Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
4802 | 1fu9 RC | 4939 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1HT GLY 1 -21.770 9.927 -22.194
2 2H GLY 1 2HT GLY 1 -21.116 8.616 -23.039
3 3H GLY 1 3HT GLY 1 -20.250 10.064 -22.923
4 1HA GLY 1 1HA GLY 1 -20.095 9.773 -20.504
5 2HA GLY 1 2HA GLY 1 -20.907 8.226 -20.687
6 H SER 2 H SER 2 -18.055 9.333 -19.967
7 HA SER 2 HA SER 2 -16.470 7.722 -21.814
8 1HB SER 2 2HB SER 2 -15.807 9.767 -19.715
9 2HB SER 2 1HB SER 2 -14.563 8.669 -20.310
10 HG SER 2 HG SER 2 -15.729 10.826 -21.531
11 H ALA 3 H ALA 3 -15.537 5.822 -21.303
12 HA ALA 3 HA ALA 3 -16.347 4.544 -18.833
13 1HB ALA 3 1HB ALA 3 -14.618 3.303 -20.948
14 2HB ALA 3 2HB ALA 3 -16.361 3.470 -21.154
15 3HB ALA 3 3HB ALA 3 -15.717 2.516 -19.816
16 H ALA 4 H ALA 4 -14.768 6.500 -18.026
17 HA ALA 4 HA ALA 4 -11.992 5.828 -17.941
18 1HB ALA 4 1HB ALA 4 -13.709 7.881 -16.617
19 2HB ALA 4 2HB ALA 4 -12.336 8.095 -17.702
20 3HB ALA 4 3HB ALA 4 -12.070 7.599 -16.030
21 H GLU 5 H GLU 5 -14.086 6.309 -15.113
22 HA GLU 5 HA GLU 5 -14.236 5.216 -13.126
23 1HB GLU 5 2HB GLU 5 -15.057 3.397 -14.606
24 2HB GLU 5 1HB GLU 5 -13.411 2.794 -14.737
25 1HG GLU 5 2HG GLU 5 -13.461 2.610 -12.194
26 2HG GLU 5 1HG GLU 5 -15.205 2.824 -12.339
27 H VAL 6 H VAL 6 -12.464 6.371 -12.249
28 HA VAL 6 HA VAL 6 -9.853 5.059 -12.302
29 HB VAL 6 HB VAL 6 -10.571 7.669 -10.966
30 1HG1 VAL 6 1HG1 VAL 6 -8.179 8.103 -11.079
31 2HG1 VAL 6 2HG1 VAL 6 -7.919 6.544 -11.862
32 3HG1 VAL 6 3HG1 VAL 6 -8.499 6.608 -10.198
33 1HG2 VAL 6 1HG2 VAL 6 -9.390 8.613 -13.060
34 2HG2 VAL 6 2HG2 VAL 6 -11.078 8.115 -13.191
35 3HG2 VAL 6 3HG2 VAL 6 -9.799 7.063 -13.796
36 H MET 7 H MET 7 -8.739 4.466 -10.410
37 HA MET 7 HA MET 7 -9.761 4.716 -7.803
38 1HB MET 7 2HB MET 7 -10.300 2.241 -7.485
39 2HB MET 7 1HB MET 7 -11.499 3.215 -8.325
40 1HG MET 7 2HG MET 7 -10.644 2.384 -10.471
41 2HG MET 7 1HG MET 7 -9.491 1.373 -9.602
42 1HE MET 7 1HE MET 7 -13.067 2.436 -9.852
43 2HE MET 7 2HE MET 7 -13.446 1.697 -8.296
44 3HE MET 7 3HE MET 7 -14.022 0.956 -9.789
45 H LYS 8 H LYS 8 -7.413 5.313 -8.080
46 HA LYS 8 HA LYS 8 -5.613 3.014 -8.015
47 1HB LYS 8 2HB LYS 8 -5.072 5.987 -8.107
48 2HB LYS 8 1HB LYS 8 -3.814 4.760 -8.027
49 1HG LYS 8 2HG LYS 8 -3.837 4.993 -10.262
50 2HG LYS 8 1HG LYS 8 -5.189 3.864 -10.153
51 1HD LYS 8 2HD LYS 8 -6.707 5.429 -10.730
52 2HD LYS 8 1HD LYS 8 -5.894 6.700 -9.815
53 1HE LYS 8 2HE LYS 8 -4.111 6.219 -11.829
54 2HE LYS 8 1HE LYS 8 -5.656 5.961 -12.639
55 1HZ LYS 8 1HZ LYS 8 -4.524 8.409 -11.537
56 2HZ LYS 8 2HZ LYS 8 -6.195 8.208 -11.371
57 3HZ LYS 8 3HZ LYS 8 -5.489 8.184 -12.908
58 H LYS 9 H LYS 9 -7.229 3.000 -5.868
59 HA LYS 9 HA LYS 9 -5.351 3.266 -3.701
60 1HB LYS 9 2HB LYS 9 -7.839 4.964 -3.822
61 2HB LYS 9 1HB LYS 9 -7.039 4.578 -2.305
62 1HG LYS 9 2HG LYS 9 -6.019 6.549 -2.726
63 2HG LYS 9 1HG LYS 9 -4.932 5.502 -3.642
64 1HD LYS 9 2HD LYS 9 -5.360 6.808 -5.401
65 2HD LYS 9 1HD LYS 9 -6.965 6.074 -5.433
66 1HE LYS 9 2HE LYS 9 -7.227 8.453 -5.451
67 2HE LYS 9 1HE LYS 9 -7.740 7.852 -3.875
68 1HZ LYS 9 1HZ LYS 9 -5.466 8.438 -3.067
69 2HZ LYS 9 2HZ LYS 9 -6.420 9.763 -3.508
70 3HZ LYS 9 3HZ LYS 9 -5.197 9.222 -4.543
71 H TYR 10 H TYR 10 -6.470 1.021 -4.825
72 HA TYR 10 HA TYR 10 -7.672 -0.204 -2.545
73 1HB TYR 10 2HB TYR 10 -9.674 0.860 -3.463
74 2HB TYR 10 1HB TYR 10 -9.365 0.122 -5.031
75 HD1 TYR 10 1HD TYR 10 -9.684 -2.302 -5.346
76 HD2 TYR 10 2HD TYR 10 -10.667 -0.393 -1.674
77 HE1 TYR 10 1HE TYR 10 -11.015 -4.262 -4.690
78 HE2 TYR 10 2HE TYR 10 -12.000 -2.348 -1.007
79 HH TYR 10 HH TYR 10 -11.863 -5.322 -2.675
80 H CYS 11 H CYS 11 -6.430 -1.963 -2.511
81 HA CYS 11 HA CYS 11 -5.572 -3.240 -4.966
82 1HB CYS 11 2HB CYS 11 -4.112 -2.925 -2.902
83 2HB CYS 11 1HB CYS 11 -5.064 -4.201 -2.150
84 H SER 12 H SER 12 -7.456 -4.093 -5.844
85 HA SER 12 HA SER 12 -9.458 -5.503 -4.582
86 1HB SER 12 2HB SER 12 -9.867 -6.583 -6.787
87 2HB SER 12 1HB SER 12 -9.640 -4.839 -6.910
88 HG SER 12 HG SER 12 -8.324 -6.699 -8.196
89 H THR 13 H THR 13 -6.368 -6.725 -5.801
90 HA THR 13 HA THR 13 -6.816 -9.451 -5.420
91 HB THR 13 HB THR 13 -4.138 -8.172 -4.934
92 HG1 THR 13 1HG THR 13 -5.300 -8.637 -7.475
93 1HG2 THR 13 1HG2 THR 13 -3.454 -10.114 -6.440
94 2HG2 THR 13 2HG2 THR 13 -5.059 -10.766 -6.105
95 3HG2 THR 13 3HG2 THR 13 -3.929 -10.483 -4.781
96 H CYS 14 H CYS 14 -5.968 -6.939 -3.141
97 HA CYS 14 HA CYS 14 -5.609 -8.898 -1.005
98 1HB CYS 14 2HB CYS 14 -5.009 -5.970 -1.289
99 2HB CYS 14 1HB CYS 14 -5.061 -6.727 0.293
100 H ASP 15 H ASP 15 -7.897 -6.622 -2.234
101 HA ASP 15 HA ASP 15 -10.059 -6.202 -1.655
102 1HB ASP 15 2HB ASP 15 -9.779 -8.711 -0.769
103 2HB ASP 15 1HB ASP 15 -9.986 -7.907 0.784
104 H ILE 16 H ILE 16 -8.262 -4.370 -0.938
105 HA ILE 16 HA ILE 16 -9.407 -3.287 1.506
106 HB ILE 16 HB ILE 16 -6.414 -3.256 1.261
107 1HG1 ILE 16 2HG1 ILE 16 -8.055 -5.301 2.777
108 2HG1 ILE 16 1HG1 ILE 16 -7.124 -5.625 1.319
109 1HG2 ILE 16 1HG2 ILE 16 -6.875 -1.736 2.865
110 2HG2 ILE 16 2HG2 ILE 16 -6.963 -3.173 3.885
111 3HG2 ILE 16 3HG2 ILE 16 -8.441 -2.451 3.247
112 1HD1 ILE 16 1HD1 ILE 16 -5.811 -6.384 3.104
113 2HD1 ILE 16 2HD1 ILE 16 -6.113 -4.929 4.053
114 3HD1 ILE 16 3HD1 ILE 16 -5.095 -4.849 2.615
115 H SER 17 H SER 17 -8.765 -0.994 1.835
116 HA SER 17 HA SER 17 -7.971 0.326 -0.672
117 1HB SER 17 2HB SER 17 -10.560 0.300 0.195
118 2HB SER 17 1HB SER 17 -9.961 1.775 0.955
119 HG SER 17 HG SER 17 -10.800 1.627 -1.439
120 H PHE 18 H PHE 18 -7.122 2.485 -0.403
121 HA PHE 18 HA PHE 18 -6.291 3.183 2.318
122 1HB PHE 18 2HB PHE 18 -4.340 3.191 0.014
123 2HB PHE 18 1HB PHE 18 -3.995 3.442 1.722
124 HD1 PHE 18 1HD PHE 18 -3.881 1.578 3.258
125 HD2 PHE 18 2HD PHE 18 -4.710 0.974 -0.872
126 HE1 PHE 18 1HE PHE 18 -3.410 -0.822 3.519
127 HE2 PHE 18 2HE PHE 18 -4.241 -1.428 -0.618
128 HZ PHE 18 HZ PHE 18 -3.591 -2.329 1.579
129 H ASN 19 H ASN 19 -6.956 5.187 2.665
130 HA ASN 19 HA ASN 19 -7.836 6.962 0.693
131 1HB ASN 19 2HB ASN 19 -8.164 6.900 3.325
132 2HB ASN 19 1HB ASN 19 -6.823 8.041 3.285
133 1HD2 ASN 19 1HD2 ASN 19 -9.907 7.434 1.638
134 2HD2 ASN 19 2HD2 ASN 19 -10.392 9.091 1.572
135 H TYR 20 H TYR 20 -4.702 6.626 2.266
136 HA TYR 20 HA TYR 20 -3.641 8.939 0.853
137 1HB TYR 20 2HB TYR 20 -2.096 7.019 2.592
138 2HB TYR 20 1HB TYR 20 -1.679 8.678 2.175
139 HD1 TYR 20 1HD TYR 20 -4.145 10.133 2.717
140 HD2 TYR 20 2HD TYR 20 -2.344 6.955 4.897
141 HE1 TYR 20 1HE TYR 20 -5.243 10.927 4.769
142 HE2 TYR 20 2HE TYR 20 -3.438 7.739 6.956
143 HH TYR 20 HH TYR 20 -4.795 10.744 7.287
144 H VAL 21 H VAL 21 -2.619 8.837 -1.033
145 HA VAL 21 HA VAL 21 -2.432 6.479 -2.537
146 HB VAL 21 HB VAL 21 -0.821 8.997 -2.973
147 1HG1 VAL 21 1HG1 VAL 21 -1.444 6.594 -4.614
148 2HG1 VAL 21 2HG1 VAL 21 0.050 7.525 -4.493
149 3HG1 VAL 21 3HG1 VAL 21 -1.309 8.156 -5.423
150 1HG2 VAL 21 1HG2 VAL 21 -3.284 8.640 -4.517
151 2HG2 VAL 21 2HG2 VAL 21 -2.630 10.080 -3.737
152 3HG2 VAL 21 3HG2 VAL 21 -3.542 8.904 -2.793
153 H LYS 22 H LYS 22 -0.077 8.155 -0.522
154 HA LYS 22 HA LYS 22 2.243 6.826 -1.276
155 1HB LYS 22 2HB LYS 22 3.007 7.293 1.089
156 2HB LYS 22 1HB LYS 22 2.439 8.690 0.183
157 1HG LYS 22 2HG LYS 22 0.160 7.801 1.433
158 2HG LYS 22 1HG LYS 22 1.417 7.509 2.636
159 1HD LYS 22 2HD LYS 22 1.534 10.116 1.262
160 2HD LYS 22 1HD LYS 22 0.149 9.872 2.327
161 1HE LYS 22 2HE LYS 22 1.486 9.602 4.210
162 2HE LYS 22 1HE LYS 22 2.918 9.217 3.256
163 1HZ LYS 22 1HZ LYS 22 2.425 11.690 2.421
164 2HZ LYS 22 2HZ LYS 22 3.430 11.341 3.735
165 3HZ LYS 22 3HZ LYS 22 1.826 11.803 3.999
166 H THR 23 H THR 23 -0.401 5.775 0.744
167 HA THR 23 HA THR 23 0.871 3.545 1.930
168 HB THR 23 HB THR 23 -2.069 3.751 1.305
169 HG1 THR 23 1HG THR 23 -2.306 5.049 3.049
170 1HG2 THR 23 1HG2 THR 23 -1.580 1.670 2.305
171 2HG2 THR 23 2HG2 THR 23 -2.257 2.695 3.571
172 3HG2 THR 23 3HG2 THR 23 -0.517 2.415 3.499
173 H TYR 24 H TYR 24 -1.226 3.852 -0.925
174 HA TYR 24 HA TYR 24 -1.214 1.145 -1.654
175 1HB TYR 24 2HB TYR 24 -2.636 3.137 -2.555
176 2HB TYR 24 1HB TYR 24 -1.316 3.342 -3.701
177 HD1 TYR 24 1HD TYR 24 -3.443 0.569 -2.356
178 HD2 TYR 24 2HD TYR 24 -1.566 2.321 -5.748
179 HE1 TYR 24 1HE TYR 24 -4.429 -1.168 -3.791
180 HE2 TYR 24 2HE TYR 24 -2.547 0.591 -7.193
181 HH TYR 24 HH TYR 24 -4.515 -0.950 -7.146
182 H LEU 25 H LEU 25 1.054 3.736 -2.249
183 HA LEU 25 HA LEU 25 2.584 2.418 -4.237
184 1HB LEU 25 2HB LEU 25 2.560 4.926 -3.386
185 2HB LEU 25 1HB LEU 25 3.852 4.349 -2.352
186 HG LEU 25 HG LEU 25 3.821 4.308 -5.369
187 1HD1 LEU 25 1HD1 LEU 25 4.201 6.511 -4.301
188 2HD1 LEU 25 2HD1 LEU 25 5.591 5.926 -5.216
189 3HD1 LEU 25 3HD1 LEU 25 5.587 5.823 -3.455
190 1HD2 LEU 25 1HD2 LEU 25 4.980 2.359 -4.710
191 2HD2 LEU 25 2HD2 LEU 25 5.781 3.195 -3.380
192 3HD2 LEU 25 3HD2 LEU 25 6.219 3.569 -5.046
193 H ALA 26 H ALA 26 3.293 2.975 -0.803
194 HA ALA 26 HA ALA 26 5.480 1.246 -0.663
195 1HB ALA 26 1HB ALA 26 5.285 2.796 1.082
196 2HB ALA 26 2HB ALA 26 4.938 1.239 1.836
197 3HB ALA 26 3HB ALA 26 3.618 2.333 1.421
198 H HIS 27 H HIS 27 2.117 0.626 -0.780
199 HA HIS 27 HA HIS 27 2.104 -1.905 0.519
200 1HB HIS 27 2HB HIS 27 0.051 -0.612 0.261
201 2HB HIS 27 1HB HIS 27 0.187 -0.703 -1.490
202 HD1 HIS 27 1HD HIS 27 -1.014 -2.609 1.459
203 HD2 HIS 27 2HD HIS 27 -0.381 -3.245 -2.597
204 HE1 HIS 27 1HE HIS 27 -2.234 -4.746 0.878
205 H LYS 28 H LYS 28 1.774 -1.085 -2.943
206 HA LYS 28 HA LYS 28 2.168 -3.726 -3.840
207 1HB LYS 28 2HB LYS 28 1.847 -1.095 -5.027
208 2HB LYS 28 1HB LYS 28 3.012 -2.063 -5.918
209 1HG LYS 28 2HG LYS 28 0.813 -2.350 -6.855
210 2HG LYS 28 1HG LYS 28 1.347 -3.860 -6.112
211 1HD LYS 28 2HD LYS 28 -0.252 -3.790 -4.515
212 2HD LYS 28 1HD LYS 28 -0.171 -2.034 -4.363
213 1HE LYS 28 2HE LYS 28 -2.321 -2.615 -5.245
214 2HE LYS 28 1HE LYS 28 -1.382 -1.853 -6.528
215 1HZ LYS 28 1HZ LYS 28 -1.145 -3.826 -7.650
216 2HZ LYS 28 2HZ LYS 28 -2.695 -4.017 -7.002
217 3HZ LYS 28 3HZ LYS 28 -1.374 -4.782 -6.274
218 H GLN 29 H GLN 29 4.369 -1.382 -2.685
219 HA GLN 29 HA GLN 29 6.686 -2.089 -4.110
220 1HB GLN 29 2HB GLN 29 6.108 -0.687 -1.549
221 2HB GLN 29 1HB GLN 29 7.751 -1.257 -1.812
222 1HG GLN 29 2HG GLN 29 6.203 0.620 -3.582
223 2HG GLN 29 1HG GLN 29 7.537 1.041 -2.510
224 1HE2 GLN 29 1HE2 GLN 29 6.617 -0.349 -5.530
225 2HE2 GLN 29 2HE2 GLN 29 8.207 -0.508 -6.187
226 H PHE 30 H PHE 30 5.925 -2.934 -0.722
227 HA PHE 30 HA PHE 30 6.851 -5.650 -1.183
228 1HB PHE 30 2HB PHE 30 8.240 -5.243 1.052
229 2HB PHE 30 1HB PHE 30 8.938 -5.011 -0.546
230 HD1 PHE 30 1HD PHE 30 6.632 -2.853 1.421
231 HD2 PHE 30 2HD PHE 30 10.483 -3.304 -0.334
232 HE1 PHE 30 1HE PHE 30 7.167 -0.523 2.004
233 HE2 PHE 30 2HE PHE 30 11.025 -0.975 0.247
234 HZ PHE 30 HZ PHE 30 9.365 0.419 1.416
235 H TYR 31 H TYR 31 4.399 -4.071 -0.225
236 HA TYR 31 HA TYR 31 4.036 -5.450 2.350
237 1HB TYR 31 2HB TYR 31 3.560 -2.796 1.676
238 2HB TYR 31 1HB TYR 31 1.959 -3.526 1.669
239 HD1 TYR 31 1HD TYR 31 5.042 -3.605 3.793
240 HD2 TYR 31 2HD TYR 31 0.793 -3.431 3.650
241 HE1 TYR 31 1HE TYR 31 4.971 -3.454 6.245
242 HE2 TYR 31 2HE TYR 31 0.711 -3.279 6.103
243 HH TYR 31 HH TYR 31 3.375 -3.937 8.076
244 H CYS 32 H CYS 32 2.876 -5.174 -0.899
245 HA CYS 32 HA CYS 32 0.351 -6.408 -0.535
246 1HB CYS 32 2HB CYS 32 1.091 -5.041 -2.530
247 2HB CYS 32 1HB CYS 32 2.020 -6.442 -3.050
248 H LYS 33 H LYS 33 -0.297 -8.538 -1.103
249 HA LYS 33 HA LYS 33 1.780 -10.526 -0.550
250 1HB LYS 33 2HB LYS 33 -0.054 -12.048 -0.035
251 2HB LYS 33 1HB LYS 33 -0.220 -10.554 0.876
252 1HG LYS 33 2HG LYS 33 -2.347 -10.664 0.181
253 2HG LYS 33 1HG LYS 33 -1.697 -9.957 -1.299
254 1HD LYS 33 2HD LYS 33 -1.934 -11.878 -2.478
255 2HD LYS 33 1HD LYS 33 -1.566 -12.901 -1.088
256 1HE LYS 33 2HE LYS 33 -3.925 -13.054 -1.951
257 2HE LYS 33 1HE LYS 33 -3.765 -12.686 -0.233
258 1HZ LYS 33 1HZ LYS 33 -4.583 -10.610 -0.507
259 2HZ LYS 33 2HZ LYS 33 -5.347 -11.322 -1.838
260 3HZ LYS 33 3HZ LYS 33 -3.934 -10.418 -2.059
261 H ASN 34 H ASN 34 1.514 -9.252 -3.163
262 HA ASN 34 HA ASN 34 0.398 -11.299 -4.890
263 1HB ASN 34 2HB ASN 34 0.306 -8.754 -5.296
264 2HB ASN 34 1HB ASN 34 1.983 -8.912 -5.812
265 1HD2 ASN 34 1HD2 ASN 34 2.426 -10.404 -7.567
266 2HD2 ASN 34 2HD2 ASN 34 1.233 -10.635 -8.795
267 H LYS 35 H LYS 35 2.211 -12.614 -3.559
268 HA LYS 35 HA LYS 35 4.880 -12.484 -4.397
269 1HB LYS 35 2HB LYS 35 3.465 -15.032 -3.628
270 2HB LYS 35 1HB LYS 35 5.160 -14.625 -3.404
271 1HG LYS 35 2HG LYS 35 4.361 -12.788 -1.845
272 2HG LYS 35 1HG LYS 35 2.782 -13.576 -1.907
273 1HD LYS 35 2HD LYS 35 5.061 -15.356 -1.357
274 2HD LYS 35 1HD LYS 35 4.709 -14.167 -0.101
275 1HE LYS 35 2HE LYS 35 3.280 -15.770 0.606
276 2HE LYS 35 1HE LYS 35 2.223 -15.036 -0.599
277 1HZ LYS 35 1HZ LYS 35 4.008 -17.119 -1.559
278 2HZ LYS 35 2HZ LYS 35 2.395 -16.806 -1.960
279 3HZ LYS 35 3HZ LYS 35 2.766 -17.627 -0.528
280 HA PRO 36 HA PRO 36 4.872 -14.156 -8.475
281 1HB PRO 36 2HB PRO 36 7.233 -15.497 -8.532
282 2HB PRO 36 1HB PRO 36 7.130 -13.732 -8.548
283 1HG PRO 36 2HG PRO 36 7.681 -15.575 -6.254
284 2HG PRO 36 1HG PRO 36 8.473 -14.045 -6.675
285 1HD PRO 36 2HD PRO 36 6.580 -14.222 -4.749
286 2HD PRO 36 1HD PRO 36 6.786 -12.773 -5.753
Start of MODEL 2
1 1H GLY 1 1HT GLY 1 -10.449 -6.169 -16.195
2 2H GLY 1 2HT GLY 1 -10.756 -7.260 -17.450
3 3H GLY 1 3HT GLY 1 -9.986 -7.790 -16.040
4 1HA GLY 1 1HA GLY 1 -12.481 -8.291 -16.358
5 2HA GLY 1 2HA GLY 1 -11.890 -7.770 -14.787
6 H SER 2 H SER 2 -12.123 -5.499 -14.228
7 HA SER 2 HA SER 2 -13.935 -3.903 -15.826
8 1HB SER 2 2HB SER 2 -15.184 -5.577 -14.149
9 2HB SER 2 1HB SER 2 -14.849 -4.267 -13.017
10 HG SER 2 HG SER 2 -16.495 -3.303 -13.873
11 H ALA 3 H ALA 3 -14.630 -1.947 -14.139
12 HA ALA 3 HA ALA 3 -13.888 -0.046 -13.133
13 1HB ALA 3 1HB ALA 3 -13.265 -1.885 -11.406
14 2HB ALA 3 2HB ALA 3 -12.603 -0.261 -11.224
15 3HB ALA 3 3HB ALA 3 -11.609 -1.546 -11.910
16 H ALA 4 H ALA 4 -13.241 1.073 -14.949
17 HA ALA 4 HA ALA 4 -10.882 0.668 -16.394
18 1HB ALA 4 1HB ALA 4 -11.244 3.166 -16.998
19 2HB ALA 4 2HB ALA 4 -12.739 2.990 -16.080
20 3HB ALA 4 3HB ALA 4 -12.446 1.972 -17.490
21 H GLU 5 H GLU 5 -11.424 3.573 -14.422
22 HA GLU 5 HA GLU 5 -8.886 4.428 -14.155
23 1HB GLU 5 2HB GLU 5 -11.219 5.251 -13.141
24 2HB GLU 5 1HB GLU 5 -10.511 4.575 -11.680
25 1HG GLU 5 2HG GLU 5 -8.815 6.126 -11.621
26 2HG GLU 5 1HG GLU 5 -8.914 6.456 -13.350
27 H VAL 6 H VAL 6 -7.175 3.150 -13.747
28 HA VAL 6 HA VAL 6 -7.317 1.242 -11.526
29 HB VAL 6 HB VAL 6 -5.096 1.517 -13.549
30 1HG1 VAL 6 1HG1 VAL 6 -5.863 -0.624 -11.575
31 2HG1 VAL 6 2HG1 VAL 6 -4.377 0.323 -11.623
32 3HG1 VAL 6 3HG1 VAL 6 -4.701 -0.872 -12.878
33 1HG2 VAL 6 1HG2 VAL 6 -6.232 -0.584 -14.520
34 2HG2 VAL 6 2HG2 VAL 6 -6.915 0.996 -14.905
35 3HG2 VAL 6 3HG2 VAL 6 -7.669 -0.014 -13.672
36 H MET 7 H MET 7 -5.473 1.070 -10.065
37 HA MET 7 HA MET 7 -4.025 1.929 -8.537
38 1HB MET 7 2HB MET 7 -3.302 4.023 -10.581
39 2HB MET 7 1HB MET 7 -2.299 3.381 -9.287
40 1HG MET 7 2HG MET 7 -3.197 1.928 -11.763
41 2HG MET 7 1HG MET 7 -1.570 2.499 -11.399
42 1HE MET 7 1HE MET 7 0.148 -0.189 -10.014
43 2HE MET 7 2HE MET 7 -0.239 1.006 -8.776
44 3HE MET 7 3HE MET 7 0.037 1.518 -10.442
45 H LYS 8 H LYS 8 -6.145 2.577 -7.541
46 HA LYS 8 HA LYS 8 -6.093 5.467 -7.044
47 1HB LYS 8 2HB LYS 8 -8.406 3.810 -7.935
48 2HB LYS 8 1HB LYS 8 -8.711 5.090 -6.769
49 1HG LYS 8 2HG LYS 8 -7.343 6.532 -8.490
50 2HG LYS 8 1HG LYS 8 -7.864 5.272 -9.609
51 1HD LYS 8 2HD LYS 8 -9.521 6.942 -9.734
52 2HD LYS 8 1HD LYS 8 -10.214 5.671 -8.726
53 1HE LYS 8 2HE LYS 8 -9.516 6.947 -6.720
54 2HE LYS 8 1HE LYS 8 -8.955 8.241 -7.778
55 1HZ LYS 8 1HZ LYS 8 -11.699 7.348 -8.163
56 2HZ LYS 8 2HZ LYS 8 -11.050 8.909 -8.221
57 3HZ LYS 8 3HZ LYS 8 -11.381 8.187 -6.728
58 H LYS 9 H LYS 9 -4.820 3.689 -5.462
59 HA LYS 9 HA LYS 9 -4.603 2.945 -3.322
60 1HB LYS 9 2HB LYS 9 -6.853 4.809 -2.598
61 2HB LYS 9 1HB LYS 9 -5.479 4.326 -1.614
62 1HG LYS 9 2HG LYS 9 -4.607 6.290 -2.206
63 2HG LYS 9 1HG LYS 9 -4.254 5.505 -3.747
64 1HD LYS 9 2HD LYS 9 -5.423 7.218 -4.621
65 2HD LYS 9 1HD LYS 9 -6.830 6.272 -4.129
66 1HE LYS 9 2HE LYS 9 -5.665 8.004 -2.050
67 2HE LYS 9 1HE LYS 9 -6.403 8.844 -3.414
68 1HZ LYS 9 1HZ LYS 9 -7.797 8.104 -1.327
69 2HZ LYS 9 2HZ LYS 9 -7.908 6.654 -2.193
70 3HZ LYS 9 3HZ LYS 9 -8.464 8.096 -2.882
