -5.473
149 1HB SER 21 HB2 SER 21 31.284 2.839 -6.228
150 2HB SER 21 HB1 SER 21 30.422 1.478 -6.967
151 HG SER 21 HG SER 21 28.698 1.983 -5.880
152 H LEU 22 HN LEU 22 29.610 1.035 -3.277
153 HA LEU 22 HA LEU 22 30.845 2.831 -1.424
154 1HB LEU 22 HB2 LEU 22 28.406 2.462 -1.541
155 2HB LEU 22 HB1 LEU 22 28.634 0.821 -0.979
156 HG LEU 22 HG LEU 22 29.737 1.973 1.090
157 1HD1 LEU 22 HD11 LEU 22 28.371 4.200 -0.314
158 2HD1 LEU 22 HD12 LEU 22 29.828 4.207 0.679
159 3HD1 LEU 22 HD13 LEU 22 28.242 4.123 1.444
160 1HD2 LEU 22 HD21 LEU 22 26.773 2.281 0.907
161 2HD2 LEU 22 HD22 LEU 22 27.758 1.662 2.233
162 3HD2 LEU 22 HD23 LEU 22 27.510 0.682 0.788
163 H ARG 23 HN ARG 23 30.739 -0.699 -1.811
164 HA ARG 23 HA ARG 23 32.088 -1.190 0.658
165 1HB ARG 23 HB2 ARG 23 30.783 -2.897 -0.679
166 2HB ARG 23 HB1 ARG 23 32.182 -2.994 -1.743
167 1HG ARG 23 HG2 ARG 23 33.453 -3.364 0.546
168 2HG ARG 23 HG1 ARG 23 31.854 -3.933 1.046
169 1HD ARG 23 HD2 ARG 23 31.997 -5.801 -0.180
170 2HD ARG 23 HD1 ARG 23 32.702 -4.954 -1.556
171 HE ARG 23 HE ARG 23 34.862 -5.158 -0.458
172 1HH1 ARG 23 HH11 ARG 23 32.261 -7.129 0.790
173 2HH1 ARG 23 HH12 ARG 23 33.318 -8.370 1.404
174 1HH2 ARG 23 HH21 ARG 23 36.271 -6.753 0.410
175 2HH2 ARG 23 HH22 ARG 23 35.605 -8.142 1.208
176 H HIS 24 HN HIS 24 33.202 -0.322 -2.524
177 HA HIS 24 HA HIS 24 35.957 -0.930 -2.028
178 1HB HIS 24 HB2 HIS 24 34.431 0.611 -4.077
179 2HB HIS 24 HB1 HIS 24 36.136 1.009 -3.888
180 HD1 HIS 24 HD1 HIS 24 37.856 -0.923 -4.416
181 HD2 HIS 24 HD2 HIS 24 33.892 -1.743 -5.379
182 HE1 HIS 24 HE1 HIS 24 37.919 -2.944 -5.920
183 HE2 HIS 24 HE2 HIS 24 35.503 -3.554 -6.277
184 H TYR 25 HN TYR 25 33.910 1.913 -1.714
185 HA TYR 25 HA TYR 25 35.796 3.660 -0.609
186 1HB TYR 25 HB2 TYR 25 33.821 4.698 -1.224
187 2HB TYR 25 HB1 TYR 25 32.824 3.414 -0.561
188 HD1 TYR 25 HD1 TYR 25 35.317 5.874 0.773
189 HD2 TYR 25 HD2 TYR 25 31.503 4.044 1.169
190 HE1 TYR 25 HE1 TYR 25 34.875 7.239 2.766
191 HE2 TYR 25 HE2 TYR 25 31.045 5.396 3.153
192 HH TYR 25 HH TYR 25 32.907 6.670 4.991
193 H LEU 26 HN LEU 26 33.626 1.297 0.907
194 HA LEU 26 HA LEU 26 34.435 1.708 3.562
195 1HB LEU 26 HB2 LEU 26 33.400 -0.765 2.186
196 2HB LEU 26 HB1 LEU 26 33.636 -0.647 3.918
197 HG LEU 26 HG LEU 26 31.810 1.193 2.383
198 1HD1 LEU 26 HD11 LEU 26 31.180 -1.402 3.781
199 2HD1 LEU 26 HD12 LEU 26 30.953 -1.020 2.074
200 3HD1 LEU 26 HD13 LEU 26 29.971 -0.213 3.295
201 1HD2 LEU 26 HD21 LEU 26 30.812 1.401 4.716
202 2HD2 LEU 26 HD22 LEU 26 32.373 2.172 4.444
203 3HD2 LEU 26 HD23 LEU 26 32.288 0.631 5.296
204 H ASN 27 HN ASN 27 35.559 -0.587 1.128
205 HA ASN 27 HA ASN 27 37.578 -1.887 2.407
206 1HB ASN 27 HB2 ASN 27 37.348 -2.657 0.275
207 2HB ASN 27 HB1 ASN 27 37.085 -1.053 -0.393
208 1HD2 ASN 27 HD21 ASN 27 39.500 -3.319 0.720
209 2HD2 ASN 27 HD22 ASN 27 40.820 -2.638 -0.170
210 H LEU 28 HN LEU 28 37.753 1.399 1.036
211 HA LEU 28 HA LEU 28 40.487 1.707 1.879
212 1HB LEU 28 HB2 LEU 28 39.675 2.987 -0.044
213 2HB LEU 28 HB1 LEU 28 38.510 3.791 1.012
214 HG LEU 28 HG LEU 28 40.805 4.294 2.355
215 1HD1 LEU 28 HD11 LEU 28 42.632 4.145 1.091
216 2HD1 LEU 28 HD12 LEU 28 41.894 5.145 -0.160
217 3HD1 LEU 28 HD13 LEU 28 41.665 3.398 -0.183
218 1HD2 LEU 28 HD21 LEU 28 39.978 6.333 2.077
219 2HD2 LEU 28 HD22 LEU 28 38.879 5.704 0.850
220 3HD2 LEU 28 HD23 LEU 28 40.456 6.338 0.380
221 H VAL 29 HN VAL 29 37.479 3.214 2.773
222 HA VAL 29 HA VAL 29 38.377 4.953 4.676
223 HB VAL 29 HB VAL 29 36.098 4.899 3.643
224 1HG1 VAL 29 HG11 VAL 29 34.749 3.189 3.981
225 2HG1 VAL 29 HG12 VAL 29 34.720 3.544 5.712
226 3HG1 VAL 29 HG13 VAL 29 35.940 2.447 5.053
227 1HG2 VAL 29 HG21 VAL 29 35.395 6.382 5.174
228 2HG2 VAL 29 HG22 VAL 29 36.962 6.087 5.924
229 3HG2 VAL 29 HG23 VAL 29 35.533 5.233 6.503
230 H THR 30 HN THR 30 37.873 1.533 5.103
231 HA THR 30 HA THR 30 37.900 1.510 7.953
232 HB THR 30 HB THR 30 37.125 -0.428 6.654
233 HG1 THR 30 HG1 THR 30 38.739 -2.011 7.720
234 1HG2 THR 30 HG21 THR 30 40.001 -0.665 5.792
235 2HG2 THR 30 HG22 THR 30 38.613 -0.294 4.767
236 3HG2 THR 30 HG23 THR 30 38.758 -1.888 5.515
237 H ARG 31 HN ARG 31 40.098 2.612 5.847
238 HA ARG 31 HA ARG 31 42.629 2.012 6.624
239 1HB ARG 31 HB2 ARG 31 42.069 3.680 4.931
240 2HB ARG 31 HB1 ARG 31 41.421 4.745 6.167
241 1HG ARG 31 HG2 ARG 31 43.408 5.669 6.411
242 2HG ARG 31 HG1 ARG 31 44.086 4.110 6.885
243 1HD ARG 31 HD2 ARG 31 43.931 3.787 4.205
244 2HD ARG 31 HD1 ARG 31 44.213 5.526 4.309
245 HE ARG 31 HE ARG 31 46.296 5.135 5.310
246 1HH1 ARG 31 HH11 ARG 31 44.662 2.171 4.430
247 2HH1 ARG 31 HH12 ARG 31 46.048 1.165 4.705
248 1HH2 ARG 31 HH21 ARG 31 48.128 3.818 5.698
249 2HH2 ARG 31 HH22 ARG 31 48.034 2.108 5.398
250 H GLN 32 HN GLN 32 40.242 3.948 8.335
251 HA GLN 32 HA GLN 32 42.118 4.622 10.446
252 1HB GLN 32 HB2 GLN 32 40.134 5.872 11.393
253 2HB GLN 32 HB1 GLN 32 40.713 6.423 9.826
254 1HG GLN 32 HG2 GLN 32 38.616 6.294 9.140
255 2HG GLN 32 HG1 GLN 32 38.799 4.541 9.186
256 1HE2 GLN 32 HE21 GLN 32 38.889 4.208 12.009
257 2HE2 GLN 32 HE22 GLN 32 37.296 4.571 12.607
258 H ARG 33 HN ARG 33 40.390 1.900 9.848
259 HA ARG 33 HA ARG 33 39.051 1.339 12.235
260 1HB ARG 33 HB2 ARG 33 39.953 -0.174 9.984
261 2HB ARG 33 HB1 ARG 33 40.445 -1.026 11.442
262 1HG ARG 33 HG2 ARG 33 38.279 -1.801 10.691
263 2HG ARG 33 HG1 ARG 33 38.136 -0.985 12.250
264 1HD ARG 33 HD2 ARG 33 37.566 1.107 10.901
265 2HD ARG 33 HD1 ARG 33 37.353 0.022 9.529
266 HE ARG 33 HE ARG 33 35.406 -0.778 10.480
267 1HH1 ARG 33 HH11 ARG 33 37.102 1.224 12.809
268 2HH1 ARG 33 HH12 ARG 33 35.725 1.406 13.847
269 1HH2 ARG 33 HH21 ARG 33 33.583 -0.498 11.833
270 2HH2 ARG 33 HH22 ARG 33 33.729 0.436 13.291
271 H TYR 34 HN TYR 34 42.439 1.128 11.387
272 HA TYR 34 HA TYR 34 43.159 1.955 13.981
273 1HB TYR 34 HB2 TYR 34 42.807 -0.536 14.328
274 2HB TYR 34 HB1 TYR 34 44.163 -0.805 13.234
275 HD1 TYR 34 HD1 TYR 34 43.247 0.896 16.421
276 HD2 TYR 34 HD2 TYR 34 46.346 -0.813 14.057
277 HE1 TYR 34 HE1 TYR 34 44.813 1.153 18.297
278 HE2 TYR 34 HE2 TYR 34 47.918 -0.563 15.931
279 HH TYR 34 HH TYR 34 47.062 1.213 18.818
280 1HN NH2 35 H1 NH2 35 45.725 1.362 10.834
281 2HN NH2 35 H2 NH2 35 44.394 0.288 11.076
Start of MODEL 9
1 1H ILE 1 HT1 ILE 1 26.440 9.674 -7.167
2 2H ILE 1 HT2 ILE 1 27.265 10.769 -8.162
3 3H ILE 1 HT3 ILE 1 26.686 11.272 -6.649
4 HA ILE 1 HA ILE 1 28.688 9.119 -6.980
5 HB ILE 1 HB ILE 1 29.366 11.463 -7.861
6 1HG1 ILE 1 HG12 ILE 1 31.555 11.082 -6.205
7 2HG1 ILE 1 HG11 ILE 1 30.791 9.496 -6.248
8 1HG2 ILE 1 HG21 ILE 1 29.683 11.991 -4.912
9 2HG2 ILE 1 HG22 ILE 1 28.422 12.693 -5.925
10 3HG2 ILE 1 HG23 ILE 1 30.116 13.065 -6.244
11 1HD1 ILE 1 HD11 ILE 1 31.903 11.096 -8.522
12 2HD1 ILE 1 HD12 ILE 1 30.778 9.763 -8.781
13 3HD1 ILE 1 HD13 ILE 1 32.329 9.466 -7.998
14 H LYS 2 HN LYS 2 26.348 10.553 -5.098
15 HA LYS 2 HA LYS 2 27.816 10.132 -2.589
16 1HB LYS 2 HB2 LYS 2 25.245 11.615 -3.159
17 2HB LYS 2 HB1 LYS 2 25.908 11.368 -1.549
18 1HG LYS 2 HG2 LYS 2 27.699 12.586 -3.564
19 2HG LYS 2 HG1 LYS 2 26.359 13.569 -2.969
20 1HD LYS 2 HD2 LYS 2 27.138 13.515 -0.770
21 2HD LYS 2 HD1 LYS 2 28.151 12.101 -1.068
22 1HE LYS 2 HE2 LYS 2 29.844 13.540 -1.264
23 2HE LYS 2 HE1 LYS 2 29.152 13.959 -2.829
24 1HZ LYS 2 HZ1 LYS 2 27.967 15.348 -0.588
25 2HZ LYS 2 HZ2 LYS 2 28.487 15.945 -2.091
26 3HZ LYS 2 HZ3 LYS 2 29.607 15.707 -0.842
27 HA PRO 3 HA PRO 3 25.504 6.335 -2.044
28 1HB PRO 3 HB2 PRO 3 26.514 6.540 0.722
29 2HB PRO 3 HB1 PRO 3 26.750 5.255 -0.467
30 1HG PRO 3 HG2 PRO 3 28.742 6.910 0.223
31 2HG PRO 3 HG1 PRO 3 28.569 6.302 -1.434
32 1HD PRO 3 HD2 PRO 3 27.837 8.981 -0.312
33 2HD PRO 3 HD1 PRO 3 28.591 8.576 -1.870
34 H GLU 4 HN GLU 4 25.302 9.236 -0.164
35 HA GLU 4 HA GLU 4 23.008 8.396 1.371
36 1HB GLU 4 HB2 GLU 4 23.084 11.031 1.838
37 2HB GLU 4 HB1 GLU 4 24.138 9.897 2.670
38 1HG GLU 4 HG2 GLU 4 25.996 10.573 1.529
39 2HG GLU 4 HG1 GLU 4 25.081 11.080 0.110
40 H ALA 5 HN ALA 5 21.733 7.832 -0.506
41 HA ALA 5 HA ALA 5 19.959 9.952 -1.202
42 1HB ALA 5 HB1 ALA 5 20.818 8.893 -3.739
43 2HB ALA 5 HB2 ALA 5 22.162 9.641 -2.874
44 3HB ALA 5 HB3 ALA 5 20.695 10.570 -3.201
45 HA PRO 6 HA PRO 6 18.137 5.903 -2.786
46 1HB PRO 6 HB2 PRO 6 19.610 3.815 -3.544
47 2HB PRO 6 HB1 PRO 6 19.475 5.251 -4.567
48 1HG PRO 6 HG2 PRO 6 21.726 4.366 -2.832
49 2HG PRO 6 HG1 PRO 6 21.769 5.213 -4.386
50 1HD PRO 6 HD2 PRO 6 22.020 6.373 -1.834
51 2HD PRO 6 HD1 PRO 6 21.769 7.232 -3.365
52 H GLY 7 HN GLY 7 17.879 3.441 -2.174
53 1HA GLY 7 HA2 GLY 7 18.814 3.115 0.613
54 2HA GLY 7 HA1 GLY 7 17.162 2.756 0.127
55 H GLU 8 HN GLU 8 16.944 0.623 0.309
56 HA GLU 8 HA GLU 8 19.043 -1.087 -0.853
57 1HB GLU 8 HB2 GLU 8 16.906 -1.823 1.155
58 2HB GLU 8 HB1 GLU 8 18.179 -2.881 0.566
59 1HG GLU 8 HG2 GLU 8 19.605 -2.127 2.080
60 2HG GLU 8 HG1 GLU 8 19.294 -0.455 1.621
61 H ASP 9 HN ASP 9 16.170 0.226 -1.655
62 HA ASP 9 HA ASP 9 15.278 -2.148 -3.137
63 1HB ASP 9 HB2 ASP 9 12.989 -0.699 -2.982
64 2HB ASP 9 HB1 ASP 9 13.413 -1.983 -1.859
65 H ALA 10 HN ALA 10 16.858 -1.155 -4.657
66 HA ALA 10 HA ALA 10 15.779 1.024 -6.250
67 1HB ALA 10 HB1 ALA 10 18.239 -0.636 -6.722
68 2HB ALA 10 HB2 ALA 10 18.210 0.872 -5.808
69 3HB ALA 10 HB3 ALA 10 17.814 0.874 -7.528
70 H SER 11 HN SER 11 16.026 0.502 -8.783
71 HA SER 11 HA SER 11 14.270 -1.457 -9.656
72 1HB SER 11 HB2 SER 11 16.641 -1.123 -11.351
73 2HB SER 11 HB1 SER 11 14.948 -0.791 -11.731
74 HG SER 11 HG SER 11 16.797 0.990 -11.309
75 HA PRO 12 HA PRO 12 15.583 -5.383 -8.274
76 1HB PRO 12 HB2 PRO 12 15.808 -5.951 -11.209
77 2HB PRO 12 HB1 PRO 12 15.127 -6.958 -9.925
78 1HG PRO 12 HG2 PRO 12 13.611 -5.363 -11.543
79 2HG PRO 12 HG1 PRO 12 13.149 -5.816 -9.896
80 1HD PRO 12 HD2 PRO 12 13.835 -3.202 -10.905
81 2HD PRO 12 HD1 PRO 12 13.311 -3.648 -9.271
82 H GLU 13 HN GLU 13 17.591 -4.059 -7.721
83 HA GLU 13 HA GLU 13 19.749 -4.456 -7.109
84 1HB GLU 13 HB2 GLU 13 19.206 -6.857 -8.328
85 2HB GLU 13 HB1 GLU 13 20.561 -6.256 -9.276
86 1HG GLU 13 HG2 GLU 13 20.795 -7.677 -6.995
87 2HG GLU 13 HG1 GLU 13 22.027 -6.577 -7.612
88 H GLU 14 HN GLU 14 19.220 -2.258 -8.305
89 HA GLU 14 HA GLU 14 21.088 -1.923 -10.550
90 1HB GLU 14 HB2 GLU 14 18.530 -0.952 -10.114
91 2HB GLU 14 HB1 GLU 14 19.557 0.419 -9.721
92 1HG GLU 14 HG2 GLU 14 20.654 -0.438 -12.058
93 2HG GLU 14 HG1 GLU 14 18.944 -0.800 -12.301
94 H LEU 15 HN LEU 15 21.289 -1.965 -7.365
95 HA LEU 15 HA LEU 15 23.049 0.391 -7.204
96 1HB LEU 15 HB2 LEU 15 21.348 -0.932 -5.097
97 2HB LEU 15 HB1 LEU 15 22.619 0.210 -4.711
98 HG LEU 15 HG LEU 15 20.138 0.788 -6.321
99 1HD1 LEU 15 HD11 LEU 15 20.014 0.475 -3.779
100 2HD1 LEU 15 HD12 LEU 15 19.335 1.950 -4.470
101 3HD1 LEU 15 HD13 LEU 15 20.917 1.990 -3.691
102 1HD2 LEU 15 HD21 LEU 15 21.704 2.220 -7.251
103 2HD2 LEU 15 HD22 LEU 15 22.590 2.398 -5.735
104 3HD2 LEU 15 HD23 LEU 15 21.028 3.190 -5.939
105 H ASN 16 HN ASN 16 23.300 -2.762 -7.700
106 HA ASN 16 HA ASN 16 24.662 -3.785 -5.471
107 1HB ASN 16 HB2 ASN 16 23.745 -4.923 -7.743
108 2HB ASN 16 HB1 ASN 16 25.477 -4.896 -8.080
109 1HD2 ASN 16 HD21 ASN 16 23.297 -5.573 -5.362
110 2HD2 ASN 16 HD22 ASN 16 24.143 -6.992 -4.818
111 H ARG 17 HN ARG 17 25.959 -2.315 -8.439
112 HA ARG 17 HA ARG 17 28.630 -2.527 -7.391
113 1HB ARG 17 HB2 ARG 17 28.895 -0.641 -9.338
114 2HB ARG 17 HB1 ARG 17 29.144 -2.365 -9.530
115 1HG ARG 17 HG2 ARG 17 27.649 -2.305 -11.163
116 2HG ARG 17 HG1 ARG 17 26.415 -2.013 -9.950
117 1HD ARG 17 HD2 ARG 17 27.012 0.450 -10.158
118 2HD ARG 17 HD1 ARG 17 27.908 -0.008 -11.606
119 HE ARG 17 HE ARG 17 25.846 -0.691 -12.614
120 1HH1 ARG 17 HH11 ARG 17 25.534 1.190 -9.668
121 2HH1 ARG 17 HH12 ARG 17 23.838 1.491 -9.902
122 1HH2 ARG 17 HH21 ARG 17 23.657 -0.221 -12.959
123 2HH2 ARG 17 HH22 ARG 17 22.777 0.725 -11.796
124 H TYR 18 HN TYR 18 26.064 -0.326 -7.002
125 HA TYR 18 HA TYR 18 27.712 1.871 -6.204
126 1HB TYR 18 HB2 TYR 18 25.636 2.775 -6.390
127 2HB TYR 18 HB1 TYR 18 24.838 1.230 -6.128
128 HD1 TYR 18 HD1 TYR 18 26.705 3.858 -4.215
129 HD2 TYR 18 HD2 TYR 18 23.618 0.933 -4.195
130 HE1 TYR 18 HE1 TYR 18 26.076 4.543 -1.936
131 HE2 TYR 18 HE2 TYR 18 22.976 1.608 -1.936
132 HH TYR 18 HH TYR 18 23.650 4.343 -0.557
133 H TYR 19 HN TYR 19 26.092 -0.816 -4.587
134 HA TYR 19 HA TYR 19 27.076 -0.367 -1.990
135 1HB TYR 19 HB2 TYR 19 25.999 -2.744 -3.459
136 2HB TYR 19 HB1 TYR 19 26.728 -2.966 -1.873
137 HD1 TYR 19 HD1 TYR 19 23.984 -1.283 -3.693
138 HD2 TYR 19 HD2 TYR 19 25.546 -2.393 0.101
139 HE1 TYR 19 HE1 TYR 19 21.833 -0.718 -2.651
140 HE2 TYR 19 HE2 TYR 19 23.399 -1.818 1.159
141 HH TYR 19 HH TYR 19 20.954 -0.089 -0.459
142 H ALA 20 HN ALA 20 28.468 -1.732 -4.805
143 HA ALA 20 HA ALA 20 30.601 -3.126 -3.460
144 1HB ALA 20 HB1 ALA 20 29.764 -4.092 -5.469
145 2HB ALA 20 HB2 ALA 20 31.397 -3.515 -5.801
146 3HB ALA 20 HB3 ALA 20 30.003 -2.586 -6.357
147 H SER 21 HN SER 21 30.365 -0.352 -5.672
148 HA SER 21 HA SER 21 33.052 0.459 -5.415
149 1HB SER 21 HB2 SER 21 30.776 1.273 -6.874
150 2HB SER 21 HB1 SER 21 31.269 2.684 -5.928
151 HG SER 21 HG SER 21 32.591 1.344 -7.982
152 H LEU 22 HN LEU 22 30.126 1.164 -3.602
153 HA LEU 22 HA LEU 22 31.396 3.079 -1.877
154 1HB LEU 22 HB2 LEU 22 29.209 3.502 -1.648
155 2HB LEU 22 HB1 LEU 22 28.741 1.895 -2.155
156 HG LEU 22 HG LEU 22 29.616 1.352 0.336
157 1HD1 LEU 22 HD11 LEU 22 28.728 3.109 1.830
158 2HD1 LEU 22 HD12 LEU 22 28.538 4.160 0.426
159 3HD1 LEU 22 HD13 LEU 22 30.147 3.624 0.916
160 1HD2 LEU 22 HD21 LEU 22 26.861 2.388 -0.275
161 2HD2 LEU 22 HD22 LEU 22 27.313 1.229 0.976
162 3HD2 LEU 22 HD23 LEU 22 27.441 0.787 -0.726
163 H ARG 23 HN ARG 23 30.897 -0.416 -1.888
164 HA ARG 23 HA ARG 23 31.889 -0.802 0.761
165 1HB ARG 23 HB2 ARG 23 30.627 -2.539 -0.502
166 2HB ARG 23 HB1 ARG 23 32.040 -2.764 -1.528
167 1HG ARG 23 HG2 ARG 23 33.063 -2.972 1.023
168 2HG ARG 23 HG1 ARG 23 31.494 -3.785 1.131
169 1HD ARG 23 HD2 ARG 23 33.558 -4.358 -0.989
170 2HD ARG 23 HD1 ARG 23 33.396 -5.277 0.508
171 HE ARG 23 HE ARG 23 30.974 -5.086 -1.054
172 1HH1 ARG 23 HH11 ARG 23 33.885 -6.905 -0.395
173 2HH1 ARG 23 HH12 ARG 23 33.277 -8.380 -1.090
174 1HH2 ARG 23 HH21 ARG 23 30.139 -7.023 -1.930
175 2HH2 ARG 23 HH22 ARG 23 31.141 -8.451 -1.962
176 H HIS 24 HN HIS 24 33.437 -0.418 -2.365
177 HA HIS 24 HA HIS 24 36.053 -1.072 -1.478
178 1HB HIS 24 HB2 HIS 24 35.272 -0.798 -3.900
179 2HB HIS 24 HB1 HIS 24 35.420 0.939 -3.641
180 HD1 HIS 24 HD1 HIS 24 37.570 -2.196 -3.518
181 HD2 HIS 24 HD2 HIS 24 37.935 1.926 -3.993
182 HE1 HIS 24 HE1 HIS 24 40.001 -1.779 -4.050
183 HE2 HIS 24 HE2 HIS 24 40.181 0.712 -4.418
184 H TYR 25 HN TYR 25 34.156 1.878 -1.554
185 HA TYR 25 HA TYR 25 36.072 3.619 -0.467
186 1HB TYR 25 HB2 TYR 25 34.282 4.789 -1.282
187 2HB TYR 25 HB1 TYR 25 33.124 3.568 -0.785
188 HD1 TYR 25 HD1 TYR 25 35.502 5.831 1.047
189 HD2 TYR 25 HD2 TYR 25 31.514 4.423 0.584
190 HE1 TYR 25 HE1 TYR 25 34.786 7.269 2.901
191 HE2 TYR 25 HE2 TYR 25 30.784 5.860 2.433
192 HH TYR 25 HH TYR 25 31.397 7.688 3.695
193 H LEU 26 HN LEU 26 33.679 1.492 1.076
194 HA LEU 26 HA LEU 26 34.333 2.076 3.748
195 1HB LEU 26 HB2 LEU 26 33.275 -0.463 2.510
196 2HB LEU 26 HB1 LEU 26 33.373 -0.183 4.237
197 HG LEU 26 HG LEU 26 31.814 1.647 2.432
198 1HD1 LEU 26 HD11 LEU 26 31.200 -1.087 3.187
199 2HD1 LEU 26 HD12 LEU 26 30.401 -0.025 2.026
200 3HD1 LEU 26 HD13 LEU 26 29.973 0.057 3.734
201 1HD2 LEU 26 HD21 LEU 26 31.388 1.016 5.339
202 2HD2 LEU 26 HD22 LEU 26 30.774 2.382 4.410
203 3HD2 LEU 26 HD23 LEU 26 32.492 2.283 4.800
204 H ASN 27 HN ASN 27 35.467 -0.514 1.612
205 HA ASN 27 HA ASN 27 37.349 -1.764 3.143
206 1HB ASN 27 HB2 ASN 27 36.698 -2.181 0.685
207 2HB ASN 27 HB1 ASN 27 37.951 -1.005 0.291
208 1HD2 ASN 27 HD21 ASN 27 40.110 -1.530 0.628
209 2HD2 ASN 27 HD22 ASN 27 40.619 -3.162 0.905
210 H LEU 28 HN LEU 28 37.689 1.362 1.509
211 HA LEU 28 HA LEU 28 40.414 1.690 2.246
212 1HB LEU 28 HB2 LEU 28 39.605 3.045 0.437
213 2HB LEU 28 HB1 LEU 28 38.360 3.732 1.482
214 HG LEU 28 HG LEU 28 40.600 4.281 2.917
215 1HD1 LEU 28 HD11 LEU 28 41.298 4.591 -0.021
216 2HD1 LEU 28 HD12 LEU 28 42.084 3.524 1.142
217 3HD1 LEU 28 HD13 LEU 28 42.218 5.272 1.322
218 1HD2 LEU 28 HD21 LEU 28 38.609 5.685 1.417
219 2HD2 LEU 28 HD22 LEU 28 40.163 6.476 1.154
220 3HD2 LEU 28 HD23 LEU 28 39.558 6.245 2.793
221 H VAL 29 HN VAL 29 37.421 3.039 3.505
222 HA VAL 29 HA VAL 29 38.614 4.765 5.304
223 HB VAL 29 HB VAL 29 36.492 4.899 6.543
224 1HG1 VAL 29 HG11 VAL 29 35.388 5.067 3.898
225 2HG1 VAL 29 HG12 VAL 29 37.056 5.642 3.918
226 3HG1 VAL 29 HG13 VAL 29 35.863 6.355 5.006
227 1HG2 VAL 29 HG21 VAL 29 34.844 3.406 6.420
228 2HG2 VAL 29 HG22 VAL 29 36.037 2.335 5.684
229 3HG2 VAL 29 HG23 VAL 29 34.960 3.288 4.664
230 H THR 30 HN THR 30 38.223 1.364 5.531
231 HA THR 30 HA THR 30 38.570 0.902 8.258
232 HB THR 30 HB THR 30 39.588 -1.193 7.690
233 HG1 THR 30 HG1 THR 30 39.839 -0.508 4.963
234 1HG2 THR 30 HG21 THR 30 37.563 -0.324 5.636
235 2HG2 THR 30 HG22 THR 30 37.259 -1.140 7.175
236 3HG2 THR 30 HG23 THR 30 38.069 -2.001 5.864
237 H ARG 31 HN ARG 31 40.666 2.469 6.042
238 HA ARG 31 HA ARG 31 43.173 2.218 7.098
239 1HB ARG 31 HB2 ARG 31 41.822 4.088 5.439
240 2HB ARG 31 HB1 ARG 31 42.758 4.989 6.624
241 1HG ARG 31 HG2 ARG 31 44.785 3.986 5.937
242 2HG ARG 31 HG1 ARG 31 43.940 2.767 4.980
243 1HD ARG 31 HD2 ARG 31 44.900 4.475 3.542
244 2HD ARG 31 HD1 ARG 31 43.141 4.521 3.468
245 HE ARG 31 HE ARG 31 43.797 6.348 5.398
246 1HH1 ARG 31 HH11 ARG 31 44.663 5.908 2.032
247 2HH1 ARG 31 HH12 ARG 31 44.855 7.609 1.723
248 1HH2 ARG 31 HH21 ARG 31 44.065 8.561 5.015
249 2HH2 ARG 31 HH22 ARG 31 44.501 9.124 3.428
250 H GLN 32 HN GLN 32 40.529 4.269 8.195
251 HA GLN 32 HA GLN 32 41.929 4.825 10.704
252 1HB GLN 32 HB2 GLN 32 40.932 6.814 10.297
253 2HB GLN 32 HB1 GLN 32 39.801 6.116 9.151
254 1HG GLN 32 HG2 GLN 32 38.987 5.249 11.701
255 2HG GLN 32 HG1 GLN 32 39.361 6.965 11.843
256 1HE2 GLN 32 HE21 GLN 32 37.851 4.887 9.383
257 2HE2 GLN 32 HE22 GLN 32 36.456 5.887 9.146
258 H ARG 33 HN ARG 33 39.031 3.316 9.400
259 HA ARG 33 HA ARG 33 37.537 1.823 10.181
260 1HB ARG 33 HB2 ARG 33 40.066 0.825 10.752
261 2HB ARG 33 HB1 ARG 33 39.167 0.598 12.248
262 1HG ARG 33 HG2 ARG 33 37.388 -0.236 10.326
263 2HG ARG 33 HG1 ARG 33 38.943 -0.797 9.708
264 1HD ARG 33 HD2 ARG 33 38.418 -2.568 11.029
265 2HD ARG 33 HD1 ARG 33 39.243 -1.568 12.224
266 HE ARG 33 HE ARG 33 36.357 -2.031 12.015
267 1HH1 ARG 33 HH11 ARG 33 39.051 -0.575 13.713
268 2HH1 ARG 33 HH12 ARG 33 38.119 -0.176 15.126
269 1HH2 ARG 33 HH21 ARG 33 35.135 -1.544 13.884
270 2HH2 ARG 33 HH22 ARG 33 35.902 -0.745 15.223
271 H TYR 34 HN TYR 34 36.205 3.430 11.127
272 HA TYR 34 HA TYR 34 36.396 3.692 14.034
273 1HB TYR 34 HB2 TYR 34 35.692 5.497 12.016
274 2HB TYR 34 HB1 TYR 34 34.175 5.102 12.819
275 HD1 TYR 34 HD1 TYR 34 34.125 7.529 13.491
276 HD2 TYR 34 HD2 TYR 34 37.136 4.855 14.855
277 HE1 TYR 34 HE1 TYR 34 34.683 9.091 15.307
278 HE2 TYR 34 HE2 TYR 34 37.702 6.405 16.674
279 HH TYR 34 HH TYR 34 36.791 8.201 17.910
280 1HN NH2 35 H1 NH2 35 33.738 1.584 14.786
281 2HN NH2 35 H2 NH2 35 35.171 2.409 15.290
Start of MODEL 10
1 1H ILE 1 HT1 ILE 1 21.769 11.366 0.779
2 2H ILE 1 HT2 ILE 1 22.132 9.712 0.727
3 3H ILE 1 HT3 ILE 1 22.292 10.654 -0.668
4 HA ILE 1 HA ILE 1 24.007 11.990 0.553
5 HB ILE 1 HB ILE 1 24.832 9.836 2.265
6 1HG1 ILE 1 HG12 ILE 1 22.320 11.072 3.307
7 2HG1 ILE 1 HG11 ILE 1 22.204 9.661 2.262
8 1HG2 ILE 1 HG21 ILE 1 25.785 11.866 2.742
9 2HG2 ILE 1 HG22 ILE 1 24.516 11.805 3.967
10 3HG2 ILE 1 HG23 ILE 1 24.278 12.749 2.498
11 1HD1 ILE 1 HD11 ILE 1 23.981 8.703 3.958
12 2HD1 ILE 1 HD12 ILE 1 22.251 8.648 4.293
13 3HD1 ILE 1 HD13 ILE 1 23.251 9.904 5.025
14 H LYS 2 HN LYS 2 26.226 10.194 1.212
15 HA LYS 2 HA LYS 2 27.102 9.529 -1.340
16 1HB LYS 2 HB2 LYS 2 28.354 9.706 1.015
17 2HB LYS 2 HB1 LYS 2 28.214 7.957 0.923
18 1HG LYS 2 HG2 LYS 2 30.339 8.955 0.026
19 2HG LYS 2 HG1 LYS 2 29.486 7.845 -1.045
20 1HD LYS 2 HD2 LYS 2 28.565 10.543 -1.441
21 2HD LYS 2 HD1 LYS 2 30.320 10.456 -1.609
22 1HE LYS 2 HE2 LYS 2 30.185 8.891 -3.346