71 H TYR 10 H TYR 10 -5.802 1.053 -4.550
72 HA TYR 10 HA TYR 10 -7.577 -0.100 -2.634
73 1HB TYR 10 2HB TYR 10 -9.209 1.273 -3.826
74 2HB TYR 10 1HB TYR 10 -8.690 0.587 -5.362
75 HD1 TYR 10 1HD TYR 10 -10.272 -0.830 -6.249
76 HD2 TYR 10 2HD TYR 10 -9.655 -0.845 -2.039
77 HE1 TYR 10 1HE TYR 10 -11.943 -2.617 -6.016
78 HE2 TYR 10 2HE TYR 10 -11.324 -2.633 -1.795
79 HH TYR 10 HH TYR 10 -13.495 -3.458 -4.162
80 H CYS 11 H CYS 11 -6.377 -1.917 -2.512
81 HA CYS 11 HA CYS 11 -5.401 -3.223 -4.905
82 1HB CYS 11 2HB CYS 11 -4.170 -3.048 -2.644
83 2HB CYS 11 1HB CYS 11 -5.238 -4.344 -2.117
84 H SER 12 H SER 12 -7.007 -4.155 -6.051
85 HA SER 12 HA SER 12 -9.322 -5.334 -5.020
86 1HB SER 12 2HB SER 12 -8.253 -6.470 -7.538
87 2HB SER 12 1HB SER 12 -9.844 -5.794 -7.189
88 HG SER 12 HG SER 12 -8.679 -3.701 -7.147
89 H THR 13 H THR 13 -6.158 -6.715 -5.744
90 HA THR 13 HA THR 13 -6.828 -9.422 -5.425
91 HB THR 13 HB THR 13 -4.177 -8.115 -4.790
92 HG1 THR 13 1HG THR 13 -3.822 -7.999 -6.866
93 1HG2 THR 13 1HG2 THR 13 -4.937 -10.789 -4.590
94 2HG2 THR 13 2HG2 THR 13 -3.301 -10.131 -4.582
95 3HG2 THR 13 3HG2 THR 13 -4.031 -10.663 -6.097
96 H CYS 14 H CYS 14 -5.470 -7.106 -3.084
97 HA CYS 14 HA CYS 14 -5.635 -8.955 -0.908
98 1HB CYS 14 2HB CYS 14 -5.044 -6.008 -1.108
99 2HB CYS 14 1HB CYS 14 -5.135 -6.840 0.436
100 H ASP 15 H ASP 15 -7.741 -6.603 -2.332
101 HA ASP 15 HA ASP 15 -9.953 -6.170 -1.979
102 1HB ASP 15 2HB ASP 15 -9.806 -8.679 -1.071
103 2HB ASP 15 1HB ASP 15 -10.137 -7.871 0.459
104 H ILE 16 H ILE 16 -8.001 -4.500 -0.958
105 HA ILE 16 HA ILE 16 -9.405 -3.383 1.363
106 HB ILE 16 HB ILE 16 -6.406 -3.295 1.257
107 1HG1 ILE 16 2HG1 ILE 16 -7.089 -5.679 1.256
108 2HG1 ILE 16 1HG1 ILE 16 -6.296 -5.209 2.756
109 1HG2 ILE 16 1HG2 ILE 16 -7.080 -1.757 2.805
110 2HG2 ILE 16 2HG2 ILE 16 -6.965 -3.191 3.827
111 3HG2 ILE 16 3HG2 ILE 16 -8.537 -2.657 3.229
112 1HD1 ILE 16 1HD1 ILE 16 -9.157 -4.871 2.921
113 2HD1 ILE 16 2HD1 ILE 16 -8.064 -5.789 3.957
114 3HD1 ILE 16 3HD1 ILE 16 -8.715 -6.523 2.492
115 H SER 17 H SER 17 -8.828 -1.082 1.740
116 HA SER 17 HA SER 17 -7.958 0.271 -0.723
117 1HB SER 17 2HB SER 17 -10.380 0.410 -0.666
118 2HB SER 17 1HB SER 17 -10.341 0.990 0.999
119 HG SER 17 HG SER 17 -10.413 2.493 -1.050
120 H PHE 18 H PHE 18 -7.294 2.535 -0.368
121 HA PHE 18 HA PHE 18 -6.383 3.075 2.370
122 1HB PHE 18 2HB PHE 18 -4.624 3.404 -0.065
123 2HB PHE 18 1HB PHE 18 -4.171 3.683 1.613
124 HD1 PHE 18 1HD PHE 18 -4.918 1.450 3.103
125 HD2 PHE 18 2HD PHE 18 -3.621 1.551 -0.948
126 HE1 PHE 18 1HE PHE 18 -4.166 -0.885 3.290
127 HE2 PHE 18 2HE PHE 18 -2.866 -0.784 -0.769
128 HZ PHE 18 HZ PHE 18 -3.137 -2.004 1.352
129 H ASN 19 H ASN 19 -6.522 5.162 2.991
130 HA ASN 19 HA ASN 19 -7.962 6.980 1.312
131 1HB ASN 19 2HB ASN 19 -8.312 6.880 3.757
132 2HB ASN 19 1HB ASN 19 -6.668 7.459 4.005
133 1HD2 ASN 19 1HD2 ASN 19 -6.666 9.491 4.603
134 2HD2 ASN 19 2HD2 ASN 19 -7.692 10.738 3.991
135 H TYR 20 H TYR 20 -4.629 6.445 2.105
136 HA TYR 20 HA TYR 20 -3.883 8.923 0.701
137 1HB TYR 20 2HB TYR 20 -2.253 7.252 2.626
138 2HB TYR 20 1HB TYR 20 -1.701 8.721 1.829
139 HD1 TYR 20 1HD TYR 20 -3.088 10.868 2.279
140 HD2 TYR 20 2HD TYR 20 -3.275 7.383 4.711
141 HE1 TYR 20 1HE TYR 20 -3.988 12.215 4.129
142 HE2 TYR 20 2HE TYR 20 -4.177 8.719 6.568
143 HH TYR 20 HH TYR 20 -4.191 11.063 7.312
144 H VAL 21 H VAL 21 -2.846 8.796 -1.189
145 HA VAL 21 HA VAL 21 -2.644 6.399 -2.615
146 HB VAL 21 HB VAL 21 -1.055 8.912 -3.151
147 1HG1 VAL 21 1HG1 VAL 21 -2.093 7.260 -5.356
148 2HG1 VAL 21 2HG1 VAL 21 -0.820 6.521 -4.383
149 3HG1 VAL 21 3HG1 VAL 21 -0.537 8.070 -5.176
150 1HG2 VAL 21 1HG2 VAL 21 -2.887 9.965 -3.892
151 2HG2 VAL 21 2HG2 VAL 21 -3.785 8.780 -2.943
152 3HG2 VAL 21 3HG2 VAL 21 -3.521 8.512 -4.666
153 H LYS 22 H LYS 22 -0.304 8.112 -0.630
154 HA LYS 22 HA LYS 22 2.036 6.815 -1.384
155 1HB LYS 22 2HB LYS 22 1.092 8.240 1.032
156 2HB LYS 22 1HB LYS 22 2.465 7.168 1.265
157 1HG LYS 22 2HG LYS 22 3.330 9.323 0.819
158 2HG LYS 22 1HG LYS 22 3.594 8.353 -0.632
159 1HD LYS 22 2HD LYS 22 1.740 9.384 -1.740
160 2HD LYS 22 1HD LYS 22 1.246 10.204 -0.258
161 1HE LYS 22 2HE LYS 22 2.483 11.608 -1.967
162 2HE LYS 22 1HE LYS 22 3.104 11.651 -0.317
163 1HZ LYS 22 1HZ LYS 22 4.200 9.967 -2.504
164 2HZ LYS 22 2HZ LYS 22 4.820 10.095 -0.936
165 3HZ LYS 22 3HZ LYS 22 4.870 11.428 -1.975
166 H THR 23 H THR 23 -0.605 5.726 0.614
167 HA THR 23 HA THR 23 0.677 3.526 1.834
168 HB THR 23 HB THR 23 -2.244 3.879 1.145
169 HG1 THR 23 1HG THR 23 -1.229 5.532 2.494
170 1HG2 THR 23 1HG2 THR 23 -1.912 1.612 1.765
171 2HG2 THR 23 2HG2 THR 23 -2.608 2.449 3.152
172 3HG2 THR 23 3HG2 THR 23 -0.886 2.072 3.123
173 H TYR 24 H TYR 24 -1.364 3.762 -1.070
174 HA TYR 24 HA TYR 24 -1.252 1.051 -1.783
175 1HB TYR 24 2HB TYR 24 -2.720 2.999 -2.715
176 2HB TYR 24 1HB TYR 24 -1.391 3.226 -3.847
177 HD1 TYR 24 1HD TYR 24 -3.245 0.277 -2.469
178 HD2 TYR 24 2HD TYR 24 -1.803 2.313 -5.915
179 HE1 TYR 24 1HE TYR 24 -4.165 -1.500 -3.897
180 HE2 TYR 24 2HE TYR 24 -2.721 0.542 -7.353
181 HH TYR 24 HH TYR 24 -3.394 -1.771 -7.223
182 H LEU 25 H LEU 25 0.942 3.710 -2.343
183 HA LEU 25 HA LEU 25 2.544 2.457 -4.312
184 1HB LEU 25 2HB LEU 25 2.834 4.788 -2.493
185 2HB LEU 25 1HB LEU 25 4.300 4.127 -3.190
186 HG LEU 25 HG LEU 25 1.929 5.216 -4.706
187 1HD1 LEU 25 1HD1 LEU 25 4.665 6.285 -5.024
188 2HD1 LEU 25 2HD1 LEU 25 3.836 6.656 -3.512
189 3HD1 LEU 25 3HD1 LEU 25 3.108 7.115 -5.051
190 1HD2 LEU 25 1HD2 LEU 25 3.527 4.896 -6.672
191 2HD2 LEU 25 2HD2 LEU 25 2.719 3.462 -6.040
192 3HD2 LEU 25 3HD2 LEU 25 4.402 3.783 -5.620
193 H ALA 26 H ALA 26 3.228 3.015 -0.874
194 HA ALA 26 HA ALA 26 5.432 1.302 -0.745
195 1HB ALA 26 1HB ALA 26 5.469 1.712 1.529
196 2HB ALA 26 2HB ALA 26 3.711 1.789 1.645
197 3HB ALA 26 3HB ALA 26 4.607 3.122 0.916
198 H HIS 27 H HIS 27 2.079 0.654 -0.839
199 HA HIS 27 HA HIS 27 2.111 -1.858 0.512
200 1HB HIS 27 2HB HIS 27 0.042 -0.581 0.299
201 2HB HIS 27 1HB HIS 27 0.129 -0.692 -1.455
202 HD1 HIS 27 1HD HIS 27 -1.000 -2.554 1.545
203 HD2 HIS 27 2HD HIS 27 -0.427 -3.267 -2.507
204 HE1 HIS 27 1HE HIS 27 -2.214 -4.711 1.026
205 H LYS 28 H LYS 28 1.789 -1.027 -2.947
206 HA LYS 28 HA LYS 28 2.156 -3.702 -3.817
207 1HB LYS 28 2HB LYS 28 2.244 -1.035 -5.205
208 2HB LYS 28 1HB LYS 28 2.627 -2.522 -6.065
209 1HG LYS 28 2HG LYS 28 0.293 -3.234 -4.952
210 2HG LYS 28 1HG LYS 28 0.036 -1.495 -5.108
211 1HD LYS 28 2HD LYS 28 -0.057 -1.583 -7.361
212 2HD LYS 28 1HD LYS 28 1.202 -2.815 -7.467
213 1HE LYS 28 2HE LYS 28 -1.712 -3.218 -6.815
214 2HE LYS 28 1HE LYS 28 -0.849 -3.770 -8.249
215 1HZ LYS 28 1HZ LYS 28 -0.787 -5.668 -7.048
216 2HZ LYS 28 2HZ LYS 28 -0.874 -4.880 -5.554
217 3HZ LYS 28 3HZ LYS 28 0.596 -4.950 -6.387
218 H GLN 29 H GLN 29 4.336 -1.371 -2.674
219 HA GLN 29 HA GLN 29 6.621 -2.037 -4.209
220 1HB GLN 29 2HB GLN 29 6.228 -0.705 -1.539
221 2HB GLN 29 1HB GLN 29 7.836 -1.035 -2.170
222 1HG GLN 29 2HG GLN 29 6.015 0.328 -4.028
223 2HG GLN 29 1HG GLN 29 6.464 1.248 -2.592
224 1HE2 GLN 29 1HE2 GLN 29 8.007 2.617 -3.119
225 2HE2 GLN 29 2HE2 GLN 29 9.403 2.260 -4.071
226 H PHE 30 H PHE 30 5.939 -2.815 -0.785
227 HA PHE 30 HA PHE 30 6.953 -5.509 -1.199
228 1HB PHE 30 2HB PHE 30 8.330 -5.017 1.024
229 2HB PHE 30 1HB PHE 30 9.018 -4.789 -0.578
230 HD1 PHE 30 1HD PHE 30 7.381 -3.023 2.234
231 HD2 PHE 30 2HD PHE 30 9.768 -2.681 -1.273
232 HE1 PHE 30 1HE PHE 30 7.842 -0.668 2.781
233 HE2 PHE 30 2HE PHE 30 10.234 -0.328 -0.732
234 HZ PHE 30 HZ PHE 30 9.269 0.683 1.297
235 H TYR 31 H TYR 31 4.459 -3.966 -0.244
236 HA TYR 31 HA TYR 31 4.140 -5.345 2.335
237 1HB TYR 31 2HB TYR 31 3.598 -2.699 1.641
238 2HB TYR 31 1HB TYR 31 2.017 -3.470 1.694
239 HD1 TYR 31 1HD TYR 31 4.555 -1.926 3.606
240 HD2 TYR 31 2HD TYR 31 1.524 -4.903 3.821
241 HE1 TYR 31 1HE TYR 31 4.559 -1.744 6.058
242 HE2 TYR 31 2HE TYR 31 1.518 -4.729 6.274
243 HH TYR 31 HH TYR 31 3.907 -3.354 8.025
244 H CYS 32 H CYS 32 3.132 -5.323 -0.925
245 HA CYS 32 HA CYS 32 0.623 -6.687 -0.413
246 1HB CYS 32 2HB CYS 32 0.944 -5.013 -2.276
247 2HB CYS 32 1HB CYS 32 1.964 -6.204 -3.075
248 H LYS 33 H LYS 33 0.425 -8.816 -0.248
249 HA LYS 33 HA LYS 33 2.698 -10.505 -0.994
250 1HB LYS 33 2HB LYS 33 1.689 -12.205 0.429
251 2HB LYS 33 1HB LYS 33 1.852 -10.690 1.309
252 1HG LYS 33 2HG LYS 33 -0.535 -10.221 0.855
253 2HG LYS 33 1HG LYS 33 -0.666 -11.810 0.096
254 1HD LYS 33 2HD LYS 33 0.019 -12.858 2.211
255 2HD LYS 33 1HD LYS 33 0.110 -11.264 2.962
256 1HE LYS 33 2HE LYS 33 -2.318 -12.718 1.951
257 2HE LYS 33 1HE LYS 33 -1.982 -12.158 3.588
258 1HZ LYS 33 1HZ LYS 33 -2.987 -10.682 1.291
259 2HZ LYS 33 2HZ LYS 33 -1.895 -9.857 2.285
260 3HZ LYS 33 3HZ LYS 33 -3.324 -10.484 2.938
261 H ASN 34 H ASN 34 1.005 -9.461 -3.047
262 HA ASN 34 HA ASN 34 -0.798 -11.554 -3.865
263 1HB ASN 34 2HB ASN 34 -1.241 -9.184 -4.407
264 2HB ASN 34 1HB ASN 34 0.209 -9.151 -5.406
265 1HD2 ASN 34 1HD2 ASN 34 -1.280 -8.487 -7.084
266 2HD2 ASN 34 2HD2 ASN 34 -2.152 -9.691 -7.964
267 H LYS 35 H LYS 35 1.206 -13.056 -3.584
268 HA LYS 35 HA LYS 35 2.745 -13.177 -6.080
269 1HB LYS 35 2HB LYS 35 3.184 -14.328 -3.339
270 2HB LYS 35 1HB LYS 35 4.042 -14.964 -4.735
271 1HG LYS 35 2HG LYS 35 4.122 -12.037 -4.387
272 2HG LYS 35 1HG LYS 35 4.983 -12.995 -3.181
273 1HD LYS 35 2HD LYS 35 5.343 -13.493 -6.119
274 2HD LYS 35 1HD LYS 35 6.266 -12.244 -5.279
275 1HE LYS 35 2HE LYS 35 6.708 -14.244 -3.593
276 2HE LYS 35 1HE LYS 35 6.406 -15.201 -5.042
277 1HZ LYS 35 1HZ LYS 35 8.156 -14.029 -6.176
278 2HZ LYS 35 2HZ LYS 35 8.763 -14.665 -4.731
279 3HZ LYS 35 3HZ LYS 35 8.407 -13.016 -4.844
280 HA PRO 36 HA PRO 36 0.531 -16.699 -7.533
281 1HB PRO 36 2HB PRO 36 2.473 -18.094 -8.815
282 2HB PRO 36 1HB PRO 36 1.801 -16.586 -9.446
283 1HG PRO 36 2HG PRO 36 4.345 -17.040 -7.934
284 2HG PRO 36 1HG PRO 36 4.057 -16.023 -9.358
285 1HD PRO 36 2HD PRO 36 4.203 -15.010 -6.851
286 2HD PRO 36 1HD PRO 36 3.165 -14.304 -8.106
Start of MODEL 3
1 1H GLY 1 1HT GLY 1 -14.589 10.738 -17.021
2 2H GLY 1 2HT GLY 1 -13.959 10.003 -15.633
3 3H GLY 1 3HT GLY 1 -14.888 9.100 -16.721
4 1HA GLY 1 1HA GLY 1 -12.908 8.423 -17.496
5 2HA GLY 1 2HA GLY 1 -12.997 9.943 -18.374
6 H SER 2 H SER 2 -11.240 11.156 -18.245
7 HA SER 2 HA SER 2 -9.255 10.608 -16.206
8 1HB SER 2 2HB SER 2 -8.409 10.894 -18.434
9 2HB SER 2 1HB SER 2 -9.260 12.428 -18.621
10 HG SER 2 HG SER 2 -7.087 11.865 -16.886
11 H ALA 3 H ALA 3 -8.717 11.897 -14.527
12 HA ALA 3 HA ALA 3 -8.884 13.527 -12.948
13 1HB ALA 3 1HB ALA 3 -8.052 14.944 -14.775
14 2HB ALA 3 2HB ALA 3 -9.137 15.822 -13.696
15 3HB ALA 3 3HB ALA 3 -9.715 15.268 -15.267
16 H ALA 4 H ALA 4 -11.151 11.824 -13.427
17 HA ALA 4 HA ALA 4 -13.273 13.593 -12.412
18 1HB ALA 4 1HB ALA 4 -13.441 12.595 -14.876
19 2HB ALA 4 2HB ALA 4 -14.852 12.813 -13.843
20 3HB ALA 4 3HB ALA 4 -14.100 11.224 -13.984
21 H GLU 5 H GLU 5 -12.674 12.954 -10.295
22 HA GLU 5 HA GLU 5 -12.831 11.716 -8.394
23 1HB GLU 5 2HB GLU 5 -15.202 11.538 -9.223
24 2HB GLU 5 1HB GLU 5 -14.770 9.993 -9.943
25 1HG GLU 5 2HG GLU 5 -14.059 10.219 -7.121
26 2HG GLU 5 1HG GLU 5 -15.787 10.349 -7.440
27 H VAL 6 H VAL 6 -10.573 11.118 -9.111
28 HA VAL 6 HA VAL 6 -10.104 8.530 -10.213
29 HB VAL 6 HB VAL 6 -8.435 10.282 -10.435
30 1HG1 VAL 6 1HG1 VAL 6 -7.480 10.110 -7.662
31 2HG1 VAL 6 2HG1 VAL 6 -9.012 10.957 -7.879
32 3HG1 VAL 6 3HG1 VAL 6 -7.575 11.496 -8.749
33 1HG2 VAL 6 1HG2 VAL 6 -6.491 8.996 -9.994
34 2HG2 VAL 6 2HG2 VAL 6 -7.784 7.850 -10.351
35 3HG2 VAL 6 3HG2 VAL 6 -7.283 8.125 -8.682
36 H MET 7 H MET 7 -9.001 6.780 -9.112
37 HA MET 7 HA MET 7 -9.218 6.652 -6.226
38 1HB MET 7 2HB MET 7 -10.953 5.042 -8.074
39 2HB MET 7 1HB MET 7 -10.478 4.392 -6.511
40 1HG MET 7 2HG MET 7 -11.385 6.627 -5.579
41 2HG MET 7 1HG MET 7 -12.214 6.740 -7.130
42 1HE MET 7 1HE MET 7 -13.823 5.607 -7.962
43 2HE MET 7 2HE MET 7 -15.171 5.424 -6.840
44 3HE MET 7 3HE MET 7 -14.392 3.997 -7.522
45 H LYS 8 H LYS 8 -6.886 6.656 -7.039
46 HA LYS 8 HA LYS 8 -5.979 4.005 -7.867
47 1HB LYS 8 2HB LYS 8 -3.795 5.049 -8.188
48 2HB LYS 8 1HB LYS 8 -5.043 5.956 -9.032
49 1HG LYS 8 2HG LYS 8 -5.012 7.270 -6.683
50 2HG LYS 8 1HG LYS 8 -3.332 6.739 -6.771
51 1HD LYS 8 2HD LYS 8 -4.805 8.261 -8.921
52 2HD LYS 8 1HD LYS 8 -3.657 8.959 -7.777
53 1HE LYS 8 2HE LYS 8 -1.862 8.116 -8.861
54 2HE LYS 8 1HE LYS 8 -2.696 6.625 -9.300
55 1HZ LYS 8 1HZ LYS 8 -2.248 7.868 -11.272
56 2HZ LYS 8 2HZ LYS 8 -2.951 9.267 -10.631
57 3HZ LYS 8 3HZ LYS 8 -3.916 7.926 -10.994
58 H LYS 9 H LYS 9 -7.052 3.862 -5.417
59 HA LYS 9 HA LYS 9 -4.749 3.184 -3.784
60 1HB LYS 9 2HB LYS 9 -5.663 4.340 -1.789
61 2HB LYS 9 1HB LYS 9 -5.162 5.451 -3.056
62 1HG LYS 9 2HG LYS 9 -7.995 4.611 -3.066
63 2HG LYS 9 1HG LYS 9 -7.476 5.676 -1.758
64 1HD LYS 9 2HD LYS 9 -6.634 7.285 -3.372
65 2HD LYS 9 1HD LYS 9 -7.069 6.207 -4.701
66 1HE LYS 9 2HE LYS 9 -9.391 6.451 -4.244
67 2HE LYS 9 1HE LYS 9 -9.067 7.276 -2.721
68 1HZ LYS 9 1HZ LYS 9 -8.236 8.377 -5.342
69 2HZ LYS 9 2HZ LYS 9 -8.302 9.176 -3.853
70 3HZ LYS 9 3HZ LYS 9 -9.733 8.730 -4.636
71 H TYR 10 H TYR 10 -5.900 1.188 -4.721
72 HA TYR 10 HA TYR 10 -7.314 -0.063 -2.581
73 1HB TYR 10 2HB TYR 10 -9.182 1.152 -3.630
74 2HB TYR 10 1HB TYR 10 -8.815 0.384 -5.171
75 HD1 TYR 10 1HD TYR 10 -8.858 -2.232 -5.171
76 HD2 TYR 10 2HD TYR 10 -10.750 0.184 -2.222
77 HE1 TYR 10 1HE TYR 10 -10.337 -4.109 -4.591
78 HE2 TYR 10 2HE TYR 10 -12.233 -1.686 -1.634
79 HH TYR 10 HH TYR 10 -12.587 -4.427 -3.549
80 H CYS 11 H CYS 11 -6.355 -1.980 -2.517
81 HA CYS 11 HA CYS 11 -5.218 -3.147 -4.913
82 1HB CYS 11 2HB CYS 11 -4.131 -3.125 -2.583
83 2HB CYS 11 1HB CYS 11 -5.258 -4.416 -2.181
84 H SER 12 H SER 12 -6.531 -4.221 -6.235
85 HA SER 12 HA SER 12 -9.009 -5.339 -5.484
86 1HB SER 12 2HB SER 12 -9.112 -6.221 -7.728
87 2HB SER 12 1HB SER 12 -8.387 -4.615 -7.802
88 HG SER 12 HG SER 12 -7.192 -7.130 -8.153
89 H THR 13 H THR 13 -5.776 -6.680 -5.750
90 HA THR 13 HA THR 13 -6.516 -9.408 -5.569
91 HB THR 13 HB THR 13 -3.916 -8.075 -4.785
92 HG1 THR 13 1HG THR 13 -3.373 -8.200 -6.835
93 1HG2 THR 13 1HG2 THR 13 -4.016 -10.850 -5.803
94 2HG2 THR 13 2HG2 THR 13 -4.479 -10.573 -4.123
95 3HG2 THR 13 3HG2 THR 13 -2.881 -10.084 -4.689
96 H CYS 14 H CYS 14 -5.282 -7.133 -3.119
97 HA CYS 14 HA CYS 14 -5.677 -8.975 -0.971
98 1HB CYS 14 2HB CYS 14 -5.028 -6.031 -1.069
99 2HB CYS 14 1HB CYS 14 -5.167 -6.937 0.429
100 H ASP 15 H ASP 15 -7.561 -6.494 -2.508
101 HA ASP 15 HA ASP 15 -9.771 -5.961 -2.323
102 1HB ASP 15 2HB ASP 15 -9.917 -8.480 -1.652
103 2HB ASP 15 1HB ASP 15 -10.123 -7.855 -0.019
104 H ILE 16 H ILE 16 -8.105 -4.236 -1.254
105 HA ILE 16 HA ILE 16 -9.569 -3.228 1.050
106 HB ILE 16 HB ILE 16 -6.573 -3.235 1.219
107 1HG1 ILE 16 2HG1 ILE 16 -8.426 -5.333 2.372
108 2HG1 ILE 16 1HG1 ILE 16 -7.280 -5.592 1.062
109 1HG2 ILE 16 1HG2 ILE 16 -7.480 -3.271 3.745
110 2HG2 ILE 16 2HG2 ILE 16 -8.850 -2.500 2.944
111 3HG2 ILE 16 3HG2 ILE 16 -7.241 -1.788 2.819
112 1HD1 ILE 16 1HD1 ILE 16 -6.608 -6.357 3.388
113 2HD1 ILE 16 2HD1 ILE 16 -6.398 -4.647 3.763
114 3HD1 ILE 16 3HD1 ILE 16 -5.439 -5.393 2.485
115 H SER 17 H SER 17 -8.957 -0.964 1.563
116 HA SER 17 HA SER 17 -7.815 0.444 -0.754
117 1HB SER 17 2HB SER 17 -10.487 0.438 -0.264
118 2HB SER 17 1HB SER 17 -9.989 1.840 0.683
119 HG SER 17 HG SER 17 -10.535 2.106 -1.670
120 H PHE 18 H PHE 18 -6.929 2.538 -0.289
121 HA PHE 18 HA PHE 18 -6.346 2.994 2.560
122 1HB PHE 18 2HB PHE 18 -4.329 3.444 0.362
123 2HB PHE 18 1HB PHE 18 -4.054 3.446 2.102
124 HD1 PHE 18 1HD PHE 18 -4.026 1.338 3.355
125 HD2 PHE 18 2HD PHE 18 -4.388 1.413 -0.884
126 HE1 PHE 18 1HE PHE 18 -3.423 -1.046 3.266
127 HE2 PHE 18 2HE PHE 18 -3.785 -0.971 -0.981
128 HZ PHE 18 HZ PHE 18 -3.302 -2.203 1.095
129 H ASN 19 H ASN 19 -6.778 4.990 3.233
130 HA ASN 19 HA ASN 19 -7.961 6.923 1.593
131 1HB ASN 19 2HB ASN 19 -8.277 6.800 4.044
132 2HB ASN 19 1HB ASN 19 -6.617 7.341 4.273
133 1HD2 ASN 19 1HD2 ASN 19 -9.757 8.253 2.986
134 2HD2 ASN 19 2HD2 ASN 19 -9.529 9.960 3.137
135 H TYR 20 H TYR 20 -4.628 6.377 2.479
136 HA TYR 20 HA TYR 20 -3.828 8.834 1.084
137 1HB TYR 20 2HB TYR 20 -2.035 7.043 2.717
138 2HB TYR 20 1HB TYR 20 -1.747 8.708 2.228
139 HD1 TYR 20 1HD TYR 20 -4.124 10.130 2.980
140 HD2 TYR 20 2HD TYR 20 -2.172 6.947 5.019
141 HE1 TYR 20 1HE TYR 20 -5.071 10.920 5.106
142 HE2 TYR 20 2HE TYR 20 -3.116 7.728 7.152
143 HH TYR 20 HH TYR 20 -4.358 10.696 7.637
144 H VAL 21 H VAL 21 -2.952 8.734 -0.878
145 HA VAL 21 HA VAL 21 -2.810 6.371 -2.365
146 HB VAL 21 HB VAL 21 -1.243 8.886 -2.944
147 1HG1 VAL 21 1HG1 VAL 21 -1.948 8.046 -5.335
148 2HG1 VAL 21 2HG1 VAL 21 -2.050 6.488 -4.514
149 3HG1 VAL 21 3HG1 VAL 21 -0.531 7.384 -4.522
150 1HG2 VAL 21 1HG2 VAL 21 -3.294 9.460 -4.339
151 2HG2 VAL 21 2HG2 VAL 21 -3.439 9.653 -2.592
152 3HG2 VAL 21 3HG2 VAL 21 -4.146 8.245 -3.386
153 H LYS 22 H LYS 22 -0.353 8.079 -0.509
154 HA LYS 22 HA LYS 22 1.931 6.784 -1.416
155 1HB LYS 22 2HB LYS 22 2.944 7.374 0.727
156 2HB LYS 22 1HB LYS 22 1.984 8.709 0.107
157 1HG LYS 22 2HG LYS 22 0.118 7.609 1.616
158 2HG LYS 22 1HG LYS 22 1.525 6.975 2.471
159 1HD LYS 22 2HD LYS 22 2.362 9.430 2.392
160 2HD LYS 22 1HD LYS 22 0.671 9.817 2.076
161 1HE LYS 22 2HE LYS 22 0.587 9.918 4.335
162 2HE LYS 22 1HE LYS 22 0.355 8.178 4.167
163 1HZ LYS 22 1HZ LYS 22 2.640 9.655 5.182
164 2HZ LYS 22 2HZ LYS 22 3.009 8.318 4.213
165 3HZ LYS 22 3HZ LYS 22 2.067 8.120 5.604
166 H THR 23 H THR 23 -0.584 5.687 0.726
167 HA THR 23 HA THR 23 0.751 3.485 1.875
168 HB THR 23 HB THR 23 -2.199 3.607 1.282
169 HG1 THR 23 1HG THR 23 -2.373 4.766 3.247
170 1HG2 THR 23 1HG2 THR 23 -1.566 1.544 2.296
171 2HG2 THR 23 2HG2 THR 23 -2.375 2.535 3.509
172 3HG2 THR 23 3HG2 THR 23 -0.619 2.381 3.525
173 H TYR 24 H TYR 24 -1.437 3.713 -0.921
174 HA TYR 24 HA TYR 24 -1.359 1.017 -1.664
175 1HB TYR 24 2HB TYR 24 -2.916 2.826 -2.536
176 2HB TYR 24 1HB TYR 24 -1.600 3.332 -3.587
177 HD1 TYR 24 1HD TYR 24 -3.577 0.290 -2.702
178 HD2 TYR 24 2HD TYR 24 -1.432 2.410 -5.703
179 HE1 TYR 24 1HE TYR 24 -4.265 -1.382 -4.367
180 HE2 TYR 24 2HE TYR 24 -2.114 0.744 -7.377
181 HH TYR 24 HH TYR 24 -4.321 -0.995 -7.450
182 H LEU 25 H LEU 25 0.759 3.704 -2.431
183 HA LEU 25 HA LEU 25 2.302 2.420 -4.407
184 1HB LEU 25 2HB LEU 25 2.642 4.791 -2.653
185 2HB LEU 25 1HB LEU 25 4.088 4.130 -3.394
186 HG LEU 25 HG LEU 25 3.060 5.998 -4.675
187 1HD1 LEU 25 1HD1 LEU 25 3.760 5.126 -6.634
188 2HD1 LEU 25 2HD1 LEU 25 2.760 3.682 -6.474
189 3HD1 LEU 25 3HD1 LEU 25 4.288 3.797 -5.601
190 1HD2 LEU 25 1HD2 LEU 25 0.933 5.997 -5.402
191 2HD2 LEU 25 2HD2 LEU 25 0.683 4.831 -4.104
192 3HD2 LEU 25 3HD2 LEU 25 0.945 4.269 -5.755
193 H ALA 26 H ALA 26 3.111 3.025 -1.003
194 HA ALA 26 HA ALA 26 5.358 1.363 -0.944
195 1HB ALA 26 1HB ALA 26 3.567 2.258 1.305
196 2HB ALA 26 2HB ALA 26 5.032 3.057 0.737
197 3HB ALA 26 3HB ALA 26 5.135 1.480 1.516
198 H HIS 27 H HIS 27 2.019 0.637 -0.912
199 HA HIS 27 HA HIS 27 2.171 -1.869 0.448
200 1HB HIS 27 2HB HIS 27 0.064 -0.658 0.353
201 2HB HIS 27 1HB HIS 27 0.071 -0.723 -1.405
202 HD1 HIS 27 1HD HIS 27 -0.880 -2.684 1.593
203 HD2 HIS 27 2HD HIS 27 -0.478 -3.282 -2.498
204 HE1 HIS 27 1HE HIS 27 -2.068 -4.854 1.073
205 H LYS 28 H LYS 28 1.650 -1.057 -2.990
206 HA LYS 28 HA LYS 28 2.039 -3.722 -3.876
207 1HB LYS 28 2HB LYS 28 1.512 -1.121 -5.076
208 2HB LYS 28 1HB LYS 28 2.609 -2.088 -6.053
209 1HG LYS 28 2HG LYS 28 0.134 -3.368 -5.017
210 2HG LYS 28 1HG LYS 28 0.007 -2.233 -6.363
211 1HD LYS 28 2HD LYS 28 1.005 -3.643 -7.812
212 2HD LYS 28 1HD LYS 28 2.157 -4.225 -6.608
213 1HE LYS 28 2HE LYS 28 -0.164 -5.256 -5.654
214 2HE LYS 28 1HE LYS 28 -0.470 -5.289 -7.390
215 1HZ LYS 28 1HZ LYS 28 1.197 -6.785 -7.750
216 2HZ LYS 28 2HZ LYS 28 0.718 -7.268 -6.202
217 3HZ LYS 28 3HZ LYS 28 2.095 -6.306 -6.398
218 H GLN 29 H GLN 29 4.213 -1.313 -2.870
219 HA GLN 29 HA GLN 29 6.436 -1.924 -4.507
220 1HB GLN 29 2HB GLN 29 5.992 -0.458 -1.959
221 2HB GLN 29 1HB GLN 29 7.634 -0.981 -2.311
222 1HG GLN 29 2HG GLN 29 6.884 0.136 -4.680
223 2HG GLN 29 1HG GLN 29 6.036 1.148 -3.512
224 1HE2 GLN 29 1HE2 GLN 29 7.177 2.951 -3.359
225 2HE2 GLN 29 2HE2 GLN 29 8.878 3.049 -3.069
226 H PHE 30 H PHE 30 5.955 -2.724 -1.053
227 HA PHE 30 HA PHE 30 7.033 -5.384 -1.532
228 1HB PHE 30 2HB PHE 30 8.485 -4.862 0.636
229 2HB PHE 30 1HB PHE 30 9.096 -4.593 -0.992
230 HD1 PHE 30 1HD PHE 30 6.951 -2.705 1.415
231 HD2 PHE 30 2HD PHE 30 10.306 -2.664 -1.203
232 HE1 PHE 30 1HE PHE 30 7.347 -0.340 1.967
233 HE2 PHE 30 2HE PHE 30 10.710 -0.300 -0.654
234 HZ PHE 30 HZ PHE 30 9.228 0.865 0.932
235 H TYR 31 H TYR 31 4.540 -3.903 -0.441
236 HA TYR 31 HA TYR 31 4.370 -5.331 2.125
237 1HB TYR 31 2HB TYR 31 3.733 -2.695 1.504
238 2HB TYR 31 1HB TYR 31 2.171 -3.504 1.581
239 HD1 TYR 31 1HD TYR 31 5.368 -3.545 3.532
240 HD2 TYR 31 2HD TYR 31 1.118 -3.383 3.620
241 HE1 TYR 31 1HE TYR 31 5.430 -3.417 5.987
242 HE2 TYR 31 2HE TYR 31 1.167 -3.254 6.075
243 HH TYR 31 HH TYR 31 3.658 -2.392 7.821
244 H CYS 32 H CYS 32 3.292 -5.383 -1.089
245 HA CYS 32 HA CYS 32 0.855 -6.859 -0.456
246 1HB CYS 32 2HB CYS 32 0.908 -5.075 -2.237
247 2HB CYS 32 1HB CYS 32 1.939 -6.143 -3.182
248 H LYS 33 H LYS 33 1.218 -8.926 0.055
249 HA LYS 33 HA LYS 33 3.253 -10.430 -1.419
250 1HB LYS 33 2HB LYS 33 1.672 -11.368 0.972
251 2HB LYS 33 1HB LYS 33 3.162 -12.051 0.334
252 1HG LYS 33 2HG LYS 33 3.367 -9.236 1.105
253 2HG LYS 33 1HG LYS 33 2.997 -10.335 2.434
254 1HD LYS 33 2HD LYS 33 5.397 -10.075 2.213
255 2HD LYS 33 1HD LYS 33 4.928 -11.723 1.792
256 1HE LYS 33 2HE LYS 33 5.395 -11.434 -0.434
257 2HE LYS 33 1HE LYS 33 5.097 -9.697 -0.380
258 1HZ LYS 33 1HZ LYS 33 7.337 -9.652 -0.493
259 2HZ LYS 33 2HZ LYS 33 7.533 -11.182 0.202
260 3HZ LYS 33 3HZ LYS 33 7.219 -9.840 1.185
261 H ASN 34 H ASN 34 0.578 -9.652 -2.478
262 HA ASN 34 HA ASN 34 -1.119 -10.538 -3.709
263 1HB ASN 34 2HB ASN 34 0.862 -11.560 -4.851
264 2HB ASN 34 1HB ASN 34 0.649 -12.990 -3.844
265 1HD2 ASN 34 1HD2 ASN 34 -0.173 -14.552 -5.021
266 2HD2 ASN 34 2HD2 ASN 34 -1.469 -14.402 -6.154
267 H LYS 35 H LYS 35 -2.059 -10.542 -1.374
268 HA LYS 35 HA LYS 35 -3.265 -11.546 0.290
269 1HB LYS 35 2HB LYS 35 -4.967 -13.168 -0.591
270 2HB LYS 35 1HB LYS 35 -4.900 -11.630 -1.441
271 1HG LYS 35 2HG LYS 35 -3.705 -12.627 -3.267
272 2HG LYS 35 1HG LYS 35 -3.560 -14.153 -2.392
273 1HD LYS 35 2HD LYS 35 -5.336 -14.269 -4.058
274 2HD LYS 35 1HD LYS 35 -5.994 -14.403 -2.426
275 1HE LYS 35 2HE LYS 35 -6.583 -12.016 -2.492
276 2HE LYS 35 1HE LYS 35 -5.967 -11.921 -4.140
277 1HZ LYS 35 1HZ LYS 35 -8.034 -13.906 -3.491
278 2HZ LYS 35 2HZ LYS 35 -7.716 -13.130 -4.960
279 3HZ LYS 35 3HZ LYS 35 -8.484 -12.290 -3.709
280 HA PRO 36 HA PRO 36 -0.343 -15.146 0.793
281 1HB PRO 36 2HB PRO 36 0.565 -14.391 3.241
282 2HB PRO 36 1HB PRO 36 1.291 -13.833 1.730
283 1HG PRO 36 2HG PRO 36 -0.667 -12.444 3.518
284 2HG PRO 36 1HG PRO 36 0.769 -11.789 2.710
285 1HD PRO 36 2HD PRO 36 -1.730 -11.411 1.751
286 2HD PRO 36 1HD PRO 36 -0.316 -11.563 0.687
Start of MODEL 4
1 1H GLY 1 1HT GLY 1 7.448 -3.765 -20.374
2 2H GLY 1 2HT GLY 1 7.983 -2.645 -21.522
3 3H GLY 1 3HT GLY 1 6.360 -3.118 -21.497
4 1HA GLY 1 1HA GLY 1 7.747 -1.160 -19.878
5 2HA GLY 1 2HA GLY 1 6.060 -1.220 -20.365
6 H SER 2 H SER 2 5.616 -0.553 -18.159
7 HA SER 2 HA SER 2 5.516 -2.872 -16.357
8 1HB SER 2 2HB SER 2 6.482 -0.092 -15.741
9 2HB SER 2 1HB SER 2 5.790 -1.103 -14.472
10 HG SER 2 HG SER 2 7.395 -2.626 -14.860
11 H ALA 3 H ALA 3 3.605 -3.192 -15.355
12 HA ALA 3 HA ALA 3 1.707 -1.199 -14.767
13 1HB ALA 3 1HB ALA 3 0.833 -2.882 -17.095
14 2HB ALA 3 2HB ALA 3 1.596 -1.307 -17.317
15 3HB ALA 3 3HB ALA 3 0.075 -1.433 -16.433
16 H ALA 4 H ALA 4 1.497 -2.258 -12.832
17 HA ALA 4 HA ALA 4 0.667 -5.063 -12.846
18 1HB ALA 4 1HB ALA 4 1.281 -3.319 -10.466
19 2HB ALA 4 2HB ALA 4 2.479 -4.291 -11.319
20 3HB ALA 4 3HB ALA 4 1.130 -5.076 -10.498
21 H GLU 5 H GLU 5 -1.395 -4.218 -13.884
22 HA GLU 5 HA GLU 5 -3.637 -3.854 -13.761
23 1HB GLU 5 2HB GLU 5 -3.359 -5.688 -12.029
24 2HB GLU 5 1HB GLU 5 -3.390 -4.421 -10.809
25 1HG GLU 5 2HG GLU 5 -5.616 -3.837 -11.336
26 2HG GLU 5 1HG GLU 5 -5.595 -4.805 -12.809
27 H VAL 6 H VAL 6 -5.344 -2.449 -12.765
28 HA VAL 6 HA VAL 6 -4.460 0.202 -12.598
29 HB VAL 6 HB VAL 6 -7.088 -0.851 -11.550
30 1HG1 VAL 6 1HG1 VAL 6 -6.646 1.449 -10.926
31 2HG1 VAL 6 2HG1 VAL 6 -7.910 1.390 -12.154
32 3HG1 VAL 6 3HG1 VAL 6 -6.269 1.855 -12.600
33 1HG2 VAL 6 1HG2 VAL 6 -7.209 -1.662 -13.678
34 2HG2 VAL 6 2HG2 VAL 6 -6.078 -0.468 -14.317
35 3HG2 VAL 6 3HG2 VAL 6 -7.747 -0.009 -13.977
36 H MET 7 H MET 7 -4.454 1.684 -10.857
37 HA MET 7 HA MET 7 -4.414 0.509 -8.168
38 1HB MET 7 2HB MET 7 -2.410 1.969 -7.668
39 2HB MET 7 1HB MET 7 -2.106 0.590 -8.717
40 1HG MET 7 2HG MET 7 -1.144 1.996 -10.126
41 2HG MET 7 1HG MET 7 -2.749 2.642 -10.464
42 1HE MET 7 1HE MET 7 -0.892 3.750 -6.739
43 2HE MET 7 2HE MET 7 0.509 4.087 -7.756
44 3HE MET 7 3HE MET 7 -0.232 2.487 -7.777
45 H LYS 8 H LYS 8 -6.597 1.586 -8.426
46 HA LYS 8 HA LYS 8 -6.503 4.484 -8.084
47 1HB LYS 8 2HB LYS 8 -8.980 2.767 -8.132
48 2HB LYS 8 1HB LYS 8 -8.850 4.490 -8.455
49 1HG LYS 8 2HG LYS 8 -7.233 3.525 -10.380
50 2HG LYS 8 1HG LYS 8 -8.375 2.188 -10.223
51 1HD LYS 8 2HD LYS 8 -9.583 4.870 -10.293
52 2HD LYS 8 1HD LYS 8 -8.777 4.369 -11.781
53 1HE LYS 8 2HE LYS 8 -11.227 3.797 -11.619
54 2HE LYS 8 1HE LYS 8 -10.149 2.451 -11.988
55 1HZ LYS 8 1HZ LYS 8 -10.288 1.692 -9.754
56 2HZ LYS 8 2HZ LYS 8 -11.870 1.959 -10.288
57 3HZ LYS 8 3HZ LYS 8 -11.127 3.074 -9.257
58 H LYS 9 H LYS 9 -5.302 3.282 -6.007
59 HA LYS 9 HA LYS 9 -5.255 3.172 -3.736
60 1HB LYS 9 2HB LYS 9 -7.503 5.064 -4.269
61 2HB LYS 9 1HB LYS 9 -7.265 4.487 -2.625
62 1HG LYS 9 2HG LYS 9 -6.038 6.429 -2.634
63 2HG LYS 9 1HG LYS 9 -4.804 5.221 -2.998
64 1HD LYS 9 2HD LYS 9 -4.345 6.786 -4.613
65 2HD LYS 9 1HD LYS 9 -5.482 5.753 -5.483
66 1HE LYS 9 2HE LYS 9 -5.936 8.185 -5.732
67 2HE LYS 9 1HE LYS 9 -7.285 7.272 -5.054
68 1HZ LYS 9 1HZ LYS 9 -5.428 8.424 -3.138
69 2HZ LYS 9 2HZ LYS 9 -7.114 8.317 -3.082
70 3HZ LYS 9 3HZ LYS 9 -6.375 9.529 -4.001
71 H TYR 10 H TYR 10 -6.308 0.960 -4.984
72 HA TYR 10 HA TYR 10 -7.786 -0.228 -2.850
73 1HB TYR 10 2HB TYR 10 -9.453 1.061 -4.470
74 2HB TYR 10 1HB TYR 10 -9.272 -0.403 -5.431
75 HD1 TYR 10 1HD TYR 10 -9.063 -2.443 -3.281
76 HD2 TYR 10 2HD TYR 10 -11.642 0.920 -3.664
77 HE1 TYR 10 1HE TYR 10 -10.736 -3.573 -1.878
78 HE2 TYR 10 2HE TYR 10 -13.322 -0.202 -2.260
79 HH TYR 10 HH TYR 10 -13.401 -1.970 -0.542
80 H CYS 11 H CYS 11 -6.608 -2.022 -2.680
81 HA CYS 11 HA CYS 11 -5.597 -3.352 -5.064
82 1HB CYS 11 2HB CYS 11 -4.251 -2.943 -2.907
83 2HB CYS 11 1HB CYS 11 -5.184 -4.271 -2.226
84 H SER 12 H SER 12 -7.438 -4.249 -5.979
85 HA SER 12 HA SER 12 -9.462 -5.642 -4.704
86 1HB SER 12 2HB SER 12 -9.791 -5.092 -6.983
87 2HB SER 12 1HB SER 12 -8.302 -5.899 -7.475
88 HG SER 12 HG SER 12 -9.445 -7.627 -7.741
89 H THR 13 H THR 13 -6.324 -6.803 -5.827
90 HA THR 13 HA THR 13 -6.724 -9.542 -5.456
91 HB THR 13 HB THR 13 -4.173 -7.953 -5.116
92 HG1 THR 13 1HG THR 13 -5.174 -9.309 -7.393
93 1HG2 THR 13 1HG2 THR 13 -4.203 -10.757 -6.084
94 2HG2 THR 13 2HG2 THR 13 -4.316 -10.459 -4.350
95 3HG2 THR 13 3HG2 THR 13 -2.932 -9.854 -5.259
96 H CYS 14 H CYS 14 -5.872 -7.008 -3.178
97 HA CYS 14 HA CYS 14 -5.561 -8.936 -1.017
98 1HB CYS 14 2HB CYS 14 -5.047 -5.991 -1.304
99 2HB CYS 14 1HB CYS 14 -5.100 -6.748 0.279
100 H ASP 15 H ASP 15 -7.884 -6.734 -2.312
101 HA ASP 15 HA ASP 15 -10.078 -6.397 -1.790
102 1HB ASP 15 2HB ASP 15 -9.762 -8.864 -0.862
103 2HB ASP 15 1HB ASP 15 -9.938 -8.052 0.691
104 H ILE 16 H ILE 16 -8.222 -4.553 -1.031
105 HA ILE 16 HA ILE 16 -9.523 -3.362 1.282
106 HB ILE 16 HB ILE 16 -6.521 -3.394 1.261
107 1HG1 ILE 16 2HG1 ILE 16 -8.306 -5.357 2.720
108 2HG1 ILE 16 1HG1 ILE 16 -7.287 -5.748 1.339
109 1HG2 ILE 16 1HG2 ILE 16 -7.064 -1.817 2.779
110 2HG2 ILE 16 2HG2 ILE 16 -7.266 -3.216 3.834
111 3HG2 ILE 16 3HG2 ILE 16 -8.672 -2.485 3.060
112 1HD1 ILE 16 1HD1 ILE 16 -5.873 -6.405 2.959
113 2HD1 ILE 16 2HD1 ILE 16 -6.575 -5.322 4.163
114 3HD1 ILE 16 3HD1 ILE 16 -5.442 -4.694 2.965
115 H SER 17 H SER 17 -8.859 -1.071 1.578
116 HA SER 17 HA SER 17 -7.770 0.149 -0.858
117 1HB SER 17 2HB SER 17 -10.156 0.292 -1.162
118 2HB SER 17 1HB SER 17 -10.377 0.895 0.480
119 HG SER 17 HG SER 17 -10.229 2.778 -0.438
120 H PHE 18 H PHE 18 -6.863 2.230 -0.575
121 HA PHE 18 HA PHE 18 -6.492 3.073 2.218
122 1HB PHE 18 2HB PHE 18 -4.270 3.163 0.181
123 2HB PHE 18 1HB PHE 18 -4.158 3.390 1.924
124 HD1 PHE 18 1HD PHE 18 -5.641 1.118 2.972
125 HD2 PHE 18 2HD PHE 18 -2.960 1.335 -0.327
126 HE1 PHE 18 1HE PHE 18 -5.115 -1.270 3.247
127 HE2 PHE 18 2HE PHE 18 -2.430 -1.053 -0.058
128 HZ PHE 18 HZ PHE 18 -3.509 -2.358 1.730
129 H ASN 19 H ASN 19 -6.864 5.168 2.555
130 HA ASN 19 HA ASN 19 -7.697 6.852 0.410
131 1HB ASN 19 2HB ASN 19 -7.213 7.407 3.342
132 2HB ASN 19 1HB ASN 19 -7.860 8.598 2.217
133 1HD2 ASN 19 1HD2 ASN 19 -9.913 8.239 1.292
134 2HD2 ASN 19 2HD2 ASN 19 -11.060 7.193 2.049
135 H TYR 20 H TYR 20 -4.737 6.438 2.212
136 HA TYR 20 HA TYR 20 -3.556 8.844 1.073
137 1HB TYR 20 2HB TYR 20 -2.038 6.823 2.691
138 2HB TYR 20 1HB TYR 20 -1.785 8.559 2.571
139 HD1 TYR 20 1HD TYR 20 -3.495 10.097 3.657
140 HD2 TYR 20 2HD TYR 20 -3.344 5.915 4.420
141 HE1 TYR 20 1HE TYR 20 -4.789 10.434 5.720
142 HE2 TYR 20 2HE TYR 20 -4.638 6.239 6.486
143 HH TYR 20 HH TYR 20 -5.175 7.966 8.071
144 H VAL 21 H VAL 21 -2.550 8.838 -0.816
145 HA VAL 21 HA VAL 21 -2.202 6.581 -2.419
146 HB VAL 21 HB VAL 21 -0.592 9.125 -2.637
147 1HG1 VAL 21 1HG1 VAL 21 -1.440 7.069 -4.673
148 2HG1 VAL 21 2HG1 VAL 21 0.197 7.359 -4.084
149 3HG1 VAL 21 3HG1 VAL 21 -0.624 8.586 -5.048
150 1HG2 VAL 21 1HG2 VAL 21 -2.793 9.904 -2.526
151 2HG2 VAL 21 2HG2 VAL 21 -3.424 8.524 -3.424
152 3HG2 VAL 21 3HG2 VAL 21 -2.478 9.758 -4.255
153 H LYS 22 H LYS 22 0.065 8.245 -0.275
154 HA LYS 22 HA LYS 22 2.406 6.911 -0.964
155 1HB LYS 22 2HB LYS 22 2.995 7.311 1.535
156 2HB LYS 22 1HB LYS 22 2.744 8.694 0.481
157 1HG LYS 22 2HG LYS 22 0.253 7.915 1.666
158 2HG LYS 22 1HG LYS 22 1.479 8.128 2.917
159 1HD LYS 22 2HD LYS 22 1.295 10.337 2.748
160 2HD LYS 22 1HD LYS 22 1.723 10.259 1.039
161 1HE LYS 22 2HE LYS 22 -0.331 11.058 0.666
162 2HE LYS 22 1HE LYS 22 -0.884 9.423 1.028
163 1HZ LYS 22 1HZ LYS 22 -0.985 10.187 3.419
164 2HZ LYS 22 2HZ LYS 22 -2.147 10.841 2.379
165 3HZ LYS 22 3HZ LYS 22 -0.806 11.766 2.837
166 H THR 23 H THR 23 -0.251 5.909 1.086
167 HA THR 23 HA THR 23 1.003 3.640 2.226
168 HB THR 23 HB THR 23 -1.938 4.121 1.723
169 HG1 THR 23 1HG THR 23 -0.369 4.734 4.004
170 1HG2 THR 23 1HG2 THR 23 -1.933 1.945 2.413
171 2HG2 THR 23 2HG2 THR 23 -2.002 2.783 3.964
172 3HG2 THR 23 3HG2 THR 23 -0.469 2.137 3.377
173 H TYR 24 H TYR 24 -1.150 4.044 -0.570
174 HA TYR 24 HA TYR 24 -1.225 1.325 -1.304
175 1HB TYR 24 2HB TYR 24 -2.667 3.362 -2.107
176 2HB TYR 24 1HB TYR 24 -1.425 3.513 -3.346
177 HD1 TYR 24 1HD TYR 24 -4.057 1.310 -1.990
178 HD2 TYR 24 2HD TYR 24 -1.312 1.980 -5.171
179 HE1 TYR 24 1HE TYR 24 -5.185 -0.421 -3.321
180 HE2 TYR 24 2HE TYR 24 -2.434 0.251 -6.512
181 HH TYR 24 HH TYR 24 -5.176 -0.750 -6.302
182 H LEU 25 H LEU 25 1.041 3.897 -1.952
183 HA LEU 25 HA LEU 25 2.439 2.637 -4.066
184 1HB LEU 25 2HB LEU 25 2.521 5.102 -2.942
185 2HB LEU 25 1HB LEU 25 3.973 4.394 -2.260
186 HG LEU 25 HG LEU 25 4.374 3.737 -4.821
187 1HD1 LEU 25 1HD1 LEU 25 3.717 6.056 -5.961
188 2HD1 LEU 25 2HD1 LEU 25 2.366 5.908 -4.836
189 3HD1 LEU 25 3HD1 LEU 25 2.673 4.634 -6.016
190 1HD2 LEU 25 1HD2 LEU 25 4.996 6.556 -4.101
191 2HD2 LEU 25 2HD2 LEU 25 6.031 5.314 -4.807
192 3HD2 LEU 25 3HD2 LEU 25 5.641 5.265 -3.088
193 H ALA 26 H ALA 26 3.328 3.013 -0.650
194 HA ALA 26 HA ALA 26 5.499 1.268 -0.697
195 1HB ALA 26 1HB ALA 26 3.778 1.724 1.720
196 2HB ALA 26 2HB ALA 26 4.887 2.949 1.102
197 3HB ALA 26 3HB ALA 26 5.509 1.394 1.655
198 H HIS 27 H HIS 27 2.132 0.659 -0.704
199 HA HIS 27 HA HIS 27 2.155 -1.936 0.450
200 1HB HIS 27 2HB HIS 27 0.102 -0.611 0.316
201 2HB HIS 27 1HB HIS 27 0.175 -0.650 -1.442
202 HD1 HIS 27 1HD HIS 27 -1.002 -2.590 1.474
203 HD2 HIS 27 2HD HIS 27 -0.368 -3.204 -2.586
204 HE1 HIS 27 1HE HIS 27 -2.231 -4.718 0.878
205 H LYS 28 H LYS 28 1.709 -0.946 -2.953
206 HA LYS 28 HA LYS 28 2.112 -3.557 -3.964
207 1HB LYS 28 2HB LYS 28 2.448 -2.322 -6.169
208 2HB LYS 28 1HB LYS 28 0.908 -2.080 -5.355
209 1HG LYS 28 2HG LYS 28 1.271 0.106 -5.050
210 2HG LYS 28 1HG LYS 28 2.968 -0.132 -4.628