23 2HE LYS 2 HE1 LYS 2 28.508 8.491 -2.974
24 1HZ LYS 2 HZ1 LYS 2 29.249 11.212 -3.841
25 2HZ LYS 2 HZ2 LYS 2 27.742 10.437 -3.938
26 3HZ LYS 2 HZ3 LYS 2 29.001 9.982 -4.980
27 HA PRO 3 HA PRO 3 25.541 5.005 -0.705
28 1HB PRO 3 HB2 PRO 3 23.785 5.079 1.632
29 2HB PRO 3 HB1 PRO 3 25.102 3.961 1.268
30 1HG PRO 3 HG2 PRO 3 25.239 5.812 3.247
31 2HG PRO 3 HG1 PRO 3 26.659 5.239 2.356
32 1HD PRO 3 HD2 PRO 3 25.123 7.783 2.048
33 2HD PRO 3 HD1 PRO 3 26.873 7.495 1.947
34 H GLU 4 HN GLU 4 24.474 6.311 -2.430
35 HA GLU 4 HA GLU 4 21.887 7.440 -1.926
36 1HB GLU 4 HB2 GLU 4 23.821 7.483 -4.053
37 2HB GLU 4 HB1 GLU 4 22.229 7.123 -4.703
38 1HG GLU 4 HG2 GLU 4 23.253 9.589 -3.435
39 2HG GLU 4 HG1 GLU 4 22.168 9.386 -4.807
40 H ALA 5 HN ALA 5 19.924 6.800 -2.827
41 HA ALA 5 HA ALA 5 19.636 4.201 -4.054
42 1HB ALA 5 HB1 ALA 5 19.678 4.139 -1.353
43 2HB ALA 5 HB2 ALA 5 18.760 3.012 -2.353
44 3HB ALA 5 HB3 ALA 5 17.960 4.414 -1.642
45 HA PRO 6 HA PRO 6 16.745 7.546 -5.386
46 1HB PRO 6 HB2 PRO 6 16.937 6.074 -7.931
47 2HB PRO 6 HB1 PRO 6 17.175 7.795 -7.606
48 1HG PRO 6 HG2 PRO 6 19.238 6.188 -8.150
49 2HG PRO 6 HG1 PRO 6 19.380 7.505 -6.971
50 1HD PRO 6 HD2 PRO 6 19.023 4.569 -6.503
51 2HD PRO 6 HD1 PRO 6 20.054 5.732 -5.640
52 H GLY 7 HN GLY 7 16.550 4.152 -6.280
53 1HA GLY 7 HA2 GLY 7 14.499 3.112 -5.173
54 2HA GLY 7 HA1 GLY 7 13.617 4.336 -6.072
55 H GLU 8 HN GLU 8 13.452 4.157 -8.342
56 HA GLU 8 HA GLU 8 13.156 1.420 -9.124
57 1HB GLU 8 HB2 GLU 8 11.996 2.223 -11.016
58 2HB GLU 8 HB1 GLU 8 11.579 3.314 -9.706
59 1HG GLU 8 HG2 GLU 8 12.469 5.077 -10.740
60 2HG GLU 8 HG1 GLU 8 13.899 4.178 -11.244
61 H ASP 9 HN ASP 9 15.497 3.854 -9.631
62 HA ASP 9 HA ASP 9 16.912 2.185 -11.586
63 1HB ASP 9 HB2 ASP 9 18.314 4.217 -11.988
64 2HB ASP 9 HB1 ASP 9 16.618 4.439 -12.399
65 H ALA 10 HN ALA 10 17.132 0.883 -9.574
66 HA ALA 10 HA ALA 10 19.598 0.987 -8.297
67 1HB ALA 10 HB1 ALA 10 18.830 2.961 -7.113
68 2HB ALA 10 HB2 ALA 10 18.869 1.600 -5.990
69 3HB ALA 10 HB3 ALA 10 17.331 2.147 -6.664
70 H SER 11 HN SER 11 18.289 0.010 -5.740
71 HA SER 11 HA SER 11 17.551 -1.929 -4.858
72 1HB SER 11 HB2 SER 11 15.519 -1.693 -7.066
73 2HB SER 11 HB1 SER 11 15.312 -2.563 -5.542
74 HG SER 11 HG SER 11 15.104 0.118 -6.084
75 HA PRO 12 HA PRO 12 18.273 -5.615 -7.555
76 1HB PRO 12 HB2 PRO 12 17.076 -5.419 -10.191
77 2HB PRO 12 HB1 PRO 12 16.732 -6.572 -8.901
78 1HG PRO 12 HG2 PRO 12 14.960 -4.682 -9.691
79 2HG PRO 12 HG1 PRO 12 15.041 -5.294 -8.029
80 1HD PRO 12 HD2 PRO 12 16.188 -2.768 -9.171
81 2HD PRO 12 HD1 PRO 12 15.312 -3.016 -7.646
82 H GLU 13 HN GLU 13 18.566 -2.561 -9.006
83 HA GLU 13 HA GLU 13 20.752 -3.469 -10.713
84 1HB GLU 13 HB2 GLU 13 18.683 -1.429 -11.045
85 2HB GLU 13 HB1 GLU 13 20.299 -0.898 -11.494
86 1HG GLU 13 HG2 GLU 13 19.782 -1.785 -13.481
87 2HG GLU 13 HG1 GLU 13 20.200 -3.313 -12.706
88 H GLU 14 HN GLU 14 20.126 -0.223 -9.459
89 HA GLU 14 HA GLU 14 22.986 -0.001 -9.152
90 1HB GLU 14 HB2 GLU 14 20.862 1.817 -9.699
91 2HB GLU 14 HB1 GLU 14 21.748 2.392 -8.294
92 1HG GLU 14 HG2 GLU 14 22.659 2.061 -11.106
93 2HG GLU 14 HG1 GLU 14 22.915 3.396 -9.985
94 H LEU 15 HN LEU 15 20.709 -1.104 -7.087
95 HA LEU 15 HA LEU 15 21.730 0.059 -4.668
96 1HB LEU 15 HB2 LEU 15 19.556 -1.506 -5.246
97 2HB LEU 15 HB1 LEU 15 20.635 -2.669 -4.501
98 HG LEU 15 HG LEU 15 20.833 -0.928 -2.591
99 1HD1 LEU 15 HD11 LEU 15 19.796 0.964 -3.539
100 2HD1 LEU 15 HD12 LEU 15 18.660 0.341 -2.341
101 3HD1 LEU 15 HD13 LEU 15 18.392 0.033 -4.057
102 1HD2 LEU 15 HD21 LEU 15 18.317 -2.511 -3.088
103 2HD2 LEU 15 HD22 LEU 15 18.795 -1.840 -1.529
104 3HD2 LEU 15 HD23 LEU 15 19.789 -3.076 -2.298
105 H ASN 16 HN ASN 16 22.563 -2.504 -6.822
106 HA ASN 16 HA ASN 16 24.226 -4.058 -5.183
107 1HB ASN 16 HB2 ASN 16 23.947 -3.616 -8.125
108 2HB ASN 16 HB1 ASN 16 25.401 -4.425 -7.544
109 1HD2 ASN 16 HD21 ASN 16 22.075 -4.591 -6.335
110 2HD2 ASN 16 HD22 ASN 16 21.893 -6.289 -6.582
111 H ARG 17 HN ARG 17 25.023 -1.401 -7.423
112 HA ARG 17 HA ARG 17 27.736 -1.360 -6.448
113 1HB ARG 17 HB2 ARG 17 26.282 0.237 -8.515
114 2HB ARG 17 HB1 ARG 17 27.858 0.737 -7.904
115 1HG ARG 17 HG2 ARG 17 28.671 -1.580 -8.525
116 2HG ARG 17 HG1 ARG 17 27.158 -1.754 -9.420
117 1HD ARG 17 HD2 ARG 17 28.755 0.701 -9.868
118 2HD ARG 17 HD1 ARG 17 29.373 -0.810 -10.538
119 HE ARG 17 HE ARG 17 26.652 0.184 -11.114
120 1HH1 ARG 17 HH11 ARG 17 29.733 -1.116 -12.141
121 2HH1 ARG 17 HH12 ARG 17 29.253 -1.302 -13.802
122 1HH2 ARG 17 HH21 ARG 17 26.005 -0.067 -13.298
123 2HH2 ARG 17 HH22 ARG 17 27.132 -0.714 -14.460
124 H TYR 18 HN TYR 18 24.903 -0.151 -5.221
125 HA TYR 18 HA TYR 18 26.154 2.235 -4.157
126 1HB TYR 18 HB2 TYR 18 24.031 2.884 -3.886
127 2HB TYR 18 HB1 TYR 18 23.473 1.311 -4.425
128 HD1 TYR 18 HD1 TYR 18 24.397 3.280 -1.412
129 HD2 TYR 18 HD2 TYR 18 22.463 -0.189 -2.933
130 HE1 TYR 18 HE1 TYR 18 23.395 2.866 0.798
131 HE2 TYR 18 HE2 TYR 18 21.472 -0.609 -0.746
132 HH TYR 18 HH TYR 18 21.694 1.693 1.855
133 H TYR 19 HN TYR 19 25.406 -1.053 -3.226
134 HA TYR 19 HA TYR 19 26.649 -0.880 -0.652
135 1HB TYR 19 HB2 TYR 19 25.879 -3.166 -2.458
136 2HB TYR 19 HB1 TYR 19 26.767 -3.439 -0.966
137 HD1 TYR 19 HD1 TYR 19 23.561 -2.854 -2.460
138 HD2 TYR 19 HD2 TYR 19 25.695 -2.736 1.218
139 HE1 TYR 19 HE1 TYR 19 21.436 -2.917 -1.227
140 HE2 TYR 19 HE2 TYR 19 23.573 -2.790 2.463
141 HH TYR 19 HH TYR 19 21.047 -2.043 1.818
142 H ALA 20 HN ALA 20 27.664 -1.265 -3.886
143 HA ALA 20 HA ALA 20 30.265 -2.351 -3.300
144 1HB ALA 20 HB1 ALA 20 30.587 -2.333 -5.665
145 2HB ALA 20 HB2 ALA 20 29.207 -1.251 -5.884
146 3HB ALA 20 HB3 ALA 20 28.953 -2.909 -5.331
147 H SER 21 HN SER 21 28.917 0.767 -4.358
148 HA SER 21 HA SER 21 31.453 2.070 -4.417
149 1HB SER 21 HB2 SER 21 30.121 4.156 -4.523
150 2HB SER 21 HB1 SER 21 29.529 2.953 -5.677
151 HG SER 21 HG SER 21 27.681 3.169 -4.745
152 H LEU 22 HN LEU 22 28.918 1.518 -2.070
153 HA LEU 22 HA LEU 22 30.097 2.939 0.090
154 1HB LEU 22 HB2 LEU 22 27.982 0.959 -0.270
155 2HB LEU 22 HB1 LEU 22 28.883 0.705 1.209
156 HG LEU 22 HG LEU 22 26.979 2.832 0.506
157 1HD1 LEU 22 HD11 LEU 22 26.384 2.657 2.779
158 2HD1 LEU 22 HD12 LEU 22 27.911 1.880 3.197
159 3HD1 LEU 22 HD13 LEU 22 26.715 1.013 2.234
160 1HD2 LEU 22 HD21 LEU 22 28.529 4.468 0.675
161 2HD2 LEU 22 HD22 LEU 22 29.667 3.451 1.561
162 3HD2 LEU 22 HD23 LEU 22 28.305 4.191 2.402
163 H ARG 23 HN ARG 23 30.468 -0.367 -1.185
164 HA ARG 23 HA ARG 23 32.387 -1.024 0.856
165 1HB ARG 23 HB2 ARG 23 30.888 -2.598 -0.715
166 2HB ARG 23 HB1 ARG 23 32.390 -2.617 -1.639
167 1HG ARG 23 HG2 ARG 23 33.015 -2.927 1.122
168 2HG ARG 23 HG1 ARG 23 31.764 -4.101 0.685
169 1HD ARG 23 HD2 ARG 23 34.517 -3.755 -0.470
170 2HD ARG 23 HD1 ARG 23 33.833 -5.173 0.321
171 HE ARG 23 HE ARG 23 33.322 -4.269 -2.422
172 1HH1 ARG 23 HH11 ARG 23 32.836 -6.646 0.116
173 2HH1 ARG 23 HH12 ARG 23 32.250 -7.877 -0.961
174 1HH2 ARG 23 HH21 ARG 23 32.579 -5.903 -3.851
175 2HH2 ARG 23 HH22 ARG 23 32.130 -7.462 -3.226
176 H HIS 24 HN HIS 24 32.589 0.727 -2.036
177 HA HIS 24 HA HIS 24 35.400 0.328 -2.478
178 1HB HIS 24 HB2 HIS 24 33.264 1.823 -3.693
179 2HB HIS 24 HB1 HIS 24 34.615 2.904 -3.380
180 HD1 HIS 24 HD1 HIS 24 33.520 1.741 -6.208
181 HD2 HIS 24 HD2 HIS 24 36.981 0.659 -4.166
182 HE1 HIS 24 HE1 HIS 24 35.070 0.799 -7.945
183 HE2 HIS 24 HE2 HIS 24 37.227 0.359 -6.724
184 H TYR 25 HN TYR 25 33.352 2.681 -0.907
185 HA TYR 25 HA TYR 25 35.378 4.282 0.215
186 1HB TYR 25 HB2 TYR 25 33.300 5.292 0.128
187 2HB TYR 25 HB1 TYR 25 32.451 3.838 0.622
188 HD1 TYR 25 HD1 TYR 25 31.162 4.398 2.416
189 HD2 TYR 25 HD2 TYR 25 35.187 5.762 2.307
190 HE1 TYR 25 HE1 TYR 25 30.897 5.329 4.659
191 HE2 TYR 25 HE2 TYR 25 34.944 6.687 4.570
192 HH TYR 25 HH TYR 25 32.344 7.477 5.929
193 H LEU 26 HN LEU 26 33.582 1.468 1.418
194 HA LEU 26 HA LEU 26 34.878 1.293 3.927
195 1HB LEU 26 HB2 LEU 26 33.540 -0.796 2.215
196 2HB LEU 26 HB1 LEU 26 34.144 -1.115 3.830
197 HG LEU 26 HG LEU 26 32.044 0.946 3.185
198 1HD1 LEU 26 HD11 LEU 26 31.343 -1.523 4.647
199 2HD1 LEU 26 HD12 LEU 26 31.638 -1.690 2.917
200 3HD1 LEU 26 HD13 LEU 26 30.401 -0.576 3.495
201 1HD2 LEU 26 HD21 LEU 26 31.666 0.457 5.747
202 2HD2 LEU 26 HD22 LEU 26 32.869 1.627 5.209
203 3HD2 LEU 26 HD23 LEU 26 33.368 0.003 5.678
204 H ASN 27 HN ASN 27 35.481 -0.365 0.837
205 HA ASN 27 HA ASN 27 37.820 -1.699 1.394
206 1HB ASN 27 HB2 ASN 27 36.537 -1.522 -0.825
207 2HB ASN 27 HB1 ASN 27 37.515 -0.090 -1.130
208 1HD2 ASN 27 HD21 ASN 27 38.946 -0.621 -2.604
209 2HD2 ASN 27 HD22 ASN 27 39.950 -2.033 -2.582
210 H LEU 28 HN LEU 28 37.395 1.777 1.016
211 HA LEU 28 HA LEU 28 40.203 2.343 1.057
212 1HB LEU 28 HB2 LEU 28 38.653 3.975 0.104
213 2HB LEU 28 HB1 LEU 28 37.878 4.136 1.681
214 HG LEU 28 HG LEU 28 40.404 4.662 2.382
215 1HD1 LEU 28 HD11 LEU 28 40.210 5.164 -0.527
216 2HD1 LEU 28 HD12 LEU 28 41.615 4.803 0.474
217 3HD1 LEU 28 HD13 LEU 28 40.955 6.439 0.439
218 1HD2 LEU 28 HD21 LEU 28 38.326 5.980 2.805
219 2HD2 LEU 28 HD22 LEU 28 38.539 6.739 1.227
220 3HD2 LEU 28 HD23 LEU 28 39.751 6.970 2.489
221 H VAL 29 HN VAL 29 37.627 2.792 3.393
222 HA VAL 29 HA VAL 29 39.162 3.855 5.421
223 HB VAL 29 HB VAL 29 37.397 3.311 7.004
224 1HG1 VAL 29 HG11 VAL 29 37.171 4.856 4.693
225 2HG1 VAL 29 HG12 VAL 29 36.251 5.019 6.189
226 3HG1 VAL 29 HG13 VAL 29 35.622 4.033 4.868
227 1HG2 VAL 29 HG21 VAL 29 35.460 2.128 5.281
228 2HG2 VAL 29 HG22 VAL 29 36.109 1.519 6.805
229 3HG2 VAL 29 HG23 VAL 29 36.913 1.123 5.282
230 H THR 30 HN THR 30 38.832 0.545 4.478
231 HA THR 30 HA THR 30 40.034 -0.504 6.884
232 HB THR 30 HB THR 30 38.414 -1.810 5.501
233 HG1 THR 30 HG1 THR 30 39.501 -3.171 6.753
234 1HG2 THR 30 HG21 THR 30 39.072 -1.248 3.282
235 2HG2 THR 30 HG22 THR 30 39.347 -2.979 3.495
236 3HG2 THR 30 HG23 THR 30 40.706 -1.858 3.548
237 H ARG 31 HN ARG 31 41.291 1.530 4.968
238 HA ARG 31 HA ARG 31 43.557 0.732 3.698
239 1HB ARG 31 HB2 ARG 31 42.575 3.140 4.851
240 2HB ARG 31 HB1 ARG 31 44.268 2.981 5.297
241 1HG ARG 31 HG2 ARG 31 44.698 2.539 2.822
242 2HG ARG 31 HG1 ARG 31 43.062 3.147 2.557
243 1HD ARG 31 HD2 ARG 31 43.614 5.284 3.133
244 2HD ARG 31 HD1 ARG 31 44.875 4.768 4.255
245 HE ARG 31 HE ARG 31 46.036 4.096 2.008
246 1HH1 ARG 31 HH11 ARG 31 44.165 6.998 2.696
247 2HH1 ARG 31 HH12 ARG 31 45.006 7.959 1.509
248 1HH2 ARG 31 HH21 ARG 31 47.131 5.381 0.453
249 2HH2 ARG 31 HH22 ARG 31 46.672 7.051 0.246
250 H GLN 32 HN GLN 32 43.343 1.590 7.131
251 HA GLN 32 HA GLN 32 45.840 0.137 7.637
252 1HB GLN 32 HB2 GLN 32 46.089 1.409 9.610
253 2HB GLN 32 HB1 GLN 32 45.536 2.544 8.389
254 1HG GLN 32 HG2 GLN 32 43.838 1.279 10.534
255 2HG GLN 32 HG1 GLN 32 44.444 2.933 10.523
256 1HE2 GLN 32 HE21 GLN 32 41.727 1.364 10.232
257 2HE2 GLN 32 HE22 GLN 32 40.908 2.293 9.024
258 H ARG 33 HN ARG 33 42.529 -0.212 7.850
259 HA ARG 33 HA ARG 33 41.106 -1.670 8.826
260 1HB ARG 33 HB2 ARG 33 42.924 -3.206 7.778
261 2HB ARG 33 HB1 ARG 33 43.411 -3.486 9.445
262 1HG ARG 33 HG2 ARG 33 41.597 -4.738 9.913
263 2HG ARG 33 HG1 ARG 33 40.534 -3.780 8.877
264 1HD ARG 33 HD2 ARG 33 40.841 -5.143 7.118
265 2HD ARG 33 HD1 ARG 33 42.578 -5.256 7.401
266 HE ARG 33 HE ARG 33 40.522 -7.062 8.367
267 1HH1 ARG 33 HH11 ARG 33 43.842 -5.992 8.643
268 2HH1 ARG 33 HH12 ARG 33 44.397 -7.460 9.384
269 1HH2 ARG 33 HH21 ARG 33 41.251 -9.013 9.329
270 2HH2 ARG 33 HH22 ARG 33 42.935 -9.191 9.735
271 H TYR 34 HN TYR 34 40.724 -0.200 10.564
272 HA TYR 34 HA TYR 34 42.031 -0.995 13.088
273 1HB TYR 34 HB2 TYR 34 41.692 1.595 11.905
274 2HB TYR 34 HB1 TYR 34 40.797 1.531 13.420
275 HD1 TYR 34 HD1 TYR 34 41.983 2.501 15.136
276 HD2 TYR 34 HD2 TYR 34 44.084 0.151 12.278
277 HE1 TYR 34 HE1 TYR 34 44.068 2.846 16.394
278 HE2 TYR 34 HE2 TYR 34 46.173 0.490 13.526
279 HH TYR 34 HH TYR 34 46.434 2.792 16.081
280 1HN NH2 35 H1 NH2 35 37.989 -0.906 12.769
281 2HN NH2 35 H2 NH2 35 39.008 -0.434 11.454
Start of MODEL 11
1 1H ILE 1 HT1 ILE 1 31.307 12.306 -5.812
2 2H ILE 1 HT2 ILE 1 29.937 11.517 -6.431
3 3H ILE 1 HT3 ILE 1 31.483 11.093 -6.985
4 HA ILE 1 HA ILE 1 30.518 9.482 -5.418
5 HB ILE 1 HB ILE 1 32.611 9.890 -3.710
6 1HG1 ILE 1 HG12 ILE 1 33.876 10.786 -6.222
7 2HG1 ILE 1 HG11 ILE 1 32.905 12.004 -5.401
8 1HG2 ILE 1 HG21 ILE 1 33.766 8.762 -5.985
9 2HG2 ILE 1 HG22 ILE 1 32.053 8.354 -6.076
10 3HG2 ILE 1 HG23 ILE 1 32.991 7.917 -4.645
11 1HD1 ILE 1 HD11 ILE 1 34.996 12.355 -4.511
12 2HD1 ILE 1 HD12 ILE 1 35.392 10.635 -4.484
13 3HD1 ILE 1 HD13 ILE 1 34.261 11.299 -3.305
14 H LYS 2 HN LYS 2 28.665 9.946 -4.309
15 HA LYS 2 HA LYS 2 28.990 10.945 -1.626
16 1HB LYS 2 HB2 LYS 2 28.325 12.822 -3.535
17 2HB LYS 2 HB1 LYS 2 26.756 12.339 -2.906
18 1HG LYS 2 HG2 LYS 2 27.754 12.737 -0.592
19 2HG LYS 2 HG1 LYS 2 29.058 13.572 -1.439
20 1HD LYS 2 HD2 LYS 2 27.578 15.286 -0.919
21 2HD LYS 2 HD1 LYS 2 27.169 14.891 -2.589
22 1HE LYS 2 HE2 LYS 2 25.547 13.194 -1.193
23 2HE LYS 2 HE1 LYS 2 25.584 14.609 -0.141
24 1HZ LYS 2 HZ1 LYS 2 23.859 14.402 -2.089
25 2HZ LYS 2 HZ2 LYS 2 25.143 15.029 -3.008
26 3HZ LYS 2 HZ3 LYS 2 24.547 15.899 -1.681
27 HA PRO 3 HA PRO 3 26.000 7.521 -1.713
28 1HB PRO 3 HB2 PRO 3 26.627 7.491 1.165
29 2HB PRO 3 HB1 PRO 3 26.782 6.202 -0.030
30 1HG PRO 3 HG2 PRO 3 28.929 7.424 1.002
31 2HG PRO 3 HG1 PRO 3 28.886 6.878 -0.686
32 1HD PRO 3 HD2 PRO 3 28.509 9.636 0.425
33 2HD PRO 3 HD1 PRO 3 29.421 9.112 -1.008
34 H GLU 4 HN GLU 4 24.312 9.128 -2.072
35 HA GLU 4 HA GLU 4 22.514 9.333 0.147
36 1HB GLU 4 HB2 GLU 4 24.297 11.416 -0.057
37 2HB GLU 4 HB1 GLU 4 22.930 12.008 -0.989
38 1HG GLU 4 HG2 GLU 4 21.757 12.438 0.845
39 2HG GLU 4 HG1 GLU 4 22.079 10.834 1.504
40 H ALA 5 HN ALA 5 20.567 9.045 -0.612
41 HA ALA 5 HA ALA 5 18.710 9.998 -1.765
42 1HB ALA 5 HB1 ALA 5 20.736 10.465 -3.844
43 2HB ALA 5 HB2 ALA 5 19.389 11.474 -3.309
44 3HB ALA 5 HB3 ALA 5 19.097 10.113 -4.394
45 HA PRO 6 HA PRO 6 18.600 6.358 -5.008
46 1HB PRO 6 HB2 PRO 6 20.932 4.759 -4.072
47 2HB PRO 6 HB1 PRO 6 20.310 5.002 -5.710
48 1HG PRO 6 HG2 PRO 6 22.505 6.259 -4.926
49 2HG PRO 6 HG1 PRO 6 21.293 7.097 -5.914
50 1HD PRO 6 HD2 PRO 6 21.810 7.302 -2.972
51 2HD PRO 6 HD1 PRO 6 21.415 8.581 -4.139
52 H GLY 7 HN GLY 7 16.883 5.382 -4.242
53 1HA GLY 7 HA2 GLY 7 17.070 3.050 -2.644
54 2HA GLY 7 HA1 GLY 7 16.438 4.392 -1.695
55 H GLU 8 HN GLU 8 14.522 2.931 -1.597
56 HA GLU 8 HA GLU 8 12.359 2.483 -2.128
57 1HB GLU 8 HB2 GLU 8 12.904 5.129 -3.110
58 2HB GLU 8 HB1 GLU 8 11.752 4.332 -4.175
59 1HG GLU 8 HG2 GLU 8 10.146 4.804 -2.740
60 2HG GLU 8 HG1 GLU 8 10.933 3.775 -1.546
61 H ASP 9 HN ASP 9 13.315 0.510 -3.118
62 HA ASP 9 HA ASP 9 13.240 -1.107 -4.714
63 1HB ASP 9 HB2 ASP 9 10.887 0.396 -5.026
64 2HB ASP 9 HB1 ASP 9 11.505 0.142 -6.655
65 H ALA 10 HN ALA 10 15.475 -0.379 -5.144
66 HA ALA 10 HA ALA 10 15.882 1.346 -7.430
67 1HB ALA 10 HB1 ALA 10 17.477 0.372 -5.204
68 2HB ALA 10 HB2 ALA 10 17.609 1.871 -6.127
69 3HB ALA 10 HB3 ALA 10 18.350 0.391 -6.735
70 H SER 11 HN SER 11 14.564 -0.561 -8.544
71 HA SER 11 HA SER 11 14.548 -2.119 -10.203
72 1HB SER 11 HB2 SER 11 17.467 -1.363 -10.543
73 2HB SER 11 HB1 SER 11 16.408 -2.061 -11.764
74 HG SER 11 HG SER 11 16.818 0.462 -11.405
75 HA PRO 12 HA PRO 12 16.564 -5.983 -8.827
76 1HB PRO 12 HB2 PRO 12 18.001 -6.957 -10.935
77 2HB PRO 12 HB1 PRO 12 16.245 -7.109 -10.804
78 1HG PRO 12 HG2 PRO 12 17.866 -5.097 -12.324
79 2HG PRO 12 HG1 PRO 12 16.429 -5.997 -12.851
80 1HD PRO 12 HD2 PRO 12 16.261 -3.450 -12.033
81 2HD PRO 12 HD1 PRO 12 14.983 -4.623 -11.657
82 H GLU 13 HN GLU 13 17.866 -3.937 -7.807
83 HA GLU 13 HA GLU 13 19.803 -3.431 -6.736
84 1HB GLU 13 HB2 GLU 13 20.774 -5.937 -8.108
85 2HB GLU 13 HB1 GLU 13 21.793 -4.980 -7.043
86 1HG GLU 13 HG2 GLU 13 19.144 -6.088 -6.167
87 2HG GLU 13 HG1 GLU 13 20.648 -6.997 -6.034
88 H GLU 14 HN GLU 14 19.281 -1.822 -8.658
89 HA GLU 14 HA GLU 14 21.055 -1.677 -10.846
90 1HB GLU 14 HB2 GLU 14 18.793 -0.488 -10.417
91 2HB GLU 14 HB1 GLU 14 19.763 0.726 -9.595
92 1HG GLU 14 HG2 GLU 14 21.098 0.944 -11.709
93 2HG GLU 14 HG1 GLU 14 19.889 -0.085 -12.481
94 H LEU 15 HN LEU 15 21.136 -0.253 -7.628
95 HA LEU 15 HA LEU 15 23.613 1.148 -8.239
96 1HB LEU 15 HB2 LEU 15 22.895 1.694 -5.611
97 2HB LEU 15 HB1 LEU 15 22.690 2.732 -7.007
98 HG LEU 15 HG LEU 15 20.546 0.756 -6.633
99 1HD1 LEU 15 HD11 LEU 15 20.284 1.105 -4.445
100 2HD1 LEU 15 HD12 LEU 15 19.721 2.713 -4.900
101 3HD1 LEU 15 HD13 LEU 15 21.404 2.466 -4.435
102 1HD2 LEU 15 HD21 LEU 15 20.902 3.581 -7.480
103 2HD2 LEU 15 HD22 LEU 15 19.325 3.097 -6.856
104 3HD2 LEU 15 HD23 LEU 15 20.012 2.269 -8.253
105 H ASN 16 HN ASN 16 23.143 -1.853 -7.617
106 HA ASN 16 HA ASN 16 24.155 -2.516 -5.118
107 1HB ASN 16 HB2 ASN 16 23.211 -4.106 -6.849
108 2HB ASN 16 HB1 ASN 16 24.777 -4.045 -7.657
109 1HD2 ASN 16 HD21 ASN 16 23.051 -5.037 -4.801
110 2HD2 ASN 16 HD22 ASN 16 24.253 -6.147 -4.222
111 H ARG 17 HN ARG 17 25.970 -1.938 -8.132
112 HA ARG 17 HA ARG 17 28.468 -2.254 -6.764
113 1HB ARG 17 HB2 ARG 17 29.450 -1.207 -8.853
114 2HB ARG 17 HB1 ARG 17 28.647 -2.765 -9.028
115 1HG ARG 17 HG2 ARG 17 27.141 -1.944 -10.457
116 2HG ARG 17 HG1 ARG 17 26.846 -0.521 -9.455
117 1HD ARG 17 HD2 ARG 17 27.787 0.536 -11.215
118 2HD ARG 17 HD1 ARG 17 29.277 0.100 -10.380
119 HE ARG 17 HE ARG 17 28.496 -1.966 -12.145
120 1HH1 ARG 17 HH11 ARG 17 29.913 1.234 -12.111
121 2HH1 ARG 17 HH12 ARG 17 30.728 1.030 -13.636
122 1HH2 ARG 17 HH21 ARG 17 29.601 -2.271 -14.120
123 2HH2 ARG 17 HH22 ARG 17 30.585 -0.976 -14.761
124 H TYR 18 HN TYR 18 26.214 0.214 -6.712
125 HA TYR 18 HA TYR 18 28.204 2.314 -6.508
126 1HB TYR 18 HB2 TYR 18 26.404 3.489 -7.140
127 2HB TYR 18 HB1 TYR 18 25.313 2.177 -6.733
128 HD1 TYR 18 HD1 TYR 18 27.066 5.142 -5.318
129 HD2 TYR 18 HD2 TYR 18 23.950 2.294 -4.839
130 HE1 TYR 18 HE1 TYR 18 26.119 6.489 -3.488
131 HE2 TYR 18 HE2 TYR 18 23.004 3.616 -3.016
132 HH TYR 18 HH TYR 18 23.255 5.388 -1.697
133 H TYR 19 HN TYR 19 26.246 0.240 -4.405
134 HA TYR 19 HA TYR 19 27.682 1.298 -2.110
135 1HB TYR 19 HB2 TYR 19 26.454 -0.921 -1.105
136 2HB TYR 19 HB1 TYR 19 25.815 0.705 -1.046
137 HD1 TYR 19 HD1 TYR 19 24.241 1.347 -3.090
138 HD2 TYR 19 HD2 TYR 19 25.193 -2.633 -1.923
139 HE1 TYR 19 HE1 TYR 19 22.154 0.559 -4.092
140 HE2 TYR 19 HE2 TYR 19 23.120 -3.435 -2.968
141 HH TYR 19 HH TYR 19 21.445 -2.865 -4.416
142 H ALA 20 HN ALA 20 28.293 -0.938 -4.482
143 HA ALA 20 HA ALA 20 29.964 -2.647 -2.850
144 1HB ALA 20 HB1 ALA 20 30.496 -3.772 -4.949
145 2HB ALA 20 HB2 ALA 20 29.618 -2.527 -5.839
146 3HB ALA 20 HB3 ALA 20 28.752 -3.602 -4.743
147 H SER 21 HN SER 21 30.358 -0.243 -5.447
148 HA SER 21 HA SER 21 33.160 -0.012 -5.169
149 1HB SER 21 HB2 SER 21 32.897 2.084 -6.430
150 2HB SER 21 HB1 SER 21 31.883 0.818 -7.137
151 HG SER 21 HG SER 21 30.127 1.827 -6.492
152 H LEU 22 HN LEU 22 30.391 1.516 -3.618
153 HA LEU 22 HA LEU 22 31.740 3.217 -1.821
154 1HB LEU 22 HB2 LEU 22 29.110 2.227 -2.191
155 2HB LEU 22 HB1 LEU 22 29.555 1.880 -0.532
156 HG LEU 22 HG LEU 22 29.795 4.626 -1.740
157 1HD1 LEU 22 HD11 LEU 22 27.568 3.930 0.094
158 2HD1 LEU 22 HD12 LEU 22 27.433 3.406 -1.585
159 3HD1 LEU 22 HD13 LEU 22 27.638 5.116 -1.210
160 1HD2 LEU 22 HD21 LEU 22 30.077 5.377 0.462
161 2HD2 LEU 22 HD22 LEU 22 31.071 3.922 0.366
162 3HD2 LEU 22 HD23 LEU 22 29.490 3.864 1.151
163 H ARG 23 HN ARG 23 30.905 -0.233 -1.656
164 HA ARG 23 HA ARG 23 31.930 -0.583 0.970
165 1HB ARG 23 HB2 ARG 23 30.359 -2.178 0.201
166 2HB ARG 23 HB1 ARG 23 31.320 -2.548 -1.224
167 1HG ARG 23 HG2 ARG 23 32.028 -4.311 -0.030
168 2HG ARG 23 HG1 ARG 23 33.066 -3.137 0.792
169 1HD ARG 23 HD2 ARG 23 31.993 -4.314 2.517
170 2HD ARG 23 HD1 ARG 23 31.121 -2.785 2.397
171 HE ARG 23 HE ARG 23 29.245 -3.923 1.672
172 1HH1 ARG 23 HH11 ARG 23 31.980 -6.112 1.826
173 2HH1 ARG 23 HH12 ARG 23 31.021 -7.530 1.541
174 1HH2 ARG 23 HH21 ARG 23 27.977 -5.794 1.338
175 2HH2 ARG 23 HH22 ARG 23 28.745 -7.350 1.269
176 H HIS 24 HN HIS 24 33.429 -0.761 -2.221
177 HA HIS 24 HA HIS 24 35.891 -1.851 -1.295
178 1HB HIS 24 HB2 HIS 24 35.039 -1.540 -3.751
179 2HB HIS 24 HB1 HIS 24 35.750 0.065 -3.612
180 HD1 HIS 24 HD1 HIS 24 37.314 -0.950 -5.609