211 1HD LYS 28 2HD LYS 28 3.063 1.060 -6.630
212 2HD LYS 28 1HD LYS 28 3.304 -0.614 -7.134
213 1HE LYS 28 2HE LYS 28 0.505 0.298 -7.048
214 2HE LYS 28 1HE LYS 28 1.518 1.078 -8.262
215 1HZ LYS 28 1HZ LYS 28 0.661 -0.773 -9.340
216 2HZ LYS 28 2HZ LYS 28 0.840 -1.783 -7.995
217 3HZ LYS 28 3HZ LYS 28 2.202 -1.290 -8.870
218 H GLN 29 H GLN 29 4.287 -1.221 -2.796
219 HA GLN 29 HA GLN 29 6.539 -1.778 -4.408
220 1HB GLN 29 2HB GLN 29 6.061 -0.452 -1.788
221 2HB GLN 29 1HB GLN 29 7.705 -0.961 -2.151
222 1HG GLN 29 2HG GLN 29 6.000 0.911 -3.775
223 2HG GLN 29 1HG GLN 29 7.398 1.336 -2.791
224 1HE2 GLN 29 1HE2 GLN 29 6.292 0.212 -5.815
225 2HE2 GLN 29 2HE2 GLN 29 7.835 0.023 -6.570
226 H PHE 30 H PHE 30 5.956 -2.760 -1.018
227 HA PHE 30 HA PHE 30 6.980 -5.412 -1.605
228 1HB PHE 30 2HB PHE 30 8.463 -5.018 0.568
229 2HB PHE 30 1HB PHE 30 9.069 -4.706 -1.053
230 HD1 PHE 30 1HD PHE 30 7.513 -3.076 1.892
231 HD2 PHE 30 2HD PHE 30 9.823 -2.579 -1.647
232 HE1 PHE 30 1HE PHE 30 7.986 -0.747 2.532
233 HE2 PHE 30 2HE PHE 30 10.301 -0.250 -1.014
234 HZ PHE 30 HZ PHE 30 9.383 0.669 1.078
235 H TYR 31 H TYR 31 4.519 -3.962 -0.470
236 HA TYR 31 HA TYR 31 4.350 -5.424 2.076
237 1HB TYR 31 2HB TYR 31 3.702 -2.786 1.491
238 2HB TYR 31 1HB TYR 31 2.142 -3.602 1.541
239 HD1 TYR 31 1HD TYR 31 5.121 -2.685 3.486
240 HD2 TYR 31 2HD TYR 31 1.270 -4.488 3.606
241 HE1 TYR 31 1HE TYR 31 5.160 -2.592 5.942
242 HE2 TYR 31 2HE TYR 31 1.297 -4.398 6.063
243 HH TYR 31 HH TYR 31 3.613 -2.595 7.811
244 H CYS 32 H CYS 32 3.019 -5.136 -1.106
245 HA CYS 32 HA CYS 32 0.626 -6.619 -0.587
246 1HB CYS 32 2HB CYS 32 0.969 -4.976 -2.479
247 2HB CYS 32 1HB CYS 32 1.969 -6.195 -3.258
248 H LYS 33 H LYS 33 0.791 -8.669 0.086
249 HA LYS 33 HA LYS 33 2.880 -10.393 -0.971
250 1HB LYS 33 2HB LYS 33 2.296 -10.222 1.489
251 2HB LYS 33 1HB LYS 33 0.803 -11.066 1.101
252 1HG LYS 33 2HG LYS 33 1.969 -12.890 1.572
253 2HG LYS 33 1HG LYS 33 2.636 -12.694 -0.046
254 1HD LYS 33 2HD LYS 33 3.882 -11.396 2.362
255 2HD LYS 33 1HD LYS 33 4.294 -13.041 1.869
256 1HE LYS 33 2HE LYS 33 4.991 -12.228 -0.317
257 2HE LYS 33 1HE LYS 33 4.536 -10.586 0.134
258 1HZ LYS 33 1HZ LYS 33 6.404 -11.928 1.910
259 2HZ LYS 33 2HZ LYS 33 6.377 -10.322 1.379
260 3HZ LYS 33 3HZ LYS 33 7.000 -11.532 0.376
261 H ASN 34 H ASN 34 0.562 -9.541 -2.615
262 HA ASN 34 HA ASN 34 -0.377 -12.227 -3.333
263 1HB ASN 34 2HB ASN 34 -2.117 -9.758 -3.428
264 2HB ASN 34 1HB ASN 34 -2.602 -11.418 -3.763
265 1HD2 ASN 34 1HD2 ASN 34 -1.223 -9.399 -1.204
266 2HD2 ASN 34 2HD2 ASN 34 -2.020 -10.205 0.100
267 H LYS 35 H LYS 35 1.218 -12.252 -4.964
268 HA LYS 35 HA LYS 35 0.632 -10.468 -7.236
269 1HB LYS 35 2HB LYS 35 3.322 -11.722 -6.713
270 2HB LYS 35 1HB LYS 35 2.930 -10.421 -7.829
271 1HG LYS 35 2HG LYS 35 3.789 -9.137 -6.199
272 2HG LYS 35 1HG LYS 35 2.168 -9.285 -5.517
273 1HD LYS 35 2HD LYS 35 3.366 -9.916 -3.689
274 2HD LYS 35 1HD LYS 35 3.241 -11.490 -4.478
275 1HE LYS 35 2HE LYS 35 5.520 -11.124 -3.777
276 2HE LYS 35 1HE LYS 35 5.435 -11.093 -5.538
277 1HZ LYS 35 1HZ LYS 35 5.348 -8.620 -3.915
278 2HZ LYS 35 2HZ LYS 35 5.666 -8.775 -5.569
279 3HZ LYS 35 3HZ LYS 35 6.806 -9.302 -4.437
280 HA PRO 36 HA PRO 36 -0.148 -14.867 -8.518
281 1HB PRO 36 2HB PRO 36 -2.429 -14.336 -9.887
282 2HB PRO 36 1HB PRO 36 -2.407 -14.654 -8.149
283 1HG PRO 36 2HG PRO 36 -2.525 -12.035 -9.595
284 2HG PRO 36 1HG PRO 36 -3.436 -12.568 -8.170
285 1HD PRO 36 2HD PRO 36 -1.266 -10.958 -7.993
286 2HD PRO 36 1HD PRO 36 -1.685 -12.136 -6.733
Start of MODEL 5
1 1H GLY 1 1HT GLY 1 -10.720 11.650 -2.945
2 2H GLY 1 2HT GLY 1 -10.743 11.575 -4.634
3 3H GLY 1 3HT GLY 1 -12.001 12.344 -3.806
4 1HA GLY 1 1HA GLY 1 -9.905 13.720 -2.883
5 2HA GLY 1 2HA GLY 1 -9.366 13.325 -4.509
6 H SER 2 H SER 2 -9.465 15.752 -4.607
7 HA SER 2 HA SER 2 -12.104 16.532 -5.628
8 1HB SER 2 2HB SER 2 -10.354 18.235 -3.837
9 2HB SER 2 1HB SER 2 -11.837 18.776 -4.625
10 HG SER 2 HG SER 2 -13.006 17.379 -3.368
11 H ALA 3 H ALA 3 -12.073 17.661 -7.500
12 HA ALA 3 HA ALA 3 -11.284 18.565 -9.434
13 1HB ALA 3 1HB ALA 3 -8.964 19.836 -9.018
14 2HB ALA 3 2HB ALA 3 -9.518 19.694 -7.349
15 3HB ALA 3 3HB ALA 3 -10.526 20.506 -8.548
16 H ALA 4 H ALA 4 -10.545 15.841 -8.698
17 HA ALA 4 HA ALA 4 -8.760 15.273 -10.797
18 1HB ALA 4 1HB ALA 4 -6.853 15.837 -9.716
19 2HB ALA 4 2HB ALA 4 -7.035 14.219 -9.040
20 3HB ALA 4 3HB ALA 4 -7.565 15.625 -8.117
21 H GLU 5 H GLU 5 -8.906 13.744 -7.594
22 HA GLU 5 HA GLU 5 -9.632 11.699 -6.913
23 1HB GLU 5 2HB GLU 5 -11.805 12.705 -7.735
24 2HB GLU 5 1HB GLU 5 -11.558 11.820 -9.234
25 1HG GLU 5 2HG GLU 5 -11.364 10.203 -6.794
26 2HG GLU 5 1HG GLU 5 -12.952 10.898 -7.111
27 H VAL 6 H VAL 6 -7.882 10.418 -7.304
28 HA VAL 6 HA VAL 6 -7.653 9.178 -9.959
29 HB VAL 6 HB VAL 6 -5.612 9.117 -7.735
30 1HG1 VAL 6 1HG1 VAL 6 -5.364 8.536 -10.684
31 2HG1 VAL 6 2HG1 VAL 6 -5.428 7.327 -9.403
32 3HG1 VAL 6 3HG1 VAL 6 -4.069 8.447 -9.491
33 1HG2 VAL 6 1HG2 VAL 6 -5.964 11.420 -8.388
34 2HG2 VAL 6 2HG2 VAL 6 -5.814 10.991 -10.091
35 3HG2 VAL 6 3HG2 VAL 6 -4.420 10.855 -9.021
36 H MET 7 H MET 7 -7.402 6.923 -10.162
37 HA MET 7 HA MET 7 -8.544 5.411 -7.919
38 1HB MET 7 2HB MET 7 -9.783 5.398 -10.092
39 2HB MET 7 1HB MET 7 -8.397 4.607 -10.830
40 1HG MET 7 2HG MET 7 -8.871 2.609 -9.908
41 2HG MET 7 1HG MET 7 -9.477 3.318 -8.413
42 1HE MET 7 1HE MET 7 -11.664 5.248 -9.107
43 2HE MET 7 2HE MET 7 -11.995 3.941 -7.970
44 3HE MET 7 3HE MET 7 -13.124 4.273 -9.283
45 H LYS 8 H LYS 8 -6.172 5.741 -7.226
46 HA LYS 8 HA LYS 8 -4.750 3.271 -7.925
47 1HB LYS 8 2HB LYS 8 -3.508 6.017 -7.680
48 2HB LYS 8 1HB LYS 8 -2.590 4.518 -7.765
49 1HG LYS 8 2HG LYS 8 -4.080 4.230 -9.965
50 2HG LYS 8 1HG LYS 8 -4.020 5.992 -9.884
51 1HD LYS 8 2HD LYS 8 -2.085 5.729 -11.009
52 2HD LYS 8 1HD LYS 8 -1.428 5.382 -9.408
53 1HE LYS 8 2HE LYS 8 -2.125 2.940 -9.926
54 2HE LYS 8 1HE LYS 8 -2.172 3.485 -11.602
55 1HZ LYS 8 1HZ LYS 8 -0.018 2.888 -11.531
56 2HZ LYS 8 2HZ LYS 8 0.108 3.065 -9.853
57 3HZ LYS 8 3HZ LYS 8 0.195 4.425 -10.856
58 H LYS 9 H LYS 9 -6.378 3.419 -5.790
59 HA LYS 9 HA LYS 9 -4.518 3.065 -3.602
60 1HB LYS 9 2HB LYS 9 -5.994 4.489 -2.082
61 2HB LYS 9 1HB LYS 9 -4.922 5.344 -3.182
62 1HG LYS 9 2HG LYS 9 -6.677 6.499 -3.876
63 2HG LYS 9 1HG LYS 9 -7.298 5.014 -4.600
64 1HD LYS 9 2HD LYS 9 -9.072 5.486 -3.265
65 2HD LYS 9 1HD LYS 9 -8.095 4.619 -2.079
66 1HE LYS 9 2HE LYS 9 -8.876 6.633 -1.058
67 2HE LYS 9 1HE LYS 9 -7.149 6.814 -1.364
68 1HZ LYS 9 1HZ LYS 9 -8.153 7.830 -3.604
69 2HZ LYS 9 2HZ LYS 9 -7.821 8.762 -2.232
70 3HZ LYS 9 3HZ LYS 9 -9.399 8.232 -2.531
71 H TYR 10 H TYR 10 -5.747 1.050 -4.760
72 HA TYR 10 HA TYR 10 -7.386 -0.031 -2.690
73 1HB TYR 10 2HB TYR 10 -9.120 1.242 -3.833
74 2HB TYR 10 1HB TYR 10 -8.667 0.523 -5.375
75 HD1 TYR 10 1HD TYR 10 -10.202 -1.007 -6.142
76 HD2 TYR 10 2HD TYR 10 -9.468 -0.785 -1.958
77 HE1 TYR 10 1HE TYR 10 -11.810 -2.829 -5.770
78 HE2 TYR 10 2HE TYR 10 -11.074 -2.607 -1.574
79 HH TYR 10 HH TYR 10 -12.220 -4.591 -4.003
80 H CYS 11 H CYS 11 -6.351 -1.917 -2.520
81 HA CYS 11 HA CYS 11 -5.319 -3.270 -4.864
82 1HB CYS 11 2HB CYS 11 -4.166 -3.108 -2.565
83 2HB CYS 11 1HB CYS 11 -5.291 -4.364 -2.059
84 H SER 12 H SER 12 -6.842 -4.238 -6.069
85 HA SER 12 HA SER 12 -9.249 -5.325 -5.130
86 1HB SER 12 2HB SER 12 -9.558 -6.192 -7.324
87 2HB SER 12 1HB SER 12 -8.658 -4.690 -7.524
88 HG SER 12 HG SER 12 -6.737 -6.032 -7.583
89 H THR 13 H THR 13 -6.081 -6.777 -5.654
90 HA THR 13 HA THR 13 -6.827 -9.466 -5.318
91 HB THR 13 HB THR 13 -4.185 -8.152 -4.655
92 HG1 THR 13 1HG THR 13 -4.064 -7.920 -6.723
93 1HG2 THR 13 1HG2 THR 13 -3.149 -10.250 -4.889
94 2HG2 THR 13 2HG2 THR 13 -4.634 -11.003 -5.472
95 3HG2 THR 13 3HG2 THR 13 -4.505 -10.492 -3.790
96 H CYS 14 H CYS 14 -5.485 -7.146 -2.971
97 HA CYS 14 HA CYS 14 -5.797 -8.931 -0.764
98 1HB CYS 14 2HB CYS 14 -5.141 -5.999 -0.996
99 2HB CYS 14 1HB CYS 14 -5.299 -6.807 0.555
100 H ASP 15 H ASP 15 -7.782 -6.561 -2.326
101 HA ASP 15 HA ASP 15 -9.998 -6.074 -2.083
102 1HB ASP 15 2HB ASP 15 -10.041 -8.545 -1.224
103 2HB ASP 15 1HB ASP 15 -10.214 -7.799 0.362
104 H ILE 16 H ILE 16 -7.989 -4.481 -0.953
105 HA ILE 16 HA ILE 16 -9.511 -3.222 1.214
106 HB ILE 16 HB ILE 16 -6.516 -3.331 1.380
107 1HG1 ILE 16 2HG1 ILE 16 -7.368 -5.666 1.358
108 2HG1 ILE 16 1HG1 ILE 16 -6.659 -5.216 2.906
109 1HG2 ILE 16 1HG2 ILE 16 -7.190 -1.730 2.850
110 2HG2 ILE 16 2HG2 ILE 16 -7.329 -3.144 3.892
111 3HG2 ILE 16 3HG2 ILE 16 -8.765 -2.477 3.115
112 1HD1 ILE 16 1HD1 ILE 16 -9.514 -4.706 2.792
113 2HD1 ILE 16 2HD1 ILE 16 -8.562 -5.583 3.990
114 3HD1 ILE 16 3HD1 ILE 16 -9.103 -6.400 2.523
115 H SER 17 H SER 17 -8.822 -0.957 1.599
116 HA SER 17 HA SER 17 -7.577 0.285 -0.754
117 1HB SER 17 2HB SER 17 -9.533 2.104 0.073
118 2HB SER 17 1HB SER 17 -9.568 1.112 -1.384
119 HG SER 17 HG SER 17 -10.892 0.768 1.044
120 H PHE 18 H PHE 18 -6.855 2.515 -0.357
121 HA PHE 18 HA PHE 18 -6.338 3.070 2.485
122 1HB PHE 18 2HB PHE 18 -4.274 3.474 0.320
123 2HB PHE 18 1HB PHE 18 -4.046 3.590 2.062
124 HD1 PHE 18 1HD PHE 18 -5.101 1.235 3.190
125 HD2 PHE 18 2HD PHE 18 -3.126 1.698 -0.550
126 HE1 PHE 18 1HE PHE 18 -4.426 -1.130 3.259
127 HE2 PHE 18 2HE PHE 18 -2.447 -0.666 -0.489
128 HZ PHE 18 HZ PHE 18 -3.096 -2.083 1.419
129 H ASN 19 H ASN 19 -6.736 5.105 3.087
130 HA ASN 19 HA ASN 19 -7.953 6.941 1.337
131 1HB ASN 19 2HB ASN 19 -7.011 6.992 4.159
132 2HB ASN 19 1HB ASN 19 -7.294 8.544 3.376
133 1HD2 ASN 19 1HD2 ASN 19 -9.160 9.273 4.101
134 2HD2 ASN 19 2HD2 ASN 19 -10.637 8.379 4.175
135 H TYR 20 H TYR 20 -4.638 6.461 2.297
136 HA TYR 20 HA TYR 20 -3.839 8.899 0.864
137 1HB TYR 20 2HB TYR 20 -2.077 7.173 2.602
138 2HB TYR 20 1HB TYR 20 -1.773 8.817 2.052
139 HD1 TYR 20 1HD TYR 20 -2.367 10.631 3.397
140 HD2 TYR 20 2HD TYR 20 -4.076 6.815 4.185
141 HE1 TYR 20 1HE TYR 20 -3.364 11.510 5.466
142 HE2 TYR 20 2HE TYR 20 -5.078 7.684 6.255
143 HH TYR 20 HH TYR 20 -4.165 10.210 7.822
144 H VAL 21 H VAL 21 -2.922 8.756 -1.075
145 HA VAL 21 HA VAL 21 -2.721 6.368 -2.504
146 HB VAL 21 HB VAL 21 -1.140 8.873 -3.085
147 1HG1 VAL 21 1HG1 VAL 21 -0.739 8.040 -5.142
148 2HG1 VAL 21 2HG1 VAL 21 -2.307 7.240 -5.241
149 3HG1 VAL 21 3HG1 VAL 21 -0.991 6.492 -4.336
150 1HG2 VAL 21 1HG2 VAL 21 -3.274 9.738 -2.907
151 2HG2 VAL 21 2HG2 VAL 21 -4.037 8.246 -3.455
152 3HG2 VAL 21 3HG2 VAL 21 -3.209 9.289 -4.611
153 H LYS 22 H LYS 22 -0.314 8.129 -0.628
154 HA LYS 22 HA LYS 22 1.992 6.802 -1.434
155 1HB LYS 22 2HB LYS 22 1.455 8.747 0.374
156 2HB LYS 22 1HB LYS 22 1.782 7.400 1.454
157 1HG LYS 22 2HG LYS 22 3.847 8.430 1.204
158 2HG LYS 22 1HG LYS 22 3.921 7.069 0.082
159 1HD LYS 22 2HD LYS 22 3.707 8.434 -1.783
160 2HD LYS 22 1HD LYS 22 2.983 9.751 -0.859
161 1HE LYS 22 2HE LYS 22 5.720 8.993 -0.077
162 2HE LYS 22 1HE LYS 22 5.556 9.712 -1.678
163 1HZ LYS 22 1HZ LYS 22 5.094 10.902 0.951
164 2HZ LYS 22 2HZ LYS 22 4.107 11.419 -0.322
165 3HZ LYS 22 3HZ LYS 22 5.786 11.580 -0.436
166 H THR 23 H THR 23 -0.563 5.794 0.714
167 HA THR 23 HA THR 23 0.754 3.616 1.935
168 HB THR 23 HB THR 23 -2.198 3.811 1.347
169 HG1 THR 23 1HG THR 23 -0.719 4.994 3.457
170 1HG2 THR 23 1HG2 THR 23 -2.304 2.775 3.667
171 2HG2 THR 23 2HG2 THR 23 -0.599 2.387 3.438
172 3HG2 THR 23 3HG2 THR 23 -1.808 1.735 2.332
173 H TYR 24 H TYR 24 -1.420 3.790 -0.875
174 HA TYR 24 HA TYR 24 -1.376 1.067 -1.525
175 1HB TYR 24 2HB TYR 24 -2.891 2.919 -2.453
176 2HB TYR 24 1HB TYR 24 -1.578 3.273 -3.569
177 HD1 TYR 24 1HD TYR 24 -3.272 0.167 -2.338
178 HD2 TYR 24 2HD TYR 24 -1.927 2.433 -5.678
179 HE1 TYR 24 1HE TYR 24 -4.089 -1.590 -3.852
180 HE2 TYR 24 2HE TYR 24 -2.742 0.683 -7.201
181 HH TYR 24 HH TYR 24 -3.598 -2.396 -6.174
182 H LEU 25 H LEU 25 0.793 3.695 -2.329
183 HA LEU 25 HA LEU 25 2.314 2.366 -4.291
184 1HB LEU 25 2HB LEU 25 2.305 4.880 -3.210
185 2HB LEU 25 1HB LEU 25 3.792 4.221 -2.559
186 HG LEU 25 HG LEU 25 4.113 3.529 -5.135
187 1HD1 LEU 25 1HD1 LEU 25 3.249 5.090 -6.645
188 2HD1 LEU 25 2HD1 LEU 25 2.752 6.192 -5.362
189 3HD1 LEU 25 3HD1 LEU 25 1.882 4.679 -5.610
190 1HD2 LEU 25 1HD2 LEU 25 5.601 4.876 -3.614
191 2HD2 LEU 25 2HD2 LEU 25 4.722 6.308 -4.151
192 3HD2 LEU 25 3HD2 LEU 25 5.632 5.343 -5.314
193 H ALA 26 H ALA 26 3.214 3.009 -0.918
194 HA ALA 26 HA ALA 26 5.371 1.261 -0.822
195 1HB ALA 26 1HB ALA 26 5.155 1.393 1.624
196 2HB ALA 26 2HB ALA 26 3.578 2.157 1.427
197 3HB ALA 26 3HB ALA 26 5.032 2.976 0.856
198 H HIS 27 H HIS 27 2.018 0.599 -0.848
199 HA HIS 27 HA HIS 27 2.103 -1.908 0.515
200 1HB HIS 27 2HB HIS 27 0.022 -0.638 0.374
201 2HB HIS 27 1HB HIS 27 0.049 -0.753 -1.382
202 HD1 HIS 27 1HD HIS 27 -0.982 -2.604 1.656
203 HD2 HIS 27 2HD HIS 27 -0.516 -3.342 -2.406
204 HE1 HIS 27 1HE HIS 27 -2.200 -4.769 1.183
205 H LYS 28 H LYS 28 1.570 -1.117 -2.926
206 HA LYS 28 HA LYS 28 1.960 -3.778 -3.804
207 1HB LYS 28 2HB LYS 28 2.274 -1.240 -5.415
208 2HB LYS 28 1HB LYS 28 1.985 -2.855 -6.047
209 1HG LYS 28 2HG LYS 28 0.013 -1.755 -4.125
210 2HG LYS 28 1HG LYS 28 0.043 -1.085 -5.758
211 1HD LYS 28 2HD LYS 28 0.136 -4.023 -5.600
212 2HD LYS 28 1HD LYS 28 -1.365 -3.285 -5.034
213 1HE LYS 28 2HE LYS 28 -1.887 -3.454 -7.236
214 2HE LYS 28 1HE LYS 28 -1.058 -1.899 -7.287
215 1HZ LYS 28 1HZ LYS 28 0.077 -4.551 -7.984
216 2HZ LYS 28 2HZ LYS 28 0.994 -3.134 -7.868
217 3HZ LYS 28 3HZ LYS 28 -0.223 -3.259 -9.036
218 H GLN 29 H GLN 29 4.154 -1.358 -2.832
219 HA GLN 29 HA GLN 29 6.370 -2.018 -4.451
220 1HB GLN 29 2HB GLN 29 5.879 -0.427 -2.027
221 2HB GLN 29 1HB GLN 29 7.497 -1.105 -2.129
222 1HG GLN 29 2HG GLN 29 7.023 1.253 -3.084
223 2HG GLN 29 1HG GLN 29 8.054 0.139 -3.976
224 1HE2 GLN 29 1HE2 GLN 29 7.208 -0.890 -5.837
225 2HE2 GLN 29 2HE2 GLN 29 5.870 -0.215 -6.696
226 H PHE 30 H PHE 30 5.873 -2.793 -0.994
227 HA PHE 30 HA PHE 30 6.887 -5.475 -1.450
228 1HB PHE 30 2HB PHE 30 8.421 -4.954 0.661
229 2HB PHE 30 1HB PHE 30 8.987 -4.736 -0.991
230 HD1 PHE 30 1HD PHE 30 6.930 -2.716 1.383
231 HD2 PHE 30 2HD PHE 30 10.293 -2.870 -1.219
232 HE1 PHE 30 1HE PHE 30 7.412 -0.353 1.874
233 HE2 PHE 30 2HE PHE 30 10.783 -0.509 -0.733
234 HZ PHE 30 HZ PHE 30 9.342 0.753 0.816
235 H TYR 31 H TYR 31 4.447 -3.973 -0.348
236 HA TYR 31 HA TYR 31 4.343 -5.287 2.282
237 1HB TYR 31 2HB TYR 31 3.683 -2.680 1.562
238 2HB TYR 31 1HB TYR 31 2.128 -3.488 1.724
239 HD1 TYR 31 1HD TYR 31 4.858 -1.967 3.457
240 HD2 TYR 31 2HD TYR 31 1.666 -4.745 3.904
241 HE1 TYR 31 1HE TYR 31 4.996 -1.724 5.899
242 HE2 TYR 31 2HE TYR 31 1.795 -4.508 6.348
243 HH TYR 31 HH TYR 31 4.400 -2.910 7.906
244 H CYS 32 H CYS 32 2.980 -5.227 -0.886
245 HA CYS 32 HA CYS 32 0.563 -6.615 -0.229
246 1HB CYS 32 2HB CYS 32 0.895 -5.134 -2.244
247 2HB CYS 32 1HB CYS 32 1.887 -6.413 -2.936
248 H LYS 33 H LYS 33 0.089 -8.772 -0.428
249 HA LYS 33 HA LYS 33 2.408 -10.560 -0.573
250 1HB LYS 33 2HB LYS 33 0.969 -12.217 0.526
251 2HB LYS 33 1HB LYS 33 1.056 -10.727 1.455
252 1HG LYS 33 2HG LYS 33 -1.174 -10.894 -0.454
253 2HG LYS 33 1HG LYS 33 -1.230 -12.033 0.892
254 1HD LYS 33 2HD LYS 33 -0.555 -9.227 1.548
255 2HD LYS 33 1HD LYS 33 -2.215 -9.547 1.041
256 1HE LYS 33 2HE LYS 33 -1.080 -11.415 3.022
257 2HE LYS 33 1HE LYS 33 -1.355 -9.766 3.584
258 1HZ LYS 33 1HZ LYS 33 -3.522 -11.008 2.088
259 2HZ LYS 33 2HZ LYS 33 -3.581 -9.994 3.441
260 3HZ LYS 33 3HZ LYS 33 -3.223 -11.636 3.632
261 H ASN 34 H ASN 34 1.358 -9.475 -2.978
262 HA ASN 34 HA ASN 34 -0.341 -11.413 -4.236
263 1HB ASN 34 2HB ASN 34 0.181 -10.123 -6.316
264 2HB ASN 34 1HB ASN 34 -0.453 -9.132 -5.004
265 1HD2 ASN 34 1HD2 ASN 34 2.213 -9.777 -7.063
266 2HD2 ASN 34 2HD2 ASN 34 3.227 -8.486 -6.524
267 H LYS 35 H LYS 35 1.325 -13.104 -3.378
268 HA LYS 35 HA LYS 35 3.776 -13.494 -4.669
269 1HB LYS 35 2HB LYS 35 3.139 -14.693 -2.631
270 2HB LYS 35 1HB LYS 35 1.884 -15.552 -3.514
271 1HG LYS 35 2HG LYS 35 3.764 -16.433 -4.994
272 2HG LYS 35 1HG LYS 35 4.860 -15.836 -3.746
273 1HD LYS 35 2HD LYS 35 2.557 -17.651 -3.095
274 2HD LYS 35 1HD LYS 35 4.121 -18.284 -3.608
275 1HE LYS 35 2HE LYS 35 4.527 -18.266 -1.384
276 2HE LYS 35 1HE LYS 35 4.937 -16.582 -1.707
277 1HZ LYS 35 1HZ LYS 35 3.092 -15.837 -0.668
278 2HZ LYS 35 2HZ LYS 35 3.224 -17.303 0.166
279 3HZ LYS 35 3HZ LYS 35 2.141 -17.161 -1.126
280 HA PRO 36 HA PRO 36 2.521 -14.701 -8.748
281 1HB PRO 36 2HB PRO 36 4.776 -15.985 -9.539
282 2HB PRO 36 1HB PRO 36 4.669 -14.226 -9.412
283 1HG PRO 36 2HG PRO 36 5.835 -16.197 -7.482
284 2HG PRO 36 1HG PRO 36 6.478 -14.628 -8.004
285 1HD PRO 36 2HD PRO 36 5.191 -14.958 -5.647
286 2HD PRO 36 1HD PRO 36 5.105 -13.448 -6.575
Start of MODEL 6
1 1H GLY 1 1HT GLY 1 -22.918 5.915 -17.035
2 2H GLY 1 2HT GLY 1 -21.839 7.019 -17.725
3 3H GLY 1 3HT GLY 1 -23.409 7.506 -17.330
4 1HA GLY 1 1HA GLY 1 -22.948 7.821 -15.173
5 2HA GLY 1 2HA GLY 1 -21.900 6.412 -15.121
6 H SER 2 H SER 2 -20.575 7.878 -13.780
7 HA SER 2 HA SER 2 -18.765 9.435 -15.496
8 1HB SER 2 2HB SER 2 -20.435 10.745 -13.906
9 2HB SER 2 1HB SER 2 -19.223 10.345 -12.688
10 HG SER 2 HG SER 2 -18.677 11.642 -15.154
11 H ALA 3 H ALA 3 -16.786 10.089 -13.881
12 HA ALA 3 HA ALA 3 -15.988 8.187 -11.964
13 1HB ALA 3 1HB ALA 3 -15.913 7.012 -14.368
14 2HB ALA 3 2HB ALA 3 -14.776 6.632 -13.075
15 3HB ALA 3 3HB ALA 3 -14.311 7.748 -14.358
16 H ALA 4 H ALA 4 -15.952 11.012 -12.314
17 HA ALA 4 HA ALA 4 -13.460 12.056 -13.041
18 1HB ALA 4 1HB ALA 4 -15.179 13.616 -12.804
19 2HB ALA 4 2HB ALA 4 -14.127 13.935 -11.425
20 3HB ALA 4 3HB ALA 4 -15.621 13.025 -11.202
21 H GLU 5 H GLU 5 -14.574 11.965 -9.670
22 HA GLU 5 HA GLU 5 -12.220 12.256 -8.397
23 1HB GLU 5 2HB GLU 5 -13.219 10.938 -6.508
24 2HB GLU 5 1HB GLU 5 -14.237 12.226 -7.134
25 1HG GLU 5 2HG GLU 5 -15.331 10.416 -8.570
26 2HG GLU 5 1HG GLU 5 -14.526 9.269 -7.501
27 H VAL 6 H VAL 6 -10.373 11.261 -8.975
28 HA VAL 6 HA VAL 6 -10.132 8.648 -9.950
29 HB VAL 6 HB VAL 6 -8.377 10.294 -10.282
30 1HG1 VAL 6 1HG1 VAL 6 -6.881 10.955 -8.463
31 2HG1 VAL 6 2HG1 VAL 6 -7.875 10.054 -7.318
32 3HG1 VAL 6 3HG1 VAL 6 -8.541 11.460 -8.150
33 1HG2 VAL 6 1HG2 VAL 6 -7.845 7.854 -10.294
34 2HG2 VAL 6 2HG2 VAL 6 -7.280 8.026 -8.632
35 3HG2 VAL 6 3HG2 VAL 6 -6.470 8.897 -9.934
36 H MET 7 H MET 7 -9.066 6.819 -8.947
37 HA MET 7 HA MET 7 -9.132 6.674 -6.047
38 1HB MET 7 2HB MET 7 -10.480 4.506 -6.214
39 2HB MET 7 1HB MET 7 -11.362 6.015 -6.399
40 1HG MET 7 2HG MET 7 -11.725 5.689 -8.642
41 2HG MET 7 1HG MET 7 -10.332 4.625 -8.823
42 1HE MET 7 1HE MET 7 -13.195 4.431 -9.972
43 2HE MET 7 2HE MET 7 -14.272 4.562 -8.581
44 3HE MET 7 3HE MET 7 -14.113 3.026 -9.432
45 H LYS 8 H LYS 8 -6.833 6.635 -6.947
46 HA LYS 8 HA LYS 8 -6.021 3.974 -7.841
47 1HB LYS 8 2HB LYS 8 -3.840 4.962 -8.258
48 2HB LYS 8 1HB LYS 8 -5.093 5.941 -9.006
49 1HG LYS 8 2HG LYS 8 -4.973 7.345 -6.848
50 2HG LYS 8 1HG LYS 8 -3.427 6.534 -6.594
51 1HD LYS 8 2HD LYS 8 -4.199 8.129 -9.037
52 2HD LYS 8 1HD LYS 8 -3.145 8.684 -7.736
53 1HE LYS 8 2HE LYS 8 -2.597 6.248 -9.421
54 2HE LYS 8 1HE LYS 8 -1.952 7.851 -9.774
55 1HZ LYS 8 1HZ LYS 8 -0.674 6.056 -8.298
56 2HZ LYS 8 2HZ LYS 8 -1.518 6.865 -7.076
57 3HZ LYS 8 3HZ LYS 8 -0.477 7.725 -8.095
58 H LYS 9 H LYS 9 -7.005 3.824 -5.355
59 HA LYS 9 HA LYS 9 -4.666 3.055 -3.823
60 1HB LYS 9 2HB LYS 9 -5.604 4.206 -1.761
61 2HB LYS 9 1HB LYS 9 -4.856 5.248 -2.963
62 1HG LYS 9 2HG LYS 9 -7.621 5.013 -3.581
63 2HG LYS 9 1HG LYS 9 -7.458 5.404 -1.869
64 1HD LYS 9 2HD LYS 9 -5.634 7.088 -2.985
65 2HD LYS 9 1HD LYS 9 -6.867 7.024 -4.246
66 1HE LYS 9 2HE LYS 9 -7.292 7.741 -1.347
67 2HE LYS 9 1HE LYS 9 -7.322 8.851 -2.717
68 1HZ LYS 9 1HZ LYS 9 -9.187 7.359 -3.579
69 2HZ LYS 9 2HZ LYS 9 -9.547 8.401 -2.296
70 3HZ LYS 9 3HZ LYS 9 -9.278 6.758 -2.000
71 H TYR 10 H TYR 10 -5.888 1.095 -4.685
72 HA TYR 10 HA TYR 10 -7.296 -0.095 -2.508
73 1HB TYR 10 2HB TYR 10 -9.156 1.153 -3.518
74 2HB TYR 10 1HB TYR 10 -8.828 0.394 -5.072
75 HD1 TYR 10 1HD TYR 10 -8.949 -2.211 -5.117
76 HD2 TYR 10 2HD TYR 10 -10.706 0.195 -2.081
77 HE1 TYR 10 1HE TYR 10 -10.463 -4.061 -4.536
78 HE2 TYR 10 2HE TYR 10 -12.224 -1.647 -1.491
79 HH TYR 10 HH TYR 10 -11.790 -4.822 -2.621
80 H CYS 11 H CYS 11 -6.389 -2.038 -2.446
81 HA CYS 11 HA CYS 11 -5.327 -3.253 -4.851
82 1HB CYS 11 2HB CYS 11 -4.214 -3.240 -2.524
83 2HB CYS 11 1HB CYS 11 -5.354 -4.518 -2.120
84 H SER 12 H SER 12 -6.653 -4.339 -6.141
85 HA SER 12 HA SER 12 -9.162 -5.371 -5.350
86 1HB SER 12 2HB SER 12 -8.906 -4.785 -7.639
87 2HB SER 12 1HB SER 12 -7.465 -5.787 -7.811
88 HG SER 12 HG SER 12 -10.008 -6.464 -8.211
89 H THR 13 H THR 13 -5.966 -6.790 -5.618
90 HA THR 13 HA THR 13 -6.781 -9.499 -5.391
91 HB THR 13 HB THR 13 -4.114 -8.331 -4.586
92 HG1 THR 13 1HG THR 13 -3.666 -8.090 -6.618
93 1HG2 THR 13 1HG2 THR 13 -3.708 -10.466 -4.083
94 2HG2 THR 13 2HG2 THR 13 -3.605 -10.682 -5.830
95 3HG2 THR 13 3HG2 THR 13 -5.107 -11.051 -4.983
96 H CYS 14 H CYS 14 -5.397 -7.235 -3.011
97 HA CYS 14 HA CYS 14 -5.801 -9.020 -0.821
98 1HB CYS 14 2HB CYS 14 -5.092 -6.091 -0.977
99 2HB CYS 14 1HB CYS 14 -5.196 -6.983 0.532
100 H ASP 15 H ASP 15 -7.649 -6.507 -2.352
101 HA ASP 15 HA ASP 15 -9.844 -5.920 -2.133
102 1HB ASP 15 2HB ASP 15 -9.941 -8.449 -1.279
103 2HB ASP 15 1HB ASP 15 -10.304 -7.650 0.248
104 H ILE 16 H ILE 16 -7.936 -4.340 -1.029
105 HA ILE 16 HA ILE 16 -9.346 -3.237 1.293
106 HB ILE 16 HB ILE 16 -6.345 -3.222 1.233
107 1HG1 ILE 16 2HG1 ILE 16 -7.091 -5.587 1.171
108 2HG1 ILE 16 1HG1 ILE 16 -6.303 -5.170 2.690
109 1HG2 ILE 16 1HG2 ILE 16 -6.884 -1.754 2.857
110 2HG2 ILE 16 2HG2 ILE 16 -7.064 -3.219 3.823
111 3HG2 ILE 16 3HG2 ILE 16 -8.484 -2.454 3.109
112 1HD1 ILE 16 1HD1 ILE 16 -8.129 -5.618 3.885
113 2HD1 ILE 16 2HD1 ILE 16 -8.681 -6.473 2.443
114 3HD1 ILE 16 3HD1 ILE 16 -9.196 -4.811 2.735
115 H SER 17 H SER 17 -8.716 -0.961 1.729
116 HA SER 17 HA SER 17 -7.717 0.432 -0.659
117 1HB SER 17 2HB SER 17 -10.369 0.361 -0.130
118 2HB SER 17 1HB SER 17 -9.906 1.770 0.823
119 HG SER 17 HG SER 17 -8.810 2.473 -1.184
120 H PHE 18 H PHE 18 -6.859 2.542 -0.259
121 HA PHE 18 HA PHE 18 -6.248 3.095 2.565
122 1HB PHE 18 2HB PHE 18 -4.254 3.476 0.332
123 2HB PHE 18 1HB PHE 18 -3.964 3.563 2.066
124 HD1 PHE 18 1HD PHE 18 -3.800 1.542 3.404
125 HD2 PHE 18 2HD PHE 18 -4.403 1.362 -0.805
126 HE1 PHE 18 1HE PHE 18 -3.170 -0.837 3.419
127 HE2 PHE 18 2HE PHE 18 -3.776 -1.017 -0.797
128 HZ PHE 18 HZ PHE 18 -3.157 -2.119 1.317
129 H ASN 19 H ASN 19 -6.639 5.122 3.181
130 HA ASN 19 HA ASN 19 -7.862 6.985 1.473
131 1HB ASN 19 2HB ASN 19 -6.631 7.273 4.214
132 2HB ASN 19 1HB ASN 19 -7.457 8.597 3.397
133 1HD2 ASN 19 1HD2 ASN 19 -9.617 7.582 2.318
134 2HD2 ASN 19 2HD2 ASN 19 -10.637 6.826 3.489
135 H TYR 20 H TYR 20 -4.529 6.473 2.361
136 HA TYR 20 HA TYR 20 -3.738 8.906 0.919
137 1HB TYR 20 2HB TYR 20 -1.944 7.138 2.580
138 2HB TYR 20 1HB TYR 20 -1.643 8.790 2.048
139 HD1 TYR 20 1HD TYR 20 -2.485 10.656 3.278
140 HD2 TYR 20 2HD TYR 20 -3.591 6.698 4.379
141 HE1 TYR 20 1HE TYR 20 -3.414 11.509 5.390
142 HE2 TYR 20 2HE TYR 20 -4.523 7.540 6.492
143 HH TYR 20 HH TYR 20 -5.383 9.618 7.428
144 H VAL 21 H VAL 21 -2.884 8.772 -1.048
145 HA VAL 21 HA VAL 21 -2.755 6.395 -2.505
146 HB VAL 21 HB VAL 21 -1.169 8.891 -3.116
147 1HG1 VAL 21 1HG1 VAL 21 -1.378 8.188 -5.425
148 2HG1 VAL 21 2HG1 VAL 21 -2.339 6.791 -4.938
149 3HG1 VAL 21 3HG1 VAL 21 -0.643 6.901 -4.469
150 1HG2 VAL 21 1HG2 VAL 21 -3.376 9.177 -4.608
151 2HG2 VAL 21 2HG2 VAL 21 -3.204 9.877 -2.998
152 3HG2 VAL 21 3HG2 VAL 21 -4.075 8.358 -3.212
153 H LYS 22 H LYS 22 -0.271 8.117 -0.695
154 HA LYS 22 HA LYS 22 1.996 6.782 -1.589
155 1HB LYS 22 2HB LYS 22 1.460 7.714 1.237
156 2HB LYS 22 1HB LYS 22 3.037 7.426 0.516
157 1HG LYS 22 2HG LYS 22 1.069 9.561 -0.276
158 2HG LYS 22 1HG LYS 22 2.585 9.791 0.597
159 1HD LYS 22 2HD LYS 22 2.357 8.673 -2.197
160 2HD LYS 22 1HD LYS 22 2.745 10.352 -1.813
161 1HE LYS 22 2HE LYS 22 4.638 9.302 -0.371
162 2HE LYS 22 1HE LYS 22 4.375 7.882 -1.381
163 1HZ LYS 22 1HZ LYS 22 6.065 9.789 -2.036
164 2HZ LYS 22 2HZ LYS 22 4.676 10.444 -2.743
165 3HZ LYS 22 3HZ LYS 22 5.212 8.906 -3.201
166 H THR 23 H THR 23 -0.493 5.768 0.634
167 HA THR 23 HA THR 23 0.857 3.567 1.781
168 HB THR 23 HB THR 23 -2.115 3.694 1.326
169 HG1 THR 23 1HG THR 23 -2.237 4.995 3.166
170 1HG2 THR 23 1HG2 THR 23 -2.200 2.728 3.594
171 2HG2 THR 23 2HG2 THR 23 -0.440 2.613 3.577
172 3HG2 THR 23 3HG2 THR 23 -1.395 1.686 2.419
173 H TYR 24 H TYR 24 -1.418 3.796 -0.944
174 HA TYR 24 HA TYR 24 -1.444 1.082 -1.622
175 1HB TYR 24 2HB TYR 24 -2.912 3.035 -2.494
176 2HB TYR 24 1HB TYR 24 -1.639 3.261 -3.687
177 HD1 TYR 24 1HD TYR 24 -3.086 0.124 -2.281
178 HD2 TYR 24 2HD TYR 24 -2.532 2.570 -5.716
179 HE1 TYR 24 1HE TYR 24 -4.096 -1.625 -3.683
180 HE2 TYR 24 2HE TYR 24 -3.540 0.828 -7.128
181 HH TYR 24 HH TYR 24 -5.010 -1.075 -6.937
182 H LEU 25 H LEU 25 0.793 3.652 -2.409
183 HA LEU 25 HA LEU 25 2.226 2.252 -4.418
184 1HB LEU 25 2HB LEU 25 2.605 4.715 -2.831
185 2HB LEU 25 1HB LEU 25 4.072 3.970 -3.438
186 HG LEU 25 HG LEU 25 1.743 4.674 -5.214
187 1HD1 LEU 25 1HD1 LEU 25 4.159 6.305 -4.466
188 2HD1 LEU 25 2HD1 LEU 25 2.459 6.739 -4.281
189 3HD1 LEU 25 3HD1 LEU 25 3.169 6.621 -5.891
190 1HD2 LEU 25 1HD2 LEU 25 3.634 2.966 -5.807
191 2HD2 LEU 25 2HD2 LEU 25 4.586 4.426 -6.073
192 3HD2 LEU 25 3HD2 LEU 25 3.104 4.161 -6.991
193 H ALA 26 H ALA 26 3.040 2.942 -1.034
194 HA ALA 26 HA ALA 26 5.278 1.276 -0.912
195 1HB ALA 26 1HB ALA 26 5.423 1.880 1.267
196 2HB ALA 26 2HB ALA 26 3.702 1.631 1.560
197 3HB ALA 26 3HB ALA 26 4.256 3.098 0.753
198 H HIS 27 H HIS 27 1.931 0.569 -0.906
199 HA HIS 27 HA HIS 27 2.037 -1.919 0.476
200 1HB HIS 27 2HB HIS 27 -0.062 -0.695 0.279
201 2HB HIS 27 1HB HIS 27 0.002 -0.819 -1.476
202 HD1 HIS 27 1HD HIS 27 -1.002 -2.703 1.566
203 HD2 HIS 27 2HD HIS 27 -0.560 -3.388 -2.508
204 HE1 HIS 27 1HE HIS 27 -2.191 -4.882 1.079
205 H LYS 28 H LYS 28 1.516 -1.221 -2.989
206 HA LYS 28 HA LYS 28 1.945 -3.874 -3.825
207 1HB LYS 28 2HB LYS 28 2.108 -1.246 -5.298
208 2HB LYS 28 1HB LYS 28 2.321 -2.798 -6.098
209 1HG LYS 28 2HG LYS 28 -0.004 -3.259 -4.846
210 2HG LYS 28 1HG LYS 28 -0.123 -1.513 -5.067
211 1HD LYS 28 2HD LYS 28 -0.315 -1.679 -7.314
212 2HD LYS 28 1HD LYS 28 0.797 -3.046 -7.412
213 1HE LYS 28 2HE LYS 28 -2.105 -3.099 -6.603
214 2HE LYS 28 1HE LYS 28 -1.387 -3.796 -8.055
215 1HZ LYS 28 1HZ LYS 28 -1.504 -5.633 -6.746
216 2HZ LYS 28 2HZ LYS 28 -1.333 -4.776 -5.299
217 3HZ LYS 28 3HZ LYS 28 0.021 -5.080 -6.264
218 H GLN 29 H GLN 29 4.134 -1.434 -2.854
219 HA GLN 29 HA GLN 29 6.400 -2.130 -4.362
220 1HB GLN 29 2HB GLN 29 5.912 -0.672 -1.811
221 2HB GLN 29 1HB GLN 29 7.554 -1.202 -2.150
222 1HG GLN 29 2HG GLN 29 7.602 0.055 -4.189
223 2HG GLN 29 1HG GLN 29 5.896 0.467 -4.024
224 1HE2 GLN 29 1HE2 GLN 29 6.317 2.669 -4.064
225 2HE2 GLN 29 2HE2 GLN 29 7.040 3.496 -2.731
226 H PHE 30 H PHE 30 5.819 -2.892 -0.918
227 HA PHE 30 HA PHE 30 6.782 -5.600 -1.344
228 1HB PHE 30 2HB PHE 30 8.281 -5.096 0.797
229 2HB PHE 30 1HB PHE 30 8.888 -4.901 -0.843
230 HD1 PHE 30 1HD PHE 30 6.724 -2.773 1.326
231 HD2 PHE 30 2HD PHE 30 10.329 -3.114 -0.911
232 HE1 PHE 30 1HE PHE 30 7.240 -0.416 1.808
233 HE2 PHE 30 2HE PHE 30 10.852 -0.757 -0.432
234 HZ PHE 30 HZ PHE 30 9.307 0.594 0.929
235 H TYR 31 H TYR 31 4.349 -4.051 -0.310
236 HA TYR 31 HA TYR 31 4.159 -5.342 2.328
237 1HB TYR 31 2HB TYR 31 3.579 -2.725 1.587
238 2HB TYR 31 1HB TYR 31 1.998 -3.495 1.694
239 HD1 TYR 31 1HD TYR 31 5.129 -2.882 3.595
240 HD2 TYR 31 2HD TYR 31 1.002 -3.896 3.783
241 HE1 TYR 31 1HE TYR 31 5.188 -2.640 6.041
242 HE2 TYR 31 2HE TYR 31 1.048 -3.656 6.230
243 HH TYR 31 HH TYR 31 3.043 -3.861 8.062
244 H CYS 32 H CYS 32 2.784 -5.169 -0.854
245 HA CYS 32 HA CYS 32 0.314 -6.418 -0.352
246 1HB CYS 32 2HB CYS 32 1.006 -5.207 -2.459
247 2HB CYS 32 1HB CYS 32 1.931 -6.640 -2.893
248 H LYS 33 H LYS 33 -0.338 -8.596 -0.877
249 HA LYS 33 HA LYS 33 1.711 -10.537 -0.107
250 1HB LYS 33 2HB LYS 33 -0.148 -12.039 0.388
251 2HB LYS 33 1HB LYS 33 -0.358 -10.499 1.209
252 1HG LYS 33 2HG LYS 33 -2.201 -9.956 0.018
253 2HG LYS 33 1HG LYS 33 -1.629 -10.765 -1.443
254 1HD LYS 33 2HD LYS 33 -2.473 -12.796 -0.813
255 2HD LYS 33 1HD LYS 33 -2.317 -12.447 0.909
256 1HE LYS 33 2HE LYS 33 -4.331 -11.387 1.018
257 2HE LYS 33 1HE LYS 33 -4.240 -10.812 -0.647
258 1HZ LYS 33 1HZ LYS 33 -4.920 -13.555 0.261
259 2HZ LYS 33 2HZ LYS 33 -4.660 -13.135 -1.357
260 3HZ LYS 33 3HZ LYS 33 -5.947 -12.447 -0.503
261 H ASN 34 H ASN 34 1.519 -9.396 -2.818
262 HA ASN 34 HA ASN 34 0.745 -11.762 -4.374
263 1HB ASN 34 2HB ASN 34 0.911 -8.854 -4.958
264 2HB ASN 34 1HB ASN 34 1.309 -9.952 -6.277
265 1HD2 ASN 34 1HD2 ASN 34 -0.380 -10.017 -7.572
266 2HD2 ASN 34 2HD2 ASN 34 -2.021 -10.256 -7.087
267 H LYS 35 H LYS 35 2.881 -12.487 -3.160
268 HA LYS 35 HA LYS 35 5.018 -13.227 -3.370
269 1HB LYS 35 2HB LYS 35 4.063 -12.867 -6.130
270 2HB LYS 35 1HB LYS 35 5.813 -12.877 -5.961
271 1HG LYS 35 2HG LYS 35 5.269 -15.019 -4.488
272 2HG LYS 35 1HG LYS 35 3.850 -15.050 -5.537
273 1HD LYS 35 2HD LYS 35 6.723 -14.966 -6.460
274 2HD LYS 35 1HD LYS 35 5.686 -16.394 -6.452
275 1HE LYS 35 2HE LYS 35 4.106 -15.088 -7.936
276 2HE LYS 35 1HE LYS 35 5.394 -13.896 -8.104
277 1HZ LYS 35 1HZ LYS 35 6.660 -15.302 -9.348
278 2HZ LYS 35 2HZ LYS 35 5.128 -15.858 -9.799
279 3HZ LYS 35 3HZ LYS 35 6.027 -16.704 -8.644
280 HA PRO 36 HA PRO 36 7.728 -9.778 -2.980
281 1HB PRO 36 2HB PRO 36 10.144 -10.830 -3.631
282 2HB PRO 36 1HB PRO 36 9.305 -11.216 -2.124
283 1HG PRO 36 2HG PRO 36 9.441 -12.784 -4.671
284 2HG PRO 36 1HG PRO 36 9.580 -13.354 -2.998
285 1HD PRO 36 2HD PRO 36 7.295 -13.587 -4.432
286 2HD PRO 36 1HD PRO 36 7.298 -13.346 -2.673
Start of MODEL 7
1 1H GLY 1 1HT GLY 1 5.318 0.801 -18.531
2 2H GLY 1 2HT GLY 1 6.327 2.147 -18.358
3 3H GLY 1 3HT GLY 1 6.424 1.192 -19.750
4 1HA GLY 1 1HA GLY 1 5.204 2.949 -20.532
5 2HA GLY 1 2HA GLY 1 3.953 1.809 -20.061
6 H SER 2 H SER 2 4.596 4.943 -20.038
7 HA SER 2 HA SER 2 4.119 5.750 -17.370
8 1HB SER 2 2HB SER 2 3.311 7.425 -19.729
9 2HB SER 2 1HB SER 2 4.020 7.932 -18.195
10 HG SER 2 HG SER 2 5.847 7.868 -19.213
11 H ALA 3 H ALA 3 2.064 7.522 -17.378
12 HA ALA 3 HA ALA 3 -0.175 7.699 -17.009
13 1HB ALA 3 1HB ALA 3 -1.582 7.150 -18.739
14 2HB ALA 3 2HB ALA 3 -0.760 5.625 -19.069
15 3HB ALA 3 3HB ALA 3 -0.024 7.148 -19.566
16 H ALA 4 H ALA 4 -0.248 6.826 -14.957
17 HA ALA 4 HA ALA 4 -0.454 3.967 -14.577
18 1HB ALA 4 1HB ALA 4 -0.403 6.329 -12.738
19 2HB ALA 4 2HB ALA 4 0.732 4.985 -12.858
20 3HB ALA 4 3HB ALA 4 -0.861 4.732 -12.147
21 H GLU 5 H GLU 5 -2.264 2.811 -14.173
22 HA GLU 5 HA GLU 5 -4.703 3.468 -15.101
23 1HB GLU 5 2HB GLU 5 -3.840 1.559 -12.971
24 2HB GLU 5 1HB GLU 5 -5.555 1.773 -13.291
25 1HG GLU 5 2HG GLU 5 -3.699 1.214 -15.554
26 2HG GLU 5 1HG GLU 5 -4.206 -0.100 -14.494
27 H VAL 6 H VAL 6 -6.793 3.777 -13.926
28 HA VAL 6 HA VAL 6 -6.571 6.075 -12.193
29 HB VAL 6 HB VAL 6 -9.094 4.664 -13.059
30 1HG1 VAL 6 1HG1 VAL 6 -9.850 6.107 -11.481
31 2HG1 VAL 6 2HG1 VAL 6 -9.775 7.235 -12.836
32 3HG1 VAL 6 3HG1 VAL 6 -8.470 7.192 -11.651
33 1HG2 VAL 6 1HG2 VAL 6 -9.189 6.417 -14.839
34 2HG2 VAL 6 2HG2 VAL 6 -7.906 5.227 -15.056
35 3HG2 VAL 6 3HG2 VAL 6 -7.523 6.834 -14.439
36 H MET 7 H MET 7 -7.556 6.262 -10.124
37 HA MET 7 HA MET 7 -7.972 5.606 -7.988
38 1HB MET 7 2HB MET 7 -9.105 3.203 -9.426
39 2HB MET 7 1HB MET 7 -9.276 3.479 -7.697
40 1HG MET 7 2HG MET 7 -10.127 5.643 -9.535
41 2HG MET 7 1HG MET 7 -11.132 4.198 -9.434
42 1HE MET 7 1HE MET 7 -10.729 7.742 -7.763
43 2HE MET 7 2HE MET 7 -12.400 7.447 -7.278
44 3HE MET 7 3HE MET 7 -11.884 7.092 -8.928
45 H LYS 8 H LYS 8 -5.558 5.509 -7.904
46 HA LYS 8 HA LYS 8 -4.484 2.801 -7.730
47 1HB LYS 8 2HB LYS 8 -2.988 5.401 -7.396
48 2HB LYS 8 1HB LYS 8 -2.305 3.807 -7.690
49 1HG LYS 8 2HG LYS 8 -2.717 3.885 -9.909
50 2HG LYS 8 1HG LYS 8 -4.208 4.809 -9.711
51 1HD LYS 8 2HD LYS 8 -2.513 6.153 -10.825
52 2HD LYS 8 1HD LYS 8 -2.885 6.822 -9.234
53 1HE LYS 8 2HE LYS 8 -0.850 5.169 -8.602
54 2HE LYS 8 1HE LYS 8 -0.400 5.601 -10.251
55 1HZ LYS 8 1HZ LYS 8 -0.802 7.986 -9.487
56 2HZ LYS 8 2HZ LYS 8 0.600 7.217 -8.937
57 3HZ LYS 8 3HZ LYS 8 -0.736 7.372 -7.911
58 H LYS 9 H LYS 9 -6.316 3.313 -5.772
59 HA LYS 9 HA LYS 9 -4.635 3.129 -3.396
60 1HB LYS 9 2HB LYS 9 -6.052 4.648 -2.110
61 2HB LYS 9 1HB LYS 9 -5.311 5.479 -3.471
62 1HG LYS 9 2HG LYS 9 -7.844 4.422 -4.271
63 2HG LYS 9 1HG LYS 9 -8.033 5.355 -2.785
64 1HD LYS 9 2HD LYS 9 -8.311 6.896 -4.552
65 2HD LYS 9 1HD LYS 9 -6.686 7.174 -3.922
66 1HE LYS 9 2HE LYS 9 -5.673 6.129 -5.749