181 HD2 HIS 24 HD2 HIS 24 37.889 -2.484 -1.789
182 HE1 HIS 24 HE1 HIS 24 39.566 -2.049 -5.653
183 HE2 HIS 24 HE2 HIS 24 39.972 -2.810 -3.286
184 H TYR 25 HN TYR 25 34.656 1.413 -1.707
185 HA TYR 25 HA TYR 25 36.887 2.845 -0.816
186 1HB TYR 25 HB2 TYR 25 35.197 4.093 -1.856
187 2HB TYR 25 HB1 TYR 25 33.928 3.355 -0.897
188 HD1 TYR 25 HD1 TYR 25 37.055 5.139 0.157
189 HD2 TYR 25 HD2 TYR 25 32.801 5.057 0.143
190 HE1 TYR 25 HE1 TYR 25 37.016 7.118 1.617
191 HE2 TYR 25 HE2 TYR 25 32.746 7.019 1.602
192 HH TYR 25 HH TYR 25 34.367 8.109 3.328
193 H LEU 26 HN LEU 26 34.095 1.560 0.971
194 HA LEU 26 HA LEU 26 34.908 2.330 3.544
195 1HB LEU 26 HB2 LEU 26 33.224 -0.001 2.649
196 2HB LEU 26 HB1 LEU 26 33.411 0.489 4.323
197 HG LEU 26 HG LEU 26 32.281 2.290 2.185
198 1HD1 LEU 26 HD11 LEU 26 31.093 0.010 3.409
199 2HD1 LEU 26 HD12 LEU 26 30.376 1.161 2.280
200 3HD1 LEU 26 HD13 LEU 26 30.295 1.462 4.016
201 1HD2 LEU 26 HD21 LEU 26 31.402 2.804 4.855
202 2HD2 LEU 26 HD22 LEU 26 32.295 3.856 3.756
203 3HD2 LEU 26 HD23 LEU 26 33.165 2.750 4.819
204 H ASN 27 HN ASN 27 35.352 -0.728 1.810
205 HA ASN 27 HA ASN 27 36.810 -2.164 3.634
206 1HB ASN 27 HB2 ASN 27 36.203 -2.422 0.946
207 2HB ASN 27 HB1 ASN 27 37.960 -2.368 0.962
208 1HD2 ASN 27 HD21 ASN 27 36.403 -4.597 0.212
209 2HD2 ASN 27 HD22 ASN 27 36.716 -5.874 1.343
210 H LEU 28 HN LEU 28 37.947 0.452 1.527
211 HA LEU 28 HA LEU 28 40.660 0.195 2.358
212 1HB LEU 28 HB2 LEU 28 40.251 1.387 0.310
213 2HB LEU 28 HB1 LEU 28 39.255 2.559 1.182
214 HG LEU 28 HG LEU 28 41.530 2.637 2.645
215 1HD1 LEU 28 HD11 LEU 28 42.977 3.062 0.240
216 2HD1 LEU 28 HD12 LEU 28 42.243 1.463 0.123
217 3HD1 LEU 28 HD13 LEU 28 43.277 1.860 1.496
218 1HD2 LEU 28 HD21 LEU 28 40.009 4.428 1.396
219 2HD2 LEU 28 HD22 LEU 28 41.363 4.451 0.268
220 3HD2 LEU 28 HD23 LEU 28 41.627 4.835 1.969
221 H VAL 29 HN VAL 29 38.077 2.402 3.266
222 HA VAL 29 HA VAL 29 39.587 4.072 4.832
223 HB VAL 29 HB VAL 29 37.656 4.903 5.936
224 1HG1 VAL 29 HG11 VAL 29 36.203 4.236 3.511
225 2HG1 VAL 29 HG12 VAL 29 37.862 4.752 3.216
226 3HG1 VAL 29 HG13 VAL 29 36.763 5.797 4.114
227 1HG2 VAL 29 HG21 VAL 29 35.742 3.792 6.426
228 2HG2 VAL 29 HG22 VAL 29 36.822 2.402 6.312
229 3HG2 VAL 29 HG23 VAL 29 35.788 2.829 4.949
230 H THR 30 HN THR 30 38.425 0.892 5.581
231 HA THR 30 HA THR 30 38.853 0.880 8.368
232 HB THR 30 HB THR 30 38.789 -1.476 8.271
233 HG1 THR 30 HG1 THR 30 39.422 -1.371 5.483
234 1HG2 THR 30 HG21 THR 30 36.955 -1.967 6.749
235 2HG2 THR 30 HG22 THR 30 37.302 -0.492 5.840
236 3HG2 THR 30 HG23 THR 30 36.721 -0.391 7.504
237 H ARG 31 HN ARG 31 41.076 1.163 5.829
238 HA ARG 31 HA ARG 31 43.321 -0.165 6.837
239 1HB ARG 31 HB2 ARG 31 43.404 0.392 4.575
240 2HB ARG 31 HB1 ARG 31 42.922 2.052 4.877
241 1HG ARG 31 HG2 ARG 31 45.313 1.840 6.224
242 2HG ARG 31 HG1 ARG 31 45.569 0.877 4.766
243 1HD ARG 31 HD2 ARG 31 44.169 3.289 4.111
244 2HD ARG 31 HD1 ARG 31 45.624 3.677 5.030
245 HE ARG 31 HE ARG 31 46.102 1.796 2.920
246 1HH1 ARG 31 HH11 ARG 31 45.764 5.203 3.668
247 2HH1 ARG 31 HH12 ARG 31 46.702 5.728 2.302
248 1HH2 ARG 31 HH21 ARG 31 47.315 2.467 1.134
249 2HH2 ARG 31 HH22 ARG 31 47.571 4.163 0.836
250 H GLN 32 HN GLN 32 42.383 3.259 7.030
251 HA GLN 32 HA GLN 32 44.408 3.591 9.144
252 1HB GLN 32 HB2 GLN 32 44.893 5.739 8.381
253 2HB GLN 32 HB1 GLN 32 44.668 4.837 6.893
254 1HG GLN 32 HG2 GLN 32 42.588 6.594 8.181
255 2HG GLN 32 HG1 GLN 32 43.629 7.069 6.843
256 1HE2 GLN 32 HE21 GLN 32 40.626 6.589 7.257
257 2HE2 GLN 32 HE22 GLN 32 40.184 5.630 5.887
258 H ARG 33 HN ARG 33 41.082 3.860 8.353
259 HA ARG 33 HA ARG 33 39.234 4.642 9.390
260 1HB ARG 33 HB2 ARG 33 41.034 3.922 11.628
261 2HB ARG 33 HB1 ARG 33 39.693 4.985 12.033
262 1HG ARG 33 HG2 ARG 33 38.740 2.940 12.397
263 2HG ARG 33 HG1 ARG 33 38.289 3.212 10.711
264 1HD ARG 33 HD2 ARG 33 39.170 1.168 10.385
265 2HD ARG 33 HD1 ARG 33 40.707 2.026 10.412
266 HE ARG 33 HE ARG 33 39.639 0.272 12.460
267 1HH1 ARG 33 HH11 ARG 33 42.053 2.654 11.607
268 2HH1 ARG 33 HH12 ARG 33 43.133 2.219 12.895
269 1HH2 ARG 33 HH21 ARG 33 41.028 -0.318 14.140
270 2HH2 ARG 33 HH22 ARG 33 42.542 0.523 14.359
271 H TYR 34 HN TYR 34 40.989 6.275 11.902
272 HA TYR 34 HA TYR 34 40.734 8.818 10.457
273 1HB TYR 34 HB2 TYR 34 38.879 8.240 12.251
274 2HB TYR 34 HB1 TYR 34 40.129 8.734 13.388
275 HD1 TYR 34 HD1 TYR 34 40.267 10.950 13.982
276 HD2 TYR 34 HD2 TYR 34 38.451 9.932 10.273
277 HE1 TYR 34 HE1 TYR 34 39.677 13.311 13.633
278 HE2 TYR 34 HE2 TYR 34 37.863 12.289 9.905
279 HH TYR 34 HH TYR 34 37.870 14.342 10.732
280 1HN NH2 35 H1 NH2 35 43.624 10.051 12.099
281 2HN NH2 35 H2 NH2 35 42.174 10.498 11.274
Start of MODEL 12
1 1H ILE 1 HT1 ILE 1 24.395 7.324 9.062
2 2H ILE 1 HT2 ILE 1 23.213 7.946 8.017
3 3H ILE 1 HT3 ILE 1 24.260 8.998 8.828
4 HA ILE 1 HA ILE 1 25.455 8.995 6.989
5 HB ILE 1 HB ILE 1 26.753 7.518 8.565
6 1HG1 ILE 1 HG12 ILE 1 27.363 6.643 5.770
7 2HG1 ILE 1 HG11 ILE 1 27.431 8.357 6.164
8 1HG2 ILE 1 HG21 ILE 1 26.973 5.119 7.879
9 2HG2 ILE 1 HG22 ILE 1 25.543 5.339 6.876
10 3HG2 ILE 1 HG23 ILE 1 25.429 5.541 8.623
11 1HD1 ILE 1 HD11 ILE 1 28.833 6.904 8.166
12 2HD1 ILE 1 HD12 ILE 1 29.447 8.097 7.019
13 3HD1 ILE 1 HD13 ILE 1 29.400 6.391 6.577
14 H LYS 2 HN LYS 2 25.486 8.617 4.805
15 HA LYS 2 HA LYS 2 24.170 6.346 3.635
16 1HB LYS 2 HB2 LYS 2 22.344 8.059 4.353
17 2HB LYS 2 HB1 LYS 2 22.921 9.001 2.985
18 1HG LYS 2 HG2 LYS 2 21.041 7.728 2.273
19 2HG LYS 2 HG1 LYS 2 22.484 7.033 1.526
20 1HD LYS 2 HD2 LYS 2 22.153 5.067 2.529
21 2HD LYS 2 HD1 LYS 2 21.913 5.830 4.102
22 1HE LYS 2 HE2 LYS 2 19.762 5.298 3.956
23 2HE LYS 2 HE1 LYS 2 19.625 6.428 2.607
24 1HZ LYS 2 HZ1 LYS 2 20.721 3.872 1.864
25 2HZ LYS 2 HZ2 LYS 2 19.474 4.773 1.146
26 3HZ LYS 2 HZ3 LYS 2 19.138 3.777 2.470
27 HA PRO 3 HA PRO 3 27.421 7.862 0.883
28 1HB PRO 3 HB2 PRO 3 27.040 5.270 -0.435
29 2HB PRO 3 HB1 PRO 3 28.484 5.927 0.339
30 1HG PRO 3 HG2 PRO 3 27.064 3.888 1.402
31 2HG PRO 3 HG1 PRO 3 27.928 5.074 2.400
32 1HD PRO 3 HD2 PRO 3 25.012 4.890 1.761
33 2HD PRO 3 HD1 PRO 3 25.807 5.322 3.289
34 H GLU 4 HN GLU 4 25.177 5.614 -0.710
35 HA GLU 4 HA GLU 4 24.646 7.679 -2.719
36 1HB GLU 4 HB2 GLU 4 24.059 4.715 -2.863
37 2HB GLU 4 HB1 GLU 4 23.882 5.877 -4.169
38 1HG GLU 4 HG2 GLU 4 26.361 4.710 -2.993
39 2HG GLU 4 HG1 GLU 4 25.866 4.826 -4.680
40 H ALA 5 HN ALA 5 22.613 8.379 -3.142
41 HA ALA 5 HA ALA 5 20.698 8.204 -1.075
42 1HB ALA 5 HB1 ALA 5 20.538 9.352 -3.848
43 2HB ALA 5 HB2 ALA 5 20.797 10.207 -2.328
44 3HB ALA 5 HB3 ALA 5 19.230 9.469 -2.668
45 HA PRO 6 HA PRO 6 18.089 5.390 -3.931
46 1HB PRO 6 HB2 PRO 6 19.665 4.471 -6.174
47 2HB PRO 6 HB1 PRO 6 18.172 5.410 -6.191
48 1HG PRO 6 HG2 PRO 6 20.596 6.402 -6.968
49 2HG PRO 6 HG1 PRO 6 19.277 7.402 -6.332
50 1HD PRO 6 HD2 PRO 6 21.721 6.376 -4.938
51 2HD PRO 6 HD1 PRO 6 20.939 7.967 -4.821
52 H GLY 7 HN GLY 7 18.685 4.149 -2.032
53 1HA GLY 7 HA2 GLY 7 20.283 1.775 -2.731
54 2HA GLY 7 HA1 GLY 7 20.576 2.629 -1.228
55 H GLU 8 HN GLU 8 17.352 2.881 -1.626
56 HA GLU 8 HA GLU 8 16.877 0.461 -0.041
57 1HB GLU 8 HB2 GLU 8 14.502 1.970 -0.125
58 2HB GLU 8 HB1 GLU 8 15.597 1.783 1.236
59 1HG GLU 8 HG2 GLU 8 15.923 3.893 -0.880
60 2HG GLU 8 HG1 GLU 8 15.014 4.133 0.611
61 H ASP 9 HN ASP 9 16.416 1.871 -3.045
62 HA ASP 9 HA ASP 9 15.218 -0.488 -4.129
63 1HB ASP 9 HB2 ASP 9 13.127 0.411 -3.493
64 2HB ASP 9 HB1 ASP 9 13.618 2.057 -3.870
65 H ALA 10 HN ALA 10 17.120 -0.486 -5.311
66 HA ALA 10 HA ALA 10 17.414 1.719 -7.227
67 1HB ALA 10 HB1 ALA 10 19.593 -0.148 -6.286
68 2HB ALA 10 HB2 ALA 10 19.281 1.446 -5.586
69 3HB ALA 10 HB3 ALA 10 19.776 1.298 -7.277
70 H SER 11 HN SER 11 16.373 1.103 -8.967
71 HA SER 11 HA SER 11 15.419 -1.404 -9.497
72 1HB SER 11 HB2 SER 11 15.915 0.669 -11.608
73 2HB SER 11 HB1 SER 11 14.635 -0.543 -11.566
74 HG SER 11 HG SER 11 14.234 0.659 -9.381
75 HA PRO 12 HA PRO 12 18.491 -2.337 -12.975
76 1HB PRO 12 HB2 PRO 12 20.729 -0.490 -12.851
77 2HB PRO 12 HB1 PRO 12 19.610 -0.791 -14.183
78 1HG PRO 12 HG2 PRO 12 19.635 1.538 -12.807
79 2HG PRO 12 HG1 PRO 12 18.155 0.859 -13.504
80 1HD PRO 12 HD2 PRO 12 19.153 0.723 -10.678
81 2HD PRO 12 HD1 PRO 12 17.515 1.084 -11.274
82 H GLU 13 HN GLU 13 18.742 -2.783 -10.074
83 HA GLU 13 HA GLU 13 19.930 -4.056 -8.634
84 1HB GLU 13 HB2 GLU 13 21.159 -4.711 -11.251
85 2HB GLU 13 HB1 GLU 13 22.126 -5.090 -9.832
86 1HG GLU 13 HG2 GLU 13 19.695 -6.086 -9.125
87 2HG GLU 13 HG1 GLU 13 19.715 -6.368 -10.868
88 H GLU 14 HN GLU 14 20.509 -1.213 -9.342
89 HA GLU 14 HA GLU 14 23.257 -0.764 -8.809
90 1HB GLU 14 HB2 GLU 14 20.812 0.878 -8.966
91 2HB GLU 14 HB1 GLU 14 22.073 1.514 -7.920
92 1HG GLU 14 HG2 GLU 14 22.357 0.801 -10.827
93 2HG GLU 14 HG1 GLU 14 22.274 2.425 -10.148
94 H LEU 15 HN LEU 15 20.662 -1.796 -6.957
95 HA LEU 15 HA LEU 15 21.347 -0.877 -4.385
96 1HB LEU 15 HB2 LEU 15 19.171 -1.804 -4.849
97 2HB LEU 15 HB1 LEU 15 19.874 -3.330 -5.346
98 HG LEU 15 HG LEU 15 20.757 -3.005 -2.729
99 1HD1 LEU 15 HD11 LEU 15 18.348 -2.794 -1.695
100 2HD1 LEU 15 HD12 LEU 15 18.061 -1.818 -3.136
101 3HD1 LEU 15 HD13 LEU 15 19.334 -1.365 -2.005
102 1HD2 LEU 15 HD21 LEU 15 20.212 -5.144 -3.266
103 2HD2 LEU 15 HD22 LEU 15 18.786 -4.664 -4.190
104 3HD2 LEU 15 HD23 LEU 15 18.724 -4.701 -2.427
105 H ASN 16 HN ASN 16 22.209 -3.794 -6.203
106 HA ASN 16 HA ASN 16 23.790 -5.019 -4.237
107 1HB ASN 16 HB2 ASN 16 23.167 -5.459 -6.981
108 2HB ASN 16 HB1 ASN 16 24.922 -5.504 -6.820
109 1HD2 ASN 16 HD21 ASN 16 21.916 -6.934 -5.835
110 2HD2 ASN 16 HD22 ASN 16 22.592 -8.399 -5.201
111 H ARG 17 HN ARG 17 24.606 -2.736 -6.815
112 HA ARG 17 HA ARG 17 27.351 -2.573 -5.958
113 1HB ARG 17 HB2 ARG 17 26.308 -0.404 -7.648
114 2HB ARG 17 HB1 ARG 17 27.767 -1.360 -7.805
115 1HG ARG 17 HG2 ARG 17 25.487 -3.017 -8.321
116 2HG ARG 17 HG1 ARG 17 25.405 -1.560 -9.313
117 1HD ARG 17 HD2 ARG 17 27.748 -3.451 -9.124
118 2HD ARG 17 HD1 ARG 17 26.593 -3.374 -10.451
119 HE ARG 17 HE ARG 17 27.737 -0.826 -10.093
120 1HH1 ARG 17 HH11 ARG 17 28.592 -4.041 -11.227
121 2HH1 ARG 17 HH12 ARG 17 29.866 -3.469 -12.266
122 1HH2 ARG 17 HH21 ARG 17 29.392 -0.079 -11.485
123 2HH2 ARG 17 HH22 ARG 17 30.324 -1.224 -12.414
124 H TYR 18 HN TYR 18 24.577 -1.463 -4.650
125 HA TYR 18 HA TYR 18 25.559 1.123 -3.795
126 1HB TYR 18 HB2 TYR 18 23.212 1.070 -3.978
127 2HB TYR 18 HB1 TYR 18 23.101 -0.521 -3.243
128 HD1 TYR 18 HD1 TYR 18 23.436 3.075 -2.597
129 HD2 TYR 18 HD2 TYR 18 23.018 -0.779 -0.853
130 HE1 TYR 18 HE1 TYR 18 22.813 4.114 -0.467
131 HE2 TYR 18 HE2 TYR 18 22.414 0.245 1.292
132 HH TYR 18 HH TYR 18 22.492 2.253 2.475
133 H TYR 19 HN TYR 19 25.083 -2.133 -2.547
134 HA TYR 19 HA TYR 19 26.488 -1.612 -0.098
135 1HB TYR 19 HB2 TYR 19 26.030 -4.299 -1.388
136 2HB TYR 19 HB1 TYR 19 26.351 -3.970 0.307
137 HD1 TYR 19 HD1 TYR 19 24.537 -2.399 1.475
138 HD2 TYR 19 HD2 TYR 19 23.873 -4.689 -2.054
139 HE1 TYR 19 HE1 TYR 19 22.121 -2.383 1.927
140 HE2 TYR 19 HE2 TYR 19 21.455 -4.679 -1.605
141 HH TYR 19 HH TYR 19 19.963 -2.625 0.455
142 H ALA 20 HN ALA 20 27.380 -2.346 -3.315
143 HA ALA 20 HA ALA 20 29.972 -3.411 -2.659
144 1HB ALA 20 HB1 ALA 20 28.360 -3.917 -4.687
145 2HB ALA 20 HB2 ALA 20 30.115 -4.033 -4.840
146 3HB ALA 20 HB3 ALA 20 29.265 -2.595 -5.413
147 H SER 21 HN SER 21 28.591 -0.439 -4.040
148 HA SER 21 HA SER 21 31.107 0.879 -4.213
149 1HB SER 21 HB2 SER 21 29.855 2.872 -4.670
150 2HB SER 21 HB1 SER 21 28.993 1.544 -5.456
151 HG SER 21 HG SER 21 27.334 2.065 -4.307
152 H LEU 22 HN LEU 22 28.650 0.415 -1.766
153 HA LEU 22 HA LEU 22 29.774 2.085 0.244
154 1HB LEU 22 HB2 LEU 22 27.625 0.281 0.058
155 2HB LEU 22 HB1 LEU 22 28.669 -0.378 1.303
156 HG LEU 22 HG LEU 22 27.710 2.478 1.338
157 1HD1 LEU 22 HD11 LEU 22 26.496 0.215 2.894
158 2HD1 LEU 22 HD12 LEU 22 25.847 0.761 1.348
159 3HD1 LEU 22 HD13 LEU 22 25.908 1.869 2.718
160 1HD2 LEU 22 HD21 LEU 22 29.359 2.489 2.883
161 2HD2 LEU 22 HD22 LEU 22 29.319 0.739 3.096
162 3HD2 LEU 22 HD23 LEU 22 28.119 1.753 3.898
163 H ARG 23 HN ARG 23 30.317 -1.297 -0.729
164 HA ARG 23 HA ARG 23 32.306 -1.799 1.250
165 1HB ARG 23 HB2 ARG 23 31.670 -3.793 0.372
166 2HB ARG 23 HB1 ARG 23 31.398 -3.127 -1.236
167 1HG ARG 23 HG2 ARG 23 33.483 -3.621 -1.930
168 2HG ARG 23 HG1 ARG 23 34.214 -3.188 -0.380
169 1HD ARG 23 HD2 ARG 23 32.700 -5.745 -0.933
170 2HD ARG 23 HD1 ARG 23 34.452 -5.590 -0.969
171 HE ARG 23 HE ARG 23 32.787 -5.836 1.344
172 1HH1 ARG 23 HH11 ARG 23 35.836 -4.523 0.202
173 2HH1 ARG 23 HH12 ARG 23 36.592 -4.587 1.764
174 1HH2 ARG 23 HH21 ARG 23 33.769 -5.915 3.376
175 2HH2 ARG 23 HH22 ARG 23 35.412 -5.367 3.579
176 H HIS 24 HN HIS 24 32.456 -0.553 -2.035
177 HA HIS 24 HA HIS 24 35.248 -0.352 -2.288
178 1HB HIS 24 HB2 HIS 24 33.205 0.095 -3.958
179 2HB HIS 24 HB1 HIS 24 33.503 1.759 -3.470
180 HD1 HIS 24 HD1 HIS 24 35.375 -1.175 -4.984
181 HD2 HIS 24 HD2 HIS 24 35.499 2.978 -4.839
182 HE1 HIS 24 HE1 HIS 24 37.180 -0.494 -6.599
183 HE2 HIS 24 HE2 HIS 24 37.090 2.031 -6.643
184 H TYR 25 HN TYR 25 32.818 1.746 -0.907
185 HA TYR 25 HA TYR 25 34.487 3.922 -0.265
186 1HB TYR 25 HB2 TYR 25 32.193 4.366 -0.289
187 2HB TYR 25 HB1 TYR 25 31.804 2.920 0.626
188 HD1 TYR 25 HD1 TYR 25 33.938 5.948 1.222
189 HD2 TYR 25 HD2 TYR 25 30.851 3.380 2.634
190 HE1 TYR 25 HE1 TYR 25 33.749 7.308 3.259
191 HE2 TYR 25 HE2 TYR 25 30.645 4.727 4.669
192 HH TYR 25 HH TYR 25 31.532 7.637 5.056
193 H LEU 26 HN LEU 26 33.510 1.015 1.527
194 HA LEU 26 HA LEU 26 34.930 1.542 3.896
195 1HB LEU 26 HB2 LEU 26 34.203 -1.070 2.575
196 2HB LEU 26 HB1 LEU 26 34.905 -0.956 4.179
197 HG LEU 26 HG LEU 26 32.319 0.403 3.457
198 1HD1 LEU 26 HD11 LEU 26 31.859 -1.868 5.067
199 2HD1 LEU 26 HD12 LEU 26 32.805 -2.392 3.673
200 3HD1 LEU 26 HD13 LEU 26 31.274 -1.548 3.433
201 1HD2 LEU 26 HD21 LEU 26 32.387 1.169 5.541
202 2HD2 LEU 26 HD22 LEU 26 34.008 0.490 5.704
203 3HD2 LEU 26 HD23 LEU 26 32.600 -0.466 6.169
204 H ASN 27 HN ASN 27 35.824 -0.424 1.085
205 HA ASN 27 HA ASN 27 38.421 -1.081 1.632
206 1HB ASN 27 HB2 ASN 27 36.792 -1.151 -0.615
207 2HB ASN 27 HB1 ASN 27 38.133 -0.125 -1.115
208 1HD2 ASN 27 HD21 ASN 27 39.493 -1.287 -2.255
209 2HD2 ASN 27 HD22 ASN 27 40.042 -2.879 -1.859
210 H LEU 28 HN LEU 28 37.198 2.019 0.468
211 HA LEU 28 HA LEU 28 39.767 3.190 0.142
212 1HB LEU 28 HB2 LEU 28 37.928 4.205 -1.032
213 2HB LEU 28 HB1 LEU 28 37.082 4.467 0.495
214 HG LEU 28 HG LEU 28 39.434 5.712 1.000
215 1HD1 LEU 28 HD11 LEU 28 39.886 5.300 -1.543
216 2HD1 LEU 28 HD12 LEU 28 40.265 6.864 -0.828
217 3HD1 LEU 28 HD13 LEU 28 38.791 6.663 -1.772
218 1HD2 LEU 28 HD21 LEU 28 36.765 6.369 0.854
219 2HD2 LEU 28 HD22 LEU 28 37.493 7.481 -0.306
220 3HD2 LEU 28 HD23 LEU 28 38.061 7.450 1.365
221 H VAL 29 HN VAL 29 37.270 3.534 2.601
222 HA VAL 29 HA VAL 29 38.527 5.525 4.034
223 HB VAL 29 HB VAL 29 37.172 4.909 6.019
224 1HG1 VAL 29 HG11 VAL 29 35.238 4.829 3.804
225 2HG1 VAL 29 HG12 VAL 29 36.427 6.132 3.758
226 3HG1 VAL 29 HG13 VAL 29 35.377 5.946 5.161
227 1HG2 VAL 29 HG21 VAL 29 36.774 2.460 4.455
228 2HG2 VAL 29 HG22 VAL 29 35.312 3.133 5.173
229 3HG2 VAL 29 HG23 VAL 29 36.688 2.728 6.197
230 H THR 30 HN THR 30 39.261 2.158 3.990
231 HA THR 30 HA THR 30 40.768 1.890 6.321
232 HB THR 30 HB THR 30 41.876 0.074 5.300
233 HG1 THR 30 HG1 THR 30 41.135 0.792 2.675
234 1HG2 THR 30 HG21 THR 30 39.261 0.349 3.822
235 2HG2 THR 30 HG22 THR 30 39.442 -0.233 5.478
236 3HG2 THR 30 HG23 THR 30 40.130 -1.153 4.142
237 H ARG 31 HN ARG 31 41.277 3.911 3.630
238 HA ARG 31 HA ARG 31 43.938 4.081 3.175
239 1HB ARG 31 HB2 ARG 31 41.967 5.409 2.177
240 2HB ARG 31 HB1 ARG 31 42.339 6.590 3.426
241 1HG ARG 31 HG2 ARG 31 44.271 7.237 2.441
242 2HG ARG 31 HG1 ARG 31 44.597 5.637 1.771
243 1HD ARG 31 HD2 ARG 31 42.206 6.806 0.633
244 2HD ARG 31 HD1 ARG 31 43.606 7.854 0.412
245 HE ARG 31 HE ARG 31 44.234 5.165 -0.259
246 1HH1 ARG 31 HH11 ARG 31 42.611 8.035 -1.462
247 2HH1 ARG 31 HH12 ARG 31 42.752 7.565 -3.134
248 1HH2 ARG 31 HH21 ARG 31 44.422 4.553 -2.443
249 2HH2 ARG 31 HH22 ARG 31 43.817 5.600 -3.691
250 H GLN 32 HN GLN 32 42.226 6.080 5.592
251 HA GLN 32 HA GLN 32 44.670 7.282 6.465
252 1HB GLN 32 HB2 GLN 32 43.334 8.822 7.411
253 2HB GLN 32 HB1 GLN 32 42.035 8.015 6.546
254 1HG GLN 32 HG2 GLN 32 42.774 7.025 9.248
255 2HG GLN 32 HG1 GLN 32 41.865 8.529 9.109
256 1HE2 GLN 32 HE21 GLN 32 41.870 5.155 7.999
257 2HE2 GLN 32 HE22 GLN 32 40.136 5.005 7.955
258 H ARG 33 HN ARG 33 43.023 4.406 7.283
259 HA ARG 33 HA ARG 33 44.622 4.201 9.761
260 1HB ARG 33 HB2 ARG 33 42.934 2.702 10.682
261 2HB ARG 33 HB1 ARG 33 42.196 4.234 10.252
262 1HG ARG 33 HG2 ARG 33 40.981 3.322 8.528
263 2HG ARG 33 HG1 ARG 33 42.108 1.983 8.298
264 1HD ARG 33 HD2 ARG 33 39.855 2.276 10.195
265 2HD ARG 33 HD1 ARG 33 40.431 0.851 9.332
266 HE ARG 33 HE ARG 33 41.467 1.905 11.867
267 1HH1 ARG 33 HH11 ARG 33 41.424 -0.605 9.428
268 2HH1 ARG 33 HH12 ARG 33 42.422 -1.700 10.336
269 1HH2 ARG 33 HH21 ARG 33 42.771 0.459 13.085
270 2HH2 ARG 33 HH22 ARG 33 43.182 -1.096 12.425
271 H TYR 34 HN TYR 34 45.824 3.764 7.492
272 HA TYR 34 HA TYR 34 45.241 1.402 6.149
273 1HB TYR 34 HB2 TYR 34 46.747 3.557 5.583
274 2HB TYR 34 HB1 TYR 34 48.023 2.424 6.015
275 HD1 TYR 34 HD1 TYR 34 49.053 1.795 4.047
276 HD2 TYR 34 HD2 TYR 34 44.806 1.899 4.197
277 HE1 TYR 34 HE1 TYR 34 48.959 0.837 1.785
278 HE2 TYR 34 HE2 TYR 34 44.695 0.934 1.937
279 HH TYR 34 HH TYR 34 47.600 -0.176 0.261
280 1HN NH2 35 H1 NH2 35 48.025 0.433 8.992
281 2HN NH2 35 H2 NH2 35 47.545 2.077 8.753
Start of MODEL 13
1 1H ILE 1 HT1 ILE 1 29.628 9.731 5.908
2 2H ILE 1 HT2 ILE 1 28.118 9.305 5.274
3 3H ILE 1 HT3 ILE 1 29.219 10.184 4.326
4 HA ILE 1 HA ILE 1 30.703 8.362 4.190
5 HB ILE 1 HB ILE 1 28.749 6.862 5.944
6 1HG1 ILE 1 HG12 ILE 1 31.607 7.494 6.640
7 2HG1 ILE 1 HG11 ILE 1 30.321 8.641 6.999
8 1HG2 ILE 1 HG21 ILE 1 29.728 5.367 4.368
9 2HG2 ILE 1 HG22 ILE 1 30.548 5.120 5.908
10 3HG2 ILE 1 HG23 ILE 1 31.332 6.047 4.631
11 1HD1 ILE 1 HD11 ILE 1 30.164 5.798 7.919
12 2HD1 ILE 1 HD12 ILE 1 29.323 7.216 8.544
13 3HD1 ILE 1 HD13 ILE 1 31.051 7.018 8.834
14 H LYS 2 HN LYS 2 27.195 7.697 4.446
15 HA LYS 2 HA LYS 2 27.329 6.338 1.844
16 1HB LYS 2 HB2 LYS 2 26.222 5.418 4.079
17 2HB LYS 2 HB1 LYS 2 24.854 6.359 3.506
18 1HG LYS 2 HG2 LYS 2 25.355 5.062 1.259
19 2HG LYS 2 HG1 LYS 2 26.071 3.900 2.377
20 1HD LYS 2 HD2 LYS 2 24.021 3.097 2.741
21 2HD LYS 2 HD1 LYS 2 23.617 4.628 3.521
22 1HE LYS 2 HE2 LYS 2 22.885 5.540 1.396
23 2HE LYS 2 HE1 LYS 2 23.352 4.054 0.571
24 1HZ LYS 2 HZ1 LYS 2 20.897 4.626 1.666
25 2HZ LYS 2 HZ2 LYS 2 21.594 3.522 2.749
26 3HZ LYS 2 HZ3 LYS 2 21.429 3.113 1.112
27 HA PRO 3 HA PRO 3 25.472 10.149 0.275
28 1HB PRO 3 HB2 PRO 3 25.753 9.485 -2.346
29 2HB PRO 3 HB1 PRO 3 27.064 10.163 -1.376
30 1HG PRO 3 HG2 PRO 3 26.541 7.319 -2.134
31 2HG PRO 3 HG1 PRO 3 28.078 8.200 -2.079
32 1HD PRO 3 HD2 PRO 3 27.283 6.493 -0.121
33 2HD PRO 3 HD1 PRO 3 28.311 7.906 0.192
34 H GLU 4 HN GLU 4 23.434 10.601 -0.413
35 HA GLU 4 HA GLU 4 21.497 8.517 -0.353
36 1HB GLU 4 HB2 GLU 4 21.020 11.316 -1.366
37 2HB GLU 4 HB1 GLU 4 19.865 10.223 -0.617
38 1HG GLU 4 HG2 GLU 4 20.253 11.531 1.169
39 2HG GLU 4 HG1 GLU 4 21.608 10.424 1.391
40 H ALA 5 HN ALA 5 22.128 7.118 -1.981
41 HA ALA 5 HA ALA 5 21.869 8.032 -4.736
42 1HB ALA 5 HB1 ALA 5 23.331 5.920 -3.390
43 2HB ALA 5 HB2 ALA 5 23.643 6.710 -4.936
44 3HB ALA 5 HB3 ALA 5 22.508 5.362 -4.848
45 HA PRO 6 HA PRO 6 18.481 4.576 -4.526
46 1HB PRO 6 HB2 PRO 6 17.466 4.011 -2.060
47 2HB PRO 6 HB1 PRO 6 18.757 3.076 -2.820
48 1HG PRO 6 HG2 PRO 6 18.932 5.208 -0.736
49 2HG PRO 6 HG1 PRO 6 19.829 3.684 -0.860
50 1HD PRO 6 HD2 PRO 6 20.877 6.081 -1.566
51 2HD PRO 6 HD1 PRO 6 21.342 4.560 -2.353
52 H GLY 7 HN GLY 7 17.464 6.411 -5.423
53 1HA GLY 7 HA2 GLY 7 16.014 8.205 -3.646
54 2HA GLY 7 HA1 GLY 7 16.161 8.355 -5.392
55 H GLU 8 HN GLU 8 15.091 6.409 -6.586
56 HA GLU 8 HA GLU 8 12.582 5.637 -5.323
57 1HB GLU 8 HB2 GLU 8 12.785 7.403 -7.765
58 2HB GLU 8 HB1 GLU 8 11.347 6.455 -7.405
59 1HG GLU 8 HG2 GLU 8 11.204 7.617 -5.219