67 2HE LYS 9 1HE LYS 9 -7.168 5.329 -6.231
68 1HZ LYS 9 1HZ LYS 9 -6.692 8.257 -6.369
69 2HZ LYS 9 2HZ LYS 9 -8.071 7.441 -6.910
70 3HZ LYS 9 3HZ LYS 9 -6.587 7.196 -7.683
71 H TYR 10 H TYR 10 -5.849 1.055 -4.732
72 HA TYR 10 HA TYR 10 -7.432 -0.092 -2.654
73 1HB TYR 10 2HB TYR 10 -9.093 1.326 -3.955
74 2HB TYR 10 1HB TYR 10 -8.830 0.233 -5.310
75 HD1 TYR 10 1HD TYR 10 -9.100 -2.344 -4.672
76 HD2 TYR 10 2HD TYR 10 -10.872 0.893 -2.556
77 HE1 TYR 10 1HE TYR 10 -10.802 -3.873 -3.773
78 HE2 TYR 10 2HE TYR 10 -12.579 -0.628 -1.649
79 HH TYR 10 HH TYR 10 -13.536 -3.155 -2.697
80 H CYS 11 H CYS 11 -6.307 -1.941 -2.565
81 HA CYS 11 HA CYS 11 -5.381 -3.244 -4.980
82 1HB CYS 11 2HB CYS 11 -4.110 -3.077 -2.737
83 2HB CYS 11 1HB CYS 11 -5.168 -4.378 -2.201
84 H SER 12 H SER 12 -7.023 -4.155 -6.095
85 HA SER 12 HA SER 12 -9.314 -5.338 -5.016
86 1HB SER 12 2HB SER 12 -7.929 -5.705 -7.674
87 2HB SER 12 1HB SER 12 -9.459 -6.490 -7.284
88 HG SER 12 HG SER 12 -10.463 -4.640 -7.477
89 H THR 13 H THR 13 -6.176 -6.723 -5.848
90 HA THR 13 HA THR 13 -6.838 -9.429 -5.544
91 HB THR 13 HB THR 13 -4.136 -8.432 -4.741
92 HG1 THR 13 1HG THR 13 -5.134 -8.401 -7.395
93 1HG2 THR 13 1HG2 THR 13 -5.120 -10.714 -6.425
94 2HG2 THR 13 2HG2 THR 13 -4.307 -10.789 -4.861
95 3HG2 THR 13 3HG2 THR 13 -3.423 -10.257 -6.292
96 H CYS 14 H CYS 14 -5.455 -7.134 -3.200
97 HA CYS 14 HA CYS 14 -5.576 -9.015 -1.044
98 1HB CYS 14 2HB CYS 14 -4.964 -6.071 -1.220
99 2HB CYS 14 1HB CYS 14 -5.029 -6.924 0.314
100 H ASP 15 H ASP 15 -7.691 -6.633 -2.400
101 HA ASP 15 HA ASP 15 -9.893 -6.191 -1.998
102 1HB ASP 15 2HB ASP 15 -9.857 -8.679 -1.214
103 2HB ASP 15 1HB ASP 15 -9.904 -7.990 0.406
104 H ILE 16 H ILE 16 -7.887 -4.553 -1.007
105 HA ILE 16 HA ILE 16 -9.243 -3.406 1.326
106 HB ILE 16 HB ILE 16 -6.242 -3.404 1.206
107 1HG1 ILE 16 2HG1 ILE 16 -7.012 -5.768 1.210
108 2HG1 ILE 16 1HG1 ILE 16 -6.171 -5.322 2.692
109 1HG2 ILE 16 1HG2 ILE 16 -8.344 -2.669 3.167
110 2HG2 ILE 16 2HG2 ILE 16 -6.830 -1.856 2.768
111 3HG2 ILE 16 3HG2 ILE 16 -6.816 -3.296 3.787
112 1HD1 ILE 16 1HD1 ILE 16 -7.934 -5.825 3.938
113 2HD1 ILE 16 2HD1 ILE 16 -8.627 -6.563 2.493
114 3HD1 ILE 16 3HD1 ILE 16 -9.022 -4.895 2.906
115 H SER 17 H SER 17 -8.597 -1.125 1.704
116 HA SER 17 HA SER 17 -7.607 0.220 -0.710
117 1HB SER 17 2HB SER 17 -10.215 0.140 -0.426
118 2HB SER 17 1HB SER 17 -9.931 1.398 0.776
119 HG SER 17 HG SER 17 -9.930 2.672 -0.895
120 H PHE 18 H PHE 18 -6.941 2.458 -0.322
121 HA PHE 18 HA PHE 18 -6.297 3.022 2.490
122 1HB PHE 18 2HB PHE 18 -4.341 3.481 0.239
123 2HB PHE 18 1HB PHE 18 -4.041 3.596 1.970
124 HD1 PHE 18 1HD PHE 18 -4.381 1.404 3.326
125 HD2 PHE 18 2HD PHE 18 -3.792 1.546 -0.886
126 HE1 PHE 18 1HE PHE 18 -3.641 -0.942 3.354
127 HE2 PHE 18 2HE PHE 18 -3.053 -0.800 -0.866
128 HZ PHE 18 HZ PHE 18 -2.975 -2.048 1.256
129 H ASN 19 H ASN 19 -6.593 5.082 3.109
130 HA ASN 19 HA ASN 19 -7.961 6.880 1.395
131 1HB ASN 19 2HB ASN 19 -7.644 8.498 3.319
132 2HB ASN 19 1HB ASN 19 -8.458 6.990 3.721
133 1HD2 ASN 19 1HD2 ASN 19 -6.540 9.071 5.049
134 2HD2 ASN 19 2HD2 ASN 19 -5.462 8.058 5.941
135 H TYR 20 H TYR 20 -4.618 6.422 2.212
136 HA TYR 20 HA TYR 20 -3.909 8.889 0.771
137 1HB TYR 20 2HB TYR 20 -2.231 7.231 2.666
138 2HB TYR 20 1HB TYR 20 -1.716 8.716 1.873
139 HD1 TYR 20 1HD TYR 20 -4.139 10.391 2.191
140 HD2 TYR 20 2HD TYR 20 -2.216 7.771 4.938
141 HE1 TYR 20 1HE TYR 20 -5.037 11.704 4.066
142 HE2 TYR 20 2HE TYR 20 -3.111 9.077 6.819
143 HH TYR 20 HH TYR 20 -4.210 12.067 6.624
144 H VAL 21 H VAL 21 -2.900 8.768 -1.134
145 HA VAL 21 HA VAL 21 -2.694 6.368 -2.556
146 HB VAL 21 HB VAL 21 -1.149 8.901 -3.127
147 1HG1 VAL 21 1HG1 VAL 21 -0.350 7.123 -4.486
148 2HG1 VAL 21 2HG1 VAL 21 -1.415 8.100 -5.496
149 3HG1 VAL 21 3HG1 VAL 21 -1.988 6.568 -4.836
150 1HG2 VAL 21 1HG2 VAL 21 -3.870 8.737 -2.871
151 2HG2 VAL 21 2HG2 VAL 21 -3.637 8.457 -4.596
152 3HG2 VAL 21 3HG2 VAL 21 -3.006 9.925 -3.847
153 H LYS 22 H LYS 22 -0.343 8.120 -0.618
154 HA LYS 22 HA LYS 22 2.000 6.850 -1.408
155 1HB LYS 22 2HB LYS 22 1.293 7.716 1.401
156 2HB LYS 22 1HB LYS 22 2.913 7.486 0.756
157 1HG LYS 22 2HG LYS 22 2.917 9.471 -0.317
158 2HG LYS 22 1HG LYS 22 1.196 9.395 -0.695
159 1HD LYS 22 2HD LYS 22 1.639 11.199 0.871
160 2HD LYS 22 1HD LYS 22 0.673 9.939 1.644
161 1HE LYS 22 2HE LYS 22 2.197 10.130 3.290
162 2HE LYS 22 1HE LYS 22 3.168 9.092 2.246
163 1HZ LYS 22 1HZ LYS 22 3.288 12.018 1.940
164 2HZ LYS 22 2HZ LYS 22 4.450 10.856 1.544
165 3HZ LYS 22 3HZ LYS 22 4.179 11.261 3.163
166 H THR 23 H THR 23 -0.551 5.773 0.727
167 HA THR 23 HA THR 23 0.769 3.573 1.887
168 HB THR 23 HB THR 23 -2.176 3.693 1.274
169 HG1 THR 23 1HG THR 23 -0.869 4.891 3.484
170 1HG2 THR 23 1HG2 THR 23 -2.417 2.583 3.434
171 2HG2 THR 23 2HG2 THR 23 -0.662 2.534 3.600
172 3HG2 THR 23 3HG2 THR 23 -1.451 1.628 2.309
173 H TYR 24 H TYR 24 -1.386 3.790 -0.933
174 HA TYR 24 HA TYR 24 -1.327 1.091 -1.657
175 1HB TYR 24 2HB TYR 24 -2.838 2.924 -2.569
176 2HB TYR 24 1HB TYR 24 -1.497 3.390 -3.607
177 HD1 TYR 24 1HD TYR 24 -3.684 0.500 -2.755
178 HD2 TYR 24 2HD TYR 24 -1.181 2.337 -5.664
179 HE1 TYR 24 1HE TYR 24 -4.382 -1.180 -4.409
180 HE2 TYR 24 2HE TYR 24 -1.872 0.662 -7.326
181 HH TYR 24 HH TYR 24 -3.750 -0.866 -7.730
182 H LEU 25 H LEU 25 0.848 3.740 -2.386
183 HA LEU 25 HA LEU 25 2.410 2.418 -4.328
184 1HB LEU 25 2HB LEU 25 2.707 4.819 -2.622
185 2HB LEU 25 1HB LEU 25 4.190 4.125 -3.250
186 HG LEU 25 HG LEU 25 3.264 5.961 -4.649
187 1HD1 LEU 25 1HD1 LEU 25 4.581 3.810 -5.441
188 2HD1 LEU 25 2HD1 LEU 25 3.987 5.011 -6.588
189 3HD1 LEU 25 3HD1 LEU 25 3.084 3.519 -6.326
190 1HD2 LEU 25 1HD2 LEU 25 0.845 4.871 -4.187
191 2HD2 LEU 25 2HD2 LEU 25 1.195 4.193 -5.777
192 3HD2 LEU 25 3HD2 LEU 25 1.195 5.942 -5.544
193 H ALA 26 H ALA 26 3.134 3.035 -0.906
194 HA ALA 26 HA ALA 26 5.371 1.372 -0.767
195 1HB ALA 26 1HB ALA 26 3.548 2.596 1.235
196 2HB ALA 26 2HB ALA 26 5.285 2.806 1.015
197 3HB ALA 26 3HB ALA 26 4.662 1.338 1.769
198 H HIS 27 H HIS 27 2.027 0.651 -0.844
199 HA HIS 27 HA HIS 27 2.112 -1.869 0.478
200 1HB HIS 27 2HB HIS 27 0.016 -0.644 0.256
201 2HB HIS 27 1HB HIS 27 0.122 -0.733 -1.499
202 HD1 HIS 27 1HD HIS 27 -0.929 -2.693 1.483
203 HD2 HIS 27 2HD HIS 27 -0.431 -3.266 -2.602
204 HE1 HIS 27 1HE HIS 27 -2.110 -4.857 0.921
205 H LYS 28 H LYS 28 1.697 -1.082 -2.982
206 HA LYS 28 HA LYS 28 2.152 -3.714 -3.873
207 1HB LYS 28 2HB LYS 28 1.925 -1.044 -5.110
208 2HB LYS 28 1HB LYS 28 2.854 -2.218 -6.032
209 1HG LYS 28 2HG LYS 28 0.742 -2.540 -6.864
210 2HG LYS 28 1HG LYS 28 0.812 -3.770 -5.600
211 1HD LYS 28 2HD LYS 28 -0.175 -1.858 -4.107
212 2HD LYS 28 1HD LYS 28 -0.680 -1.184 -5.657
213 1HE LYS 28 2HE LYS 28 -1.329 -3.951 -4.648
214 2HE LYS 28 1HE LYS 28 -2.429 -2.574 -4.637
215 1HZ LYS 28 1HZ LYS 28 -1.317 -3.978 -6.999
216 2HZ LYS 28 2HZ LYS 28 -2.125 -2.496 -7.104
217 3HZ LYS 28 3HZ LYS 28 -2.940 -3.863 -6.534
218 H GLN 29 H GLN 29 4.300 -1.285 -2.783
219 HA GLN 29 HA GLN 29 6.615 -1.931 -4.233
220 1HB GLN 29 2HB GLN 29 6.037 -0.548 -1.660
221 2HB GLN 29 1HB GLN 29 7.692 -1.065 -1.955
222 1HG GLN 29 2HG GLN 29 6.046 0.781 -3.667
223 2HG GLN 29 1HG GLN 29 7.421 1.216 -2.652
224 1HE2 GLN 29 1HE2 GLN 29 6.461 0.509 -5.732
225 2HE2 GLN 29 2HE2 GLN 29 7.994 0.116 -6.423
226 H PHE 30 H PHE 30 5.942 -2.793 -0.829
227 HA PHE 30 HA PHE 30 6.947 -5.479 -1.312
228 1HB PHE 30 2HB PHE 30 8.347 -5.034 0.908
229 2HB PHE 30 1HB PHE 30 9.019 -4.774 -0.695
230 HD1 PHE 30 1HD PHE 30 7.189 -2.978 2.004
231 HD2 PHE 30 2HD PHE 30 9.987 -2.739 -1.193
232 HE1 PHE 30 1HE PHE 30 7.654 -0.634 2.591
233 HE2 PHE 30 2HE PHE 30 10.458 -0.396 -0.612
234 HZ PHE 30 HZ PHE 30 9.291 0.661 1.283
235 H TYR 31 H TYR 31 4.462 -3.965 -0.305
236 HA TYR 31 HA TYR 31 4.172 -5.369 2.263
237 1HB TYR 31 2HB TYR 31 3.600 -2.733 1.606
238 2HB TYR 31 1HB TYR 31 2.024 -3.516 1.598
239 HD1 TYR 31 1HD TYR 31 5.064 -3.930 3.738
240 HD2 TYR 31 2HD TYR 31 0.906 -3.045 3.560
241 HE1 TYR 31 1HE TYR 31 4.993 -3.795 6.193
242 HE2 TYR 31 2HE TYR 31 0.824 -2.907 6.013
243 HH TYR 31 HH TYR 31 3.635 -2.799 7.944
244 H CYS 32 H CYS 32 2.998 -5.165 -0.978
245 HA CYS 32 HA CYS 32 0.537 -6.549 -0.536
246 1HB CYS 32 2HB CYS 32 1.037 -5.015 -2.479
247 2HB CYS 32 1HB CYS 32 2.050 -6.295 -3.137
248 H LYS 33 H LYS 33 0.357 -8.626 -0.048
249 HA LYS 33 HA LYS 33 2.543 -10.453 -0.721
250 1HB LYS 33 2HB LYS 33 1.359 -12.011 0.855
251 2HB LYS 33 1HB LYS 33 1.947 -10.525 1.590
252 1HG LYS 33 2HG LYS 33 -0.824 -10.460 0.590
253 2HG LYS 33 1HG LYS 33 -0.517 -11.508 1.976
254 1HD LYS 33 2HD LYS 33 0.822 -9.285 2.730
255 2HD LYS 33 1HD LYS 33 -0.474 -8.568 1.771
256 1HE LYS 33 2HE LYS 33 -1.996 -10.173 3.157
257 2HE LYS 33 1HE LYS 33 -0.635 -10.184 4.279
258 1HZ LYS 33 1HZ LYS 33 -1.004 -8.063 4.888
259 2HZ LYS 33 2HZ LYS 33 -2.580 -8.383 4.364
260 3HZ LYS 33 3HZ LYS 33 -1.501 -7.571 3.346
261 H ASN 34 H ASN 34 0.777 -9.565 -2.790
262 HA ASN 34 HA ASN 34 -0.393 -12.155 -3.542
263 1HB ASN 34 2HB ASN 34 -1.690 -9.479 -3.486
264 2HB ASN 34 1HB ASN 34 -2.063 -10.526 -4.854
265 1HD2 ASN 34 1HD2 ASN 34 -2.349 -10.064 -1.433
266 2HD2 ASN 34 2HD2 ASN 34 -3.514 -11.308 -1.153
267 H LYS 35 H LYS 35 1.581 -12.485 -4.706
268 HA LYS 35 HA LYS 35 1.646 -11.005 -7.251
269 1HB LYS 35 2HB LYS 35 4.161 -11.464 -7.206
270 2HB LYS 35 1HB LYS 35 3.557 -10.204 -6.139
271 1HG LYS 35 2HG LYS 35 4.065 -11.354 -4.263
272 2HG LYS 35 1HG LYS 35 3.728 -12.922 -4.999
273 1HD LYS 35 2HD LYS 35 6.040 -11.481 -6.111
274 2HD LYS 35 1HD LYS 35 6.213 -12.001 -4.434
275 1HE LYS 35 2HE LYS 35 5.310 -13.840 -6.637
276 2HE LYS 35 1HE LYS 35 7.004 -13.633 -6.197
277 1HZ LYS 35 1HZ LYS 35 5.176 -14.218 -4.014
278 2HZ LYS 35 2HZ LYS 35 6.742 -14.789 -4.298
279 3HZ LYS 35 3HZ LYS 35 5.432 -15.474 -5.118
280 HA PRO 36 HA PRO 36 1.461 -14.939 -9.228
281 1HB PRO 36 2HB PRO 36 2.890 -14.491 -11.491
282 2HB PRO 36 1HB PRO 36 1.279 -13.815 -11.224
283 1HG PRO 36 2HG PRO 36 3.957 -12.519 -10.885
284 2HG PRO 36 1HG PRO 36 2.481 -11.862 -11.618
285 1HD PRO 36 2HD PRO 36 3.250 -11.253 -9.094
286 2HD PRO 36 1HD PRO 36 1.544 -11.351 -9.575
Start of MODEL 8
1 1H GLY 1 1HT GLY 1 -11.598 2.879 -27.702
2 2H GLY 1 2HT GLY 1 -9.950 2.938 -27.331
3 3H GLY 1 3HT GLY 1 -10.980 4.166 -26.794
4 1HA GLY 1 1HA GLY 1 -12.049 2.771 -25.251
5 2HA GLY 1 2HA GLY 1 -11.320 1.344 -25.971
6 H SER 2 H SER 2 -9.477 4.258 -25.478
7 HA SER 2 HA SER 2 -7.449 2.945 -24.045
8 1HB SER 2 2HB SER 2 -7.552 5.287 -25.341
9 2HB SER 2 1HB SER 2 -7.763 5.884 -23.694
10 HG SER 2 HG SER 2 -5.688 4.099 -24.415
11 H ALA 3 H ALA 3 -6.729 4.354 -21.886
12 HA ALA 3 HA ALA 3 -8.755 4.966 -20.032
13 1HB ALA 3 1HB ALA 3 -9.477 2.849 -19.682
14 2HB ALA 3 2HB ALA 3 -8.088 2.807 -18.595
15 3HB ALA 3 3HB ALA 3 -7.961 2.125 -20.217
16 H ALA 4 H ALA 4 -7.430 6.636 -19.433
17 HA ALA 4 HA ALA 4 -4.686 6.481 -18.918
18 1HB ALA 4 1HB ALA 4 -5.865 8.594 -19.266
19 2HB ALA 4 2HB ALA 4 -4.950 8.612 -17.759
20 3HB ALA 4 3HB ALA 4 -6.699 8.386 -17.726
21 H GLU 5 H GLU 5 -3.509 6.393 -16.970
22 HA GLU 5 HA GLU 5 -4.050 4.405 -15.225
23 1HB GLU 5 2HB GLU 5 -2.486 6.926 -14.675
24 2HB GLU 5 1HB GLU 5 -2.426 5.481 -13.676
25 1HG GLU 5 2HG GLU 5 -1.776 4.303 -15.905
26 2HG GLU 5 1HG GLU 5 -1.350 5.934 -16.419
27 H VAL 6 H VAL 6 -6.116 4.311 -14.398
28 HA VAL 6 HA VAL 6 -6.817 6.413 -12.453
29 HB VAL 6 HB VAL 6 -8.737 4.765 -14.104
30 1HG1 VAL 6 1HG1 VAL 6 -9.129 6.819 -11.953
31 2HG1 VAL 6 2HG1 VAL 6 -9.840 5.211 -12.093
32 3HG1 VAL 6 3HG1 VAL 6 -10.372 6.507 -13.165
33 1HG2 VAL 6 1HG2 VAL 6 -8.704 6.349 -15.667
34 2HG2 VAL 6 2HG2 VAL 6 -7.288 7.022 -14.863
35 3HG2 VAL 6 3HG2 VAL 6 -8.897 7.624 -14.467
36 H MET 7 H MET 7 -8.087 5.692 -10.617
37 HA MET 7 HA MET 7 -8.454 4.340 -8.822
38 1HB MET 7 2HB MET 7 -8.605 2.318 -11.052
39 2HB MET 7 1HB MET 7 -8.874 1.880 -9.370
40 1HG MET 7 2HG MET 7 -10.420 4.158 -10.464
41 2HG MET 7 1HG MET 7 -10.850 2.535 -10.999
42 1HE MET 7 1HE MET 7 -12.644 0.994 -9.346
43 2HE MET 7 2HE MET 7 -11.798 0.687 -7.830
44 3HE MET 7 3HE MET 7 -10.924 0.605 -9.360
45 H LYS 8 H LYS 8 -6.427 4.753 -7.905
46 HA LYS 8 HA LYS 8 -4.625 2.442 -7.972
47 1HB LYS 8 2HB LYS 8 -3.859 5.341 -8.270
48 2HB LYS 8 1HB LYS 8 -2.711 4.127 -7.723
49 1HG LYS 8 2HG LYS 8 -3.392 2.864 -9.878
50 2HG LYS 8 1HG LYS 8 -3.999 4.437 -10.399
51 1HD LYS 8 2HD LYS 8 -1.243 4.258 -9.279
52 2HD LYS 8 1HD LYS 8 -1.530 3.690 -10.925
53 1HE LYS 8 2HE LYS 8 -0.818 6.041 -10.864
54 2HE LYS 8 1HE LYS 8 -2.433 5.850 -11.545
55 1HZ LYS 8 1HZ LYS 8 -2.117 6.429 -8.677
56 2HZ LYS 8 2HZ LYS 8 -3.415 6.782 -9.703
57 3HZ LYS 8 3HZ LYS 8 -1.988 7.686 -9.803
58 H LYS 9 H LYS 9 -6.565 2.805 -6.109
59 HA LYS 9 HA LYS 9 -4.984 3.033 -3.695
60 1HB LYS 9 2HB LYS 9 -7.339 4.845 -4.230
61 2HB LYS 9 1HB LYS 9 -6.685 4.559 -2.624
62 1HG LYS 9 2HG LYS 9 -5.553 6.453 -3.131
63 2HG LYS 9 1HG LYS 9 -4.434 5.280 -3.828
64 1HD LYS 9 2HD LYS 9 -4.620 6.572 -5.665
65 2HD LYS 9 1HD LYS 9 -6.114 5.666 -5.913
66 1HE LYS 9 2HE LYS 9 -6.650 7.966 -6.163
67 2HE LYS 9 1HE LYS 9 -7.296 7.452 -4.605
68 1HZ LYS 9 1HZ LYS 9 -5.176 8.359 -3.625
69 2HZ LYS 9 2HZ LYS 9 -6.255 9.509 -4.238
70 3HZ LYS 9 3HZ LYS 9 -4.880 9.083 -5.126
71 H TYR 10 H TYR 10 -6.145 0.828 -4.918
72 HA TYR 10 HA TYR 10 -7.689 -0.220 -2.759
73 1HB TYR 10 2HB TYR 10 -9.419 1.049 -4.064
74 2HB TYR 10 1HB TYR 10 -9.094 -0.016 -5.428
75 HD1 TYR 10 1HD TYR 10 -9.292 -2.596 -4.881
76 HD2 TYR 10 2HD TYR 10 -11.137 0.500 -2.620
77 HE1 TYR 10 1HE TYR 10 -10.927 -4.213 -4.011
78 HE2 TYR 10 2HE TYR 10 -12.774 -1.109 -1.742
79 HH TYR 10 HH TYR 10 -13.740 -3.441 -2.660
80 H CYS 11 H CYS 11 -6.534 -2.042 -2.558
81 HA CYS 11 HA CYS 11 -5.680 -3.500 -4.931
82 1HB CYS 11 2HB CYS 11 -4.278 -3.047 -2.770
83 2HB CYS 11 1HB CYS 11 -5.163 -4.424 -2.124
84 H SER 12 H SER 12 -7.556 -4.387 -5.739
85 HA SER 12 HA SER 12 -9.579 -5.644 -4.306
86 1HB SER 12 2HB SER 12 -9.440 -5.001 -6.824
87 2HB SER 12 1HB SER 12 -8.768 -6.619 -7.029
88 HG SER 12 HG SER 12 -10.695 -7.372 -5.905
89 H THR 13 H THR 13 -6.589 -6.990 -5.638
90 HA THR 13 HA THR 13 -7.087 -9.688 -5.145
91 HB THR 13 HB THR 13 -4.307 -8.932 -4.663
92 HG1 THR 13 1HG THR 13 -3.961 -7.717 -6.378
93 1HG2 THR 13 1HG2 THR 13 -5.780 -10.619 -6.637
94 2HG2 THR 13 2HG2 THR 13 -4.573 -11.089 -5.441
95 3HG2 THR 13 3HG2 THR 13 -4.084 -10.207 -6.888
96 H CYS 14 H CYS 14 -5.748 -7.193 -3.028
97 HA CYS 14 HA CYS 14 -5.418 -9.061 -0.842
98 1HB CYS 14 2HB CYS 14 -4.897 -6.120 -1.198
99 2HB CYS 14 1HB CYS 14 -4.792 -6.889 0.377
100 H ASP 15 H ASP 15 -7.771 -6.807 -1.996
101 HA ASP 15 HA ASP 15 -9.920 -6.424 -1.332
102 1HB ASP 15 2HB ASP 15 -9.649 -8.867 -0.409
103 2HB ASP 15 1HB ASP 15 -9.576 -8.062 1.155
104 H ILE 16 H ILE 16 -8.055 -4.561 -0.795
105 HA ILE 16 HA ILE 16 -9.120 -3.323 1.610
106 HB ILE 16 HB ILE 16 -6.135 -3.342 1.289
107 1HG1 ILE 16 2HG1 ILE 16 -7.760 -5.277 2.957
108 2HG1 ILE 16 1HG1 ILE 16 -6.856 -5.694 1.504
109 1HG2 ILE 16 1HG2 ILE 16 -6.742 -1.652 2.741
110 2HG2 ILE 16 2HG2 ILE 16 -6.428 -2.994 3.843
111 3HG2 ILE 16 3HG2 ILE 16 -8.086 -2.573 3.416
112 1HD1 ILE 16 1HD1 ILE 16 -4.968 -5.906 2.644
113 2HD1 ILE 16 2HD1 ILE 16 -5.948 -5.806 4.108
114 3HD1 ILE 16 3HD1 ILE 16 -5.194 -4.353 3.450
115 H SER 17 H SER 17 -8.451 -1.023 1.783
116 HA SER 17 HA SER 17 -7.558 0.156 -0.743
117 1HB SER 17 2HB SER 17 -9.540 1.908 -0.002
118 2HB SER 17 1HB SER 17 -9.701 0.671 -1.248
119 HG SER 17 HG SER 17 -10.740 0.757 1.324
120 H PHE 18 H PHE 18 -6.773 2.320 -0.551
121 HA PHE 18 HA PHE 18 -6.347 3.278 2.188
122 1HB PHE 18 2HB PHE 18 -4.094 3.317 0.195
123 2HB PHE 18 1HB PHE 18 -4.022 3.515 1.943
124 HD1 PHE 18 1HD PHE 18 -4.379 1.529 3.413
125 HD2 PHE 18 2HD PHE 18 -3.929 1.194 -0.806
126 HE1 PHE 18 1HE PHE 18 -3.861 -0.864 3.662
127 HE2 PHE 18 2HE PHE 18 -3.411 -1.200 -0.565
128 HZ PHE 18 HZ PHE 18 -3.377 -2.231 1.672
129 H ASN 19 H ASN 19 -7.104 5.278 2.295
130 HA ASN 19 HA ASN 19 -7.814 6.852 0.100
131 1HB ASN 19 2HB ASN 19 -8.339 6.982 2.739
132 2HB ASN 19 1HB ASN 19 -7.133 8.261 2.620
133 1HD2 ASN 19 1HD2 ASN 19 -7.600 9.454 0.302
134 2HD2 ASN 19 2HD2 ASN 19 -9.198 10.108 0.236
135 H TYR 20 H TYR 20 -4.858 6.760 2.008
136 HA TYR 20 HA TYR 20 -3.718 9.028 0.613
137 1HB TYR 20 2HB TYR 20 -2.277 7.135 2.469