60 2HG GLU 8 HG1 GLU 8 12.544 8.644 -5.729
61 H ASP 9 HN ASP 9 13.650 3.588 -5.502
62 HA ASP 9 HA ASP 9 13.835 1.517 -6.392
63 1HB ASP 9 HB2 ASP 9 11.677 2.042 -7.577
64 2HB ASP 9 HB1 ASP 9 12.633 2.581 -8.956
65 H ALA 10 HN ALA 10 15.948 1.301 -6.435
66 HA ALA 10 HA ALA 10 17.615 2.584 -8.400
67 1HB ALA 10 HB1 ALA 10 18.057 0.868 -6.028
68 2HB ALA 10 HB2 ALA 10 18.829 2.385 -6.488
69 3HB ALA 10 HB3 ALA 10 19.311 0.878 -7.267
70 H SER 11 HN SER 11 15.795 1.182 -9.810
71 HA SER 11 HA SER 11 15.495 -0.352 -11.456
72 1HB SER 11 HB2 SER 11 18.471 -0.720 -11.594
73 2HB SER 11 HB1 SER 11 17.307 -0.570 -12.909
74 HG SER 11 HG SER 11 17.992 1.425 -12.942
75 HA PRO 12 HA PRO 12 16.174 -4.639 -10.004
76 1HB PRO 12 HB2 PRO 12 17.791 -5.917 -11.821
77 2HB PRO 12 HB1 PRO 12 16.053 -5.688 -12.036
78 1HG PRO 12 HG2 PRO 12 18.328 -4.106 -13.156
79 2HG PRO 12 HG1 PRO 12 16.833 -4.634 -13.950
80 1HD PRO 12 HD2 PRO 12 17.144 -2.122 -13.073
81 2HD PRO 12 HD1 PRO 12 15.574 -2.949 -12.977
82 H GLU 13 HN GLU 13 17.672 -3.023 -8.589
83 HA GLU 13 HA GLU 13 19.374 -3.017 -7.097
84 1HB GLU 13 HB2 GLU 13 19.407 -5.779 -8.093
85 2HB GLU 13 HB1 GLU 13 20.970 -5.230 -7.507
86 1HG GLU 13 HG2 GLU 13 18.432 -5.669 -6.034
87 2HG GLU 13 HG1 GLU 13 20.083 -6.107 -5.602
88 H GLU 14 HN GLU 14 19.633 -1.621 -9.426
89 HA GLU 14 HA GLU 14 22.203 -2.075 -10.626
90 1HB GLU 14 HB2 GLU 14 19.963 -0.181 -10.974
91 2HB GLU 14 HB1 GLU 14 21.554 0.455 -11.369
92 1HG GLU 14 HG2 GLU 14 21.352 -2.111 -12.532
93 2HG GLU 14 HG1 GLU 14 19.871 -1.232 -12.910
94 H LEU 15 HN LEU 15 21.463 -1.165 -7.673
95 HA LEU 15 HA LEU 15 23.520 0.920 -7.452
96 1HB LEU 15 HB2 LEU 15 20.921 0.799 -6.449
97 2HB LEU 15 HB1 LEU 15 21.942 0.445 -5.069
98 HG LEU 15 HG LEU 15 23.222 2.569 -5.645
99 1HD1 LEU 15 HD11 LEU 15 21.313 4.109 -6.820
100 2HD1 LEU 15 HD12 LEU 15 21.138 2.594 -7.707
101 3HD1 LEU 15 HD13 LEU 15 22.699 3.413 -7.660
102 1HD2 LEU 15 HD21 LEU 15 21.463 2.202 -3.842
103 2HD2 LEU 15 HD22 LEU 15 20.348 3.034 -4.928
104 3HD2 LEU 15 HD23 LEU 15 21.783 3.869 -4.330
105 H ASN 16 HN ASN 16 23.117 -2.317 -7.145
106 HA ASN 16 HA ASN 16 24.071 -2.947 -4.595
107 1HB ASN 16 HB2 ASN 16 23.155 -4.401 -6.693
108 2HB ASN 16 HB1 ASN 16 24.874 -4.772 -6.770
109 1HD2 ASN 16 HD21 ASN 16 22.133 -4.648 -4.529
110 2HD2 ASN 16 HD22 ASN 16 22.666 -5.986 -3.554
111 H ARG 17 HN ARG 17 25.848 -2.428 -7.637
112 HA ARG 17 HA ARG 17 28.348 -2.979 -6.311
113 1HB ARG 17 HB2 ARG 17 27.958 -1.768 -9.036
114 2HB ARG 17 HB1 ARG 17 29.450 -2.420 -8.367
115 1HG ARG 17 HG2 ARG 17 26.962 -4.059 -8.833
116 2HG ARG 17 HG1 ARG 17 28.280 -3.915 -9.998
117 1HD ARG 17 HD2 ARG 17 29.174 -5.686 -8.966
118 2HD ARG 17 HD1 ARG 17 29.584 -4.570 -7.666
119 HE ARG 17 HE ARG 17 27.903 -5.476 -6.368
120 1HH1 ARG 17 HH11 ARG 17 27.717 -6.774 -9.627
121 2HH1 ARG 17 HH12 ARG 17 26.531 -7.979 -9.206
122 1HH2 ARG 17 HH21 ARG 17 26.371 -7.070 -5.819
123 2HH2 ARG 17 HH22 ARG 17 25.796 -8.171 -7.036
124 H TYR 18 HN TYR 18 26.313 -0.263 -6.589
125 HA TYR 18 HA TYR 18 28.404 1.665 -6.238
126 1HB TYR 18 HB2 TYR 18 26.620 2.982 -6.684
127 2HB TYR 18 HB1 TYR 18 25.485 1.702 -6.273
128 HD1 TYR 18 HD1 TYR 18 24.301 1.746 -4.256
129 HD2 TYR 18 HD2 TYR 18 27.556 4.426 -4.800
130 HE1 TYR 18 HE1 TYR 18 23.672 2.902 -2.195
131 HE2 TYR 18 HE2 TYR 18 26.937 5.605 -2.729
132 HH TYR 18 HH TYR 18 24.723 5.905 -1.357
133 H TYR 19 HN TYR 19 26.322 -0.271 -4.165
134 HA TYR 19 HA TYR 19 27.408 0.626 -1.695
135 1HB TYR 19 HB2 TYR 19 25.816 -1.782 -2.531
136 2HB TYR 19 HB1 TYR 19 26.429 -1.629 -0.890
137 HD1 TYR 19 HD1 TYR 19 23.928 -0.597 -3.256
138 HD2 TYR 19 HD2 TYR 19 25.643 0.261 0.531
139 HE1 TYR 19 HE1 TYR 19 21.931 0.713 -2.658
140 HE2 TYR 19 HE2 TYR 19 23.659 1.574 1.148
141 HH TYR 19 HH TYR 19 20.793 1.385 -0.345
142 H ALA 20 HN ALA 20 28.359 -1.656 -4.061
143 HA ALA 20 HA ALA 20 30.136 -3.164 -2.380
144 1HB ALA 20 HB1 ALA 20 30.624 -4.416 -4.354
145 2HB ALA 20 HB2 ALA 20 29.927 -3.153 -5.376
146 3HB ALA 20 HB3 ALA 20 28.885 -4.105 -4.314
147 H SER 21 HN SER 21 30.458 -0.847 -5.046
148 HA SER 21 HA SER 21 33.290 -0.718 -4.895
149 1HB SER 21 HB2 SER 21 33.056 1.198 -6.416
150 2HB SER 21 HB1 SER 21 31.999 -0.128 -6.928
151 HG SER 21 HG SER 21 30.275 0.997 -6.373
152 H LEU 22 HN LEU 22 30.623 0.993 -3.410
153 HA LEU 22 HA LEU 22 32.219 2.880 -1.969
154 1HB LEU 22 HB2 LEU 22 29.577 2.679 -2.359
155 2HB LEU 22 HB1 LEU 22 29.675 1.876 -0.804
156 HG LEU 22 HG LEU 22 30.923 3.965 0.002
157 1HD1 LEU 22 HD11 LEU 22 30.454 6.009 -1.235
158 2HD1 LEU 22 HD12 LEU 22 29.667 5.071 -2.504
159 3HD1 LEU 22 HD13 LEU 22 31.396 4.883 -2.213
160 1HD2 LEU 22 HD21 LEU 22 28.538 5.217 -0.144
161 2HD2 LEU 22 HD22 LEU 22 28.896 3.906 0.982
162 3HD2 LEU 22 HD23 LEU 22 28.056 3.564 -0.531
163 H ARG 23 HN ARG 23 31.126 -0.438 -1.429
164 HA ARG 23 HA ARG 23 32.112 -0.556 1.250
165 1HB ARG 23 HB2 ARG 23 30.497 -2.198 0.346
166 2HB ARG 23 HB1 ARG 23 31.772 -2.850 -0.679
167 1HG ARG 23 HG2 ARG 23 33.086 -3.373 1.350
168 2HG ARG 23 HG1 ARG 23 31.722 -2.827 2.330
169 1HD ARG 23 HD2 ARG 23 31.560 -5.032 0.285
170 2HD ARG 23 HD1 ARG 23 31.812 -5.298 2.009
171 HE ARG 23 HE ARG 23 29.440 -3.810 1.121
172 1HH1 ARG 23 HH11 ARG 23 30.842 -6.671 2.588
173 2HH1 ARG 23 HH12 ARG 23 29.321 -7.235 3.228
174 1HH2 ARG 23 HH21 ARG 23 27.460 -4.563 1.926
175 2HH2 ARG 23 HH22 ARG 23 27.383 -6.061 2.810
176 H HIS 24 HN HIS 24 33.587 -1.081 -1.905
177 HA HIS 24 HA HIS 24 36.061 -2.042 -0.912
178 1HB HIS 24 HB2 HIS 24 35.161 -1.909 -3.374
179 2HB HIS 24 HB1 HIS 24 35.919 -0.320 -3.362
180 HD1 HIS 24 HD1 HIS 24 38.516 -0.238 -3.216
181 HD2 HIS 24 HD2 HIS 24 36.917 -4.072 -3.435
182 HE1 HIS 24 HE1 HIS 24 40.457 -1.760 -3.713
183 HE2 HIS 24 HE2 HIS 24 39.487 -4.091 -3.671
184 H TYR 25 HN TYR 25 34.737 1.153 -1.486
185 HA TYR 25 HA TYR 25 36.987 2.666 -0.753
186 1HB TYR 25 HB2 TYR 25 35.392 3.966 -1.787
187 2HB TYR 25 HB1 TYR 25 34.054 3.133 -1.010
188 HD1 TYR 25 HD1 TYR 25 32.774 4.461 0.360
189 HD2 TYR 25 HD2 TYR 25 36.949 5.247 0.083
190 HE1 TYR 25 HE1 TYR 25 32.517 6.333 1.919
191 HE2 TYR 25 HE2 TYR 25 36.704 7.120 1.653
192 HH TYR 25 HH TYR 25 33.998 8.626 2.312
193 H LEU 26 HN LEU 26 34.254 1.412 1.140
194 HA LEU 26 HA LEU 26 35.047 2.388 3.650
195 1HB LEU 26 HB2 LEU 26 33.497 -0.091 2.905
196 2HB LEU 26 HB1 LEU 26 33.692 0.474 4.553
197 HG LEU 26 HG LEU 26 32.444 2.186 2.413
198 1HD1 LEU 26 HD11 LEU 26 30.352 1.378 3.922
199 2HD1 LEU 26 HD12 LEU 26 31.326 -0.093 3.907
200 3HD1 LEU 26 HD13 LEU 26 30.807 0.637 2.386
201 1HD2 LEU 26 HD21 LEU 26 32.142 2.264 5.408
202 2HD2 LEU 26 HD22 LEU 26 31.596 3.461 4.234
203 3HD2 LEU 26 HD23 LEU 26 33.322 3.228 4.518
204 H ASN 27 HN ASN 27 35.543 -0.813 2.214
205 HA ASN 27 HA ASN 27 37.184 -2.034 4.011
206 1HB ASN 27 HB2 ASN 27 36.492 -2.434 1.334
207 2HB ASN 27 HB1 ASN 27 38.251 -2.369 1.324
208 1HD2 ASN 27 HD21 ASN 27 39.099 -4.314 1.407
209 2HD2 ASN 27 HD22 ASN 27 38.485 -5.664 2.301
210 H LEU 28 HN LEU 28 38.109 0.413 1.617
211 HA LEU 28 HA LEU 28 40.869 0.371 2.210
212 1HB LEU 28 HB2 LEU 28 40.226 1.428 0.172
213 2HB LEU 28 HB1 LEU 28 39.146 2.520 1.042
214 HG LEU 28 HG LEU 28 41.579 2.947 2.265
215 1HD1 LEU 28 HD11 LEU 28 42.293 1.678 -0.031
216 2HD1 LEU 28 HD12 LEU 28 43.294 2.874 0.794
217 3HD1 LEU 28 HD13 LEU 28 42.290 3.357 -0.575
218 1HD2 LEU 28 HD21 LEU 28 41.393 4.987 0.421
219 2HD2 LEU 28 HD22 LEU 28 40.546 4.918 1.967
220 3HD2 LEU 28 HD23 LEU 28 39.736 4.387 0.492
221 H VAL 29 HN VAL 29 38.313 2.585 3.193
222 HA VAL 29 HA VAL 29 40.009 4.358 4.473
223 HB VAL 29 HB VAL 29 38.049 5.288 5.657
224 1HG1 VAL 29 HG11 VAL 29 37.411 4.809 2.772
225 2HG1 VAL 29 HG12 VAL 29 38.763 5.817 3.290
226 3HG1 VAL 29 HG13 VAL 29 37.116 6.250 3.747
227 1HG2 VAL 29 HG21 VAL 29 36.941 2.782 5.362
228 2HG2 VAL 29 HG22 VAL 29 36.070 3.758 4.180
229 3HG2 VAL 29 HG23 VAL 29 36.094 4.240 5.876
230 H THR 30 HN THR 30 38.844 1.327 5.563
231 HA THR 30 HA THR 30 39.277 1.656 8.339
232 HB THR 30 HB THR 30 39.301 -0.691 8.526
233 HG1 THR 30 HG1 THR 30 39.811 -1.039 5.746
234 1HG2 THR 30 HG21 THR 30 37.164 0.108 7.730
235 2HG2 THR 30 HG22 THR 30 37.512 -1.459 6.992
236 3HG2 THR 30 HG23 THR 30 37.722 0.021 6.054
237 H ARG 31 HN ARG 31 41.413 1.907 5.782
238 HA ARG 31 HA ARG 31 43.821 0.883 6.595
239 1HB ARG 31 HB2 ARG 31 42.951 2.679 4.648
240 2HB ARG 31 HB1 ARG 31 44.161 3.566 5.566
241 1HG ARG 31 HG2 ARG 31 45.607 2.589 4.175
242 2HG ARG 31 HG1 ARG 31 45.408 1.185 5.225
243 1HD ARG 31 HD2 ARG 31 43.494 0.500 3.718
244 2HD ARG 31 HD1 ARG 31 44.041 1.753 2.603
245 HE ARG 31 HE ARG 31 45.849 -0.408 3.477
246 1HH1 ARG 31 HH11 ARG 31 44.210 1.351 0.943
247 2HH1 ARG 31 HH12 ARG 31 45.111 0.621 -0.346
248 1HH2 ARG 31 HH21 ARG 31 47.067 -1.382 1.777
249 2HH2 ARG 31 HH22 ARG 31 46.734 -0.937 0.131
250 H GLN 32 HN GLN 32 42.473 4.065 7.323
251 HA GLN 32 HA GLN 32 44.232 4.228 9.677
252 1HB GLN 32 HB2 GLN 32 43.167 6.780 9.235
253 2HB GLN 32 HB1 GLN 32 44.819 6.260 8.956
254 1HG GLN 32 HG2 GLN 32 43.952 7.384 7.007
255 2HG GLN 32 HG1 GLN 32 44.241 5.684 6.645
256 1HE2 GLN 32 HE21 GLN 32 41.561 7.601 8.012
257 2HE2 GLN 32 HE22 GLN 32 40.344 6.915 6.991
258 H ARG 33 HN ARG 33 40.996 4.651 8.416
259 HA ARG 33 HA ARG 33 38.949 4.793 9.338
260 1HB ARG 33 HB2 ARG 33 40.485 3.545 11.541
261 2HB ARG 33 HB1 ARG 33 38.953 4.291 11.978
262 1HG ARG 33 HG2 ARG 33 37.760 2.903 10.431
263 2HG ARG 33 HG1 ARG 33 39.268 2.243 9.794
264 1HD ARG 33 HD2 ARG 33 38.979 1.956 12.691
265 2HD ARG 33 HD1 ARG 33 37.735 1.116 11.761
266 HE ARG 33 HE ARG 33 39.408 -0.209 10.753
267 1HH1 ARG 33 HH11 ARG 33 40.632 1.899 13.272
268 2HH1 ARG 33 HH12 ARG 33 42.141 1.039 13.431
269 1HH2 ARG 33 HH21 ARG 33 41.376 -1.342 10.966
270 2HH2 ARG 33 HH22 ARG 33 42.551 -0.805 12.127
271 H TYR 34 HN TYR 34 41.089 5.950 11.940
272 HA TYR 34 HA TYR 34 41.255 7.929 13.026
273 1HB TYR 34 HB2 TYR 34 40.773 8.634 10.219
274 2HB TYR 34 HB1 TYR 34 40.361 9.912 11.355
275 HD1 TYR 34 HD1 TYR 34 42.033 11.495 11.427
276 HD2 TYR 34 HD2 TYR 34 43.120 7.387 11.220
277 HE1 TYR 34 HE1 TYR 34 44.406 12.118 11.595
278 HE2 TYR 34 HE2 TYR 34 45.496 7.999 11.390
279 HH TYR 34 HH TYR 34 46.799 10.556 10.717
280 1HN NH2 35 H1 NH2 35 37.681 7.653 13.966
281 2HN NH2 35 H2 NH2 35 38.958 6.536 13.642
Start of MODEL 14
1 1H ILE 1 HT1 ILE 1 27.295 5.804 7.563
2 2H ILE 1 HT2 ILE 1 27.094 7.480 7.395
3 3H ILE 1 HT3 ILE 1 28.367 6.874 8.319
4 HA ILE 1 HA ILE 1 28.911 7.715 6.005
5 HB ILE 1 HB ILE 1 30.231 5.398 5.596
6 1HG1 ILE 1 HG12 ILE 1 30.579 5.056 8.373
7 2HG1 ILE 1 HG11 ILE 1 28.841 5.040 8.098
8 1HG2 ILE 1 HG21 ILE 1 31.652 6.532 7.688
9 2HG2 ILE 1 HG22 ILE 1 30.704 7.866 7.029
10 3HG2 ILE 1 HG23 ILE 1 31.782 6.944 5.978
11 1HD1 ILE 1 HD11 ILE 1 30.572 2.916 7.814
12 2HD1 ILE 1 HD12 ILE 1 30.264 3.431 6.157
13 3HD1 ILE 1 HD13 ILE 1 28.916 3.006 7.215
14 H LYS 2 HN LYS 2 26.257 7.053 5.568
15 HA LYS 2 HA LYS 2 26.434 5.209 3.278
16 1HB LYS 2 HB2 LYS 2 25.265 4.270 5.329
17 2HB LYS 2 HB1 LYS 2 24.019 5.483 5.066
18 1HG LYS 2 HG2 LYS 2 24.499 4.089 2.622
19 2HG LYS 2 HG1 LYS 2 24.229 2.924 3.923
20 1HD LYS 2 HD2 LYS 2 22.096 3.689 4.347
21 2HD LYS 2 HD1 LYS 2 22.421 5.285 3.660
22 1HE LYS 2 HE2 LYS 2 21.434 4.583 1.795
23 2HE LYS 2 HE1 LYS 2 22.810 3.506 1.560
24 1HZ LYS 2 HZ1 LYS 2 20.198 2.890 2.815
25 2HZ LYS 2 HZ2 LYS 2 21.553 1.888 3.014
26 3HZ LYS 2 HZ3 LYS 2 20.919 2.149 1.464
27 HA PRO 3 HA PRO 3 24.996 9.146 1.432
28 1HB PRO 3 HB2 PRO 3 25.474 7.500 -0.993
29 2HB PRO 3 HB1 PRO 3 26.023 9.135 -0.613
30 1HG PRO 3 HG2 PRO 3 27.712 7.068 -0.552
31 2HG PRO 3 HG1 PRO 3 27.827 8.387 0.628
32 1HD PRO 3 HD2 PRO 3 26.708 5.634 0.961
33 2HD PRO 3 HD1 PRO 3 27.656 6.612 2.101
34 H GLU 4 HN GLU 4 22.903 9.576 1.082
35 HA GLU 4 HA GLU 4 21.010 7.438 0.834
36 1HB GLU 4 HB2 GLU 4 20.616 10.429 0.748
37 2HB GLU 4 HB1 GLU 4 19.324 9.240 0.841
38 1HG GLU 4 HG2 GLU 4 19.469 9.341 3.043
39 2HG GLU 4 HG1 GLU 4 21.064 8.601 2.922
40 H ALA 5 HN ALA 5 19.703 6.931 -0.888
41 HA ALA 5 HA ALA 5 19.749 8.192 -3.397
42 1HB ALA 5 HB1 ALA 5 21.237 5.724 -3.837
43 2HB ALA 5 HB2 ALA 5 22.134 6.932 -2.913
44 3HB ALA 5 HB3 ALA 5 21.486 7.338 -4.503
45 HA PRO 6 HA PRO 6 17.966 3.578 -3.687
46 1HB PRO 6 HB2 PRO 6 16.975 2.740 -1.245
47 2HB PRO 6 HB1 PRO 6 18.501 2.206 -1.955
48 1HG PRO 6 HG2 PRO 6 18.004 4.331 0.087
49 2HG PRO 6 HG1 PRO 6 19.289 3.108 0.031
50 1HD PRO 6 HD2 PRO 6 19.777 5.627 -0.676
51 2HD PRO 6 HD1 PRO 6 20.500 4.276 -1.577
52 H GLY 7 HN GLY 7 15.816 3.170 -4.060
53 1HA GLY 7 HA2 GLY 7 13.972 5.271 -3.099
54 2HA GLY 7 HA1 GLY 7 13.872 4.540 -4.695
55 H GLU 8 HN GLU 8 12.522 2.890 -4.956
56 HA GLU 8 HA GLU 8 11.143 1.795 -2.668
57 1HB GLU 8 HB2 GLU 8 10.773 0.696 -5.423
58 2HB GLU 8 HB1 GLU 8 9.580 0.954 -4.159
59 1HG GLU 8 HG2 GLU 8 10.851 3.071 -5.879
60 2HG GLU 8 HG1 GLU 8 9.200 2.472 -5.996
61 H ASP 9 HN ASP 9 13.634 0.924 -4.857
62 HA ASP 9 HA ASP 9 14.461 -1.189 -3.073
63 1HB ASP 9 HB2 ASP 9 13.063 -2.376 -4.754
64 2HB ASP 9 HB1 ASP 9 14.101 -1.749 -6.030
65 H ALA 10 HN ALA 10 15.790 -1.340 -6.182
66 HA ALA 10 HA ALA 10 17.600 0.856 -6.010
67 1HB ALA 10 HB1 ALA 10 19.570 -0.967 -5.982
68 2HB ALA 10 HB2 ALA 10 18.406 -1.767 -4.923
69 3HB ALA 10 HB3 ALA 10 18.984 -0.144 -4.531
70 H SER 11 HN SER 11 15.834 0.007 -7.955
71 HA SER 11 HA SER 11 15.561 -0.629 -10.115
72 1HB SER 11 HB2 SER 11 18.536 -0.280 -10.492
73 2HB SER 11 HB1 SER 11 17.229 0.095 -11.613
74 HG SER 11 HG SER 11 17.682 2.042 -10.839
75 HA PRO 12 HA PRO 12 17.026 -4.908 -10.738
76 1HB PRO 12 HB2 PRO 12 18.490 -4.986 -13.063
77 2HB PRO 12 HB1 PRO 12 16.724 -5.019 -12.998
78 1HG PRO 12 HG2 PRO 12 18.561 -2.719 -13.528
79 2HG PRO 12 HG1 PRO 12 17.030 -3.137 -14.319
80 1HD PRO 12 HD2 PRO 12 17.185 -1.203 -12.457
81 2HD PRO 12 HD1 PRO 12 15.757 -2.249 -12.600
82 H GLU 13 HN GLU 13 18.462 -3.845 -8.879
83 HA GLU 13 HA GLU 13 20.334 -4.220 -7.661
84 1HB GLU 13 HB2 GLU 13 20.358 -6.304 -9.454
85 2HB GLU 13 HB1 GLU 13 21.923 -5.560 -9.741
86 1HG GLU 13 HG2 GLU 13 21.881 -5.660 -7.030
87 2HG GLU 13 HG1 GLU 13 20.960 -7.106 -7.449
88 H GLU 14 HN GLU 14 19.980 -1.906 -9.292
89 HA GLU 14 HA GLU 14 22.478 -1.237 -10.514
90 1HB GLU 14 HB2 GLU 14 20.953 0.052 -11.566
91 2HB GLU 14 HB1 GLU 14 19.828 -0.025 -10.219
92 1HG GLU 14 HG2 GLU 14 20.252 2.142 -9.964
93 2HG GLU 14 HG1 GLU 14 21.778 1.635 -9.245
94 H LEU 15 HN LEU 15 20.752 -0.108 -7.623
95 HA LEU 15 HA LEU 15 22.945 1.478 -6.703
96 1HB LEU 15 HB2 LEU 15 20.234 1.259 -6.117
97 2HB LEU 15 HB1 LEU 15 21.049 0.761 -4.647
98 HG LEU 15 HG LEU 15 22.407 3.057 -5.409
99 1HD1 LEU 15 HD11 LEU 15 20.348 4.640 -5.481
100 2HD1 LEU 15 HD12 LEU 15 19.505 3.225 -6.114
101 3HD1 LEU 15 HD13 LEU 15 20.905 3.873 -6.966
102 1HD2 LEU 15 HD21 LEU 15 20.304 3.633 -3.551
103 2HD2 LEU 15 HD22 LEU 15 22.033 3.433 -3.260
104 3HD2 LEU 15 HD23 LEU 15 20.965 2.028 -3.239
105 H ASN 16 HN ASN 16 22.232 -1.832 -6.550
106 HA ASN 16 HA ASN 16 23.375 -2.527 -4.084
107 1HB ASN 16 HB2 ASN 16 22.148 -3.948 -6.014
108 2HB ASN 16 HB1 ASN 16 23.822 -4.360 -6.377
109 1HD2 ASN 16 HD21 ASN 16 21.148 -5.017 -4.445
110 2HD2 ASN 16 HD22 ASN 16 21.920 -6.053 -3.286
111 H ARG 17 HN ARG 17 24.808 -1.959 -7.272
112 HA ARG 17 HA ARG 17 27.447 -2.624 -6.380
113 1HB ARG 17 HB2 ARG 17 26.634 -1.008 -8.782
114 2HB ARG 17 HB1 ARG 17 28.257 -1.586 -8.418
115 1HG ARG 17 HG2 ARG 17 26.138 -3.637 -8.504
116 2HG ARG 17 HG1 ARG 17 26.546 -2.873 -10.044
117 1HD ARG 17 HD2 ARG 17 28.399 -4.086 -10.187
118 2HD ARG 17 HD1 ARG 17 28.949 -3.466 -8.631
119 HE ARG 17 HE ARG 17 27.066 -5.442 -8.098
120 1HH1 ARG 17 HH11 ARG 17 30.259 -5.167 -9.530
121 2HH1 ARG 17 HH12 ARG 17 30.698 -6.817 -9.169
122 1HH2 ARG 17 HH21 ARG 17 27.639 -7.606 -7.651
123 2HH2 ARG 17 HH22 ARG 17 29.208 -8.195 -8.112
124 H TYR 18 HN TYR 18 25.446 0.145 -6.028
125 HA TYR 18 HA TYR 18 27.620 1.950 -5.585
126 1HB TYR 18 HB2 TYR 18 25.887 3.389 -5.630
127 2HB TYR 18 HB1 TYR 18 24.723 2.090 -5.394
128 HD1 TYR 18 HD1 TYR 18 23.710 1.734 -3.310
129 HD2 TYR 18 HD2 TYR 18 26.950 4.468 -3.611
130 HE1 TYR 18 HE1 TYR 18 23.274 2.482 -1.029
131 HE2 TYR 18 HE2 TYR 18 26.520 5.235 -1.313
132 HH TYR 18 HH TYR 18 24.213 5.206 0.223
133 H TYR 19 HN TYR 19 25.621 -0.183 -3.610
134 HA TYR 19 HA TYR 19 26.908 0.305 -1.148
135 1HB TYR 19 HB2 TYR 19 25.438 -2.122 -2.181
136 2HB TYR 19 HB1 TYR 19 26.020 -1.977 -0.528
137 HD1 TYR 19 HD1 TYR 19 23.377 -1.213 -2.821
138 HD2 TYR 19 HD2 TYR 19 25.087 -0.085 0.901
139 HE1 TYR 19 HE1 TYR 19 21.266 -0.111 -2.193
140 HE2 TYR 19 HE2 TYR 19 22.988 1.015 1.549
141 HH TYR 19 HH TYR 19 20.154 0.460 0.277
142 H ALA 20 HN ALA 20 27.761 -1.508 -3.913
143 HA ALA 20 HA ALA 20 29.734 -3.163 -2.619
144 1HB ALA 20 HB1 ALA 20 29.054 -2.707 -5.517
145 2HB ALA 20 HB2 ALA 20 28.466 -4.021 -4.493
146 3HB ALA 20 HB3 ALA 20 30.177 -3.931 -4.918
147 H SER 21 HN SER 21 29.680 -0.496 -4.928
148 HA SER 21 HA SER 21 32.485 -0.200 -5.115
149 1HB SER 21 HB2 SER 21 31.977 1.830 -6.354
150 2HB SER 21 HB1 SER 21 30.815 0.581 -6.826
151 HG SER 21 HG SER 21 29.334 1.937 -6.258
152 H LEU 22 HN LEU 22 29.964 1.196 -3.125
153 HA LEU 22 HA LEU 22 31.690 3.001 -1.706
154 1HB LEU 22 HB2 LEU 22 29.446 3.628 -1.641
155 2HB LEU 22 HB1 LEU 22 28.891 1.998 -1.320
156 HG LEU 22 HG LEU 22 30.232 2.430 0.957
157 1HD1 LEU 22 HD11 LEU 22 29.763 5.084 -0.232
158 2HD1 LEU 22 HD12 LEU 22 30.963 4.565 0.952
159 3HD1 LEU 22 HD13 LEU 22 29.308 4.901 1.461
160 1HD2 LEU 22 HD21 LEU 22 27.958 3.333 1.813
161 2HD2 LEU 22 HD22 LEU 22 28.036 1.715 1.117
162 3HD2 LEU 22 HD23 LEU 22 27.423 3.058 0.153
163 H ARG 23 HN ARG 23 30.634 -0.365 -1.313
164 HA ARG 23 HA ARG 23 31.865 -0.688 1.246
165 1HB ARG 23 HB2 ARG 23 30.329 -2.361 0.624
166 2HB ARG 23 HB1 ARG 23 31.125 -2.644 -0.916
167 1HG ARG 23 HG2 ARG 23 33.110 -3.211 0.883
168 2HG ARG 23 HG1 ARG 23 31.658 -3.785 1.712
169 1HD ARG 23 HD2 ARG 23 31.489 -4.569 -1.016
170 2HD ARG 23 HD1 ARG 23 33.086 -5.015 -0.414
171 HE ARG 23 HE ARG 23 32.100 -6.509 1.062
172 1HH1 ARG 23 HH11 ARG 23 29.650 -4.712 -0.671
173 2HH1 ARG 23 HH12 ARG 23 28.352 -5.754 -0.185
174 1HH2 ARG 23 HH21 ARG 23 30.418 -7.885 1.704
175 2HH2 ARG 23 HH22 ARG 23 28.790 -7.560 1.187
176 H HIS 24 HN HIS 24 33.043 -1.131 -2.073
177 HA HIS 24 HA HIS 24 35.650 -1.958 -1.420
178 1HB HIS 24 HB2 HIS 24 35.640 -2.133 -3.664
179 2HB HIS 24 HB1 HIS 24 34.220 -1.109 -3.783
180 HD1 HIS 24 HD1 HIS 24 34.638 1.446 -4.234
181 HD2 HIS 24 HD2 HIS 24 38.050 -0.931 -4.359
182 HE1 HIS 24 HE1 HIS 24 36.397 2.850 -5.353
183 HE2 HIS 24 HE2 HIS 24 38.390 1.322 -5.591
184 H TYR 25 HN TYR 25 34.154 1.186 -1.702
185 HA TYR 25 HA TYR 25 36.436 2.779 -1.290
186 1HB TYR 25 HB2 TYR 25 34.524 3.816 -2.201
187 2HB TYR 25 HB1 TYR 25 33.472 3.182 -0.945
188 HD1 TYR 25 HD1 TYR 25 32.634 4.755 0.485
189 HD2 TYR 25 HD2 TYR 25 36.548 5.306 -1.098
190 HE1 TYR 25 HE1 TYR 25 32.820 6.868 1.697
191 HE2 TYR 25 HE2 TYR 25 36.753 7.419 0.135
192 HH TYR 25 HH TYR 25 35.341 9.122 1.098
193 H LEU 26 HN LEU 26 33.996 1.482 0.900
194 HA LEU 26 HA LEU 26 34.959 2.529 3.296
195 1HB LEU 26 HB2 LEU 26 32.928 0.790 2.480
196 2HB LEU 26 HB1 LEU 26 33.889 -0.125 3.628
197 HG LEU 26 HG LEU 26 33.620 2.261 4.900
198 1HD1 LEU 26 HD11 LEU 26 31.133 2.690 4.796
199 2HD1 LEU 26 HD12 LEU 26 31.122 1.735 3.312
200 3HD1 LEU 26 HD13 LEU 26 32.068 3.221 3.398
201 1HD2 LEU 26 HD21 LEU 26 31.467 0.286 5.357
202 2HD2 LEU 26 HD22 LEU 26 32.588 1.026 6.499
203 3HD2 LEU 26 HD23 LEU 26 33.126 -0.301 5.471
204 H ASN 27 HN ASN 27 35.351 -0.749 2.049
205 HA ASN 27 HA ASN 27 37.287 -1.736 3.707
206 1HB ASN 27 HB2 ASN 27 36.160 -2.922 1.764
207 2HB ASN 27 HB1 ASN 27 37.369 -2.177 0.724
208 1HD2 ASN 27 HD21 ASN 27 39.135 -3.325 0.366
209 2HD2 ASN 27 HD22 ASN 27 39.743 -4.600 1.364
210 H LEU 28 HN LEU 28 37.750 0.567 1.060
211 HA LEU 28 HA LEU 28 40.588 0.546 1.238
212 1HB LEU 28 HB2 LEU 28 39.593 1.406 -0.783
213 2HB LEU 28 HB1 LEU 28 38.734 2.634 0.148
214 HG LEU 28 HG LEU 28 41.269 3.122 0.924
215 1HD1 LEU 28 HD11 LEU 28 42.749 2.210 -0.470
216 2HD1 LEU 28 HD12 LEU 28 42.075 3.179 -1.780
217 3HD1 LEU 28 HD13 LEU 28 41.465 1.551 -1.484
218 1HD2 LEU 28 HD21 LEU 28 39.620 4.268 -1.324
219 2HD2 LEU 28 HD22 LEU 28 41.172 4.966 -0.856
220 3HD2 LEU 28 HD23 LEU 28 39.850 4.888 0.311
221 H VAL 29 HN VAL 29 38.144 2.817 2.350
222 HA VAL 29 HA VAL 29 39.870 4.725 3.319
223 HB VAL 29 HB VAL 29 38.084 5.631 4.713
224 1HG1 VAL 29 HG11 VAL 29 38.115 5.373 1.956
225 2HG1 VAL 29 HG12 VAL 29 37.220 6.558 2.907
226 3HG1 VAL 29 HG13 VAL 29 36.443 5.053 2.420
227 1HG2 VAL 29 HG21 VAL 29 36.272 3.417 3.833
228 2HG2 VAL 29 HG22 VAL 29 36.039 4.609 5.113
229 3HG2 VAL 29 HG23 VAL 29 37.199 3.296 5.326
230 H THR 30 HN THR 30 39.041 1.689 4.718
231 HA THR 30 HA THR 30 39.831 1.987 7.359
232 HB THR 30 HB THR 30 40.434 -0.338 7.361
233 HG1 THR 30 HG1 THR 30 40.203 -0.654 4.594
234 1HG2 THR 30 HG21 THR 30 38.070 0.062 7.159
235 2HG2 THR 30 HG22 THR 30 38.496 -1.332 6.164
236 3HG2 THR 30 HG23 THR 30 38.213 0.238 5.409
237 H ARG 31 HN ARG 31 41.679 2.565 4.576
238 HA ARG 31 HA ARG 31 44.262 1.986 5.044
239 1HB ARG 31 HB2 ARG 31 42.891 3.822 3.458
240 2HB ARG 31 HB1 ARG 31 44.044 4.798 4.358
241 1HG ARG 31 HG2 ARG 31 45.704 4.125 3.062
242 2HG ARG 31 HG1 ARG 31 45.320 2.430 3.370
243 1HD ARG 31 HD2 ARG 31 43.668 2.441 1.609
244 2HD ARG 31 HD1 ARG 31 43.913 4.170 1.358
245 HE ARG 31 HE ARG 31 46.064 3.698 0.439
246 1HH1 ARG 31 HH11 ARG 31 44.151 0.839 1.112
247 2HH1 ARG 31 HH12 ARG 31 45.028 -0.165 -0.012
248 1HH2 ARG 31 HH21 ARG 31 47.213 2.404 -1.030
249 2HH2 ARG 31 HH22 ARG 31 46.806 0.718 -1.210
250 H GLN 32 HN GLN 32 42.769 4.999 6.206
251 HA GLN 32 HA GLN 32 44.577 4.929 8.532
252 1HB GLN 32 HB2 GLN 32 44.650 7.266 8.561
253 2HB GLN 32 HB1 GLN 32 44.715 6.884 6.849
254 1HG GLN 32 HG2 GLN 32 42.243 7.726 8.350
255 2HG GLN 32 HG1 GLN 32 43.240 8.774 7.340
256 1HE2 GLN 32 HE21 GLN 32 40.397 7.443 7.316
257 2HE2 GLN 32 HE22 GLN 32 40.226 6.996 5.651
258 H ARG 33 HN ARG 33 41.429 4.588 7.473
259 HA ARG 33 HA ARG 33 39.421 4.316 8.454
260 1HB ARG 33 HB2 ARG 33 41.275 3.982 10.745
261 2HB ARG 33 HB1 ARG 33 39.584 4.275 11.130
262 1HG ARG 33 HG2 ARG 33 39.008 2.202 10.587
263 2HG ARG 33 HG1 ARG 33 39.878 2.284 9.055
264 1HD ARG 33 HD2 ARG 33 41.082 1.672 11.751
265 2HD ARG 33 HD1 ARG 33 40.756 0.507 10.468
266 HE ARG 33 HE ARG 33 42.442 1.659 9.126
267 1HH1 ARG 33 HH11 ARG 33 42.460 2.246 12.589
268 2HH1 ARG 33 HH12 ARG 33 44.140 2.704 12.624
269 1HH2 ARG 33 HH21 ARG 33 44.632 2.297 9.171
270 2HH2 ARG 33 HH22 ARG 33 45.367 2.739 10.680
271 H TYR 34 HN TYR 34 40.338 6.002 11.337
272 HA TYR 34 HA TYR 34 39.669 7.962 12.251
273 1HB TYR 34 HB2 TYR 34 40.373 8.665 9.461
274 2HB TYR 34 HB1 TYR 34 39.426 9.856 10.347
275 HD1 TYR 34 HD1 TYR 34 40.484 11.343 11.787
276 HD2 TYR 34 HD2 TYR 34 42.516 7.791 10.617
277 HE1 TYR 34 HE1 TYR 34 42.519 12.146 12.903
278 HE2 TYR 34 HE2 TYR 34 44.553 8.582 11.736
279 HH TYR 34 HH TYR 34 44.637 11.735 13.380
280 1HN NH2 35 H1 NH2 35 36.165 7.098 11.440
281 2HN NH2 35 H2 NH2 35 37.593 6.224 11.870
Start of MODEL 15
1 1H ILE 1 HT1 ILE 1 30.842 9.494 5.995
2 2H ILE 1 HT2 ILE 1 30.168 8.630 4.700
3 3H ILE 1 HT3 ILE 1 31.710 8.233 5.272
4 HA ILE 1 HA ILE 1 30.932 6.888 6.804
5 HB ILE 1 HB ILE 1 28.548 8.423 7.647
6 1HG1 ILE 1 HG12 ILE 1 30.421 10.122 7.076
7 2HG1 ILE 1 HG11 ILE 1 29.625 10.236 8.640
8 1HG2 ILE 1 HG21 ILE 1 29.308 7.799 9.850
9 2HG2 ILE 1 HG22 ILE 1 30.838 7.226 9.189
10 3HG2 ILE 1 HG23 ILE 1 29.338 6.397 8.779
11 1HD1 ILE 1 HD11 ILE 1 32.254 10.355 8.357
12 2HD1 ILE 1 HD12 ILE 1 32.088 8.605 8.490
13 3HD1 ILE 1 HD13 ILE 1 31.491 9.648 9.779
14 H LYS 2 HN LYS 2 27.786 8.359 6.070
15 HA LYS 2 HA LYS 2 26.955 5.775 4.938
16 1HB LYS 2 HB2 LYS 2 25.739 6.483 6.977
17 2HB LYS 2 HB1 LYS 2 25.255 7.962 6.159
18 1HG LYS 2 HG2 LYS 2 24.422 5.976 4.438
19 2HG LYS 2 HG1 LYS 2 24.098 5.307 6.040
20 1HD LYS 2 HD2 LYS 2 22.208 6.509 5.999
21 2HD LYS 2 HD1 LYS 2 23.233 7.925 6.252
22 1HE LYS 2 HE2 LYS 2 23.483 7.903 3.681
23 2HE LYS 2 HE1 LYS 2 22.056 6.868 3.710
24 1HZ LYS 2 HZ1 LYS 2 22.087 9.611 3.753
25 2HZ LYS 2 HZ2 LYS 2 21.722 9.178 5.351
26 3HZ LYS 2 HZ3 LYS 2 20.755 8.615 4.079
27 HA PRO 3 HA PRO 3 26.585 8.065 1.100
28 1HB PRO 3 HB2 PRO 3 25.831 5.986 -0.432
29 2HB PRO 3 HB1 PRO 3 27.495 6.163 0.137
30 1HG PRO 3 HG2 PRO 3 25.300 4.432 1.212
31 2HG PRO 3 HG1 PRO 3 27.011 4.042 0.955
32 1HD PRO 3 HD2 PRO 3 25.963 4.719 3.386
33 2HD PRO 3 HD1 PRO 3 27.653 5.011 2.932
34 H GLU 4 HN GLU 4 24.879 9.263 0.499
35 HA GLU 4 HA GLU 4 22.279 8.800 1.498
36 1HB GLU 4 HB2 GLU 4 22.846 10.572 -0.863
37 2HB GLU 4 HB1 GLU 4 21.646 10.779 0.404
38 1HG GLU 4 HG2 GLU 4 24.620 11.025 0.800
39 2HG GLU 4 HG1 GLU 4 23.517 12.374 0.547
40 H ALA 5 HN ALA 5 20.695 7.584 0.759
41 HA ALA 5 HA ALA 5 21.053 5.734 -1.298
42 1HB ALA 5 HB1 ALA 5 19.080 6.315 0.659
43 2HB ALA 5 HB2 ALA 5 19.315 4.832 -0.267
44 3HB ALA 5 HB3 ALA 5 18.270 6.107 -0.895
45 HA PRO 6 HA PRO 6 20.056 7.974 -4.991
46 1HB PRO 6 HB2 PRO 6 19.239 5.390 -6.121
47 2HB PRO 6 HB1 PRO 6 20.569 6.448 -6.594
48 1HG PRO 6 HG2 PRO 6 21.007 4.104 -5.366
49 2HG PRO 6 HG1 PRO 6 22.030 5.522 -5.063
50 1HD PRO 6 HD2 PRO 6 19.790 4.414 -3.406
51 2HD PRO 6 HD1 PRO 6 21.379 5.022 -2.889
52 H GLY 7 HN GLY 7 17.937 5.515 -5.941
53 1HA GLY 7 HA2 GLY 7 15.533 5.565 -5.053
54 2HA GLY 7 HA1 GLY 7 15.635 7.281 -5.424
55 H GLU 8 HN GLU 8 17.205 6.915 -7.817
56 HA GLU 8 HA GLU 8 15.045 6.021 -9.590
57 1HB GLU 8 HB2 GLU 8 16.774 8.286 -9.569
58 2HB GLU 8 HB1 GLU 8 17.152 7.339 -11.001
59 1HG GLU 8 HG2 GLU 8 14.323 8.047 -10.326
60 2HG GLU 8 HG1 GLU 8 15.376 9.187 -11.164
61 H ASP 9 HN ASP 9 17.401 4.520 -8.205
62 HA ASP 9 HA ASP 9 18.087 2.805 -10.357
63 1HB ASP 9 HB2 ASP 9 20.626 3.221 -9.987
64 2HB ASP 9 HB1 ASP 9 19.739 4.301 -11.055
65 H ALA 10 HN ALA 10 17.423 1.172 -9.157
66 HA ALA 10 HA ALA 10 19.214 -0.094 -7.448
67 1HB ALA 10 HB1 ALA 10 16.889 0.326 -5.739
68 2HB ALA 10 HB2 ALA 10 17.822 1.798 -6.036
69 3HB ALA 10 HB3 ALA 10 18.612 0.375 -5.348
70 H SER 11 HN SER 11 16.412 0.100 -9.240
71 HA SER 11 HA SER 11 15.017 -2.174 -8.274
72 1HB SER 11 HB2 SER 11 14.745 -0.895 -10.978
73 2HB SER 11 HB1 SER 11 13.541 -1.868 -10.135
74 HG SER 11 HG SER 11 13.629 0.670 -10.077
75 HA PRO 12 HA PRO 12 17.114 -4.657 -11.797
76 1HB PRO 12 HB2 PRO 12 19.089 -2.865 -13.008
77 2HB PRO 12 HB1 PRO 12 17.839 -3.835 -13.789
78 1HG PRO 12 HG2 PRO 12 17.680 -1.159 -13.706
79 2HG PRO 12 HG1 PRO 12 16.235 -2.181 -13.577
80 1HD PRO 12 HD2 PRO 12 17.805 -0.858 -11.384
81 2HD PRO 12 HD1 PRO 12 16.046 -0.884 -11.648
82 H GLU 13 HN GLU 13 17.996 -3.376 -9.223
83 HA GLU 13 HA GLU 13 19.357 -3.997 -7.580
84 1HB GLU 13 HB2 GLU 13 19.815 -6.020 -9.500
85 2HB GLU 13 HB1 GLU 13 21.389 -5.535 -8.892
86 1HG GLU 13 HG2 GLU 13 19.488 -7.248 -7.702
87 2HG GLU 13 HG1 GLU 13 21.072 -6.778 -7.097
88 H GLU 14 HN GLU 14 19.747 -1.641 -9.084
89 HA GLU 14 HA GLU 14 22.553 -1.151 -9.116
90 1HB GLU 14 HB2 GLU 14 20.149 0.640 -9.044
91 2HB GLU 14 HB1 GLU 14 21.770 1.297 -8.854
92 1HG GLU 14 HG2 GLU 14 21.691 1.503 -11.076
93 2HG GLU 14 HG1 GLU 14 22.098 -0.213 -11.066
94 H LEU 15 HN LEU 15 20.167 -1.457 -6.700
95 HA LEU 15 HA LEU 15 21.363 -0.049 -4.580
96 1HB LEU 15 HB2 LEU 15 19.030 -1.147 -4.720
97 2HB LEU 15 HB1 LEU 15 19.847 -2.624 -4.244
98 HG LEU 15 HG LEU 15 20.739 -1.092 -2.274
99 1HD1 LEU 15 HD11 LEU 15 19.861 0.987 -2.688
100 2HD1 LEU 15 HD12 LEU 15 18.640 0.306 -1.613
101 3HD1 LEU 15 HD13 LEU 15 18.360 0.341 -3.356
102 1HD2 LEU 15 HD21 LEU 15 19.623 -2.799 -1.362
103 2HD2 LEU 15 HD22 LEU 15 18.406 -2.803 -2.637
104 3HD2 LEU 15 HD23 LEU 15 18.259 -1.685 -1.282
105 H ASN 16 HN ASN 16 21.803 -3.314 -5.839
106 HA ASN 16 HA ASN 16 23.572 -4.267 -3.902
107 1HB ASN 16 HB2 ASN 16 22.687 -5.088 -6.503
108 2HB ASN 16 HB1 ASN 16 24.435 -5.292 -6.391
109 1HD2 ASN 16 HD21 ASN 16 21.429 -5.954 -4.662
110 2HD2 ASN 16 HD22 ASN 16 21.951 -7.464 -3.983
111 H ARG 17 HN ARG 17 24.162 -2.318 -6.803
112 HA ARG 17 HA ARG 17 26.999 -2.289 -6.347
113 1HB ARG 17 HB2 ARG 17 25.347 -0.523 -8.140
114 2HB ARG 17 HB1 ARG 17 27.107 -0.577 -8.076
115 1HG ARG 17 HG2 ARG 17 27.168 -2.293 -9.479
116 2HG ARG 17 HG1 ARG 17 26.027 -3.214 -8.495
117 1HD ARG 17 HD2 ARG 17 24.159 -2.189 -9.583
118 2HD ARG 17 HD1 ARG 17 25.208 -1.052 -10.431
119 HE ARG 17 HE ARG 17 24.955 -3.930 -10.985
120 1HH1 ARG 17 HH11 ARG 17 26.134 -0.754 -11.882
121 2HH1 ARG 17 HH12 ARG 17 26.621 -1.237 -13.477
122 1HH2 ARG 17 HH21 ARG 17 25.573 -4.577 -13.079
123 2HH2 ARG 17 HH22 ARG 17 26.290 -3.412 -14.168
124 H TYR 18 HN TYR 18 24.319 -0.513 -5.121
125 HA TYR 18 HA TYR 18 25.864 1.768 -4.374
126 1HB TYR 18 HB2 TYR 18 23.808 2.535 -3.867
127 2HB TYR 18 HB1 TYR 18 23.128 0.926 -4.060
128 HD1 TYR 18 HD1 TYR 18 25.054 2.912 -1.523
129 HD2 TYR 18 HD2 TYR 18 22.055 -0.001 -2.277
130 HE1 TYR 18 HE1 TYR 18 24.583 2.787 0.886
131 HE2 TYR 18 HE2 TYR 18 21.563 -0.135 0.111
132 HH TYR 18 HH TYR 18 21.821 1.091 2.126
133 H TYR 19 HN TYR 19 25.005 -1.321 -2.925
134 HA TYR 19 HA TYR 19 26.499 -1.001 -0.537
135 1HB TYR 19 HB2 TYR 19 25.437 -3.366 -2.050
136 2HB TYR 19 HB1 TYR 19 26.486 -3.599 -0.658
137 HD1 TYR 19 HD1 TYR 19 25.732 -2.921 1.587
138 HD2 TYR 19 HD2 TYR 19 23.168 -2.673 -1.799
139 HE1 TYR 19 HE1 TYR 19 23.786 -2.763 3.085
140 HE2 TYR 19 HE2 TYR 19 21.211 -2.519 -0.305
141 HH TYR 19 HH TYR 19 20.831 -3.394 2.326
142 H ALA 20 HN ALA 20 27.296 -1.830 -3.761
143 HA ALA 20 HA ALA 20 29.761 -3.187 -3.172
144 1HB ALA 20 HB1 ALA 20 29.975 -3.336 -5.598
145 2HB ALA 20 HB2 ALA 20 28.592 -2.248 -5.786
146 3HB ALA 20 HB3 ALA 20 28.372 -3.845 -5.062
147 H SER 21 HN SER 21 28.886 -0.215 -4.886
148 HA SER 21 HA SER 21 31.561 0.700 -5.084
149 1HB SER 21 HB2 SER 21 28.849 1.736 -5.756
150 2HB SER 21 HB1 SER 21 30.156 2.925 -5.600
151 HG SER 21 HG SER 21 30.506 2.330 -7.615
152 H LEU 22 HN LEU 22 28.955 1.169 -2.760
153 HA LEU 22 HA LEU 22 30.400 3.066 -1.158
154 1HB LEU 22 HB2 LEU 22 28.306 3.143 -0.346
155 2HB LEU 22 HB1 LEU 22 27.924 1.529 -0.906
156 HG LEU 22 HG LEU 22 29.346 0.778 1.157
157 1HD1 LEU 22 HD11 LEU 22 29.015 2.374 3.056
158 2HD1 LEU 22 HD12 LEU 22 28.603 3.604 1.859
159 3HD1 LEU 22 HD13 LEU 22 30.210 2.876 1.858
160 1HD2 LEU 22 HD21 LEU 22 26.674 1.974 1.766
161 2HD2 LEU 22 HD22 LEU 22 27.379 0.466 2.349
162 3HD2 LEU 22 HD23 LEU 22 26.832 0.596 0.677
163 H ARG 23 HN ARG 23 30.273 -0.476 -1.406
164 HA ARG 23 HA ARG 23 32.025 -0.854 0.823
165 1HB ARG 23 HB2 ARG 23 30.575 -2.559 -0.740
166 2HB ARG 23 HB1 ARG 23 32.219 -2.876 -1.285
167 1HG ARG 23 HG2 ARG 23 32.120 -4.354 0.434
168 2HG ARG 23 HG1 ARG 23 32.684 -2.928 1.323
169 1HD ARG 23 HD2 ARG 23 30.868 -3.023 2.611
170 2HD ARG 23 HD1 ARG 23 29.848 -2.810 1.190
171 HE ARG 23 HE ARG 23 30.307 -5.233 2.657
172 1HH1 ARG 23 HH11 ARG 23 29.441 -3.943 -0.494
173 2HH1 ARG 23 HH12 ARG 23 28.625 -5.394 -0.999
174 1HH2 ARG 23 HH21 ARG 23 29.192 -7.111 2.001
175 2HH2 ARG 23 HH22 ARG 23 28.495 -7.184 0.412
176 H HIS 24 HN HIS 24 32.566 0.031 -2.488
177 HA HIS 24 HA HIS 24 35.357 -0.492 -2.547
178 1HB HIS 24 HB2 HIS 24 33.575 0.357 -4.411
179 2HB HIS 24 HB1 HIS 24 34.358 1.884 -4.015
180 HD1 HIS 24 HD1 HIS 24 36.768 2.230 -4.836
181 HD2 HIS 24 HD2 HIS 24 35.257 -1.569 -5.631
182 HE1 HIS 24 HE1 HIS 24 38.404 1.160 -6.419
183 HE2 HIS 24 HE2 HIS 24 37.407 -1.088 -6.983
184 H TYR 25 HN TYR 25 33.415 2.348 -1.753
185 HA TYR 25 HA TYR 25 35.523 3.995 -0.889
186 1HB TYR 25 HB2 TYR 25 33.626 5.237 -1.136
187 2HB TYR 25 HB1 TYR 25 32.580 3.935 -0.593
188 HD1 TYR 25 HD1 TYR 25 31.406 4.344 1.309
189 HD2 TYR 25 HD2 TYR 25 35.253 6.102 0.883
190 HE1 TYR 25 HE1 TYR 25 31.133 5.436 3.478
191 HE2 TYR 25 HE2 TYR 25 35.006 7.199 3.056
192 HH TYR 25 HH TYR 25 33.246 6.418 5.328
193 H LEU 26 HN LEU 26 33.385 1.796 0.925
194 HA LEU 26 HA LEU 26 34.465 2.127 3.461
195 1HB LEU 26 HB2 LEU 26 33.245 -0.278 2.122
196 2HB LEU 26 HB1 LEU 26 33.779 -0.318 3.792
197 HG LEU 26 HG LEU 26 31.648 1.486 2.656
198 1HD1 LEU 26 HD11 LEU 26 30.069 0.121 3.602
199 2HD1 LEU 26 HD12 LEU 26 31.203 -0.579 4.754
200 3HD1 LEU 26 HD13 LEU 26 31.261 -1.059 3.060
201 1HD2 LEU 26 HD21 LEU 26 32.169 1.167 5.573
202 2HD2 LEU 26 HD22 LEU 26 31.421 2.505 4.699
203 3HD2 LEU 26 HD23 LEU 26 33.169 2.278 4.638
204 H ASN 27 HN ASN 27 35.230 -0.452 1.151
205 HA ASN 27 HA ASN 27 37.401 -1.671 2.109
206 1HB ASN 27 HB2 ASN 27 36.387 -1.172 -0.483
207 2HB ASN 27 HB1 ASN 27 38.117 -0.862 -0.550
208 1HD2 ASN 27 HD21 ASN 27 35.746 -3.167 -0.713
209 2HD2 ASN 27 HD22 ASN 27 36.728 -4.584 -0.549
210 H LEU 28 HN LEU 28 37.592 1.499 0.469
211 HA LEU 28 HA LEU 28 40.377 1.772 0.974
212 1HB LEU 28 HB2 LEU 28 39.418 3.085 -0.808
213 2HB LEU 28 HB1 LEU 28 38.322 3.872 0.338
214 HG LEU 28 HG LEU 28 40.709 4.368 1.514
215 1HD1 LEU 28 HD11 LEU 28 41.301 4.893 -1.394
216 2HD1 LEU 28 HD12 LEU 28 41.721 3.347 -0.657
217 3HD1 LEU 28 HD13 LEU 28 42.403 4.843 -0.018
218 1HD2 LEU 28 HD21 LEU 28 40.302 6.604 0.989
219 2HD2 LEU 28 HD22 LEU 28 38.709 5.871 0.792
220 3HD2 LEU 28 HD23 LEU 28 39.697 6.230 -0.626
221 H VAL 29 HN VAL 29 37.573 3.336 2.355
222 HA VAL 29 HA VAL 29 38.930 5.169 3.897
223 HB VAL 29 HB VAL 29 36.540 5.314 3.285
224 1HG1 VAL 29 HG11 VAL 29 35.203 4.178 5.408
225 2HG1 VAL 29 HG12 VAL 29 36.364 2.937 4.925
226 3HG1 VAL 29 HG13 VAL 29 35.228 3.592 3.741
227 1HG2 VAL 29 HG21 VAL 29 37.588 5.888 5.984
228 2HG2 VAL 29 HG22 VAL 29 35.847 6.051 5.746
229 3HG2 VAL 29 HG23 VAL 29 36.963 6.979 4.745
230 H THR 30 HN THR 30 38.402 1.837 4.537
231 HA THR 30 HA THR 30 38.798 1.704 7.292
232 HB THR 30 HB THR 30 39.640 -0.538 6.946
233 HG1 THR 30 HG1 THR 30 39.723 -0.151 4.142
234 1HG2 THR 30 HG21 THR 30 37.896 -1.467 5.513
235 2HG2 THR 30 HG22 THR 30 37.601 0.137 4.830
236 3HG2 THR 30 HG23 THR 30 37.248 -0.179 6.533
237 H ARG 31 HN ARG 31 40.894 2.748 4.816
238 HA ARG 31 HA ARG 31 43.438 2.263 5.505
239 1HB ARG 31 HB2 ARG 31 42.288 3.952 3.788
240 2HB ARG 31 HB1 ARG 31 42.857 5.115 4.981
241 1HG ARG 31 HG2 ARG 31 44.899 5.001 4.151
242 2HG ARG 31 HG1 ARG 31 44.948 3.263 4.450
243 1HD ARG 31 HD2 ARG 31 44.208 2.749 2.308
244 2HD ARG 31 HD1 ARG 31 43.526 4.355 2.056
245 HE ARG 31 HE ARG 31 45.908 5.148 2.012
246 1HH1 ARG 31 HH11 ARG 31 45.050 1.866 1.099
247 2HH1 ARG 31 HH12 ARG 31 46.451 1.647 0.091
248 1HH2 ARG 31 HH21 ARG 31 47.738 4.867 0.690
249 2HH2 ARG 31 HH22 ARG 31 48.000 3.351 -0.126
250 H GLN 32 HN GLN 32 41.605 5.004 6.797
251 HA GLN 32 HA GLN 32 43.201 4.858 9.261
252 1HB GLN 32 HB2 GLN 32 43.427 7.217 9.359
253 2HB GLN 32 HB1 GLN 32 43.851 6.764 7.716
254 1HG GLN 32 HG2 GLN 32 41.222 7.929 8.612
255 2HG GLN 32 HG1 GLN 32 42.504 8.783 7.752
256 1HE2 GLN 32 HE21 GLN 32 39.593 7.430 7.370
257 2HE2 GLN 32 HE22 GLN 32 39.683 6.962 5.703
258 H ARG 33 HN ARG 33 40.244 4.645 7.868
259 HA ARG 33 HA ARG 33 38.086 4.801 8.476
260 1HB ARG 33 HB2 ARG 33 39.503 3.754 10.723
261 2HB ARG 33 HB1 ARG 33 38.203 4.784 11.311
262 1HG ARG 33 HG2 ARG 33 36.573 3.404 10.544
263 2HG ARG 33 HG1 ARG 33 37.524 2.869 9.158
264 1HD ARG 33 HD2 ARG 33 37.039 1.413 11.442
265 2HD ARG 33 HD1 ARG 33 38.303 1.088 10.257
266 HE ARG 33 HE ARG 33 38.757 2.778 12.637
267 1HH1 ARG 33 HH11 ARG 33 39.683 0.136 10.533
268 2HH1 ARG 33 HH12 ARG 33 41.200 -0.140 11.321
269 1HH2 ARG 33 HH21 ARG 33 40.772 2.422 13.675
270 2HH2 ARG 33 HH22 ARG 33 41.817 1.150 13.115
271 H TYR 34 HN TYR 34 38.107 6.099 11.536
272 HA TYR 34 HA TYR 34 37.731 8.811 10.457
273 1HB TYR 34 HB2 TYR 34 36.151 7.601 12.734
274 2HB TYR 34 HB1 TYR 34 35.857 9.142 11.931
275 HD1 TYR 34 HD1 TYR 34 35.656 8.782 9.216
276 HD2 TYR 34 HD2 TYR 34 34.638 5.942 12.218
277 HE1 TYR 34 HE1 TYR 34 34.151 7.662 7.630
278 HE2 TYR 34 HE2 TYR 34 33.124 4.811 10.641
279 HH TYR 34 HH TYR 34 32.921 4.597 8.104
280 1HN NH2 35 H1 NH2 35 39.323 10.286 13.244
281 2HN NH2 35 H2 NH2 35 38.239 10.547 11.922
Start of MODEL 16
1 1H ILE 1 HT1 ILE 1 33.930 10.713 0.778
2 2H ILE 1 HT2 ILE 1 33.843 10.079 -0.792
3 3H ILE 1 HT3 ILE 1 33.407 9.122 0.536
4 HA ILE 1 HA ILE 1 31.928 11.530 0.514
5 HB ILE 1 HB ILE 1 32.419 11.056 -2.002
6 1HG1 ILE 1 HG12 ILE 1 29.704 11.389 -2.263
7 2HG1 ILE 1 HG11 ILE 1 29.983 11.890 -0.598
8 1HG2 ILE 1 HG21 ILE 1 30.133 9.136 -1.683
9 2HG2 ILE 1 HG22 ILE 1 31.813 8.603 -1.722
10 3HG2 ILE 1 HG23 ILE 1 31.122 9.442 -3.112
11 1HD1 ILE 1 HD11 ILE 1 31.794 12.971 -2.677
12 2HD1 ILE 1 HD12 ILE 1 31.167 13.725 -1.209
13 3HD1 ILE 1 HD13 ILE 1 30.136 13.572 -2.633
14 H LYS 2 HN LYS 2 29.656 11.002 0.934
15 HA LYS 2 HA LYS 2 29.369 8.300 2.061
16 1HB LYS 2 HB2 LYS 2 28.873 10.914 3.154
17 2HB LYS 2 HB1 LYS 2 27.366 10.008 3.094
18 1HG LYS 2 HG2 LYS 2 28.662 8.121 4.222
19 2HG LYS 2 HG1 LYS 2 29.896 9.340 4.554
20 1HD LYS 2 HD2 LYS 2 28.674 10.289 6.179
21 2HD LYS 2 HD1 LYS 2 27.190 10.208 5.227
22 1HE LYS 2 HE2 LYS 2 27.856 7.563 5.930
23 2HE LYS 2 HE1 LYS 2 28.053 8.538 7.385
24 1HZ LYS 2 HZ1 LYS 2 25.781 9.436 6.915
25 2HZ LYS 2 HZ2 LYS 2 25.832 7.796 7.344
26 3HZ LYS 2 HZ3 LYS 2 25.618 8.241 5.721
27 HA PRO 3 HA PRO 3 26.277 7.727 -1.119
28 1HB PRO 3 HB2 PRO 3 25.465 5.423 0.529
29 2HB PRO 3 HB1 PRO 3 26.030 5.462 -1.143
30 1HG PRO 3 HG2 PRO 3 27.563 4.490 0.823
31 2HG PRO 3 HG1 PRO 3 28.252 5.395 -0.538
32 1HD PRO 3 HD2 PRO 3 27.691 6.318 2.260
33 2HD PRO 3 HD1 PRO 3 29.094 6.655 1.222
34 H GLU 4 HN GLU 4 24.068 8.014 -1.330
35 HA GLU 4 HA GLU 4 22.726 9.141 0.956
36 1HB GLU 4 HB2 GLU 4 22.546 9.464 -1.828
37 2HB GLU 4 HB1 GLU 4 21.005 8.782 -1.329
38 1HG GLU 4 HG2 GLU 4 21.581 10.786 0.535
39 2HG GLU 4 HG1 GLU 4 21.995 11.458 -1.041
40 H ALA 5 HN ALA 5 23.125 6.158 -0.318
41 HA ALA 5 HA ALA 5 22.312 4.092 0.109
42 1HB ALA 5 HB1 ALA 5 22.699 5.247 2.458
43 2HB ALA 5 HB2 ALA 5 22.038 3.619 2.305
44 3HB ALA 5 HB3 ALA 5 20.958 4.987 2.583
45 HA PRO 6 HA PRO 6 18.027 4.642 -1.521
46 1HB PRO 6 HB2 PRO 6 18.974 2.278 -3.033
47 2HB PRO 6 HB1 PRO 6 18.145 3.726 -3.613
48 1HG PRO 6 HG2 PRO 6 20.737 3.335 -4.109
49 2HG PRO 6 HG1 PRO 6 20.104 4.953 -3.753
50 1HD PRO 6 HD2 PRO 6 21.589 3.063 -1.964
51 2HD PRO 6 HD1 PRO 6 21.758 4.824 -2.126
52 H GLY 7 HN GLY 7 16.362 2.834 -1.654
53 1HA GLY 7 HA2 GLY 7 16.349 1.544 0.884
54 2HA GLY 7 HA1 GLY 7 15.102 1.429 -0.345
55 H GLU 8 HN GLU 8 18.158 0.122 0.750
56 HA GLU 8 HA GLU 8 18.744 -2.053 1.066
57 1HB GLU 8 HB2 GLU 8 15.995 -2.311 0.370
58 2HB GLU 8 HB1 GLU 8 16.900 -3.546 -0.494
59 1HG GLU 8 HG2 GLU 8 16.392 -4.639 1.447
60 2HG GLU 8 HG1 GLU 8 17.983 -3.982 1.834
61 H ASP 9 HN ASP 9 17.385 -1.621 -2.116
62 HA ASP 9 HA ASP 9 19.784 -2.035 -3.548
63 1HB ASP 9 HB2 ASP 9 18.950 -4.415 -2.594
64 2HB ASP 9 HB1 ASP 9 17.966 -4.343 -4.050
65 H ALA 10 HN ALA 10 19.138 -0.322 -4.692
66 HA ALA 10 HA ALA 10 16.527 0.260 -5.502
67 1HB ALA 10 HB1 ALA 10 18.766 1.381 -7.074
68 2HB ALA 10 HB2 ALA 10 18.765 1.689 -5.338
69 3HB ALA 10 HB3 ALA 10 17.389 2.186 -6.324
70 H SER 11 HN SER 11 15.472 0.180 -7.464
71 HA SER 11 HA SER 11 14.750 -0.734 -9.413
72 1HB SER 11 HB2 SER 11 17.643 -0.865 -10.248
73 2HB SER 11 HB1 SER 11 16.228 -0.534 -11.246
74 HG SER 11 HG SER 11 16.614 1.234 -9.157
75 HA PRO 12 HA PRO 12 15.563 -5.216 -9.644
76 1HB PRO 12 HB2 PRO 12 16.325 -5.222 -12.479
77 2HB PRO 12 HB1 PRO 12 14.940 -5.981 -11.691
78 1HG PRO 12 HG2 PRO 12 14.679 -3.848 -13.313
79 2HG PRO 12 HG1 PRO 12 13.616 -4.117 -11.921
80 1HD PRO 12 HD2 PRO 12 15.953 -2.267 -12.196
81 2HD PRO 12 HD1 PRO 12 14.387 -1.997 -11.398
82 H GLU 13 HN GLU 13 17.567 -4.308 -8.440
83 HA GLU 13 HA GLU 13 19.675 -4.850 -7.815
84 1HB GLU 13 HB2 GLU 13 19.509 -6.499 -10.311
85 2HB GLU 13 HB1 GLU 13 21.054 -6.289 -9.498
86 1HG GLU 13 HG2 GLU 13 20.384 -7.452 -7.626
87 2HG GLU 13 HG1 GLU 13 18.671 -7.172 -7.937
88 H GLU 14 HN GLU 14 19.134 -2.423 -8.863
89 HA GLU 14 HA GLU 14 21.644 -1.815 -10.260
90 1HB GLU 14 HB2 GLU 14 18.985 -0.834 -10.691
91 2HB GLU 14 HB1 GLU 14 20.010 0.495 -10.171
92 1HG GLU 14 HG2 GLU 14 20.339 -1.270 -12.572
93 2HG GLU 14 HG1 GLU 14 20.099 0.473 -12.524
94 H LEU 15 HN LEU 15 22.516 0.389 -9.565