138 2HB TYR 20 1HB TYR 20 -1.845 8.794 2.066
139 HD1 TYR 20 1HD TYR 20 -3.219 10.673 2.959
140 HD2 TYR 20 2HD TYR 20 -3.817 6.652 4.215
141 HE1 TYR 20 1HE TYR 20 -4.458 11.478 4.925
142 HE2 TYR 20 2HE TYR 20 -5.060 7.446 6.184
143 HH TYR 20 HH TYR 20 -5.302 9.419 7.536
144 H VAL 21 H VAL 21 -2.602 8.923 -1.214
145 HA VAL 21 HA VAL 21 -2.278 6.578 -2.697
146 HB VAL 21 HB VAL 21 -0.626 9.089 -2.994
147 1HG1 VAL 21 1HG1 VAL 21 0.069 8.311 -4.991
148 2HG1 VAL 21 2HG1 VAL 21 -1.474 7.534 -5.343
149 3HG1 VAL 21 3HG1 VAL 21 -0.307 6.738 -4.286
150 1HG2 VAL 21 1HG2 VAL 21 -2.940 8.787 -4.745
151 2HG2 VAL 21 2HG2 VAL 21 -2.376 10.194 -3.845
152 3HG2 VAL 21 3HG2 VAL 21 -3.369 8.976 -3.044
153 H LYS 22 H LYS 22 -0.061 8.257 -0.525
154 HA LYS 22 HA LYS 22 2.290 6.891 -1.097
155 1HB LYS 22 2HB LYS 22 2.831 7.350 1.370
156 2HB LYS 22 1HB LYS 22 2.497 8.734 0.339
157 1HG LYS 22 2HG LYS 22 0.076 7.749 1.556
158 2HG LYS 22 1HG LYS 22 1.300 8.116 2.773
159 1HD LYS 22 2HD LYS 22 0.606 10.031 0.562
160 2HD LYS 22 1HD LYS 22 -0.261 10.010 2.098
161 1HE LYS 22 2HE LYS 22 2.214 10.096 3.055
162 2HE LYS 22 1HE LYS 22 2.521 10.850 1.491
163 1HZ LYS 22 1HZ LYS 22 0.535 12.324 2.095
164 2HZ LYS 22 2HZ LYS 22 2.009 12.623 2.868
165 3HZ LYS 22 3HZ LYS 22 0.783 11.789 3.681
166 H THR 23 H THR 23 -0.495 5.913 0.765
167 HA THR 23 HA THR 23 0.658 3.683 2.062
168 HB THR 23 HB THR 23 -2.230 4.012 1.247
169 HG1 THR 23 1HG THR 23 -0.802 5.097 3.433
170 1HG2 THR 23 1HG2 THR 23 -1.825 1.834 2.154
171 2HG2 THR 23 2HG2 THR 23 -2.679 2.805 3.353
172 3HG2 THR 23 3HG2 THR 23 -0.946 2.520 3.520
173 H TYR 24 H TYR 24 -1.242 3.976 -0.929
174 HA TYR 24 HA TYR 24 -1.211 1.251 -1.609
175 1HB TYR 24 2HB TYR 24 -2.569 3.247 -2.614
176 2HB TYR 24 1HB TYR 24 -1.194 3.403 -3.702
177 HD1 TYR 24 1HD TYR 24 -2.925 0.388 -2.335
178 HD2 TYR 24 2HD TYR 24 -1.858 2.640 -5.784
179 HE1 TYR 24 1HE TYR 24 -3.867 -1.373 -3.770
180 HE2 TYR 24 2HE TYR 24 -2.797 0.884 -7.227
181 HH TYR 24 HH TYR 24 -4.786 -1.068 -6.695
182 H LEU 25 H LEU 25 1.099 3.824 -2.101
183 HA LEU 25 HA LEU 25 2.727 2.495 -3.998
184 1HB LEU 25 2HB LEU 25 3.041 4.832 -2.184
185 2HB LEU 25 1HB LEU 25 4.498 4.119 -2.850
186 HG LEU 25 HG LEU 25 2.290 4.797 -4.732
187 1HD1 LEU 25 1HD1 LEU 25 4.237 6.873 -3.760
188 2HD1 LEU 25 2HD1 LEU 25 2.583 6.744 -3.162
189 3HD1 LEU 25 3HD1 LEU 25 2.880 7.083 -4.867
190 1HD2 LEU 25 1HD2 LEU 25 5.161 5.398 -5.180
191 2HD2 LEU 25 2HD2 LEU 25 3.937 4.804 -6.303
192 3HD2 LEU 25 3HD2 LEU 25 4.672 3.704 -5.137
193 H ALA 26 H ALA 26 3.221 3.027 -0.522
194 HA ALA 26 HA ALA 26 5.407 1.313 -0.257
195 1HB ALA 26 1HB ALA 26 5.188 1.576 2.063
196 2HB ALA 26 2HB ALA 26 3.447 1.837 1.952
197 3HB ALA 26 3HB ALA 26 4.564 3.077 1.380
198 H HIS 27 H HIS 27 2.065 0.660 -0.596
199 HA HIS 27 HA HIS 27 2.020 -1.892 0.674
200 1HB HIS 27 2HB HIS 27 -0.034 -0.604 0.350
201 2HB HIS 27 1HB HIS 27 0.169 -0.686 -1.397
202 HD1 HIS 27 1HD HIS 27 -1.111 -2.623 1.504
203 HD2 HIS 27 2HD HIS 27 -0.346 -3.220 -2.536
204 HE1 HIS 27 1HE HIS 27 -2.291 -4.768 0.868
205 H LYS 28 H LYS 28 1.827 -1.007 -2.781
206 HA LYS 28 HA LYS 28 2.293 -3.628 -3.710
207 1HB LYS 28 2HB LYS 28 2.878 -1.060 -5.189
208 2HB LYS 28 1HB LYS 28 2.564 -2.641 -5.894
209 1HG LYS 28 2HG LYS 28 0.327 -2.461 -5.648
210 2HG LYS 28 1HG LYS 28 0.455 -1.549 -4.142
211 1HD LYS 28 2HD LYS 28 -0.451 -0.091 -5.806
212 2HD LYS 28 1HD LYS 28 1.209 0.418 -5.489
213 1HE LYS 28 2HE LYS 28 1.893 -0.966 -7.479
214 2HE LYS 28 1HE LYS 28 0.178 -1.157 -7.840
215 1HZ LYS 28 1HZ LYS 28 1.629 1.429 -7.667
216 2HZ LYS 28 2HZ LYS 28 -0.015 1.244 -8.018
217 3HZ LYS 28 3HZ LYS 28 1.150 0.661 -9.096
218 H GLN 29 H GLN 29 4.404 -1.284 -2.410
219 HA GLN 29 HA GLN 29 6.785 -1.922 -3.774
220 1HB GLN 29 2HB GLN 29 6.212 -0.705 -1.083
221 2HB GLN 29 1HB GLN 29 7.859 -1.004 -1.623
222 1HG GLN 29 2HG GLN 29 6.114 0.452 -3.501
223 2HG GLN 29 1HG GLN 29 6.559 1.301 -2.021
224 1HE2 GLN 29 1HE2 GLN 29 7.745 2.786 -3.284
225 2HE2 GLN 29 2HE2 GLN 29 9.304 2.381 -3.909
226 H PHE 30 H PHE 30 5.912 -2.823 -0.425
227 HA PHE 30 HA PHE 30 6.956 -5.501 -0.888
228 1HB PHE 30 2HB PHE 30 8.168 -5.102 1.448
229 2HB PHE 30 1HB PHE 30 8.967 -4.797 -0.090
230 HD1 PHE 30 1HD PHE 30 6.608 -2.920 2.118
231 HD2 PHE 30 2HD PHE 30 10.253 -2.906 -0.077
232 HE1 PHE 30 1HE PHE 30 7.005 -0.590 2.801
233 HE2 PHE 30 2HE PHE 30 10.658 -0.575 0.601
234 HZ PHE 30 HZ PHE 30 9.033 0.585 2.042
235 H TYR 31 H TYR 31 4.392 -3.997 -0.030
236 HA TYR 31 HA TYR 31 3.903 -5.497 2.453
237 1HB TYR 31 2HB TYR 31 3.396 -2.836 1.867
238 2HB TYR 31 1HB TYR 31 1.821 -3.601 1.683
239 HD1 TYR 31 1HD TYR 31 4.383 -2.541 4.015
240 HD2 TYR 31 2HD TYR 31 0.804 -4.806 3.608
241 HE1 TYR 31 1HE TYR 31 4.094 -2.510 6.456
242 HE2 TYR 31 2HE TYR 31 0.504 -4.780 6.048
243 HH TYR 31 HH TYR 31 2.968 -3.738 8.193
244 H CYS 32 H CYS 32 3.034 -5.209 -0.864
245 HA CYS 32 HA CYS 32 0.562 -6.680 -0.618
246 1HB CYS 32 2HB CYS 32 1.043 -4.899 -2.364
247 2HB CYS 32 1HB CYS 32 2.086 -6.078 -3.151
248 H LYS 33 H LYS 33 0.182 -8.751 -1.561
249 HA LYS 33 HA LYS 33 2.577 -10.382 -2.026
250 1HB LYS 33 2HB LYS 33 1.640 -12.198 -0.673
251 2HB LYS 33 1HB LYS 33 1.900 -10.752 0.294
252 1HG LYS 33 2HG LYS 33 -0.304 -10.443 0.681
253 2HG LYS 33 1HG LYS 33 -0.781 -11.064 -0.901
254 1HD LYS 33 2HD LYS 33 -0.805 -13.246 -0.189
255 2HD LYS 33 1HD LYS 33 0.389 -12.957 1.078
256 1HE LYS 33 2HE LYS 33 -1.461 -11.508 2.159
257 2HE LYS 33 1HE LYS 33 -2.551 -12.381 1.082
258 1HZ LYS 33 1HZ LYS 33 -2.451 -13.480 3.199
259 2HZ LYS 33 2HZ LYS 33 -0.764 -13.578 3.129
260 3HZ LYS 33 3HZ LYS 33 -1.707 -14.465 2.042
261 H ASN 34 H ASN 34 0.548 -9.197 -3.797
262 HA ASN 34 HA ASN 34 -0.347 -11.690 -5.069
263 1HB ASN 34 2HB ASN 34 -1.969 -9.204 -4.560
264 2HB ASN 34 1HB ASN 34 -2.391 -10.336 -5.840
265 1HD2 ASN 34 1HD2 ASN 34 -3.233 -9.485 -2.883
266 2HD2 ASN 34 2HD2 ASN 34 -3.743 -11.002 -2.232
267 H LYS 35 H LYS 35 1.465 -11.519 -6.448
268 HA LYS 35 HA LYS 35 1.426 -9.245 -8.312
269 1HB LYS 35 2HB LYS 35 3.541 -9.853 -6.993
270 2HB LYS 35 1HB LYS 35 3.650 -11.258 -8.045
271 1HG LYS 35 2HG LYS 35 3.377 -9.346 -9.899
272 2HG LYS 35 1HG LYS 35 4.155 -8.409 -8.621
273 1HD LYS 35 2HD LYS 35 5.184 -10.998 -9.781
274 2HD LYS 35 1HD LYS 35 5.796 -9.387 -10.158
275 1HE LYS 35 2HE LYS 35 6.694 -9.100 -8.023
276 2HE LYS 35 1HE LYS 35 5.707 -10.386 -7.334
277 1HZ LYS 35 1HZ LYS 35 7.778 -11.354 -7.509
278 2HZ LYS 35 2HZ LYS 35 8.140 -10.604 -8.980
279 3HZ LYS 35 3HZ LYS 35 7.032 -11.881 -8.933
280 HA PRO 36 HA PRO 36 -0.347 -12.657 -10.838
281 1HB PRO 36 2HB PRO 36 -1.873 -11.034 -12.389
282 2HB PRO 36 1HB PRO 36 -2.399 -11.620 -10.806
283 1HG PRO 36 2HG PRO 36 -1.213 -8.973 -11.548
284 2HG PRO 36 1HG PRO 36 -2.578 -9.325 -10.473
285 1HD PRO 36 2HD PRO 36 -0.097 -8.776 -9.541
286 2HD PRO 36 1HD PRO 36 -1.206 -9.883 -8.705
Start of MODEL 9
1 1H GLY 1 1HT GLY 1 -21.597 7.602 -12.430
2 2H GLY 1 2HT GLY 1 -20.907 8.957 -13.172
3 3H GLY 1 3HT GLY 1 -19.931 7.872 -12.318
4 1HA GLY 1 1HA GLY 1 -20.680 6.117 -13.959
5 2HA GLY 1 2HA GLY 1 -21.288 7.460 -14.914
6 H SER 2 H SER 2 -19.060 9.199 -13.973
7 HA SER 2 HA SER 2 -17.285 8.764 -16.104
8 1HB SER 2 2HB SER 2 -17.673 10.961 -14.974
9 2HB SER 2 1HB SER 2 -16.745 10.369 -13.596
10 HG SER 2 HG SER 2 -15.788 10.619 -16.258
11 H ALA 3 H ALA 3 -14.737 9.031 -15.192
12 HA ALA 3 HA ALA 3 -14.141 6.953 -13.270
13 1HB ALA 3 1HB ALA 3 -12.819 6.486 -15.876
14 2HB ALA 3 2HB ALA 3 -14.516 6.023 -15.745
15 3HB ALA 3 3HB ALA 3 -13.327 5.339 -14.637
16 H ALA 4 H ALA 4 -13.135 8.697 -12.188
17 HA ALA 4 HA ALA 4 -11.150 10.338 -13.346
18 1HB ALA 4 1HB ALA 4 -10.523 10.359 -10.699
19 2HB ALA 4 2HB ALA 4 -12.207 9.838 -10.658
20 3HB ALA 4 3HB ALA 4 -11.772 11.355 -11.445
21 H GLU 5 H GLU 5 -9.905 8.710 -14.505
22 HA GLU 5 HA GLU 5 -8.045 7.438 -14.816
23 1HB GLU 5 2HB GLU 5 -7.026 9.309 -13.508
24 2HB GLU 5 1HB GLU 5 -7.266 8.363 -12.046
25 1HG GLU 5 2HG GLU 5 -5.768 6.660 -12.841
26 2HG GLU 5 1HG GLU 5 -5.612 7.475 -14.397
27 H VAL 6 H VAL 6 -6.867 5.497 -14.041
28 HA VAL 6 HA VAL 6 -8.722 3.736 -12.645
29 HB VAL 6 HB VAL 6 -6.108 2.982 -13.950
30 1HG1 VAL 6 1HG1 VAL 6 -6.733 1.180 -12.647
31 2HG1 VAL 6 2HG1 VAL 6 -7.491 0.792 -14.192
32 3HG1 VAL 6 3HG1 VAL 6 -8.456 1.473 -12.881
33 1HG2 VAL 6 1HG2 VAL 6 -8.751 3.598 -15.124
34 2HG2 VAL 6 2HG2 VAL 6 -7.930 2.160 -15.731
35 3HG2 VAL 6 3HG2 VAL 6 -7.138 3.734 -15.824
36 H MET 7 H MET 7 -7.909 2.207 -11.026
37 HA MET 7 HA MET 7 -6.867 1.686 -9.071
38 1HB MET 7 2HB MET 7 -4.597 3.425 -10.045
39 2HB MET 7 1HB MET 7 -4.517 2.179 -8.808
40 1HG MET 7 2HG MET 7 -3.822 0.826 -10.421
41 2HG MET 7 1HG MET 7 -5.493 0.817 -10.982
42 1HE MET 7 1HE MET 7 -2.128 3.372 -11.765
43 2HE MET 7 2HE MET 7 -1.816 2.137 -12.985
44 3HE MET 7 3HE MET 7 -2.038 1.674 -11.298
45 H LYS 8 H LYS 8 -8.553 2.961 -8.070
46 HA LYS 8 HA LYS 8 -7.759 5.621 -7.163
47 1HB LYS 8 2HB LYS 8 -10.368 4.200 -6.625
48 2HB LYS 8 1HB LYS 8 -10.032 5.917 -6.462
49 1HG LYS 8 2HG LYS 8 -9.595 4.788 -9.144
50 2HG LYS 8 1HG LYS 8 -11.267 4.818 -8.582
51 1HD LYS 8 2HD LYS 8 -10.441 7.301 -7.872
52 2HD LYS 8 1HD LYS 8 -9.477 7.030 -9.327
53 1HE LYS 8 2HE LYS 8 -12.477 6.818 -9.093
54 2HE LYS 8 1HE LYS 8 -11.578 8.106 -9.892
55 1HZ LYS 8 1HZ LYS 8 -11.497 5.252 -10.709
56 2HZ LYS 8 2HZ LYS 8 -10.790 6.558 -11.520
57 3HZ LYS 8 3HZ LYS 8 -12.474 6.427 -11.436
58 H LYS 9 H LYS 9 -6.163 3.706 -6.120
59 HA LYS 9 HA LYS 9 -5.278 2.969 -4.158
60 1HB LYS 9 2HB LYS 9 -7.310 4.594 -2.655
61 2HB LYS 9 1HB LYS 9 -5.649 4.226 -2.212
62 1HG LYS 9 2HG LYS 9 -5.242 6.316 -2.891
63 2HG LYS 9 1HG LYS 9 -5.276 5.617 -4.510
64 1HD LYS 9 2HD LYS 9 -7.109 6.767 -5.050
65 2HD LYS 9 1HD LYS 9 -7.943 6.240 -3.587
66 1HE LYS 9 2HE LYS 9 -7.618 8.736 -3.858
67 2HE LYS 9 1HE LYS 9 -7.086 8.039 -2.328
68 1HZ LYS 9 1HZ LYS 9 -4.874 8.276 -2.890
69 2HZ LYS 9 2HZ LYS 9 -5.552 9.677 -3.553
70 3HZ LYS 9 3HZ LYS 9 -5.181 8.365 -4.552
71 H TYR 10 H TYR 10 -6.401 0.946 -4.915
72 HA TYR 10 HA TYR 10 -7.744 -0.247 -2.698
73 1HB TYR 10 2HB TYR 10 -9.676 0.861 -3.684
74 2HB TYR 10 1HB TYR 10 -9.306 0.161 -5.257
75 HD1 TYR 10 1HD TYR 10 -10.562 -1.659 -5.895
76 HD2 TYR 10 2HD TYR 10 -9.887 -1.004 -1.747
77 HE1 TYR 10 1HE TYR 10 -11.970 -3.604 -5.366
78 HE2 TYR 10 2HE TYR 10 -11.292 -2.948 -1.204
79 HH TYR 10 HH TYR 10 -12.003 -5.289 -3.097
80 H CYS 11 H CYS 11 -6.497 -2.010 -2.623
81 HA CYS 11 HA CYS 11 -5.619 -3.329 -5.048
82 1HB CYS 11 2HB CYS 11 -4.212 -3.004 -2.926
83 2HB CYS 11 1HB CYS 11 -5.169 -4.308 -2.233
84 H SER 12 H SER 12 -7.485 -4.177 -5.954
85 HA SER 12 HA SER 12 -9.543 -5.526 -4.718
86 1HB SER 12 2HB SER 12 -8.351 -5.688 -7.462
87 2HB SER 12 1HB SER 12 -9.619 -6.823 -6.999
88 HG SER 12 HG SER 12 -10.971 -5.276 -7.376
89 H THR 13 H THR 13 -6.441 -6.827 -5.820
90 HA THR 13 HA THR 13 -6.953 -9.536 -5.392
91 HB THR 13 HB THR 13 -4.268 -8.273 -4.886
92 HG1 THR 13 1HG THR 13 -3.979 -8.039 -7.029
93 1HG2 THR 13 1HG2 THR 13 -3.538 -10.353 -4.956
94 2HG2 THR 13 2HG2 THR 13 -4.127 -10.485 -6.613
95 3HG2 THR 13 3HG2 THR 13 -5.169 -10.946 -5.267
96 H CYS 14 H CYS 14 -5.642 -7.090 -3.181
97 HA CYS 14 HA CYS 14 -5.491 -8.957 -0.991
98 1HB CYS 14 2HB CYS 14 -4.954 -6.017 -1.305
99 2HB CYS 14 1HB CYS 14 -4.964 -6.778 0.277
100 H ASP 15 H ASP 15 -7.815 -6.769 -2.279
101 HA ASP 15 HA ASP 15 -9.972 -6.343 -1.722
102 1HB ASP 15 2HB ASP 15 -9.828 -8.093 0.703
103 2HB ASP 15 1HB ASP 15 -11.159 -7.837 -0.418
104 H ILE 16 H ILE 16 -8.207 -4.491 -1.000
105 HA ILE 16 HA ILE 16 -9.394 -3.391 1.414
106 HB ILE 16 HB ILE 16 -6.397 -3.341 1.217
107 1HG1 ILE 16 2HG1 ILE 16 -8.064 -5.387 2.702
108 2HG1 ILE 16 1HG1 ILE 16 -7.052 -5.711 1.298
109 1HG2 ILE 16 1HG2 ILE 16 -7.150 -1.719 2.703
110 2HG2 ILE 16 2HG2 ILE 16 -6.759 -3.082 3.750
111 3HG2 ILE 16 3HG2 ILE 16 -8.439 -2.749 3.326
112 1HD1 ILE 16 1HD1 ILE 16 -6.177 -4.922 4.058
113 2HD1 ILE 16 2HD1 ILE 16 -5.097 -4.929 2.665
114 3HD1 ILE 16 3HD1 ILE 16 -5.855 -6.428 3.201
115 H SER 17 H SER 17 -8.780 -1.088 1.720
116 HA SER 17 HA SER 17 -7.964 0.197 -0.798
117 1HB SER 17 2HB SER 17 -9.747 1.999 0.244
118 2HB SER 17 1HB SER 17 -10.125 0.830 -1.022
119 HG SER 17 HG SER 17 -11.303 1.009 1.260
120 H PHE 18 H PHE 18 -7.240 2.441 -0.527
121 HA PHE 18 HA PHE 18 -6.297 3.072 2.180
122 1HB PHE 18 2HB PHE 18 -4.516 3.345 -0.241
123 2HB PHE 18 1HB PHE 18 -4.070 3.512 1.453
124 HD1 PHE 18 1HD PHE 18 -4.441 1.379 2.922
125 HD2 PHE 18 2HD PHE 18 -4.096 1.357 -1.319
126 HE1 PHE 18 1HE PHE 18 -3.804 -0.995 2.991
127 HE2 PHE 18 2HE PHE 18 -3.460 -1.019 -1.258
128 HZ PHE 18 HZ PHE 18 -3.314 -2.198 0.898
129 H ASN 19 H ASN 19 -6.584 5.139 2.729
130 HA ASN 19 HA ASN 19 -7.837 6.934 0.876
131 1HB ASN 19 2HB ASN 19 -7.789 8.525 2.818
132 2HB ASN 19 1HB ASN 19 -8.578 6.988 3.160
133 1HD2 ASN 19 1HD2 ASN 19 -7.752 5.659 4.689
134 2HD2 ASN 19 2HD2 ASN 19 -6.388 6.052 5.673
135 H TYR 20 H TYR 20 -4.629 6.484 2.165
136 HA TYR 20 HA TYR 20 -3.715 8.968 0.901
137 1HB TYR 20 2HB TYR 20 -2.216 7.094 2.742
138 2HB TYR 20 1HB TYR 20 -1.651 8.659 2.167
139 HD1 TYR 20 1HD TYR 20 -4.032 10.341 2.506
140 HD2 TYR 20 2HD TYR 20 -2.441 7.320 5.045
141 HE1 TYR 20 1HE TYR 20 -5.074 11.432 4.448
142 HE2 TYR 20 2HE TYR 20 -3.479 8.402 6.993
143 HH TYR 20 HH TYR 20 -5.864 10.694 6.770
144 H VAL 21 H VAL 21 -2.542 8.971 -0.912
145 HA VAL 21 HA VAL 21 -2.299 6.680 -2.511
146 HB VAL 21 HB VAL 21 -0.699 9.236 -2.739
147 1HG1 VAL 21 1HG1 VAL 21 0.355 7.952 -4.277
148 2HG1 VAL 21 2HG1 VAL 21 -1.034 8.404 -5.264
149 3HG1 VAL 21 3HG1 VAL 21 -1.005 6.843 -4.445
150 1HG2 VAL 21 1HG2 VAL 21 -3.255 9.416 -2.668
151 2HG2 VAL 21 2HG2 VAL 21 -3.224 8.605 -4.233
152 3HG2 VAL 21 3HG2 VAL 21 -2.418 10.160 -4.031
153 H LYS 22 H LYS 22 -0.057 8.233 -0.290
154 HA LYS 22 HA LYS 22 2.302 6.937 -0.987
155 1HB LYS 22 2HB LYS 22 2.858 7.219 1.513
156 2HB LYS 22 1HB LYS 22 2.534 8.667 0.569
157 1HG LYS 22 2HG LYS 22 0.082 7.704 1.670
158 2HG LYS 22 1HG LYS 22 1.291 7.823 2.949
159 1HD LYS 22 2HD LYS 22 0.805 10.054 0.994
160 2HD LYS 22 1HD LYS 22 -0.122 9.895 2.486
161 1HE LYS 22 2HE LYS 22 2.839 10.324 2.176
162 2HE LYS 22 1HE LYS 22 1.663 11.389 2.944
163 1HZ LYS 22 1HZ LYS 22 2.653 10.371 4.734
164 2HZ LYS 22 2HZ LYS 22 2.827 8.882 3.952
165 3HZ LYS 22 3HZ LYS 22 1.305 9.374 4.500
166 H THR 23 H THR 23 -0.440 5.800 0.852
167 HA THR 23 HA THR 23 0.759 3.498 1.970
168 HB THR 23 HB THR 23 -2.138 3.974 1.252
169 HG1 THR 23 1HG THR 23 -1.032 5.498 2.734
170 1HG2 THR 23 1HG2 THR 23 -1.855 1.662 1.749
171 2HG2 THR 23 2HG2 THR 23 -2.592 2.439 3.150
172 3HG2 THR 23 3HG2 THR 23 -0.877 2.032 3.168
173 H TYR 24 H TYR 24 -1.199 3.975 -0.959
174 HA TYR 24 HA TYR 24 -1.163 1.307 -1.826
175 1HB TYR 24 2HB TYR 24 -2.532 3.374 -2.677
176 2HB TYR 24 1HB TYR 24 -1.175 3.585 -3.778
177 HD1 TYR 24 1HD TYR 24 -2.818 0.463 -2.569
178 HD2 TYR 24 2HD TYR 24 -1.967 2.995 -5.881
179 HE1 TYR 24 1HE TYR 24 -3.799 -1.204 -4.087
180 HE2 TYR 24 2HE TYR 24 -2.946 1.335 -7.408
181 HH TYR 24 HH TYR 24 -3.680 -1.843 -6.445
182 H LEU 25 H LEU 25 1.141 3.907 -2.156
183 HA LEU 25 HA LEU 25 2.748 2.690 -4.157
184 1HB LEU 25 2HB LEU 25 2.986 4.986 -2.314
185 2HB LEU 25 1HB LEU 25 4.501 4.285 -2.852
186 HG LEU 25 HG LEU 25 3.924 4.689 -5.170
187 1HD1 LEU 25 1HD1 LEU 25 1.778 6.253 -5.376
188 2HD1 LEU 25 2HD1 LEU 25 1.267 5.270 -4.005
189 3HD1 LEU 25 3HD1 LEU 25 1.695 4.499 -5.531
190 1HD2 LEU 25 1HD2 LEU 25 3.962 7.113 -5.167
191 2HD2 LEU 25 2HD2 LEU 25 4.998 6.490 -3.883
192 3HD2 LEU 25 3HD2 LEU 25 3.406 7.143 -3.493
193 H ALA 26 H ALA 26 3.257 3.052 -0.664
194 HA ALA 26 HA ALA 26 5.463 1.336 -0.513
195 1HB ALA 26 1HB ALA 26 4.408 3.054 1.207
196 2HB ALA 26 2HB ALA 26 5.430 1.717 1.733
197 3HB ALA 26 3HB ALA 26 3.675 1.580 1.840
198 H HIS 27 H HIS 27 2.123 0.698 -0.848
199 HA HIS 27 HA HIS 27 2.056 -1.873 0.370
200 1HB HIS 27 2HB HIS 27 0.026 -0.515 -0.011
201 2HB HIS 27 1HB HIS 27 0.238 -0.706 -1.749
202 HD1 HIS 27 1HD HIS 27 -0.964 -2.520 1.290
203 HD2 HIS 27 2HD HIS 27 -0.400 -3.232 -2.764
204 HE1 HIS 27 1HE HIS 27 -2.179 -4.678 0.772
205 H LYS 28 H LYS 28 2.037 -0.890 -3.062
206 HA LYS 28 HA LYS 28 2.464 -3.516 -4.033
207 1HB LYS 28 2HB LYS 28 2.324 -0.806 -5.152