95 HA LEU 15 HA LEU 15 23.431 1.706 -7.960
96 1HB LEU 15 HB2 LEU 15 20.794 1.050 -6.776
97 2HB LEU 15 HB1 LEU 15 22.019 1.644 -5.674
98 HG LEU 15 HG LEU 15 20.706 3.506 -6.361
99 1HD1 LEU 15 HD11 LEU 15 22.346 4.974 -7.067
100 2HD1 LEU 15 HD12 LEU 15 23.128 3.771 -8.091
101 3HD1 LEU 15 HD13 LEU 15 23.267 3.657 -6.335
102 1HD2 LEU 15 HD21 LEU 15 21.252 2.638 -9.199
103 2HD2 LEU 15 HD22 LEU 15 20.444 4.133 -8.725
104 3HD2 LEU 15 HD23 LEU 15 19.702 2.577 -8.357
105 H ASN 16 HN ASN 16 22.789 -1.573 -7.483
106 HA ASN 16 HA ASN 16 23.863 -2.134 -5.006
107 1HB ASN 16 HB2 ASN 16 22.719 -3.787 -6.454
108 2HB ASN 16 HB1 ASN 16 24.110 -3.794 -7.527
109 1HD2 ASN 16 HD21 ASN 16 22.749 -4.969 -4.610
110 2HD2 ASN 16 HD22 ASN 16 24.060 -6.031 -4.183
111 H ARG 17 HN ARG 17 25.565 -1.963 -8.126
112 HA ARG 17 HA ARG 17 28.105 -2.315 -6.858
113 1HB ARG 17 HB2 ARG 17 28.497 -1.077 -9.364
114 2HB ARG 17 HB1 ARG 17 28.802 -2.741 -8.902
115 1HG ARG 17 HG2 ARG 17 27.396 -3.037 -10.696
116 2HG ARG 17 HG1 ARG 17 26.242 -3.044 -9.365
117 1HD ARG 17 HD2 ARG 17 25.605 -1.645 -11.370
118 2HD ARG 17 HD1 ARG 17 25.565 -0.822 -9.813
119 HE ARG 17 HE ARG 17 28.089 -0.445 -11.025
120 1HH1 ARG 17 HH11 ARG 17 24.732 0.530 -11.452
121 2HH1 ARG 17 HH12 ARG 17 25.150 2.072 -12.123
122 1HH2 ARG 17 HH21 ARG 17 28.613 1.567 -11.924
123 2HH2 ARG 17 HH22 ARG 17 27.350 2.663 -12.412
124 H TYR 18 HN TYR 18 26.040 0.229 -6.751
125 HA TYR 18 HA TYR 18 28.082 2.286 -7.021
126 1HB TYR 18 HB2 TYR 18 26.132 3.287 -7.682
127 2HB TYR 18 HB1 TYR 18 25.134 2.226 -6.706
128 HD1 TYR 18 HD1 TYR 18 27.369 5.207 -6.475
129 HD2 TYR 18 HD2 TYR 18 24.199 2.988 -4.724
130 HE1 TYR 18 HE1 TYR 18 26.957 7.045 -4.896
131 HE2 TYR 18 HE2 TYR 18 23.770 4.807 -3.146
132 HH TYR 18 HH TYR 18 25.364 7.911 -3.462
133 H TYR 19 HN TYR 19 26.103 0.663 -4.582
134 HA TYR 19 HA TYR 19 27.783 1.770 -2.500
135 1HB TYR 19 HB2 TYR 19 26.248 -0.180 -1.285
136 2HB TYR 19 HB1 TYR 19 25.931 1.543 -1.298
137 HD1 TYR 19 HD1 TYR 19 24.267 2.464 -2.880
138 HD2 TYR 19 HD2 TYR 19 24.869 -1.714 -2.433
139 HE1 TYR 19 HE1 TYR 19 22.034 2.046 -3.819
140 HE2 TYR 19 HE2 TYR 19 22.648 -2.147 -3.389
141 HH TYR 19 HH TYR 19 21.027 -1.037 -4.839
142 H ALA 20 HN ALA 20 28.052 -0.740 -4.645
143 HA ALA 20 HA ALA 20 29.500 -2.500 -2.838
144 1HB ALA 20 HB1 ALA 20 28.697 -2.605 -5.709
145 2HB ALA 20 HB2 ALA 20 28.407 -3.774 -4.420
146 3HB ALA 20 HB3 ALA 20 30.013 -3.631 -5.136
147 H SER 21 HN SER 21 30.147 -0.484 -5.689
148 HA SER 21 HA SER 21 32.962 -0.611 -5.471
149 1HB SER 21 HB2 SER 21 32.964 1.240 -7.045
150 2HB SER 21 HB1 SER 21 31.668 0.126 -7.512
151 HG SER 21 HG SER 21 30.233 1.593 -7.061
152 H LEU 22 HN LEU 22 30.439 1.422 -4.094
153 HA LEU 22 HA LEU 22 32.205 3.137 -2.648
154 1HB LEU 22 HB2 LEU 22 29.347 2.759 -2.889
155 2HB LEU 22 HB1 LEU 22 29.813 3.001 -1.217
156 HG LEU 22 HG LEU 22 30.451 5.177 -1.556
157 1HD1 LEU 22 HD11 LEU 22 31.979 4.322 -3.540
158 2HD1 LEU 22 HD12 LEU 22 31.592 6.031 -3.330
159 3HD1 LEU 22 HD13 LEU 22 30.707 5.064 -4.510
160 1HD2 LEU 22 HD21 LEU 22 28.793 5.508 -3.892
161 2HD2 LEU 22 HD22 LEU 22 28.530 6.044 -2.236
162 3HD2 LEU 22 HD23 LEU 22 28.056 4.415 -2.721
163 H ARG 23 HN ARG 23 30.765 -0.020 -2.024
164 HA ARG 23 HA ARG 23 31.439 -0.101 0.735
165 1HB ARG 23 HB2 ARG 23 29.843 -1.676 -0.336
166 2HB ARG 23 HB1 ARG 23 31.195 -2.441 -1.159
167 1HG ARG 23 HG2 ARG 23 31.242 -3.829 0.583
168 2HG ARG 23 HG1 ARG 23 32.007 -2.491 1.451
169 1HD ARG 23 HD2 ARG 23 29.978 -3.628 2.536
170 2HD ARG 23 HD1 ARG 23 30.013 -1.867 2.485
171 HE ARG 23 HE ARG 23 28.672 -2.652 0.213
172 1HH1 ARG 23 HH11 ARG 23 28.230 -3.079 3.671
173 2HH1 ARG 23 HH12 ARG 23 26.497 -3.148 3.551
174 1HH2 ARG 23 HH21 ARG 23 26.384 -2.747 0.080
175 2HH2 ARG 23 HH22 ARG 23 25.455 -2.955 1.542
176 H HIS 24 HN HIS 24 33.164 -1.140 -2.198
177 HA HIS 24 HA HIS 24 35.419 -2.178 -0.871
178 1HB HIS 24 HB2 HIS 24 34.679 -2.070 -3.475
179 2HB HIS 24 HB1 HIS 24 35.908 -0.808 -3.453
180 HD1 HIS 24 HD1 HIS 24 35.801 -4.041 -4.495
181 HD2 HIS 24 HD2 HIS 24 38.185 -2.185 -1.633
182 HE1 HIS 24 HE1 HIS 24 37.838 -5.498 -4.252
183 HE2 HIS 24 HE2 HIS 24 39.148 -4.469 -2.363
184 H TYR 25 HN TYR 25 34.668 1.054 -2.075
185 HA TYR 25 HA TYR 25 37.007 2.343 -1.199
186 1HB TYR 25 HB2 TYR 25 35.711 3.630 -2.637
187 2HB TYR 25 HB1 TYR 25 34.212 3.199 -1.825
188 HD1 TYR 25 HD1 TYR 25 33.171 4.854 -0.626
189 HD2 TYR 25 HD2 TYR 25 37.397 4.987 -1.054
190 HE1 TYR 25 HE1 TYR 25 33.215 6.988 0.584
191 HE2 TYR 25 HE2 TYR 25 37.460 7.111 0.168
192 HH TYR 25 HH TYR 25 36.159 8.415 1.681
193 H LEU 26 HN LEU 26 33.914 1.744 0.388
194 HA LEU 26 HA LEU 26 34.351 3.132 2.753
195 1HB LEU 26 HB2 LEU 26 32.358 1.543 1.702
196 2HB LEU 26 HB1 LEU 26 32.896 0.636 3.103
197 HG LEU 26 HG LEU 26 32.668 3.091 4.188
198 1HD1 LEU 26 HD11 LEU 26 30.126 3.353 2.993
199 2HD1 LEU 26 HD12 LEU 26 31.309 3.260 1.691
200 3HD1 LEU 26 HD13 LEU 26 31.476 4.486 2.947
201 1HD2 LEU 26 HD21 LEU 26 30.309 1.256 3.898
202 2HD2 LEU 26 HD22 LEU 26 30.724 2.288 5.263
203 3HD2 LEU 26 HD23 LEU 26 31.701 0.868 4.903
204 H ASN 27 HN ASN 27 34.613 -0.359 2.256
205 HA ASN 27 HA ASN 27 35.830 -1.117 4.577
206 1HB ASN 27 HB2 ASN 27 35.226 -2.392 2.259
207 2HB ASN 27 HB1 ASN 27 36.987 -2.383 2.173
208 1HD2 ASN 27 HD21 ASN 27 37.126 -4.606 2.443
209 2HD2 ASN 27 HD22 ASN 27 36.788 -5.375 3.963
210 H LEU 28 HN LEU 28 37.418 0.277 1.719
211 HA LEU 28 HA LEU 28 40.045 0.048 2.751
212 1HB LEU 28 HB2 LEU 28 39.792 0.479 0.394
213 2HB LEU 28 HB1 LEU 28 38.930 1.981 0.745
214 HG LEU 28 HG LEU 28 41.185 2.437 2.117
215 1HD1 LEU 28 HD11 LEU 28 43.104 1.751 0.754
216 2HD1 LEU 28 HD12 LEU 28 42.034 0.819 -0.294
217 3HD1 LEU 28 HD13 LEU 28 42.238 0.355 1.396
218 1HD2 LEU 28 HD21 LEU 28 39.936 3.705 0.213
219 2HD2 LEU 28 HD22 LEU 28 41.178 3.008 -0.828
220 3HD2 LEU 28 HD23 LEU 28 41.639 4.051 0.516
221 H VAL 29 HN VAL 29 37.853 2.766 2.541
222 HA VAL 29 HA VAL 29 39.652 4.651 3.493
223 HB VAL 29 HB VAL 29 37.653 5.192 2.159
224 1HG1 VAL 29 HG11 VAL 29 36.267 4.129 4.491
225 2HG1 VAL 29 HG12 VAL 29 35.728 4.303 2.817
226 3HG1 VAL 29 HG13 VAL 29 35.634 5.675 3.924
227 1HG2 VAL 29 HG21 VAL 29 38.468 7.159 2.892
228 2HG2 VAL 29 HG22 VAL 29 38.458 6.661 4.585
229 3HG2 VAL 29 HG23 VAL 29 36.962 7.187 3.811
230 H THR 30 HN THR 30 37.771 2.368 5.229
231 HA THR 30 HA THR 30 37.782 3.514 7.796
232 HB THR 30 HB THR 30 37.563 1.313 8.676
233 HG1 THR 30 HG1 THR 30 38.317 0.078 6.247
234 1HG2 THR 30 HG21 THR 30 35.673 2.022 7.306
235 2HG2 THR 30 HG22 THR 30 35.896 0.275 7.213
236 3HG2 THR 30 HG23 THR 30 36.432 1.307 5.882
237 H ARG 31 HN ARG 31 40.323 2.518 5.788
238 HA ARG 31 HA ARG 31 42.457 1.687 7.095
239 1HB ARG 31 HB2 ARG 31 42.190 2.805 4.747
240 2HB ARG 31 HB1 ARG 31 42.780 4.239 5.571
241 1HG ARG 31 HG2 ARG 31 44.822 3.104 6.169
242 2HG ARG 31 HG1 ARG 31 44.216 1.599 5.468
243 1HD ARG 31 HD2 ARG 31 44.078 2.717 3.273
244 2HD ARG 31 HD1 ARG 31 44.776 4.168 3.990
245 HE ARG 31 HE ARG 31 46.833 3.005 4.268
246 1HH1 ARG 31 HH11 ARG 31 44.417 1.216 2.471
247 2HH1 ARG 31 HH12 ARG 31 45.562 0.125 1.748
248 1HH2 ARG 31 HH21 ARG 31 48.351 1.576 3.339
249 2HH2 ARG 31 HH22 ARG 31 47.809 0.338 2.240
250 H GLN 32 HN GLN 32 41.668 5.137 7.028
251 HA GLN 32 HA GLN 32 42.850 5.406 9.708
252 1HB GLN 32 HB2 GLN 32 43.862 7.430 9.135
253 2HB GLN 32 HB1 GLN 32 44.140 6.422 7.726
254 1HG GLN 32 HG2 GLN 32 42.027 8.555 7.991
255 2HG GLN 32 HG1 GLN 32 43.537 8.688 7.091
256 1HE2 GLN 32 HE21 GLN 32 40.509 8.636 6.465
257 2HE2 GLN 32 HE22 GLN 32 40.416 7.578 5.097
258 H ARG 33 HN ARG 33 40.181 5.963 7.631
259 HA ARG 33 HA ARG 33 38.291 7.211 7.711
260 1HB ARG 33 HB2 ARG 33 38.598 5.849 10.238
261 2HB ARG 33 HB1 ARG 33 37.728 7.362 10.462
262 1HG ARG 33 HG2 ARG 33 36.258 6.603 8.518
263 2HG ARG 33 HG1 ARG 33 36.991 5.016 8.751
264 1HD ARG 33 HD2 ARG 33 35.339 6.593 10.713
265 2HD ARG 33 HD1 ARG 33 34.971 5.023 9.996
266 HE ARG 33 HE ARG 33 36.747 4.072 11.336
267 1HH1 ARG 33 HH11 ARG 33 35.645 7.277 12.236
268 2HH1 ARG 33 HH12 ARG 33 36.274 7.179 13.857
269 1HH2 ARG 33 HH21 ARG 33 37.609 3.952 13.459
270 2HH2 ARG 33 HH22 ARG 33 37.419 5.308 14.537
271 H TYR 34 HN TYR 34 38.481 8.471 10.832
272 HA TYR 34 HA TYR 34 40.214 10.682 10.296
273 1HB TYR 34 HB2 TYR 34 37.713 11.095 9.338
274 2HB TYR 34 HB1 TYR 34 37.505 11.659 10.994
275 HD1 TYR 34 HD1 TYR 34 38.894 12.392 7.743
276 HD2 TYR 34 HD2 TYR 34 38.981 13.493 11.851
277 HE1 TYR 34 HE1 TYR 34 39.960 14.522 7.140
278 HE2 TYR 34 HE2 TYR 34 40.050 15.628 11.260
279 HH TYR 34 HH TYR 34 40.580 16.546 7.867
280 1HN NH2 35 H1 NH2 35 40.469 10.851 13.761
281 2HN NH2 35 H2 NH2 35 41.158 11.146 12.201
Start of MODEL 17
1 1H ILE 1 HT1 ILE 1 31.488 12.772 -6.126
2 2H ILE 1 HT2 ILE 1 31.837 14.379 -5.715
3 3H ILE 1 HT3 ILE 1 30.291 13.744 -5.426
4 HA ILE 1 HA ILE 1 32.824 13.073 -4.055
5 HB ILE 1 HB ILE 1 30.422 13.524 -2.459
6 1HG1 ILE 1 HG12 ILE 1 31.443 16.126 -3.313
7 2HG1 ILE 1 HG11 ILE 1 30.638 15.252 -4.614
8 1HG2 ILE 1 HG21 ILE 1 32.622 15.308 -1.974
9 2HG2 ILE 1 HG22 ILE 1 33.190 13.652 -2.182
10 3HG2 ILE 1 HG23 ILE 1 31.974 14.021 -0.959
11 1HD1 ILE 1 HD11 ILE 1 29.525 16.251 -2.035
12 2HD1 ILE 1 HD12 ILE 1 28.761 14.893 -2.863
13 3HD1 ILE 1 HD13 ILE 1 28.916 16.452 -3.677
14 H LYS 2 HN LYS 2 29.350 12.310 -4.013
15 HA LYS 2 HA LYS 2 30.055 9.509 -3.443
16 1HB LYS 2 HB2 LYS 2 27.512 10.950 -2.644
17 2HB LYS 2 HB1 LYS 2 27.952 9.299 -2.234
18 1HG LYS 2 HG2 LYS 2 30.059 10.567 -1.192
19 2HG LYS 2 HG1 LYS 2 28.854 11.850 -1.056
20 1HD LYS 2 HD2 LYS 2 27.608 10.707 0.468
21 2HD LYS 2 HD1 LYS 2 28.049 9.130 -0.191
22 1HE LYS 2 HE2 LYS 2 29.730 8.901 1.257
23 2HE LYS 2 HE1 LYS 2 30.341 10.517 0.908
24 1HZ LYS 2 HZ1 LYS 2 28.287 11.194 2.372
25 2HZ LYS 2 HZ2 LYS 2 29.761 10.758 3.083
26 3HZ LYS 2 HZ3 LYS 2 28.491 9.635 3.006
27 HA PRO 3 HA PRO 3 28.146 8.440 -7.286
28 1HB PRO 3 HB2 PRO 3 26.961 6.108 -5.886
29 2HB PRO 3 HB1 PRO 3 28.028 6.154 -7.294
30 1HG PRO 3 HG2 PRO 3 28.928 5.373 -4.902
31 2HG PRO 3 HG1 PRO 3 29.941 6.322 -6.004
32 1HD PRO 3 HD2 PRO 3 28.453 7.203 -3.564
33 2HD PRO 3 HD1 PRO 3 30.055 7.695 -4.149
34 H GLU 4 HN GLU 4 25.874 7.085 -4.939
35 HA GLU 4 HA GLU 4 23.887 9.092 -5.274
36 1HB GLU 4 HB2 GLU 4 23.430 8.230 -7.409
37 2HB GLU 4 HB1 GLU 4 23.747 6.574 -6.912
38 1HG GLU 4 HG2 GLU 4 21.523 6.392 -6.926
39 2HG GLU 4 HG1 GLU 4 21.629 7.170 -5.348
40 H ALA 5 HN ALA 5 22.505 8.973 -3.561
41 HA ALA 5 HA ALA 5 22.433 6.429 -2.064
42 1HB ALA 5 HB1 ALA 5 22.168 9.195 -0.881
43 2HB ALA 5 HB2 ALA 5 23.660 8.251 -0.894
44 3HB ALA 5 HB3 ALA 5 22.252 7.665 -0.010
45 HA PRO 6 HA PRO 6 18.123 7.386 -3.215
46 1HB PRO 6 HB2 PRO 6 17.623 5.066 -4.526
47 2HB PRO 6 HB1 PRO 6 18.461 6.422 -5.283
48 1HG PRO 6 HG2 PRO 6 19.514 3.822 -4.454
49 2HG PRO 6 HG1 PRO 6 20.223 5.024 -5.543
50 1HD PRO 6 HD2 PRO 6 20.799 4.538 -2.739
51 2HD PRO 6 HD1 PRO 6 21.646 5.599 -3.880
52 H GLY 7 HN GLY 7 17.305 4.248 -3.409
53 1HA GLY 7 HA2 GLY 7 17.124 3.573 -0.603
54 2HA GLY 7 HA1 GLY 7 15.585 3.949 -1.372
55 H GLU 8 HN GLU 8 14.595 2.019 -1.634
56 HA GLU 8 HA GLU 8 16.130 -0.282 -2.537
57 1HB GLU 8 HB2 GLU 8 13.145 -0.106 -2.150
58 2HB GLU 8 HB1 GLU 8 14.128 -1.561 -2.226
59 1HG GLU 8 HG2 GLU 8 14.730 -1.426 -0.074
60 2HG GLU 8 HG1 GLU 8 14.876 0.331 -0.116
61 H ASP 9 HN ASP 9 15.987 1.961 -4.306
62 HA ASP 9 HA ASP 9 14.762 0.683 -6.618
63 1HB ASP 9 HB2 ASP 9 13.099 2.329 -5.816
64 2HB ASP 9 HB1 ASP 9 14.310 3.600 -5.949
65 H ALA 10 HN ALA 10 16.970 0.187 -7.019
66 HA ALA 10 HA ALA 10 18.111 2.336 -8.633
67 1HB ALA 10 HB1 ALA 10 19.850 0.387 -7.141
68 2HB ALA 10 HB2 ALA 10 19.456 1.989 -6.513
69 3HB ALA 10 HB3 ALA 10 20.347 1.829 -8.028
70 H SER 11 HN SER 11 16.817 1.373 -10.219
71 HA SER 11 HA SER 11 16.298 -0.054 -11.898
72 1HB SER 11 HB2 SER 11 19.160 -1.007 -11.624
73 2HB SER 11 HB1 SER 11 18.155 -1.053 -13.072
74 HG SER 11 HG SER 11 19.722 0.707 -12.937
75 HA PRO 12 HA PRO 12 15.488 -4.223 -10.389
76 1HB PRO 12 HB2 PRO 12 17.200 -5.538 -12.418
77 2HB PRO 12 HB1 PRO 12 15.492 -5.794 -12.046
78 1HG PRO 12 HG2 PRO 12 16.232 -4.495 -14.253
79 2HG PRO 12 HG1 PRO 12 14.806 -3.987 -13.327
80 1HD PRO 12 HD2 PRO 12 17.547 -2.789 -13.401
81 2HD PRO 12 HD1 PRO 12 15.965 -1.986 -13.338
82 H GLU 13 HN GLU 13 18.720 -3.070 -10.633
83 HA GLU 13 HA GLU 13 19.811 -4.496 -8.506
84 1HB GLU 13 HB2 GLU 13 19.597 -6.116 -10.891
85 2HB GLU 13 HB1 GLU 13 21.287 -5.882 -10.478
86 1HG GLU 13 HG2 GLU 13 19.437 -6.650 -8.299
87 2HG GLU 13 HG1 GLU 13 19.845 -7.869 -9.505
88 H GLU 14 HN GLU 14 20.103 -1.915 -9.408
89 HA GLU 14 HA GLU 14 22.952 -1.848 -10.136
90 1HB GLU 14 HB2 GLU 14 20.745 -0.097 -10.691
91 2HB GLU 14 HB1 GLU 14 21.947 0.780 -9.755
92 1HG GLU 14 HG2 GLU 14 22.827 1.193 -11.769
93 2HG GLU 14 HG1 GLU 14 23.538 -0.409 -11.566
94 H LEU 15 HN LEU 15 20.784 -1.730 -7.581
95 HA LEU 15 HA LEU 15 21.926 0.010 -5.732
96 1HB LEU 15 HB2 LEU 15 20.039 -2.200 -5.730
97 2HB LEU 15 HB1 LEU 15 20.991 -2.156 -4.262
98 HG LEU 15 HG LEU 15 19.338 0.102 -5.339
99 1HD1 LEU 15 HD11 LEU 15 18.816 -2.055 -3.373
100 2HD1 LEU 15 HD12 LEU 15 17.731 -1.313 -4.549
101 3HD1 LEU 15 HD13 LEU 15 18.141 -0.456 -3.063
102 1HD2 LEU 15 HD21 LEU 15 20.742 -0.108 -2.691
103 2HD2 LEU 15 HD22 LEU 15 19.811 1.263 -3.296
104 3HD2 LEU 15 HD23 LEU 15 21.334 0.821 -4.070
105 H ASN 16 HN ASN 16 22.322 -3.476 -6.037
106 HA ASN 16 HA ASN 16 24.138 -4.045 -4.124
107 1HB ASN 16 HB2 ASN 16 24.666 -6.006 -5.345
108 2HB ASN 16 HB1 ASN 16 23.015 -5.577 -5.831
109 1HD2 ASN 16 HD21 ASN 16 23.047 -3.899 -7.634
110 2HD2 ASN 16 HD22 ASN 16 24.029 -4.299 -8.982
111 H ARG 17 HN ARG 17 24.973 -2.547 -7.279
112 HA ARG 17 HA ARG 17 27.789 -2.724 -6.637
113 1HB ARG 17 HB2 ARG 17 26.493 -1.202 -8.885
114 2HB ARG 17 HB1 ARG 17 28.219 -1.467 -8.647
115 1HG ARG 17 HG2 ARG 17 27.897 -3.868 -8.940
116 2HG ARG 17 HG1 ARG 17 26.163 -3.618 -9.157
117 1HD ARG 17 HD2 ARG 17 27.001 -3.793 -11.333
118 2HD ARG 17 HD1 ARG 17 26.811 -2.058 -11.076
119 HE ARG 17 HE ARG 17 29.280 -2.098 -10.534
120 1HH1 ARG 17 HH11 ARG 17 27.803 -4.402 -12.735
121 2HH1 ARG 17 HH12 ARG 17 29.277 -4.678 -13.619
122 1HH2 ARG 17 HH21 ARG 17 31.195 -2.457 -11.682
123 2HH2 ARG 17 HH22 ARG 17 31.215 -3.564 -13.020
124 H TYR 18 HN TYR 18 25.227 -0.414 -6.250
125 HA TYR 18 HA TYR 18 26.918 1.782 -5.611
126 1HB TYR 18 HB2 TYR 18 24.836 2.696 -5.598
127 2HB TYR 18 HB1 TYR 18 24.067 1.134 -5.330
128 HD1 TYR 18 HD1 TYR 18 23.262 0.527 -3.193
129 HD2 TYR 18 HD2 TYR 18 25.729 3.968 -3.610
130 HE1 TYR 18 HE1 TYR 18 22.775 1.144 -0.869
131 HE2 TYR 18 HE2 TYR 18 25.249 4.602 -1.284
132 HH TYR 18 HH TYR 18 24.437 3.001 0.935
133 H TYR 19 HN TYR 19 25.535 -0.927 -3.908
134 HA TYR 19 HA TYR 19 26.617 -0.447 -1.350
135 1HB TYR 19 HB2 TYR 19 25.725 -2.967 -2.750
136 2HB TYR 19 HB1 TYR 19 26.238 -2.939 -1.071
137 HD1 TYR 19 HD1 TYR 19 23.454 -2.592 -3.319
138 HD2 TYR 19 HD2 TYR 19 24.955 -1.349 0.502
139 HE1 TYR 19 HE1 TYR 19 21.173 -2.106 -2.534
140 HE2 TYR 19 HE2 TYR 19 22.672 -0.855 1.247
141 HH TYR 19 HH TYR 19 20.241 -1.851 0.469
142 H ALA 20 HN ALA 20 27.878 -1.847 -4.221
143 HA ALA 20 HA ALA 20 30.053 -3.263 -2.977
144 1HB ALA 20 HB1 ALA 20 30.628 -3.826 -5.327
145 2HB ALA 20 HB2 ALA 20 29.280 -2.810 -5.855
146 3HB ALA 20 HB3 ALA 20 28.975 -4.253 -4.880
147 H SER 21 HN SER 21 29.696 -0.579 -5.249
148 HA SER 21 HA SER 21 32.422 0.140 -5.236
149 1HB SER 21 HB2 SER 21 29.921 1.083 -6.421
150 2HB SER 21 HB1 SER 21 30.998 2.417 -5.968
151 HG SER 21 HG SER 21 31.783 0.143 -7.486
152 H LEU 22 HN LEU 22 29.627 1.006 -3.287
153 HA LEU 22 HA LEU 22 30.976 2.947 -1.669
154 1HB LEU 22 HB2 LEU 22 28.426 2.369 -1.853
155 2HB LEU 22 HB1 LEU 22 28.796 1.188 -0.611
156 HG LEU 22 HG LEU 22 29.754 3.130 0.738
157 1HD1 LEU 22 HD11 LEU 22 30.025 4.821 -0.874
158 2HD1 LEU 22 HD12 LEU 22 28.657 5.331 0.118
159 3HD1 LEU 22 HD13 LEU 22 28.378 4.623 -1.473
160 1HD2 LEU 22 HD21 LEU 22 27.005 3.882 0.633
161 2HD2 LEU 22 HD22 LEU 22 27.848 2.914 1.842
162 3HD2 LEU 22 HD23 LEU 22 27.137 2.135 0.427
163 H ARG 23 HN ARG 23 30.589 -0.576 -1.583
164 HA ARG 23 HA ARG 23 31.882 -0.916 0.927
165 1HB ARG 23 HB2 ARG 23 30.564 -2.713 0.004
166 2HB ARG 23 HB1 ARG 23 31.620 -2.820 -1.400
167 1HG ARG 23 HG2 ARG 23 32.667 -4.443 -0.280
168 2HG ARG 23 HG1 ARG 23 33.367 -3.146 0.695
169 1HD ARG 23 HD2 ARG 23 32.091 -3.632 2.489
170 2HD ARG 23 HD1 ARG 23 30.678 -4.015 1.509
171 HE ARG 23 HE ARG 23 32.866 -5.857 2.202
172 1HH1 ARG 23 HH11 ARG 23 29.689 -5.274 0.866
173 2HH1 ARG 23 HH12 ARG 23 29.271 -6.955 0.758
174 1HH2 ARG 23 HH21 ARG 23 32.302 -8.090 2.108
175 2HH2 ARG 23 HH22 ARG 23 30.734 -8.554 1.513
176 H HIS 24 HN HIS 24 33.107 -0.767 -2.391
177 HA HIS 24 HA HIS 24 35.803 -1.309 -1.838
178 1HB HIS 24 HB2 HIS 24 34.741 -1.057 -4.125
179 2HB HIS 24 HB1 HIS 24 34.782 0.687 -3.879
180 HD1 HIS 24 HD1 HIS 24 37.162 -2.259 -4.123
181 HD2 HIS 24 HD2 HIS 24 37.125 1.874 -4.608
182 HE1 HIS 24 HE1 HIS 24 39.424 -1.662 -5.060
183 HE2 HIS 24 HE2 HIS 24 39.330 0.824 -5.480
184 H TYR 25 HN TYR 25 33.972 1.690 -1.815
185 HA TYR 25 HA TYR 25 35.996 3.429 -0.960
186 1HB TYR 25 HB2 TYR 25 34.081 4.476 -1.772
187 2HB TYR 25 HB1 TYR 25 33.004 3.428 -0.864
188 HD1 TYR 25 HD1 TYR 25 31.702 4.681 0.521
189 HD2 TYR 25 HD2 TYR 25 35.818 5.672 0.165
190 HE1 TYR 25 HE1 TYR 25 31.422 6.410 2.231
191 HE2 TYR 25 HE2 TYR 25 35.558 7.407 1.878
192 HH TYR 25 HH TYR 25 33.251 8.860 2.689
193 H LEU 26 HN LEU 26 33.598 1.567 0.893
194 HA LEU 26 HA LEU 26 34.336 2.385 3.453
195 1HB LEU 26 HB2 LEU 26 33.196 -0.233 2.485
196 2HB LEU 26 HB1 LEU 26 33.391 0.164 4.182
197 HG LEU 26 HG LEU 26 31.773 1.880 2.323
198 1HD1 LEU 26 HD11 LEU 26 31.168 -0.762 3.101
199 2HD1 LEU 26 HD12 LEU 26 30.124 0.405 2.288
200 3HD1 LEU 26 HD13 LEU 26 30.138 0.310 4.049
201 1HD2 LEU 26 HD21 LEU 26 32.571 2.788 4.516
202 2HD2 LEU 26 HD22 LEU 26 31.612 1.537 5.309
203 3HD2 LEU 26 HD23 LEU 26 30.820 2.762 4.319
204 H ASN 27 HN ASN 27 35.352 -0.496 1.652
205 HA ASN 27 HA ASN 27 37.159 -1.583 3.410
206 1HB ASN 27 HB2 ASN 27 36.426 -2.128 0.836
207 2HB ASN 27 HB1 ASN 27 38.094 -1.604 0.618
208 1HD2 ASN 27 HD21 ASN 27 38.309 -3.860 -0.087
209 2HD2 ASN 27 HD22 ASN 27 38.633 -5.066 1.120
210 H LEU 28 HN LEU 28 37.751 1.030 1.063
211 HA LEU 28 HA LEU 28 40.487 1.323 1.776
212 1HB LEU 28 HB2 LEU 28 39.809 2.293 -0.313
213 2HB LEU 28 HB1 LEU 28 38.587 3.270 0.507
214 HG LEU 28 HG LEU 28 40.817 4.029 1.848
215 1HD1 LEU 28 HD11 LEU 28 41.621 3.226 -0.925
216 2HD1 LEU 28 HD12 LEU 28 42.486 3.026 0.598
217 3HD1 LEU 28 HD13 LEU 28 42.385 4.617 -0.158
218 1HD2 LEU 28 HD21 LEU 28 39.698 5.872 1.231
219 2HD2 LEU 28 HD22 LEU 28 39.084 5.114 -0.241
220 3HD2 LEU 28 HD23 LEU 28 40.686 5.851 -0.231
221 H VAL 29 HN VAL 29 37.609 3.124 2.582
222 HA VAL 29 HA VAL 29 38.895 5.200 3.885
223 HB VAL 29 HB VAL 29 36.582 5.269 2.963
224 1HG1 VAL 29 HG11 VAL 29 35.000 4.695 5.154
225 2HG1 VAL 29 HG12 VAL 29 36.116 3.331 5.048
226 3HG1 VAL 29 HG13 VAL 29 35.118 3.769 3.655
227 1HG2 VAL 29 HG21 VAL 29 36.441 7.196 4.035
228 2HG2 VAL 29 HG22 VAL 29 37.665 6.633 5.173
229 3HG2 VAL 29 HG23 VAL 29 35.955 6.368 5.515
230 H THR 30 HN THR 30 38.222 2.051 5.065
231 HA THR 30 HA THR 30 38.422 2.457 7.828
232 HB THR 30 HB THR 30 39.199 0.217 8.017
233 HG1 THR 30 HG1 THR 30 39.753 -0.107 5.283
234 1HG2 THR 30 HG21 THR 30 36.924 0.390 7.157
235 2HG2 THR 30 HG22 THR 30 37.733 -1.034 6.498
236 3HG2 THR 30 HG23 THR 30 37.544 0.413 5.502
237 H ARG 31 HN ARG 31 40.666 3.056 5.332
238 HA ARG 31 HA ARG 31 43.164 2.682 6.334
239 1HB ARG 31 HB2 ARG 31 41.988 4.199 4.257
240 2HB ARG 31 HB1 ARG 31 43.128 5.247 5.092
241 1HG ARG 31 HG2 ARG 31 44.169 4.094 3.218
242 2HG ARG 31 HG1 ARG 31 44.903 3.621 4.752
243 1HD ARG 31 HD2 ARG 31 44.025 1.502 4.673
244 2HD ARG 31 HD1 ARG 31 42.647 1.997 3.691
245 HE ARG 31 HE ARG 31 44.034 1.930 1.767
246 1HH1 ARG 31 HH11 ARG 31 45.629 0.784 4.661
247 2HH1 ARG 31 HH12 ARG 31 46.858 -0.086 3.796
248 1HH2 ARG 31 HH21 ARG 31 45.660 0.812 0.623
249 2HH2 ARG 31 HH22 ARG 31 46.886 -0.064 1.507
250 H GLN 32 HN GLN 32 41.192 5.584 6.742
251 HA GLN 32 HA GLN 32 42.704 6.189 9.178
252 1HB GLN 32 HB2 GLN 32 42.834 8.497 8.658
253 2HB GLN 32 HB1 GLN 32 43.338 7.652 7.210
254 1HG GLN 32 HG2 GLN 32 40.834 9.204 7.715
255 2HG GLN 32 HG1 GLN 32 42.019 9.394 6.430
256 1HE2 GLN 32 HE21 GLN 32 39.021 8.244 7.236
257 2HE2 GLN 32 HE22 GLN 32 38.740 7.222 5.867
258 H ARG 33 HN ARG 33 40.434 4.709 9.104
259 HA ARG 33 HA ARG 33 37.925 5.362 9.182
260 1HB ARG 33 HB2 ARG 33 39.540 3.691 10.827
261 2HB ARG 33 HB1 ARG 33 38.317 4.443 11.843
262 1HG ARG 33 HG2 ARG 33 36.605 3.667 10.182
263 2HG ARG 33 HG1 ARG 33 37.887 2.730 9.412
264 1HD ARG 33 HD2 ARG 33 37.641 1.113 10.914
265 2HD ARG 33 HD1 ARG 33 37.955 2.251 12.222
266 HE ARG 33 HE ARG 33 35.336 1.428 11.204
267 1HH1 ARG 33 HH11 ARG 33 37.246 3.220 13.535
268 2HH1 ARG 33 HH12 ARG 33 35.886 3.590 14.549
269 1HH2 ARG 33 HH21 ARG 33 33.540 1.917 12.559
270 2HH2 ARG 33 HH22 ARG 33 33.792 2.870 13.998
271 H TYR 34 HN TYR 34 37.261 7.462 9.337
272 HA TYR 34 HA TYR 34 37.382 8.676 12.002
273 1HB TYR 34 HB2 TYR 34 38.623 9.662 9.585
274 2HB TYR 34 HB1 TYR 34 37.423 10.808 10.175
275 HD1 TYR 34 HD1 TYR 34 40.249 8.721 11.446
276 HD2 TYR 34 HD2 TYR 34 38.089 12.370 11.755
277 HE1 TYR 34 HE1 TYR 34 41.860 9.525 13.119
278 HE2 TYR 34 HE2 TYR 34 39.694 13.185 13.429
279 HH TYR 34 HH TYR 34 41.388 11.716 15.203
280 1HN NH2 35 H1 NH2 35 34.007 8.452 10.024
281 2HN NH2 35 H2 NH2 35 35.355 7.373 9.927
Start of MODEL 18
1 1H ILE 1 HT1 ILE 1 32.816 13.826 -2.905
2 2H ILE 1 HT2 ILE 1 32.268 12.261 -3.275
3 3H ILE 1 HT3 ILE 1 33.158 12.534 -1.860
4 HA ILE 1 HA ILE 1 31.392 13.972 -1.021
5 HB ILE 1 HB ILE 1 29.224 13.019 -2.612
6 1HG1 ILE 1 HG12 ILE 1 30.650 14.826 -4.413
7 2HG1 ILE 1 HG11 ILE 1 31.456 13.271 -4.232
8 1HG2 ILE 1 HG21 ILE 1 28.575 15.264 -2.629
9 2HG2 ILE 1 HG22 ILE 1 30.239 15.842 -2.544
10 3HG2 ILE 1 HG23 ILE 1 29.493 15.086 -1.134
11 1HD1 ILE 1 HD11 ILE 1 29.226 13.923 -5.828
12 2HD1 ILE 1 HD12 ILE 1 28.684 12.797 -4.581
13 3HD1 ILE 1 HD13 ILE 1 30.024 12.361 -5.641
14 H LYS 2 HN LYS 2 29.747 11.345 -2.668
15 HA LYS 2 HA LYS 2 30.149 9.351 -0.691
16 1HB LYS 2 HB2 LYS 2 28.496 11.287 0.235
17 2HB LYS 2 HB1 LYS 2 27.329 10.276 -0.602
18 1HG LYS 2 HG2 LYS 2 27.283 9.442 1.550
19 2HG LYS 2 HG1 LYS 2 28.392 8.340 0.734
20 1HD LYS 2 HD2 LYS 2 29.712 8.769 2.506
21 2HD LYS 2 HD1 LYS 2 30.124 10.223 1.593
22 1HE LYS 2 HE2 LYS 2 28.672 11.563 2.865
23 2HE LYS 2 HE1 LYS 2 27.822 10.166 3.525
24 1HZ LYS 2 HZ1 LYS 2 29.268 11.094 5.184
25 2HZ LYS 2 HZ2 LYS 2 30.601 11.003 4.142
26 3HZ LYS 2 HZ3 LYS 2 29.879 9.576 4.714
27 HA PRO 3 HA PRO 3 28.478 6.968 -4.091
28 1HB PRO 3 HB2 PRO 3 27.459 5.114 -2.018
29 2HB PRO 3 HB1 PRO 3 28.539 4.795 -3.376
30 1HG PRO 3 HG2 PRO 3 29.458 4.869 -0.872
31 2HG PRO 3 HG1 PRO 3 30.417 5.507 -2.221
32 1HD PRO 3 HD2 PRO 3 28.810 6.977 -0.170
33 2HD PRO 3 HD1 PRO 3 30.388 7.389 -0.874
34 H GLU 4 HN GLU 4 26.627 7.925 -1.333
35 HA GLU 4 HA GLU 4 24.550 8.764 -1.107
36 1HB GLU 4 HB2 GLU 4 24.071 9.980 -2.913
37 2HB GLU 4 HB1 GLU 4 24.992 8.907 -3.949
38 1HG GLU 4 HG2 GLU 4 23.144 8.095 -4.856
39 2HG GLU 4 HG1 GLU 4 22.452 7.732 -3.273
40 H ALA 5 HN ALA 5 22.357 8.035 -0.840
41 HA ALA 5 HA ALA 5 22.224 5.096 -0.978
42 1HB ALA 5 HB1 ALA 5 22.002 5.317 1.245
43 2HB ALA 5 HB2 ALA 5 20.345 5.797 0.877
44 3HB ALA 5 HB3 ALA 5 21.586 7.025 1.129
45 HA PRO 6 HA PRO 6 18.839 6.195 -3.815
46 1HB PRO 6 HB2 PRO 6 19.192 3.433 -4.710
47 2HB PRO 6 HB1 PRO 6 19.339 4.927 -5.638
48 1HG PRO 6 HG2 PRO 6 21.475 3.393 -5.023
49 2HG PRO 6 HG1 PRO 6 21.581 5.160 -5.155
50 1HD PRO 6 HD2 PRO 6 21.398 3.449 -2.702
51 2HD PRO 6 HD1 PRO 6 22.407 4.882 -3.005
52 H GLY 7 HN GLY 7 19.335 3.660 -1.582
53 1HA GLY 7 HA2 GLY 7 17.787 2.911 0.006
54 2HA GLY 7 HA1 GLY 7 16.496 3.598 -0.969
55 H GLU 8 HN GLU 8 15.587 1.406 -0.305
56 HA GLU 8 HA GLU 8 16.553 -0.856 -1.813
57 1HB GLU 8 HB2 GLU 8 13.935 -0.540 -0.337
58 2HB GLU 8 HB1 GLU 8 14.651 -2.050 -0.879
59 1HG GLU 8 HG2 GLU 8 15.431 -2.190 1.203
60 2HG GLU 8 HG1 GLU 8 16.646 -1.030 0.662
61 H ASP 9 HN ASP 9 16.174 1.158 -3.525
62 HA ASP 9 HA ASP 9 14.155 0.162 -5.329
63 1HB ASP 9 HB2 ASP 9 12.982 1.862 -3.824
64 2HB ASP 9 HB1 ASP 9 14.047 3.077 -4.522
65 H ALA 10 HN ALA 10 16.469 -0.266 -6.066
66 HA ALA 10 HA ALA 10 17.466 2.035 -7.601
67 1HB ALA 10 HB1 ALA 10 18.856 1.514 -5.557
68 2HB ALA 10 HB2 ALA 10 19.719 1.504 -7.097
69 3HB ALA 10 HB3 ALA 10 19.256 -0.018 -6.337
70 H SER 11 HN SER 11 15.989 1.011 -9.141
71 HA SER 11 HA SER 11 15.668 -0.090 -11.095
72 1HB SER 11 HB2 SER 11 18.699 -0.190 -10.990
73 2HB SER 11 HB1 SER 11 17.728 -0.467 -12.432
74 HG SER 11 HG SER 11 18.540 1.862 -11.356
75 HA PRO 12 HA PRO 12 15.945 -4.651 -10.938
76 1HB PRO 12 HB2 PRO 12 18.490 -4.708 -12.515
77 2HB PRO 12 HB1 PRO 12 17.049 -5.722 -12.666
78 1HG PRO 12 HG2 PRO 12 17.480 -3.740 -14.372
79 2HG PRO 12 HG1 PRO 12 15.846 -4.085 -13.773
80 1HD PRO 12 HD2 PRO 12 17.692 -1.863 -13.067
81 2HD PRO 12 HD1 PRO 12 15.921 -1.885 -13.117
82 H GLU 13 HN GLU 13 18.985 -2.884 -10.305
83 HA GLU 13 HA GLU 13 19.717 -4.396 -8.060
84 1HB GLU 13 HB2 GLU 13 20.364 -5.652 -10.617
85 2HB GLU 13 HB1 GLU 13 21.771 -5.438 -9.586
86 1HG GLU 13 HG2 GLU 13 19.958 -6.437 -7.823
87 2HG GLU 13 HG1 GLU 13 19.491 -7.252 -9.314
88 H GLU 14 HN GLU 14 19.922 -1.667 -9.308
89 HA GLU 14 HA GLU 14 22.707 -1.060 -9.453
90 1HB GLU 14 HB2 GLU 14 20.197 0.430 -9.451
91 2HB GLU 14 HB1 GLU 14 21.448 1.242 -8.523
92 1HG GLU 14 HG2 GLU 14 22.687 1.715 -10.348
93 2HG GLU 14 HG1 GLU 14 22.243 0.225 -11.179
94 H LEU 15 HN LEU 15 20.470 -1.751 -6.988
95 HA LEU 15 HA LEU 15 21.587 -0.609 -4.714
96 1HB LEU 15 HB2 LEU 15 19.771 -2.799 -5.335
97 2HB LEU 15 HB1 LEU 15 20.759 -3.148 -3.928
98 HG LEU 15 HG LEU 15 19.762 -0.493 -3.664
99 1HD1 LEU 15 HD11 LEU 15 17.384 -0.849 -3.690
100 2HD1 LEU 15 HD12 LEU 15 17.602 -2.536 -4.163
101 3HD1 LEU 15 HD13 LEU 15 18.038 -1.241 -5.280
102 1HD2 LEU 15 HD21 LEU 15 20.232 -2.724 -2.109
103 2HD2 LEU 15 HD22 LEU 15 18.480 -2.528 -2.036
104 3HD2 LEU 15 HD23 LEU 15 19.536 -1.198 -1.561
105 H ASN 16 HN ASN 16 22.520 -3.485 -6.527
106 HA ASN 16 HA ASN 16 24.286 -4.536 -4.598
107 1HB ASN 16 HB2 ASN 16 23.397 -5.338 -7.096
108 2HB ASN 16 HB1 ASN 16 25.118 -5.050 -7.341
109 1HD2 ASN 16 HD21 ASN 16 22.777 -7.146 -6.147
110 2HD2 ASN 16 HD22 ASN 16 23.835 -8.284 -5.383
111 H ARG 17 HN ARG 17 24.772 -2.243 -7.263
112 HA ARG 17 HA ARG 17 27.579 -2.009 -6.641
113 1HB ARG 17 HB2 ARG 17 25.988 -0.122 -8.354
114 2HB ARG 17 HB1 ARG 17 27.732 -0.352 -8.315
115 1HG ARG 17 HG2 ARG 17 26.651 -2.868 -8.898
116 2HG ARG 17 HG1 ARG 17 25.748 -1.715 -9.884
117 1HD ARG 17 HD2 ARG 17 27.726 -0.898 -10.897
118 2HD ARG 17 HD1 ARG 17 28.753 -1.730 -9.732
119 HE ARG 17 HE ARG 17 27.817 -3.846 -10.792
120 1HH1 ARG 17 HH11 ARG 17 28.132 -0.835 -12.553
121 2HH1 ARG 17 HH12 ARG 17 28.363 -1.605 -14.091
122 1HH2 ARG 17 HH21 ARG 17 28.102 -4.868 -12.802
123 2HH2 ARG 17 HH22 ARG 17 28.343 -3.909 -14.234
124 H TYR 18 HN TYR 18 24.734 -0.739 -5.344
125 HA TYR 18 HA TYR 18 25.976 1.652 -4.317
126 1HB TYR 18 HB2 TYR 18 23.702 2.000 -4.326
127 2HB TYR 18 HB1 TYR 18 23.334 0.302 -4.063
128 HD1 TYR 18 HD1 TYR 18 22.194 -0.127 -2.136
129 HD2 TYR 18 HD2 TYR 18 25.032 3.039 -2.129
130 HE1 TYR 18 HE1 TYR 18 21.661 0.336 0.209
131 HE2 TYR 18 HE2 TYR 18 24.510 3.516 0.226
132 HH TYR 18 HH TYR 18 23.485 1.949 2.241
133 H TYR 19 HN TYR 19 25.245 -1.634 -3.350
134 HA TYR 19 HA TYR 19 26.479 -1.610 -0.810
135 1HB TYR 19 HB2 TYR 19 26.150 -3.862 -2.798
136 2HB TYR 19 HB1 TYR 19 26.662 -4.070 -1.133
137 HD1 TYR 19 HD1 TYR 19 24.700 -5.759 -1.465
138 HD2 TYR 19 HD2 TYR 19 24.174 -1.533 -1.219
139 HE1 TYR 19 HE1 TYR 19 22.369 -6.095 -0.790
140 HE2 TYR 19 HE2 TYR 19 21.834 -1.872 -0.535
141 HH TYR 19 HH TYR 19 20.605 -4.232 0.723
142 H ALA 20 HN ALA 20 27.667 -1.788 -4.032
143 HA ALA 20 HA ALA 20 30.220 -2.939 -3.334
144 1HB ALA 20 HB1 ALA 20 29.130 -1.992 -5.974
145 2HB ALA 20 HB2 ALA 20 29.063 -3.646 -5.356
146 3HB ALA 20 HB3 ALA 20 30.620 -2.911 -5.737
147 H SER 21 HN SER 21 28.983 0.081 -4.727
148 HA SER 21 HA SER 21 31.494 1.381 -4.757
149 1HB SER 21 HB2 SER 21 28.909 1.960 -5.653
150 2HB SER 21 HB1 SER 21 29.243 3.195 -4.429
151 HG SER 21 HG SER 21 30.146 4.062 -6.179
152 H LEU 22 HN LEU 22 28.938 0.988 -2.396
153 HA LEU 22 HA LEU 22 30.075 2.665 -0.386
154 1HB LEU 22 HB2 LEU 22 27.718 1.411 -0.593
155 2HB LEU 22 HB1 LEU 22 28.560 0.217 0.373
156 HG LEU 22 HG LEU 22 28.944 1.839 2.128
157 1HD1 LEU 22 HD11 LEU 22 29.277 3.871 0.995
158 2HD1 LEU 22 HD12 LEU 22 27.789 4.085 1.915
159 3HD1 LEU 22 HD13 LEU 22 27.714 3.766 0.185
160 1HD2 LEU 22 HD21 LEU 22 26.235 2.533 2.050
161 2HD2 LEU 22 HD22 LEU 22 26.967 1.154 2.862
162 3HD2 LEU 22 HD23 LEU 22 26.362 0.990 1.215
163 H ARG 23 HN ARG 23 30.447 -0.715 -1.352
164 HA ARG 23 HA ARG 23 32.071 -1.409 0.900
165 1HB ARG 23 HB2 ARG 23 30.911 -3.152 -0.250
166 2HB ARG 23 HB1 ARG 23 31.714 -2.756 -1.764
167 1HG ARG 23 HG2 ARG 23 33.113 -4.413 -1.206
168 2HG ARG 23 HG1 ARG 23 33.840 -3.206 -0.133
169 1HD ARG 23 HD2 ARG 23 33.133 -4.268 1.704
170 2HD ARG 23 HD1 ARG 23 31.524 -4.544 1.034
171 HE ARG 23 HE ARG 23 33.882 -6.260 0.543
172 1HH1 ARG 23 HH11 ARG 23 30.411 -5.785 0.808
173 2HH1 ARG 23 HH12 ARG 23 30.043 -7.472 0.579
174 1HH2 ARG 23 HH21 ARG 23 33.396 -8.456 0.192
175 2HH2 ARG 23 HH22 ARG 23 31.734 -8.984 0.184
176 H HIS 24 HN HIS 24 32.839 -0.304 -2.380
177 HA HIS 24 HA HIS 24 35.665 -0.639 -2.029
178 1HB HIS 24 HB2 HIS 24 34.143 -0.194 -4.218
179 2HB HIS 24 HB1 HIS 24 34.693 1.451 -3.908
180 HD1 HIS 24 HD1 HIS 24 36.776 1.997 -5.131
181 HD2 HIS 24 HD2 HIS 24 36.563 -2.040 -4.174
182 HE1 HIS 24 HE1 HIS 24 38.870 0.970 -6.074
183 HE2 HIS 24 HE2 HIS 24 38.746 -1.471 -5.444
184 H TYR 25 HN TYR 25 33.341 1.929 -1.475
185 HA TYR 25 HA TYR 25 35.127 3.922 -0.631
186 1HB TYR 25 HB2 TYR 25 32.905 4.629 -0.906
187 2HB TYR 25 HB1 TYR 25 32.263 3.268 0.007
188 HD1 TYR 25 HD1 TYR 25 31.211 3.932 1.922
189 HD2 TYR 25 HD2 TYR 25 34.744 5.966 0.718
190 HE1 TYR 25 HE1 TYR 25 31.085 5.319 3.939
191 HE2 TYR 25 HE2 TYR 25 34.641 7.363 2.729
192 HH TYR 25 HH TYR 25 33.622 7.166 5.072
193 H LEU 26 HN LEU 26 33.418 1.399 1.206
194 HA LEU 26 HA LEU 26 34.604 1.790 3.677
195 1HB LEU 26 HB2 LEU 26 33.664 -0.736 2.341
196 2HB LEU 26 HB1 LEU 26 34.221 -0.693 4.002
197 HG LEU 26 HG LEU 26 31.879 0.892 2.942
198 1HD1 LEU 26 HD11 LEU 26 31.423 -1.503 2.901
199 2HD1 LEU 26 HD12 LEU 26 30.493 -0.696 4.165
200 3HD1 LEU 26 HD13 LEU 26 31.926 -1.631 4.588
201 1HD2 LEU 26 HD21 LEU 26 31.686 0.608 5.690
202 2HD2 LEU 26 HD22 LEU 26 32.142 2.070 4.812
203 3HD2 LEU 26 HD23 LEU 26 33.390 0.973 5.409
204 H ASN 27 HN ASN 27 35.565 -0.464 1.147
205 HA ASN 27 HA ASN 27 37.861 -1.552 2.023
206 1HB ASN 27 HB2 ASN 27 36.617 -1.486 -0.353
207 2HB ASN 27 HB1 ASN 27 37.991 -0.452 -0.731
208 1HD2 ASN 27 HD21 ASN 27 40.097 -1.487 0.351
209 2HD2 ASN 27 HD22 ASN 27 40.356 -3.130 -0.109
210 H LEU 28 HN LEU 28 37.620 1.712 0.585
211 HA LEU 28 HA LEU 28 40.416 2.219 1.015
212 1HB LEU 28 HB2 LEU 28 39.405 3.470 -0.754
213 2HB LEU 28 HB1 LEU 28 38.153 4.072 0.342
214 HG LEU 28 HG LEU 28 40.405 4.827 1.658
215 1HD1 LEU 28 HD11 LEU 28 40.984 5.461 -1.240
216 2HD1 LEU 28 HD12 LEU 28 41.689 4.070 -0.414
217 3HD1 LEU 28 HD13 LEU 28 42.015 5.699 0.171
218 1HD2 LEU 28 HD21 LEU 28 38.933 6.451 -0.444
219 2HD2 LEU 28 HD22 LEU 28 39.855 7.085 0.922
220 3HD2 LEU 28 HD23 LEU 28 38.375 6.164 1.205
221 H VAL 29 HN VAL 29 37.449 3.391 2.437
222 HA VAL 29 HA VAL 29 38.595 5.414 3.942
223 HB VAL 29 HB VAL 29 36.168 5.137 3.297
224 1HG1 VAL 29 HG11 VAL 29 36.369 2.985 5.196
225 2HG1 VAL 29 HG12 VAL 29 35.081 3.370 4.051
226 3HG1 VAL 29 HG13 VAL 29 35.100 4.124 5.648
227 1HG2 VAL 29 HG21 VAL 29 35.859 6.907 4.579
228 2HG2 VAL 29 HG22 VAL 29 37.373 6.531 5.404
229 3HG2 VAL 29 HG23 VAL 29 35.844 5.911 6.031
230 H THR 30 HN THR 30 38.532 2.071 4.578
231 HA THR 30 HA THR 30 38.940 2.072 7.377
232 HB THR 30 HB THR 30 39.915 -0.152 7.021
233 HG1 THR 30 HG1 THR 30 39.557 -0.200 4.301
234 1HG2 THR 30 HG21 THR 30 37.483 0.091 6.945
235 2HG2 THR 30 HG22 THR 30 38.022 -1.171 5.833
236 3HG2 THR 30 HG23 THR 30 37.574 0.422 5.214
237 H ARG 31 HN ARG 31 40.802 3.340 4.896
238 HA ARG 31 HA ARG 31 43.420 2.775 5.469
239 1HB ARG 31 HB2 ARG 31 42.149 4.462 3.747
240 2HB ARG 31 HB1 ARG 31 42.964 5.594 4.821
241 1HG ARG 31 HG2 ARG 31 44.833 5.277 3.690
242 2HG ARG 31 HG1 ARG 31 44.839 3.589 4.204
243 1HD ARG 31 HD2 ARG 31 43.606 4.746 1.713
244 2HD ARG 31 HD1 ARG 31 44.976 3.644 1.817
245 HE ARG 31 HE ARG 31 42.244 2.857 2.624
246 1HH1 ARG 31 HH11 ARG 31 45.264 2.228 0.956
247 2HH1 ARG 31 HH12 ARG 31 44.777 0.654 0.395
248 1HH2 ARG 31 HH21 ARG 31 41.615 0.762 1.908
249 2HH2 ARG 31 HH22 ARG 31 42.713 -0.183 0.946
250 H GLN 32 HN GLN 32 41.920 5.842 6.458
251 HA GLN 32 HA GLN 32 43.709 5.970 8.739
252 1HB GLN 32 HB2 GLN 32 43.085 8.232 8.959
253 2HB GLN 32 HB1 GLN 32 43.160 7.953 7.226
254 1HG GLN 32 HG2 GLN 32 40.615 7.922 8.841
255 2HG GLN 32 HG1 GLN 32 41.229 9.325 7.971
256 1HE2 GLN 32 HE21 GLN 32 38.721 7.950 7.597
257 2HE2 GLN 32 HE22 GLN 32 38.708 7.393 5.961
258 H ARG 33 HN ARG 33 40.371 5.371 8.001
259 HA ARG 33 HA ARG 33 38.553 4.802 9.224
260 1HB ARG 33 HB2 ARG 33 40.735 3.196 10.036
261 2HB ARG 33 HB1 ARG 33 39.802 3.570 11.480
262 1HG ARG 33 HG2 ARG 33 37.909 2.926 9.542
263 2HG ARG 33 HG1 ARG 33 39.210 1.754 9.328
264 1HD ARG 33 HD2 ARG 33 37.394 1.100 10.951
265 2HD ARG 33 HD1 ARG 33 39.045 1.016 11.562
266 HE ARG 33 HE ARG 33 38.624 2.906 12.901
267 1HH1 ARG 33 HH11 ARG 33 35.799 1.922 11.069
268 2HH1 ARG 33 HH12 ARG 33 34.679 2.733 12.127
269 1HH2 ARG 33 HH21 ARG 33 37.159 3.950 14.299
270 2HH2 ARG 33 HH22 ARG 33 35.453 3.875 13.972
271 H TYR 34 HN TYR 34 38.116 7.030 9.724
272 HA TYR 34 HA TYR 34 38.430 7.606 12.593
273 1HB TYR 34 HB2 TYR 34 39.663 9.033 10.545
274 2HB TYR 34 HB1 TYR 34 38.251 10.003 10.949
275 HD1 TYR 34 HD1 TYR 34 39.738 7.961 13.560
276 HD2 TYR 34 HD2 TYR 34 39.767 11.802 11.727
277 HE1 TYR 34 HE1 TYR 34 40.921 8.875 15.513
278 HE2 TYR 34 HE2 TYR 34 40.950 12.730 13.675
279 HH TYR 34 HH TYR 34 41.771 10.686 16.485
280 1HN NH2 35 H1 NH2 35 35.127 8.854 10.489
281 2HN NH2 35 H2 NH2 35 36.657 8.747 9.698
Start of MODEL 19
1 1H ILE 1 HT1 ILE 1 31.501 14.188 -2.393
2 2H ILE 1 HT2 ILE 1 31.853 12.795 -3.294
3 3H ILE 1 HT3 ILE 1 33.108 13.691 -2.596
4 HA ILE 1 HA ILE 1 32.265 11.515 -1.490
5 HB ILE 1 HB ILE 1 32.421 13.161 0.778
6 1HG1 ILE 1 HG12 ILE 1 34.678 14.085 -0.887
7 2HG1 ILE 1 HG11 ILE 1 33.120 14.814 -1.259
8 1HG2 ILE 1 HG21 ILE 1 34.526 12.141 1.100
9 2HG2 ILE 1 HG22 ILE 1 34.748 11.885 -0.633
10 3HG2 ILE 1 HG23 ILE 1 33.527 10.965 0.247
11 1HD1 ILE 1 HD11 ILE 1 34.901 15.574 0.726
12 2HD1 ILE 1 HD12 ILE 1 33.588 14.767 1.581
13 3HD1 ILE 1 HD13 ILE 1 33.240 16.129 0.518
14 H LYS 2 HN LYS 2 31.029 11.083 0.571
15 HA LYS 2 HA LYS 2 29.108 10.910 1.745
16 1HB LYS 2 HB2 LYS 2 29.504 13.630 1.576
17 2HB LYS 2 HB1 LYS 2 27.862 13.437 0.982
18 1HG LYS 2 HG2 LYS 2 27.578 11.947 3.102
19 2HG LYS 2 HG1 LYS 2 28.984 12.841 3.678
20 1HD LYS 2 HD2 LYS 2 27.451 14.328 4.401
21 2HD LYS 2 HD1 LYS 2 27.429 14.854 2.716
22 1HE LYS 2 HE2 LYS 2 25.690 12.645 2.902
23 2HE LYS 2 HE1 LYS 2 25.327 13.690 4.276
24 1HZ LYS 2 HZ1 LYS 2 24.153 14.913 2.868
25 2HZ LYS 2 HZ2 LYS 2 24.723 14.063 1.520
26 3HZ LYS 2 HZ3 LYS 2 25.604 15.383 2.128
27 HA PRO 3 HA PRO 3 26.597 9.728 -1.841
28 1HB PRO 3 HB2 PRO 3 26.134 7.215 -1.064
29 2HB PRO 3 HB1 PRO 3 27.687 7.688 -1.764
30 1HG PRO 3 HG2 PRO 3 26.953 7.258 1.101
31 2HG PRO 3 HG1 PRO 3 28.425 6.780 0.237
32 1HD PRO 3 HD2 PRO 3 28.202 9.019 1.837
33 2HD PRO 3 HD1 PRO 3 29.403 8.819 0.546
34 H GLU 4 HN GLU 4 24.383 9.600 -2.020
35 HA GLU 4 HA GLU 4 22.847 9.707 0.483
36 1HB GLU 4 HB2 GLU 4 21.776 10.520 -2.208
37 2HB GLU 4 HB1 GLU 4 21.203 10.988 -0.613
38 1HG GLU 4 HG2 GLU 4 23.909 11.806 -1.606
39 2HG GLU 4 HG1 GLU 4 22.462 12.725 -2.007
40 H ALA 5 HN ALA 5 20.768 8.607 0.499
41 HA ALA 5 HA ALA 5 21.042 5.952 -0.514
42 1HB ALA 5 HB1 ALA 5 18.728 7.271 0.899
43 2HB ALA 5 HB2 ALA 5 20.044 6.381 1.665
44 3HB ALA 5 HB3 ALA 5 18.904 5.540 0.613
45 HA PRO 6 HA PRO 6 18.677 6.511 -4.244
46 1HB PRO 6 HB2 PRO 6 18.309 3.683 -4.492
47 2HB PRO 6 HB1 PRO 6 19.483 4.698 -5.328
48 1HG PRO 6 HG2 PRO 6 20.112 2.771 -3.453
49 2HG PRO 6 HG1 PRO 6 21.155 4.134 -3.897
50 1HD PRO 6 HD2 PRO 6 19.359 3.806 -1.531
51 2HD PRO 6 HD1 PRO 6 20.958 4.578 -1.641
52 H GLY 7 HN GLY 7 17.348 3.494 -3.197
53 1HA GLY 7 HA2 GLY 7 15.063 4.356 -1.852
54 2HA GLY 7 HA1 GLY 7 14.677 4.285 -3.567
55 H GLU 8 HN GLU 8 13.132 2.658 -2.526
56 HA GLU 8 HA GLU 8 14.369 0.079 -1.971
57 1HB GLU 8 HB2 GLU 8 11.511 1.043 -1.862
58 2HB GLU 8 HB1 GLU 8 11.969 -0.632 -1.587
59 1HG GLU 8 HG2 GLU 8 11.802 0.240 0.550
60 2HG GLU 8 HG1 GLU 8 13.532 0.305 0.222
61 H ASP 9 HN ASP 9 13.633 1.729 -4.643
62 HA ASP 9 HA ASP 9 13.056 -0.708 -6.182
63 1HB ASP 9 HB2 ASP 9 11.082 0.813 -6.126
64 2HB ASP 9 HB1 ASP 9 12.072 2.076 -6.851
65 H ALA 10 HN ALA 10 15.475 -0.652 -6.066
66 HA ALA 10 HA ALA 10 16.634 1.144 -8.079
67 1HB ALA 10 HB1 ALA 10 18.656 -0.456 -6.954
68 2HB ALA 10 HB2 ALA 10 17.624 0.050 -5.615
69 3HB ALA 10 HB3 ALA 10 18.360 1.262 -6.666
70 H SER 11 HN SER 11 15.023 -0.451 -9.292
71 HA SER 11 HA SER 11 14.758 -2.116 -10.815
72 1HB SER 11 HB2 SER 11 17.758 -2.254 -11.059
73 2HB SER 11 HB1 SER 11 16.541 -2.368 -12.327
74 HG SER 11 HG SER 11 16.141 -0.023 -11.362
75 HA PRO 12 HA PRO 12 15.838 -6.256 -9.102
76 1HB PRO 12 HB2 PRO 12 18.113 -6.669 -10.988
77 2HB PRO 12 HB1 PRO 12 16.799 -7.768 -10.551
78 1HG PRO 12 HG2 PRO 12 16.771 -6.507 -12.887
79 2HG PRO 12 HG1 PRO 12 15.278 -6.721 -11.953
80 1HD PRO 12 HD2 PRO 12 16.955 -4.276 -12.308
81 2HD PRO 12 HD1 PRO 12 15.192 -4.429 -12.169
82 H GLU 13 HN GLU 13 18.458 -4.012 -9.805
83 HA GLU 13 HA GLU 13 19.734 -4.014 -7.379
84 1HB GLU 13 HB2 GLU 13 20.151 -6.531 -8.575
85 2HB GLU 13 HB1 GLU 13 21.656 -5.647 -8.799
86 1HG GLU 13 HG2 GLU 13 22.038 -5.468 -6.534
87 2HG GLU 13 HG1 GLU 13 20.342 -5.703 -6.121
88 H GLU 14 HN GLU 14 19.281 -2.098 -9.167
89 HA GLU 14 HA GLU 14 21.811 -1.488 -10.440
90 1HB GLU 14 HB2 GLU 14 19.339 -0.680 -11.079
91 2HB GLU 14 HB1 GLU 14 19.756 0.623 -9.973
92 1HG GLU 14 HG2 GLU 14 20.290 0.615 -12.628
93 2HG GLU 14 HG1 GLU 14 21.151 1.582 -11.431
94 H LEU 15 HN LEU 15 22.881 0.588 -9.833
95 HA LEU 15 HA LEU 15 24.041 1.835 -8.329
96 1HB LEU 15 HB2 LEU 15 21.629 1.257 -6.643
97 2HB LEU 15 HB1 LEU 15 23.020 2.086 -5.977
98 HG LEU 15 HG LEU 15 20.849 3.130 -7.506
99 1HD1 LEU 15 HD11 LEU 15 21.256 4.591 -5.890
100 2HD1 LEU 15 HD12 LEU 15 22.568 5.201 -6.898
101 3HD1 LEU 15 HD13 LEU 15 22.897 3.988 -5.658
102 1HD2 LEU 15 HD21 LEU 15 23.534 3.272 -8.798
103 2HD2 LEU 15 HD22 LEU 15 22.467 4.672 -8.879
104 3HD2 LEU 15 HD23 LEU 15 21.940 3.122 -9.534
105 H ASN 16 HN ASN 16 23.529 -1.382 -8.158
106 HA ASN 16 HA ASN 16 24.586 -2.278 -5.787
107 1HB ASN 16 HB2 ASN 16 23.759 -3.558 -7.927
108 2HB ASN 16 HB1 ASN 16 25.476 -3.570 -8.332
109 1HD2 ASN 16 HD21 ASN 16 23.313 -4.213 -5.597
110 2HD2 ASN 16 HD22 ASN 16 24.169 -5.608 -5.037
111 H ARG 17 HN ARG 17 26.367 -1.103 -8.639
112 HA ARG 17 HA ARG 17 28.892 -1.563 -7.335
113 1HB ARG 17 HB2 ARG 17 29.867 -0.266 -9.192
114 2HB ARG 17 HB1 ARG 17 28.964 -1.700 -9.680
115 1HG ARG 17 HG2 ARG 17 27.338 -0.491 -10.717
116 2HG ARG 17 HG1 ARG 17 27.494 0.873 -9.604
117 1HD ARG 17 HD2 ARG 17 29.578 0.158 -11.643
118 2HD ARG 17 HD1 ARG 17 28.262 1.282 -11.970
119 HE ARG 17 HE ARG 17 30.655 1.828 -10.549
120 1HH1 ARG 17 HH11 ARG 17 27.230 2.617 -10.519
121 2HH1 ARG 17 HH12 ARG 17 27.480 4.182 -9.797
122 1HH2 ARG 17 HH21 ARG 17 30.974 3.862 -9.632
123 2HH2 ARG 17 HH22 ARG 17 29.611 4.905 -9.328
124 H TYR 18 HN TYR 18 26.605 1.000 -7.313
125 HA TYR 18 HA TYR 18 28.478 2.964 -6.384
126 1HB TYR 18 HB2 TYR 18 26.677 4.220 -6.897
127 2HB TYR 18 HB1 TYR 18 25.606 2.827 -6.858
128 HD1 TYR 18 HD1 TYR 18 27.043 5.572 -4.855
129 HD2 TYR 18 HD2 TYR 18 24.284 2.338 -4.922
130 HE1 TYR 18 HE1 TYR 18 26.007 6.417 -2.788
131 HE2 TYR 18 HE2 TYR 18 23.237 3.163 -2.870
132 HH TYR 18 HH TYR 18 23.437 6.086 -1.739
133 H TYR 19 HN TYR 19 26.397 0.521 -5.024
134 HA TYR 19 HA TYR 19 27.006 0.983 -2.275
135 1HB TYR 19 HB2 TYR 19 25.776 -1.245 -3.868
136 2HB TYR 19 HB1 TYR 19 26.194 -1.511 -2.181
137 HD1 TYR 19 HD1 TYR 19 24.991 -0.346 -0.417
138 HD2 TYR 19 HD2 TYR 19 23.928 0.168 -4.501
139 HE1 TYR 19 HE1 TYR 19 22.829 0.596 0.275
140 HE2 TYR 19 HE2 TYR 19 21.763 1.111 -3.827
141 HH TYR 19 HH TYR 19 20.236 0.851 -1.617
142 H ALA 20 HN ALA 20 28.507 -0.673 -4.868
143 HA ALA 20 HA ALA 20 30.178 -2.372 -3.247
144 1HB ALA 20 HB1 ALA 20 31.023 -3.170 -5.408
145 2HB ALA 20 HB2 ALA 20 30.059 -1.935 -6.224
146 3HB ALA 20 HB3 ALA 20 29.261 -3.225 -5.321
147 H SER 21 HN SER 21 30.559 0.383 -5.438
148 HA SER 21 HA SER 21 33.336 0.686 -4.956
149 1HB SER 21 HB2 SER 21 31.501 1.780 -6.720
150 2HB SER 21 HB1 SER 21 31.876 3.139 -5.646
151 HG SER 21 HG SER 21 33.983 3.044 -6.229
152 H LEU 22 HN LEU 22 30.384 1.819 -3.454
153 HA LEU 22 HA LEU 22 31.542 3.484 -1.461
154 1HB LEU 22 HB2 LEU 22 28.970 2.402 -2.058
155 2HB LEU 22 HB1 LEU 22 29.342 2.004 -0.392
156 HG LEU 22 HG LEU 22 29.294 4.775 -1.587
157 1HD1 LEU 22 HD11 LEU 22 27.342 3.112 -0.113
158 2HD1 LEU 22 HD12 LEU 22 27.081 4.364 -1.326
159 3HD1 LEU 22 HD13 LEU 22 27.448 4.815 0.341
160 1HD2 LEU 22 HD21 LEU 22 30.959 4.751 0.116
161 2HD2 LEU 22 HD22 LEU 22 29.935 3.803 1.192
162 3HD2 LEU 22 HD23 LEU 22 29.511 5.472 0.815
163 H ARG 23 HN ARG 23 30.878 0.003 -1.698
164 HA ARG 23 HA ARG 23 31.823 -0.469 0.967
165 1HB ARG 23 HB2 ARG 23 30.254 -1.926 -0.626
166 2HB ARG 23 HB1 ARG 23 31.796 -2.731 -0.928
167 1HG ARG 23 HG2 ARG 23 31.670 -2.301 1.839
168 2HG ARG 23 HG1 ARG 23 30.085 -2.929 1.359
169 1HD ARG 23 HD2 ARG 23 30.925 -4.962 0.810
170 2HD ARG 23 HD1 ARG 23 32.447 -4.289 0.222
171 HE ARG 23 HE ARG 23 33.318 -4.382 2.375
172 1HH1 ARG 23 HH11 ARG 23 29.956 -5.398 2.340
173 2HH1 ARG 23 HH12 ARG 23 29.994 -5.986 3.981
174 1HH2 ARG 23 HH21 ARG 23 33.343 -5.118 4.551
175 2HH2 ARG 23 HH22 ARG 23 31.906 -5.830 5.225
176 H HIS 24 HN HIS 24 33.370 -0.364 -2.148
177 HA HIS 24 HA HIS 24 35.781 -1.606 -1.295
178 1HB HIS 24 HB2 HIS 24 34.897 -0.832 -3.718
179 2HB HIS 24 HB1 HIS 24 35.937 0.538 -3.341
180 HD1 HIS 24 HD1 HIS 24 38.381 0.229 -3.771
181 HD2 HIS 24 HD2 HIS 24 36.334 -3.387 -3.583
182 HE1 HIS 24 HE1 HIS 24 40.061 -1.537 -4.399
183 HE2 HIS 24 HE2 HIS 24 38.845 -3.730 -4.114
184 H TYR 25 HN TYR 25 34.525 1.663 -1.311
185 HA TYR 25 HA TYR 25 36.761 2.931 -0.176
186 1HB TYR 25 HB2 TYR 25 35.260 4.482 -0.949
187 2HB TYR 25 HB1 TYR 25 33.864 3.540 -0.447
188 HD1 TYR 25 HD1 TYR 25 32.556 4.535 1.119
189 HD2 TYR 25 HD2 TYR 25 36.747 5.241 1.240
190 HE1 TYR 25 HE1 TYR 25 32.245 5.990 3.061
191 HE2 TYR 25 HE2 TYR 25 36.455 6.691 3.194
192 HH TYR 25 HH TYR 25 33.391 6.967 4.850
193 H LEU 26 HN LEU 26 33.893 1.423 1.306
194 HA LEU 26 HA LEU 26 34.599 1.877 3.982
195 1HB LEU 26 HB2 LEU 26 33.006 -0.359 2.730
196 2HB LEU 26 HB1 LEU 26 33.147 -0.119 4.461
197 HG LEU 26 HG LEU 26 32.070 2.020 2.640
198 1HD1 LEU 26 HD11 LEU 26 30.606 0.219 2.241
199 2HD1 LEU 26 HD12 LEU 26 29.815 1.219 3.458
200 3HD1 LEU 26 HD13 LEU 26 30.621 -0.274 3.936
201 1HD2 LEU 26 HD21 LEU 26 32.445 3.075 4.618
202 2HD2 LEU 26 HD22 LEU 26 32.316 1.593 5.563
203 3HD2 LEU 26 HD23 LEU 26 30.858 2.396 4.980
204 H ASN 27 HN ASN 27 35.028 -1.070 2.050
205 HA ASN 27 HA ASN 27 36.655 -2.522 3.737
206 1HB ASN 27 HB2 ASN 27 35.961 -2.562 0.939
207 2HB ASN 27 HB1 ASN 27 37.662 -2.969 1.141
208 1HD2 ASN 27 HD21 ASN 27 38.120 -4.989 1.558
209 2HD2 ASN 27 HD22 ASN 27 37.032 -6.176 2.189
210 H LEU 28 HN LEU 28 37.534 0.279 1.810
211 HA LEU 28 HA LEU 28 40.364 -0.116 2.230
212 1HB LEU 28 HB2 LEU 28 39.598 1.088 0.235
213 2HB LEU 28 HB1 LEU 28 38.897 2.330 1.279
214 HG LEU 28 HG LEU 28 41.409 2.307 2.225
215 1HD1 LEU 28 HD11 LEU 28 41.751 0.668 0.112
216 2HD1 LEU 28 HD12 LEU 28 43.012 1.737 0.730
217 3HD1 LEU 28 HD13 LEU 28 42.047 2.224 -0.663
218 1HD2 LEU 28 HD21 LEU 28 41.510 4.095 0.068
219 2HD2 LEU 28 HD22 LEU 28 40.980 4.431 1.716
220 3HD2 LEU 28 HD23 LEU 28 39.805 3.960 0.489
221 H VAL 29 HN VAL 29 38.052 2.289 3.215
222 HA VAL 29 HA VAL 29 39.695 3.853 4.749
223 HB VAL 29 HB VAL 29 37.474 4.548 3.997
224 1HG1 VAL 29 HG11 VAL 29 35.722 3.244 4.325
225 2HG1 VAL 29 HG12 VAL 29 35.768 3.680 6.037
226 3HG1 VAL 29 HG13 VAL 29 36.620 2.238 5.469
227 1HG2 VAL 29 HG21 VAL 29 37.574 4.794 6.988
228 2HG2 VAL 29 HG22 VAL 29 36.934 5.941 5.813
229 3HG2 VAL 29 HG23 VAL 29 38.671 5.665 5.917
230 H THR 30 HN THR 30 38.139 0.861 5.630
231 HA THR 30 HA THR 30 38.629 1.039 8.435
232 HB THR 30 HB THR 30 36.991 -0.528 7.409
233 HG1 THR 30 HG1 THR 30 37.245 -1.895 9.028
234 1HG2 THR 30 HG21 THR 30 39.454 -2.006 6.508
235 2HG2 THR 30 HG22 THR 30 38.242 -1.237 5.477
236 3HG2 THR 30 HG23 THR 30 37.809 -2.641 6.456
237 H ARG 31 HN ARG 31 40.765 1.242 6.073
238 HA ARG 31 HA ARG 31 42.841 -0.507 6.416
239 1HB ARG 31 HB2 ARG 31 42.479 1.827 5.038
240 2HB ARG 31 HB1 ARG 31 43.704 2.290 6.214
241 1HG ARG 31 HG2 ARG 31 45.247 0.726 5.398
242 2HG ARG 31 HG1 ARG 31 44.000 -0.172 4.524
243 1HD ARG 31 HD2 ARG 31 43.737 1.623 2.946
244 2HD ARG 31 HD1 ARG 31 44.828 2.652 3.873
245 HE ARG 31 HE ARG 31 45.604 0.305 2.274
246 1HH1 ARG 31 HH11 ARG 31 46.443 3.255 3.967
247 2HH1 ARG 31 HH12 ARG 31 48.107 3.224 3.452
248 1HH2 ARG 31 HH21 ARG 31 47.779 0.267 1.593
249 2HH2 ARG 31 HH22 ARG 31 48.874 1.508 2.129
250 H GLN 32 HN GLN 32 42.302 2.532 8.146
251 HA GLN 32 HA GLN 32 44.355 1.802 10.107
252 1HB GLN 32 HB2 GLN 32 43.247 4.354 10.689
253 2HB GLN 32 HB1 GLN 32 44.852 3.980 10.084
254 1HG GLN 32 HG2 GLN 32 44.197 5.341 8.417
255 2HG GLN 32 HG1 GLN 32 43.516 3.844 7.785
256 1HE2 GLN 32 HE21 GLN 32 41.708 4.581 10.437
257 2HE2 GLN 32 HE22 GLN 32 40.453 5.496 9.677
258 H ARG 33 HN ARG 33 40.949 2.502 9.766
259 HA ARG 33 HA ARG 33 39.156 2.319 11.128
260 1HB ARG 33 HB2 ARG 33 41.021 0.268 12.124
261 2HB ARG 33 HB1 ARG 33 39.788 0.766 13.272
262 1HG ARG 33 HG2 ARG 33 38.051 0.002 11.928
263 2HG ARG 33 HG1 ARG 33 39.059 -0.025 10.478
264 1HD ARG 33 HD2 ARG 33 38.459 -2.193 12.064
265 2HD ARG 33 HD1 ARG 33 39.779 -2.101 10.897
266 HE ARG 33 HE ARG 33 41.267 -1.557 12.703
267 1HH1 ARG 33 HH11 ARG 33 38.112 -2.737 13.662
268 2HH1 ARG 33 HH12 ARG 33 38.585 -3.044 15.306
269 1HH2 ARG 33 HH21 ARG 33 41.896 -1.962 14.849
270 2HH2 ARG 33 HH22 ARG 33 40.742 -2.607 15.985
271 H TYR 34 HN TYR 34 38.895 2.147 13.871
272 HA TYR 34 HA TYR 34 40.304 4.533 14.845
273 1HB TYR 34 HB2 TYR 34 37.557 4.038 15.860
274 2HB TYR 34 HB1 TYR 34 38.368 5.561 15.504
275 HD1 TYR 34 HD1 TYR 34 38.438 6.411 13.170
276 HD2 TYR 34 HD2 TYR 34 36.196 2.950 14.228
277 HE1 TYR 34 HE1 TYR 34 37.199 6.571 11.056
278 HE2 TYR 34 HE2 TYR 34 34.952 3.100 12.113
279 HH TYR 34 HH TYR 34 34.375 5.030 10.446
280 1HN NH2 35 H1 NH2 35 41.267 2.413 17.467
281 2HN NH2 35 H2 NH2 35 41.754 3.405 16.135
Start of MODEL 20
1 1H ILE 1 HT1 ILE 1 31.823 14.998 -1.298
2 2H ILE 1 HT2 ILE 1 31.888 14.078 -2.719
3 3H ILE 1 HT3 ILE 1 33.281 14.862 -2.156
4 HA ILE 1 HA ILE 1 32.883 12.320 -1.748
5 HB ILE 1 HB ILE 1 34.059 12.757 0.598
6 1HG1 ILE 1 HG12 ILE 1 35.017 15.251 -0.656
7 2HG1 ILE 1 HG11 ILE 1 33.386 15.333 0.006
8 1HG2 ILE 1 HG21 ILE 1 34.896 12.455 -2.093
9 2HG2 ILE 1 HG22 ILE 1 35.747 11.998 -0.617
10 3HG2 ILE 1 HG23 ILE 1 35.981 13.602 -1.310
11 1HD1 ILE 1 HD11 ILE 1 35.344 15.993 1.506
12 2HD1 ILE 1 HD12 ILE 1 35.664 14.262 1.621
13 3HD1 ILE 1 HD13 ILE 1 34.118 14.910 2.169
14 H LYS 2 HN LYS 2 30.308 12.745 -1.526
15 HA LYS 2 HA LYS 2 29.620 11.552 0.978
16 1HB LYS 2 HB2 LYS 2 29.525 14.397 0.859
17 2HB LYS 2 HB1 LYS 2 27.870 13.808 0.870
18 1HG LYS 2 HG2 LYS 2 29.639 12.528 2.824
19 2HG LYS 2 HG1 LYS 2 29.365 14.252 3.078
20 1HD LYS 2 HD2 LYS 2 26.979 13.915 3.110
21 2HD LYS 2 HD1 LYS 2 27.176 12.213 2.688
22 1HE LYS 2 HE2 LYS 2 26.772 12.276 5.018
23 2HE LYS 2 HE1 LYS 2 28.496 11.961 4.822
24 1HZ LYS 2 HZ1 LYS 2 27.847 13.679 6.535
25 2HZ LYS 2 HZ2 LYS 2 27.433 14.693 5.242
26 3HZ LYS 2 HZ3 LYS 2 29.029 14.152 5.415
27 HA PRO 3 HA PRO 3 26.775 10.352 -2.373
28 1HB PRO 3 HB2 PRO 3 26.429 7.816 -1.514
29 2HB PRO 3 HB1 PRO 3 27.847 8.308 -2.444
30 1HG PRO 3 HG2 PRO 3 27.563 7.919 0.511
31 2HG PRO 3 HG1 PRO 3 28.882 7.419 -0.567
32 1HD PRO 3 HD2 PRO 3 29.002 9.645 0.996
33 2HD PRO 3 HD1 PRO 3 29.848 9.500 -0.556
34 H GLU 4 HN GLU 4 24.526 9.902 -2.336
35 HA GLU 4 HA GLU 4 23.287 10.172 0.320
36 1HB GLU 4 HB2 GLU 4 22.924 11.728 -2.101
37 2HB GLU 4 HB1 GLU 4 21.404 11.033 -1.552
38 1HG GLU 4 HG2 GLU 4 23.260 12.806 0.019
39 2HG GLU 4 HG1 GLU 4 21.662 13.216 -0.603
40 H ALA 5 HN ALA 5 20.901 9.453 0.213
41 HA ALA 5 HA ALA 5 20.974 6.665 -0.461
42 1HB ALA 5 HB1 ALA 5 18.394 7.777 0.357
43 2HB ALA 5 HB2 ALA 5 19.721 8.113 1.467
44 3HB ALA 5 HB3 ALA 5 19.329 6.447 1.042
45 HA PRO 6 HA PRO 6 19.125 7.009 -4.474
46 1HB PRO 6 HB2 PRO 6 18.508 4.161 -4.230
47 2HB PRO 6 HB1 PRO 6 19.617 4.971 -5.337
48 1HG PRO 6 HG2 PRO 6 20.492 3.414 -3.319
49 2HG PRO 6 HG1 PRO 6 21.389 4.845 -3.864
50 1HD PRO 6 HD2 PRO 6 19.573 4.534 -1.496
51 2HD PRO 6 HD1 PRO 6 21.147 5.353 -1.606
52 H GLY 7 HN GLY 7 17.332 4.317 -3.174
53 1HA GLY 7 HA2 GLY 7 14.938 5.873 -2.728
54 2HA GLY 7 HA1 GLY 7 14.890 4.890 -4.183
55 H GLU 8 HN GLU 8 13.037 3.946 -3.057
56 HA GLU 8 HA GLU 8 13.563 2.309 -0.725
57 1HB GLU 8 HB2 GLU 8 11.118 2.929 -2.363
58 2HB GLU 8 HB1 GLU 8 11.100 1.654 -1.152
59 1HG GLU 8 HG2 GLU 8 12.092 4.330 -0.351
60 2HG GLU 8 HG1 GLU 8 10.359 4.116 -0.595
61 H ASP 9 HN ASP 9 13.876 1.943 -4.015
62 HA ASP 9 HA ASP 9 14.376 -0.815 -3.889
63 1HB ASP 9 HB2 ASP 9 12.481 -1.774 -4.629
64 2HB ASP 9 HB1 ASP 9 11.675 -0.258 -4.264
65 H ALA 10 HN ALA 10 16.148 -0.717 -4.906
66 HA ALA 10 HA ALA 10 16.475 1.003 -7.238
67 1HB ALA 10 HB1 ALA 10 18.242 1.330 -5.753
68 2HB ALA 10 HB2 ALA 10 18.917 0.248 -6.971
69 3HB ALA 10 HB3 ALA 10 18.398 -0.393 -5.412
70 H SER 11 HN SER 11 14.824 -0.895 -7.989
71 HA SER 11 HA SER 11 14.476 -2.481 -9.585
72 1HB SER 11 HB2 SER 11 17.321 -2.112 -10.502
73 2HB SER 11 HB1 SER 11 15.871 -2.360 -11.470
74 HG SER 11 HG SER 11 15.610 -0.103 -10.030
75 HA PRO 12 HA PRO 12 16.583 -6.363 -8.408
76 1HB PRO 12 HB2 PRO 12 17.607 -7.490 -10.669
77 2HB PRO 12 HB1 PRO 12 15.891 -7.546 -10.247
78 1HG PRO 12 HG2 PRO 12 17.319 -5.709 -12.128
79 2HG PRO 12 HG1 PRO 12 15.765 -6.538 -12.338
80 1HD PRO 12 HD2 PRO 12 15.919 -3.941 -11.643
81 2HD PRO 12 HD1 PRO 12 14.629 -5.002 -11.043
82 H GLU 13 HN GLU 13 18.091 -4.347 -7.695
83 HA GLU 13 HA GLU 13 20.168 -4.085 -6.803
84 1HB GLU 13 HB2 GLU 13 20.680 -6.547 -8.416
85 2HB GLU 13 HB1 GLU 13 22.061 -5.620 -7.850
86 1HG GLU 13 HG2 GLU 13 20.680 -5.792 -5.562
87 2HG GLU 13 HG1 GLU 13 20.130 -7.268 -6.349
88 H GLU 14 HN GLU 14 19.235 -2.424 -8.715
89 HA GLU 14 HA GLU 14 21.527 -1.726 -10.340
90 1HB GLU 14 HB2 GLU 14 19.083 -1.210 -10.948
91 2HB GLU 14 HB1 GLU 14 19.153 0.028 -9.707
92 1HG GLU 14 HG2 GLU 14 19.578 0.650 -12.183
93 2HG GLU 14 HG1 GLU 14 20.580 1.358 -10.919
94 H LEU 15 HN LEU 15 22.570 0.428 -9.943
95 HA LEU 15 HA LEU 15 23.848 1.758 -8.593
96 1HB LEU 15 HB2 LEU 15 21.550 1.240 -6.731
97 2HB LEU 15 HB1 LEU 15 22.983 2.082 -6.168
98 HG LEU 15 HG LEU 15 22.202 3.308 -8.577
99 1HD1 LEU 15 HD11 LEU 15 19.899 3.920 -7.045
100 2HD1 LEU 15 HD12 LEU 15 19.966 2.173 -7.272
101 3HD1 LEU 15 HD13 LEU 15 19.995 3.244 -8.673
102 1HD2 LEU 15 HD21 LEU 15 21.929 5.263 -7.160
103 2HD2 LEU 15 HD22 LEU 15 23.379 4.357 -6.717
104 3HD2 LEU 15 HD23 LEU 15 21.922 4.231 -5.729
105 H ASN 16 HN ASN 16 23.550 -1.400 -8.431
106 HA ASN 16 HA ASN 16 24.513 -2.340 -6.050
107 1HB ASN 16 HB2 ASN 16 23.873 -3.569 -8.289
108 2HB ASN 16 HB1 ASN 16 25.618 -3.542 -8.544
109 1HD2 ASN 16 HD21 ASN 16 23.535 -4.003 -5.713
110 2HD2 ASN 16 HD22 ASN 16 24.240 -5.499 -5.221
111 H ARG 17 HN ARG 17 26.492 -1.152 -8.787
112 HA ARG 17 HA ARG 17 28.879 -1.658 -7.262
113 1HB ARG 17 HB2 ARG 17 30.084 -0.517 -9.072
114 2HB ARG 17 HB1 ARG 17 29.126 -1.895 -9.604
115 1HG ARG 17 HG2 ARG 17 28.398 -0.517 -11.210
116 2HG ARG 17 HG1 ARG 17 27.382 0.183 -9.951
117 1HD ARG 17 HD2 ARG 17 28.417 2.126 -10.230
118 2HD ARG 17 HD1 ARG 17 29.922 1.377 -9.702
119 HE ARG 17 HE ARG 17 29.123 1.994 -12.417
120 1HH1 ARG 17 HH11 ARG 17 31.325 0.196 -10.360
121 2HH1 ARG 17 HH12 ARG 17 32.532 0.029 -11.591
122 1HH2 ARG 17 HH21 ARG 17 30.722 1.813 -14.021
123 2HH2 ARG 17 HH22 ARG 17 32.196 0.945 -13.674
124 H TYR 18 HN TYR 18 26.676 0.957 -7.446
125 HA TYR 18 HA TYR 18 28.550 2.918 -6.520
126 1HB TYR 18 HB2 TYR 18 26.761 4.160 -7.146
127 2HB TYR 18 HB1 TYR 18 25.672 2.786 -7.038
128 HD1 TYR 18 HD1 TYR 18 27.101 5.643 -5.211
129 HD2 TYR 18 HD2 TYR 18 24.368 2.397 -5.080
130 HE1 TYR 18 HE1 TYR 18 26.047 6.618 -3.212
131 HE2 TYR 18 HE2 TYR 18 23.311 3.344 -3.092
132 HH TYR 18 HH TYR 18 23.661 6.449 -2.101
133 H TYR 19 HN TYR 19 26.347 0.586 -5.150
134 HA TYR 19 HA TYR 19 26.896 1.117 -2.405
135 1HB TYR 19 HB2 TYR 19 25.614 -1.105 -3.956
136 2HB TYR 19 HB1 TYR 19 25.973 -1.333 -2.251
137 HD1 TYR 19 HD1 TYR 19 24.846 0.070 -0.563
138 HD2 TYR 19 HD2 TYR 19 23.802 0.243 -4.681
139 HE1 TYR 19 HE1 TYR 19 22.703 1.116 0.038
140 HE2 TYR 19 HE2 TYR 19 21.648 1.286 -4.097
141 HH TYR 19 HH TYR 19 20.775 1.913 -0.689
142 H ALA 20 HN ALA 20 28.401 -0.711 -4.875
143 HA ALA 20 HA ALA 20 29.861 -2.470 -3.111
144 1HB ALA 20 HB1 ALA 20 30.636 -3.509 -5.177
145 2HB ALA 20 HB2 ALA 20 29.860 -2.225 -6.112
146 3HB ALA 20 HB3 ALA 20 28.879 -3.344 -5.161
147 H SER 21 HN SER 21 30.496 0.145 -5.410
148 HA SER 21 HA SER 21 33.292 0.206 -4.868
149 1HB SER 21 HB2 SER 21 31.394 1.652 -6.537
150 2HB SER 21 HB1 SER 21 32.549 2.750 -5.769
151 HG SER 21 HG SER 21 33.965 2.068 -7.155
152 H LEU 22 HN LEU 22 30.404 1.641 -3.503
153 HA LEU 22 HA LEU 22 31.687 3.291 -1.566
154 1HB LEU 22 HB2 LEU 22 29.035 2.461 -2.170
155 2HB LEU 22 HB1 LEU 22 29.331 2.054 -0.492
156 HG LEU 22 HG LEU 22 29.714 4.807 -1.669
157 1HD1 LEU 22 HD11 LEU 22 27.542 5.196 -1.390
158 2HD1 LEU 22 HD12 LEU 22 27.591 4.559 0.254
159 3HD1 LEU 22 HD13 LEU 22 27.321 3.469 -1.105
160 1HD2 LEU 22 HD21 LEU 22 30.246 5.545 0.437
161 2HD2 LEU 22 HD22 LEU 22 30.965 3.935 0.476
162 3HD2 LEU 22 HD23 LEU 22 29.399 4.220 1.234
163 H ARG 23 HN ARG 23 30.703 -0.120 -1.662
164 HA ARG 23 HA ARG 23 31.540 -0.672 1.005
165 1HB ARG 23 HB2 ARG 23 29.950 -2.113 -0.112
166 2HB ARG 23 HB1 ARG 23 31.149 -2.547 -1.323
167 1HG ARG 23 HG2 ARG 23 32.336 -3.094 1.161
168 2HG ARG 23 HG1 ARG 23 30.677 -3.700 1.267
169 1HD ARG 23 HD2 ARG 23 31.047 -5.340 -0.252
170 2HD ARG 23 HD1 ARG 23 32.088 -4.318 -1.243
171 HE ARG 23 HE ARG 23 33.906 -4.812 0.263
172 1HH1 ARG 23 HH11 ARG 23 31.054 -6.802 0.618
173 2HH1 ARG 23 HH12 ARG 23 31.897 -8.098 1.416
174 1HH2 ARG 23 HH21 ARG 23 35.027 -6.507 1.343
175 2HH2 ARG 23 HH22 ARG 23 34.154 -7.931 1.832
176 H HIS 24 HN HIS 24 33.184 -0.827 -2.104
177 HA HIS 24 HA HIS 24 35.539 -2.072 -1.125
178 1HB HIS 24 HB2 HIS 24 34.818 -1.794 -3.571
179 2HB HIS 24 HB1 HIS 24 35.439 -0.150 -3.452
180 HD1 HIS 24 HD1 HIS 24 36.614 -3.743 -3.203
181 HD2 HIS 24 HD2 HIS 24 38.159 0.083 -3.739
182 HE1 HIS 24 HE1 HIS 24 39.060 -4.056 -3.701
183 HE2 HIS 24 HE2 HIS 24 40.005 -1.723 -3.826
184 H TYR 25 HN TYR 25 34.489 1.259 -1.522
185 HA TYR 25 HA TYR 25 36.757 2.554 -0.533
186 1HB TYR 25 HB2 TYR 25 35.102 3.912 -1.518
187 2HB TYR 25 HB1 TYR 25 33.819 3.195 -0.561
188 HD1 TYR 25 HD1 TYR 25 32.805 4.934 0.538
189 HD2 TYR 25 HD2 TYR 25 37.056 4.722 0.521
190 HE1 TYR 25 HE1 TYR 25 32.893 6.819 2.096
191 HE2 TYR 25 HE2 TYR 25 37.164 6.608 2.091
192 HH TYR 25 HH TYR 25 35.150 7.559 3.974
193 H LEU 26 HN LEU 26 33.862 1.379 1.174
194 HA LEU 26 HA LEU 26 34.637 1.960 3.772
195 1HB LEU 26 HB2 LEU 26 32.987 -0.315 2.693
196 2HB LEU 26 HB1 LEU 26 33.171 0.006 4.407
197 HG LEU 26 HG LEU 26 31.994 1.944 2.417
198 1HD1 LEU 26 HD11 LEU 26 29.952 1.288 4.028
199 2HD1 LEU 26 HD12 LEU 26 30.821 -0.244 4.007
200 3HD1 LEU 26 HD13 LEU 26 30.279 0.482 2.492
201 1HD2 LEU 26 HD21 LEU 26 32.952 3.104 4.283
202 2HD2 LEU 26 HD22 LEU 26 32.201 1.988 5.423
203 3HD2 LEU 26 HD23 LEU 26 31.199 3.088 4.476
204 H ASN 27 HN ASN 27 35.107 -1.042 1.956
205 HA ASN 27 HA ASN 27 36.556 -2.489 3.814
206 1HB ASN 27 HB2 ASN 27 36.047 -2.610 0.963
207 2HB ASN 27 HB1 ASN 27 37.664 -3.188 1.351
208 1HD2 ASN 27 HD21 ASN 27 35.052 -3.422 3.631
209 2HD2 ASN 27 HD22 ASN 27 34.882 -5.145 3.563
210 H LEU 28 HN LEU 28 37.715 0.063 1.674
211 HA LEU 28 HA LEU 28 40.472 -0.465 2.353
212 1HB LEU 28 HB2 LEU 28 39.989 0.527 0.172
213 2HB LEU 28 HB1 LEU 28 39.253 1.915 0.980
214 HG LEU 28 HG LEU 28 41.677 1.890 2.168
215 1HD1 LEU 28 HD11 LEU 28 43.316 1.679 0.249
216 2HD1 LEU 28 HD12 LEU 28 42.042 0.837 -0.632
217 3HD1 LEU 28 HD13 LEU 28 42.662 0.164 0.878
218 1HD2 LEU 28 HD21 LEU 28 41.916 3.410 -0.244
219 2HD2 LEU 28 HD22 LEU 28 41.559 3.973 1.390
220 3HD2 LEU 28 HD23 LEU 28 40.247 3.487 0.316
221 H VAL 29 HN VAL 29 38.255 2.171 2.871
222 HA VAL 29 HA VAL 29 39.888 3.829 4.311
223 HB VAL 29 HB VAL 29 37.694 4.480 3.374
224 1HG1 VAL 29 HG11 VAL 29 35.846 3.399 3.918
225 2HG1 VAL 29 HG12 VAL 29 35.991 4.003 5.571
226 3HG1 VAL 29 HG13 VAL 29 36.725 2.458 5.130
227 1HG2 VAL 29 HG21 VAL 29 37.085 5.582 5.860
228 2HG2 VAL 29 HG22 VAL 29 38.104 6.280 4.600
229 3HG2 VAL 29 HG23 VAL 29 38.828 5.310 5.884
230 H THR 30 HN THR 30 38.128 1.039 5.439
231 HA THR 30 HA THR 30 38.479 1.547 8.229
232 HB THR 30 HB THR 30 36.730 0.042 7.279
233 HG1 THR 30 HG1 THR 30 37.457 -1.796 8.866
234 1HG2 THR 30 HG21 THR 30 39.105 -1.730 6.744
235 2HG2 THR 30 HG22 THR 30 37.923 -1.118 5.585
236 3HG2 THR 30 HG23 THR 30 37.438 -2.312 6.790
237 H ARG 31 HN ARG 31 40.781 1.307 6.073
238 HA ARG 31 HA ARG 31 42.591 -0.647 6.678
239 1HB ARG 31 HB2 ARG 31 42.835 1.129 4.936
240 2HB ARG 31 HB1 ARG 31 43.297 2.249 6.212
241 1HG ARG 31 HG2 ARG 31 45.326 1.204 6.579
242 2HG ARG 31 HG1 ARG 31 44.778 -0.320 5.878
243 1HD ARG 31 HD2 ARG 31 46.147 0.472 4.210
244 2HD ARG 31 HD1 ARG 31 44.575 1.086 3.693
245 HE ARG 31 HE ARG 31 45.266 3.239 4.164
246 1HH1 ARG 31 HH11 ARG 31 47.640 0.970 5.412
247 2HH1 ARG 31 HH12 ARG 31 48.872 2.184 5.612
248 1HH2 ARG 31 HH21 ARG 31 46.849 4.822 4.461
249 2HH2 ARG 31 HH22 ARG 31 48.415 4.382 5.087
250 H GLN 32 HN GLN 32 42.149 2.456 8.296
251 HA GLN 32 HA GLN 32 43.869 1.553 10.506
252 1HB GLN 32 HB2 GLN 32 43.463 4.203 11.009
253 2HB GLN 32 HB1 GLN 32 44.842 3.558 10.132
254 1HG GLN 32 HG2 GLN 32 44.211 5.134 8.647
255 2HG GLN 32 HG1 GLN 32 43.154 3.844 8.087
256 1HE2 GLN 32 HE21 GLN 32 40.982 3.794 9.315
257 2HE2 GLN 32 HE22 GLN 32 40.214 5.327 9.516
258 H ARG 33 HN ARG 33 40.798 1.518 9.658
259 HA ARG 33 HA ARG 33 38.758 1.591 10.630
260 1HB ARG 33 HB2 ARG 33 40.500 0.104 12.246
261 2HB ARG 33 HB1 ARG 33 39.540 1.080 13.352
262 1HG ARG 33 HG2 ARG 33 37.964 -0.469 13.170
263 2HG ARG 33 HG1 ARG 33 37.694 0.133 11.532
264 1HD ARG 33 HD2 ARG 33 38.023 -2.133 11.184
265 2HD ARG 33 HD1 ARG 33 39.625 -1.461 10.888
266 HE ARG 33 HE ARG 33 39.089 -2.405 13.591
267 1HH1 ARG 33 HH11 ARG 33 40.483 -3.046 10.449
268 2HH1 ARG 33 HH12 ARG 33 41.528 -4.312 11.019
269 1HH2 ARG 33 HH21 ARG 33 40.443 -4.102 14.349
270 2HH2 ARG 33 HH22 ARG 33 41.483 -4.934 13.228
271 H TYR 34 HN TYR 34 39.641 2.332 13.811
272 HA TYR 34 HA TYR 34 38.785 5.122 13.424
273 1HB TYR 34 HB2 TYR 34 38.398 3.475 15.932
274 2HB TYR 34 HB1 TYR 34 37.705 5.052 15.570
275 HD1 TYR 34 HD1 TYR 34 36.090 5.161 13.540
276 HD2 TYR 34 HD2 TYR 34 37.179 1.549 15.502
277 HE1 TYR 34 HE1 TYR 34 34.088 4.069 12.624
278 HE2 TYR 34 HE2 TYR 34 35.181 0.447 14.593
279 HH TYR 34 HH TYR 34 33.045 0.946 13.692
280 1HN NH2 35 H1 NH2 35 42.098 5.784 14.509
281 2HN NH2 35 H2 NH2 35 41.025 5.732 13.155