208 2HB LYS 28 1HB LYS 28 3.396 -1.884 -6.034
209 1HG LYS 28 2HG LYS 28 1.338 -2.122 -7.091
210 2HG LYS 28 1HG LYS 28 1.448 -3.533 -6.037
211 1HD LYS 28 2HD LYS 28 0.159 -2.153 -4.327
212 2HD LYS 28 1HD LYS 28 -0.171 -1.029 -5.646
213 1HE LYS 28 2HE LYS 28 -2.031 -2.494 -5.520
214 2HE LYS 28 1HE LYS 28 -1.098 -2.981 -6.934
215 1HZ LYS 28 1HZ LYS 28 -1.727 -4.925 -5.741
216 2HZ LYS 28 2HZ LYS 28 -1.140 -4.306 -4.280
217 3HZ LYS 28 3HZ LYS 28 -0.063 -4.714 -5.518
218 H GLN 29 H GLN 29 4.560 -1.206 -2.645
219 HA GLN 29 HA GLN 29 6.972 -1.854 -3.943
220 1HB GLN 29 2HB GLN 29 6.234 -0.537 -1.370
221 2HB GLN 29 1HB GLN 29 7.901 -1.048 -1.596
222 1HG GLN 29 2HG GLN 29 7.991 0.277 -3.674
223 2HG GLN 29 1HG GLN 29 6.352 0.843 -3.350
224 1HE2 GLN 29 1HE2 GLN 29 6.298 2.792 -2.521
225 2HE2 GLN 29 2HE2 GLN 29 7.464 3.485 -1.450
226 H PHE 30 H PHE 30 5.970 -2.800 -0.641
227 HA PHE 30 HA PHE 30 6.974 -5.485 -1.098
228 1HB PHE 30 2HB PHE 30 8.211 -5.113 1.229
229 2HB PHE 30 1HB PHE 30 9.007 -4.836 -0.315
230 HD1 PHE 30 1HD PHE 30 7.179 -3.129 2.421
231 HD2 PHE 30 2HD PHE 30 9.885 -2.739 -0.841
232 HE1 PHE 30 1HE PHE 30 7.642 -0.807 3.088
233 HE2 PHE 30 2HE PHE 30 10.354 -0.416 -0.179
234 HZ PHE 30 HZ PHE 30 9.231 0.553 1.788
235 H TYR 31 H TYR 31 4.430 -4.003 -0.290
236 HA TYR 31 HA TYR 31 3.942 -5.405 2.251
237 1HB TYR 31 2HB TYR 31 3.412 -2.773 1.560
238 2HB TYR 31 1HB TYR 31 1.845 -3.560 1.408
239 HD1 TYR 31 1HD TYR 31 4.452 -2.470 3.705
240 HD2 TYR 31 2HD TYR 31 0.790 -4.610 3.368
241 HE1 TYR 31 1HE TYR 31 4.161 -2.345 6.143
242 HE2 TYR 31 2HE TYR 31 0.490 -4.490 5.806
243 HH TYR 31 HH TYR 31 2.435 -2.484 7.802
244 H CYS 32 H CYS 32 3.087 -5.253 -1.076
245 HA CYS 32 HA CYS 32 0.663 -6.818 -0.737
246 1HB CYS 32 2HB CYS 32 0.970 -4.961 -2.461
247 2HB CYS 32 1HB CYS 32 2.003 -6.085 -3.337
248 H LYS 33 H LYS 33 0.828 -8.941 -0.434
249 HA LYS 33 HA LYS 33 3.135 -10.373 -1.525
250 1HB LYS 33 2HB LYS 33 2.226 -12.261 -0.075
251 2HB LYS 33 1HB LYS 33 2.856 -10.851 0.765
252 1HG LYS 33 2HG LYS 33 0.661 -10.056 1.236
253 2HG LYS 33 1HG LYS 33 -0.065 -11.276 0.188
254 1HD LYS 33 2HD LYS 33 0.615 -13.037 1.671
255 2HD LYS 33 1HD LYS 33 1.547 -11.908 2.657
256 1HE LYS 33 2HE LYS 33 -0.513 -10.746 3.275
257 2HE LYS 33 1HE LYS 33 -1.446 -11.864 2.280
258 1HZ LYS 33 1HZ LYS 33 -1.615 -12.655 4.466
259 2HZ LYS 33 2HZ LYS 33 0.036 -12.447 4.775
260 3HZ LYS 33 3HZ LYS 33 -0.480 -13.671 3.729
261 H ASN 34 H ASN 34 0.801 -9.466 -3.135
262 HA ASN 34 HA ASN 34 -0.665 -10.237 -4.709
263 1HB ASN 34 2HB ASN 34 1.802 -11.188 -5.246
264 2HB ASN 34 1HB ASN 34 0.918 -12.706 -5.125
265 1HD2 ASN 34 1HD2 ASN 34 0.663 -9.498 -6.610
266 2HD2 ASN 34 2HD2 ASN 34 -0.019 -10.051 -8.097
267 H LYS 35 H LYS 35 -1.692 -10.827 -2.301
268 HA LYS 35 HA LYS 35 -2.454 -13.651 -2.324
269 1HB LYS 35 2HB LYS 35 -2.366 -11.516 -0.289
270 2HB LYS 35 1HB LYS 35 -3.740 -12.606 -0.168
271 1HG LYS 35 2HG LYS 35 -1.732 -14.381 -0.492
272 2HG LYS 35 1HG LYS 35 -0.892 -13.085 0.361
273 1HD LYS 35 2HD LYS 35 -1.690 -14.124 2.197
274 2HD LYS 35 1HD LYS 35 -3.166 -13.236 1.813
275 1HE LYS 35 2HE LYS 35 -4.225 -15.095 0.968
276 2HE LYS 35 1HE LYS 35 -2.711 -15.897 0.550
277 1HZ LYS 35 1HZ LYS 35 -3.306 -17.097 2.367
278 2HZ LYS 35 2HZ LYS 35 -4.128 -15.818 3.106
279 3HZ LYS 35 3HZ LYS 35 -2.439 -15.873 3.151
280 HA PRO 36 HA PRO 36 -6.402 -12.855 -4.126
281 1HB PRO 36 2HB PRO 36 -7.866 -14.874 -3.064
282 2HB PRO 36 1HB PRO 36 -6.633 -15.137 -4.304
283 1HG PRO 36 2HG PRO 36 -6.449 -15.512 -1.339
284 2HG PRO 36 1HG PRO 36 -5.848 -16.559 -2.638
285 1HD PRO 36 2HD PRO 36 -4.243 -14.855 -1.273
286 2HD PRO 36 1HD PRO 36 -3.966 -15.275 -2.975
Start of MODEL 10
1 1H GLY 1 1HT GLY 1 -0.707 18.396 -13.526
2 2H GLY 1 2HT GLY 1 0.614 18.224 -12.484
3 3H GLY 1 3HT GLY 1 -0.936 17.791 -11.963
4 1HA GLY 1 1HA GLY 1 0.656 16.448 -14.076
5 2HA GLY 1 2HA GLY 1 0.308 15.812 -12.476
6 H SER 2 H SER 2 -2.196 15.901 -12.002
7 HA SER 2 HA SER 2 -4.230 14.985 -12.436
8 1HB SER 2 2HB SER 2 -4.660 16.788 -13.925
9 2HB SER 2 1HB SER 2 -3.581 16.127 -15.154
10 HG SER 2 HG SER 2 -5.383 15.337 -15.914
11 H ALA 3 H ALA 3 -5.332 13.180 -13.510
12 HA ALA 3 HA ALA 3 -3.733 11.408 -15.144
13 1HB ALA 3 1HB ALA 3 -4.434 10.719 -12.302
14 2HB ALA 3 2HB ALA 3 -2.844 10.725 -13.063
15 3HB ALA 3 3HB ALA 3 -4.032 9.501 -13.512
16 H ALA 4 H ALA 4 -6.285 12.831 -15.327
17 HA ALA 4 HA ALA 4 -8.387 12.492 -16.129
18 1HB ALA 4 1HB ALA 4 -7.796 11.162 -17.867
19 2HB ALA 4 2HB ALA 4 -8.720 9.974 -16.948
20 3HB ALA 4 3HB ALA 4 -6.960 9.999 -16.838
21 H GLU 5 H GLU 5 -7.744 11.980 -13.276
22 HA GLU 5 HA GLU 5 -8.766 11.254 -11.378
23 1HB GLU 5 2HB GLU 5 -10.664 12.448 -12.577
24 2HB GLU 5 1HB GLU 5 -11.225 10.859 -13.077
25 1HG GLU 5 2HG GLU 5 -11.391 10.213 -10.698
26 2HG GLU 5 1HG GLU 5 -10.941 11.859 -10.254
27 H VAL 6 H VAL 6 -7.483 9.350 -11.280
28 HA VAL 6 HA VAL 6 -8.781 6.889 -12.219
29 HB VAL 6 HB VAL 6 -5.980 7.171 -11.131
30 1HG1 VAL 6 1HG1 VAL 6 -5.610 5.018 -12.209
31 2HG1 VAL 6 2HG1 VAL 6 -7.283 4.997 -12.768
32 3HG1 VAL 6 3HG1 VAL 6 -6.928 4.916 -11.042
33 1HG2 VAL 6 1HG2 VAL 6 -5.602 6.777 -13.761
34 2HG2 VAL 6 2HG2 VAL 6 -5.649 8.375 -13.017
35 3HG2 VAL 6 3HG2 VAL 6 -7.086 7.730 -13.811
36 H MET 7 H MET 7 -9.045 5.105 -10.815
37 HA MET 7 HA MET 7 -9.258 5.874 -7.990
38 1HB MET 7 2HB MET 7 -11.212 4.902 -9.566
39 2HB MET 7 1HB MET 7 -10.554 3.388 -8.959
40 1HG MET 7 2HG MET 7 -10.752 4.694 -6.650
41 2HG MET 7 1HG MET 7 -12.024 5.527 -7.542
42 1HE MET 7 1HE MET 7 -14.327 3.815 -5.665
43 2HE MET 7 2HE MET 7 -12.834 4.668 -5.274
44 3HE MET 7 3HE MET 7 -13.019 2.969 -4.839
45 H LYS 8 H LYS 8 -6.815 5.437 -8.275
46 HA LYS 8 HA LYS 8 -6.161 2.606 -8.004
47 1HB LYS 8 2HB LYS 8 -4.231 4.922 -7.924
48 2HB LYS 8 1HB LYS 8 -3.878 3.233 -8.264
49 1HG LYS 8 2HG LYS 8 -5.507 3.622 -10.280
50 2HG LYS 8 1HG LYS 8 -5.076 5.312 -10.021
51 1HD LYS 8 2HD LYS 8 -2.927 3.241 -10.173
52 2HD LYS 8 1HD LYS 8 -3.673 3.838 -11.657
53 1HE LYS 8 2HE LYS 8 -2.721 5.879 -11.472
54 2HE LYS 8 1HE LYS 8 -2.845 5.893 -9.713
55 1HZ LYS 8 1HZ LYS 8 -0.558 5.798 -10.282
56 2HZ LYS 8 2HZ LYS 8 -0.797 4.513 -11.356
57 3HZ LYS 8 3HZ LYS 8 -0.978 4.269 -9.692
58 H LYS 9 H LYS 9 -7.690 3.340 -5.937
59 HA LYS 9 HA LYS 9 -5.780 3.447 -3.702
60 1HB LYS 9 2HB LYS 9 -8.531 4.623 -3.456
61 2HB LYS 9 1HB LYS 9 -7.111 4.923 -2.466
62 1HG LYS 9 2HG LYS 9 -7.284 5.767 -5.344
63 2HG LYS 9 1HG LYS 9 -7.827 6.787 -4.010
64 1HD LYS 9 2HD LYS 9 -5.145 5.658 -3.651
65 2HD LYS 9 1HD LYS 9 -5.294 6.750 -5.031
66 1HE LYS 9 2HE LYS 9 -6.491 7.595 -2.446
67 2HE LYS 9 1HE LYS 9 -4.734 7.627 -2.590
68 1HZ LYS 9 1HZ LYS 9 -5.258 9.699 -3.340
69 2HZ LYS 9 2HZ LYS 9 -6.744 9.228 -3.998
70 3HZ LYS 9 3HZ LYS 9 -5.306 8.860 -4.809
71 H TYR 10 H TYR 10 -6.699 1.100 -4.856
72 HA TYR 10 HA TYR 10 -7.821 -0.205 -2.581
73 1HB TYR 10 2HB TYR 10 -9.886 0.713 -3.544
74 2HB TYR 10 1HB TYR 10 -9.517 -0.058 -5.083
75 HD1 TYR 10 1HD TYR 10 -9.836 -2.434 -5.392
76 HD2 TYR 10 2HD TYR 10 -10.622 -0.613 -1.629
77 HE1 TYR 10 1HE TYR 10 -11.026 -4.460 -4.668
78 HE2 TYR 10 2HE TYR 10 -11.814 -2.634 -0.892
79 HH TYR 10 HH TYR 10 -11.761 -5.136 -1.520
80 H CYS 11 H CYS 11 -6.533 -1.925 -2.512
81 HA CYS 11 HA CYS 11 -5.496 -3.106 -4.946
82 1HB CYS 11 2HB CYS 11 -4.123 -2.766 -2.846
83 2HB CYS 11 1HB CYS 11 -5.065 -4.057 -2.111
84 H SER 12 H SER 12 -7.308 -4.023 -5.916
85 HA SER 12 HA SER 12 -9.291 -5.551 -4.791
86 1HB SER 12 2HB SER 12 -8.744 -4.811 -7.307
87 2HB SER 12 1HB SER 12 -8.237 -6.497 -7.405
88 HG SER 12 HG SER 12 -10.425 -6.319 -7.919
89 H THR 13 H THR 13 -6.086 -6.618 -5.846
90 HA THR 13 HA THR 13 -6.430 -9.365 -5.495
91 HB THR 13 HB THR 13 -3.916 -7.734 -5.079
92 HG1 THR 13 1HG THR 13 -4.955 -8.994 -7.396
93 1HG2 THR 13 1HG2 THR 13 -2.821 -9.611 -4.710
94 2HG2 THR 13 2HG2 THR 13 -3.409 -10.265 -6.239
95 3HG2 THR 13 3HG2 THR 13 -4.337 -10.510 -4.759
96 H CYS 14 H CYS 14 -5.887 -6.821 -3.177
97 HA CYS 14 HA CYS 14 -5.526 -8.769 -1.023
98 1HB CYS 14 2HB CYS 14 -4.997 -5.832 -1.304
99 2HB CYS 14 1HB CYS 14 -5.148 -6.555 0.288
100 H ASP 15 H ASP 15 -7.855 -6.645 -2.397
101 HA ASP 15 HA ASP 15 -10.036 -6.254 -1.914
102 1HB ASP 15 2HB ASP 15 -9.977 -8.056 0.472
103 2HB ASP 15 1HB ASP 15 -11.247 -7.816 -0.720
104 H ILE 16 H ILE 16 -8.335 -4.393 -1.063
105 HA ILE 16 HA ILE 16 -9.644 -3.385 1.329
106 HB ILE 16 HB ILE 16 -6.644 -3.271 1.255
107 1HG1 ILE 16 2HG1 ILE 16 -8.315 -5.389 2.630
108 2HG1 ILE 16 1HG1 ILE 16 -7.279 -5.657 1.231
109 1HG2 ILE 16 1HG2 ILE 16 -7.458 -1.719 2.770
110 2HG2 ILE 16 2HG2 ILE 16 -7.136 -3.122 3.789
111 3HG2 ILE 16 3HG2 ILE 16 -8.786 -2.763 3.280
112 1HD1 ILE 16 1HD1 ILE 16 -6.595 -5.389 4.070
113 2HD1 ILE 16 2HD1 ILE 16 -5.514 -4.560 2.950
114 3HD1 ILE 16 3HD1 ILE 16 -5.796 -6.293 2.784
115 H SER 17 H SER 17 -9.083 -1.081 1.731
116 HA SER 17 HA SER 17 -8.305 0.290 -0.759
117 1HB SER 17 2HB SER 17 -10.832 0.294 0.131
118 2HB SER 17 1HB SER 17 -10.208 1.637 1.089
119 HG SER 17 HG SER 17 -9.807 1.463 -1.704
120 H PHE 18 H PHE 18 -7.537 2.525 -0.429
121 HA PHE 18 HA PHE 18 -6.408 3.026 2.228
122 1HB PHE 18 2HB PHE 18 -4.770 3.246 -0.301
123 2HB PHE 18 1HB PHE 18 -4.211 3.479 1.352
124 HD1 PHE 18 1HD PHE 18 -3.684 1.618 2.757
125 HD2 PHE 18 2HD PHE 18 -5.269 1.007 -1.145
126 HE1 PHE 18 1HE PHE 18 -3.070 -0.761 2.885
127 HE2 PHE 18 2HE PHE 18 -4.658 -1.374 -1.024
128 HZ PHE 18 HZ PHE 18 -3.557 -2.261 0.993
129 H ASN 19 H ASN 19 -6.561 5.094 2.845
130 HA ASN 19 HA ASN 19 -7.864 6.976 1.112
131 1HB ASN 19 2HB ASN 19 -6.880 7.082 3.956
132 2HB ASN 19 1HB ASN 19 -7.498 8.518 3.144
133 1HD2 ASN 19 1HD2 ASN 19 -8.362 5.134 3.750
134 2HD2 ASN 19 2HD2 ASN 19 -10.045 5.429 4.002
135 H TYR 20 H TYR 20 -4.605 6.370 2.178
136 HA TYR 20 HA TYR 20 -3.694 8.854 0.898
137 1HB TYR 20 2HB TYR 20 -2.105 6.989 2.669
138 2HB TYR 20 1HB TYR 20 -1.635 8.598 2.129
139 HD1 TYR 20 1HD TYR 20 -3.187 10.552 2.868
140 HD2 TYR 20 2HD TYR 20 -3.143 6.726 4.729
141 HE1 TYR 20 1HE TYR 20 -4.202 11.528 4.884
142 HE2 TYR 20 2HE TYR 20 -4.160 7.691 6.750
143 HH TYR 20 HH TYR 20 -4.149 10.710 7.552
144 H VAL 21 H VAL 21 -2.608 8.805 -0.964
145 HA VAL 21 HA VAL 21 -2.416 6.458 -2.500
146 HB VAL 21 HB VAL 21 -0.882 9.032 -2.906
147 1HG1 VAL 21 1HG1 VAL 21 0.107 7.650 -4.423
148 2HG1 VAL 21 2HG1 VAL 21 -1.293 8.146 -5.374
149 3HG1 VAL 21 3HG1 VAL 21 -1.298 6.591 -4.541
150 1HG2 VAL 21 1HG2 VAL 21 -3.446 9.149 -2.697
151 2HG2 VAL 21 2HG2 VAL 21 -3.464 8.323 -4.255
152 3HG2 VAL 21 3HG2 VAL 21 -2.687 9.898 -4.101
153 H LYS 22 H LYS 22 -0.099 8.144 -0.459
154 HA LYS 22 HA LYS 22 2.250 6.871 -1.223
155 1HB LYS 22 2HB LYS 22 3.032 7.349 1.107
156 2HB LYS 22 1HB LYS 22 2.342 8.737 0.278
157 1HG LYS 22 2HG LYS 22 1.279 8.985 2.251
158 2HG LYS 22 1HG LYS 22 0.144 7.859 1.505
159 1HD LYS 22 2HD LYS 22 0.461 6.746 3.458
160 2HD LYS 22 1HD LYS 22 1.844 6.095 2.575
161 1HE LYS 22 2HE LYS 22 2.376 6.884 4.882
162 2HE LYS 22 1HE LYS 22 3.328 7.654 3.612
163 1HZ LYS 22 1HZ LYS 22 0.854 8.952 4.509
164 2HZ LYS 22 2HZ LYS 22 2.272 9.644 3.899
165 3HZ LYS 22 3HZ LYS 22 2.230 9.066 5.487
166 H THR 23 H THR 23 -0.385 5.742 0.761
167 HA THR 23 HA THR 23 0.916 3.521 1.929
168 HB THR 23 HB THR 23 -2.021 3.651 1.279
169 HG1 THR 23 1HG THR 23 -0.585 5.023 3.290
170 1HG2 THR 23 1HG2 THR 23 -0.428 2.369 3.471
171 2HG2 THR 23 2HG2 THR 23 -1.520 1.607 2.314
172 3HG2 THR 23 3HG2 THR 23 -2.167 2.641 3.590
173 H TYR 24 H TYR 24 -1.162 3.822 -0.941
174 HA TYR 24 HA TYR 24 -1.076 1.119 -1.696
175 1HB TYR 24 2HB TYR 24 -2.560 3.087 -2.566
176 2HB TYR 24 1HB TYR 24 -1.258 3.322 -3.727
177 HD1 TYR 24 1HD TYR 24 -3.539 0.676 -2.419
178 HD2 TYR 24 2HD TYR 24 -1.274 2.123 -5.715
179 HE1 TYR 24 1HE TYR 24 -4.502 -1.081 -3.844
180 HE2 TYR 24 2HE TYR 24 -2.231 0.372 -7.150
181 HH TYR 24 HH TYR 24 -3.453 -2.251 -6.285
182 H LEU 25 H LEU 25 1.111 3.786 -2.260
183 HA LEU 25 HA LEU 25 2.664 2.572 -4.287
184 1HB LEU 25 2HB LEU 25 2.980 4.868 -2.438
185 2HB LEU 25 1HB LEU 25 4.451 4.205 -3.123
186 HG LEU 25 HG LEU 25 3.649 4.630 -5.373
187 1HD1 LEU 25 1HD1 LEU 25 1.191 5.851 -4.135
188 2HD1 LEU 25 2HD1 LEU 25 1.239 4.233 -4.836
189 3HD1 LEU 25 3HD1 LEU 25 1.545 5.643 -5.850
190 1HD2 LEU 25 1HD2 LEU 25 4.811 6.482 -4.681
191 2HD2 LEU 25 2HD2 LEU 25 3.675 6.846 -3.382
192 3HD2 LEU 25 3HD2 LEU 25 3.245 7.203 -5.055
193 H ALA 26 H ALA 26 3.467 3.064 -0.864
194 HA ALA 26 HA ALA 26 5.640 1.306 -0.836
195 1HB ALA 26 1HB ALA 26 4.955 1.285 1.740
196 2HB ALA 26 2HB ALA 26 4.002 2.670 1.212
197 3HB ALA 26 3HB ALA 26 5.749 2.662 0.978
198 H HIS 27 H HIS 27 2.273 0.725 -0.814
199 HA HIS 27 HA HIS 27 2.278 -1.784 0.527
200 1HB HIS 27 2HB HIS 27 0.226 -0.490 0.331
201 2HB HIS 27 1HB HIS 27 0.305 -0.578 -1.425
202 HD1 HIS 27 1HD HIS 27 -0.790 -2.499 1.564
203 HD2 HIS 27 2HD HIS 27 -0.342 -3.095 -2.523
204 HE1 HIS 27 1HE HIS 27 -2.041 -4.627 1.016
205 H LYS 28 H LYS 28 2.033 -0.938 -2.931
206 HA LYS 28 HA LYS 28 2.307 -3.630 -3.802
207 1HB LYS 28 2HB LYS 28 2.305 -0.953 -5.115
208 2HB LYS 28 1HB LYS 28 2.950 -2.316 -6.019
209 1HG LYS 28 2HG LYS 28 0.688 -3.440 -5.247
210 2HG LYS 28 1HG LYS 28 0.170 -1.757 -5.147
211 1HD LYS 28 2HD LYS 28 1.633 -2.540 -7.593
212 2HD LYS 28 1HD LYS 28 0.017 -3.220 -7.394
213 1HE LYS 28 2HE LYS 28 -1.004 -1.215 -7.645
214 2HE LYS 28 1HE LYS 28 0.294 -0.335 -6.840
215 1HZ LYS 28 1HZ LYS 28 1.540 -0.243 -8.783
216 2HZ LYS 28 2HZ LYS 28 -0.038 0.029 -9.328
217 3HZ LYS 28 3HZ LYS 28 0.674 -1.491 -9.530
218 H GLN 29 H GLN 29 4.545 -1.397 -2.605
219 HA GLN 29 HA GLN 29 6.819 -2.126 -4.142
220 1HB GLN 29 2HB GLN 29 6.355 -0.644 -1.592
221 2HB GLN 29 1HB GLN 29 7.984 -1.194 -1.958
222 1HG GLN 29 2HG GLN 29 6.279 0.622 -3.647
223 2HG GLN 29 1HG GLN 29 7.690 1.080 -2.693
224 1HE2 GLN 29 1HE2 GLN 29 6.609 0.243 -5.713
225 2HE2 GLN 29 2HE2 GLN 29 8.121 -0.157 -6.448
226 H PHE 30 H PHE 30 6.087 -2.851 -0.715
227 HA PHE 30 HA PHE 30 7.073 -5.566 -1.102
228 1HB PHE 30 2HB PHE 30 8.370 -5.085 1.175
229 2HB PHE 30 1HB PHE 30 9.119 -4.863 -0.401
230 HD1 PHE 30 1HD PHE 30 7.454 -3.104 2.388
231 HD2 PHE 30 2HD PHE 30 9.849 -2.740 -1.110
232 HE1 PHE 30 1HE PHE 30 7.912 -0.753 2.951
233 HE2 PHE 30 2HE PHE 30 10.312 -0.388 -0.554
234 HZ PHE 30 HZ PHE 30 9.341 0.608 1.479
235 H TYR 31 H TYR 31 4.563 -3.979 -0.214
236 HA TYR 31 HA TYR 31 4.140 -5.376 2.341
237 1HB TYR 31 2HB TYR 31 3.663 -2.729 1.677
238 2HB TYR 31 1HB TYR 31 2.068 -3.468 1.581
239 HD1 TYR 31 1HD TYR 31 5.003 -3.075 3.831
240 HD2 TYR 31 2HD TYR 31 0.837 -3.882 3.527
241 HE1 TYR 31 1HE TYR 31 4.807 -2.951 6.279
242 HE2 TYR 31 2HE TYR 31 0.629 -3.759 5.975
243 HH TYR 31 HH TYR 31 2.396 -2.374 7.904
244 H CYS 32 H CYS 32 3.259 -5.331 -0.952
245 HA CYS 32 HA CYS 32 0.776 -6.797 -0.496
246 1HB CYS 32 2HB CYS 32 0.987 -4.938 -2.214
247 2HB CYS 32 1HB CYS 32 1.997 -6.034 -3.148
248 H LYS 33 H LYS 33 0.818 -8.940 -0.353
249 HA LYS 33 HA LYS 33 3.098 -10.398 -1.472
250 1HB LYS 33 2HB LYS 33 0.957 -11.436 0.388
251 2HB LYS 33 1HB LYS 33 2.480 -12.215 -0.014
252 1HG LYS 33 2HG LYS 33 3.699 -10.864 1.359
253 2HG LYS 33 1HG LYS 33 2.574 -9.511 1.210
254 1HD LYS 33 2HD LYS 33 1.471 -11.915 2.496
255 2HD LYS 33 1HD LYS 33 2.768 -11.118 3.389
256 1HE LYS 33 2HE LYS 33 1.036 -9.905 4.200
257 2HE LYS 33 1HE LYS 33 1.327 -8.968 2.735
258 1HZ LYS 33 1HZ LYS 33 -0.944 -9.347 2.709
259 2HZ LYS 33 2HZ LYS 33 -0.805 -10.935 3.273
260 3HZ LYS 33 3HZ LYS 33 -0.360 -10.561 1.686
261 H ASN 34 H ASN 34 0.797 -9.364 -3.055
262 HA ASN 34 HA ASN 34 -0.678 -10.033 -4.665
263 1HB ASN 34 2HB ASN 34 1.520 -10.762 -5.586
264 2HB ASN 34 1HB ASN 34 1.242 -12.358 -4.896
265 1HD2 ASN 34 1HD2 ASN 34 1.535 -12.961 -7.181
266 2HD2 ASN 34 2HD2 ASN 34 0.147 -12.955 -8.209
267 H LYS 35 H LYS 35 -1.749 -10.653 -2.285
268 HA LYS 35 HA LYS 35 -3.339 -12.977 -2.920
269 1HB LYS 35 2HB LYS 35 -1.131 -13.279 -1.191
270 2HB LYS 35 1HB LYS 35 -2.557 -13.280 -0.164
271 1HG LYS 35 2HG LYS 35 -3.278 -15.266 -0.935
272 2HG LYS 35 1HG LYS 35 -2.735 -14.945 -2.583
273 1HD LYS 35 2HD LYS 35 -1.168 -16.491 -2.096
274 2HD LYS 35 1HD LYS 35 -0.359 -15.136 -1.306
275 1HE LYS 35 2HE LYS 35 -0.375 -16.973 0.222
276 2HE LYS 35 1HE LYS 35 -1.524 -15.771 0.808
277 1HZ LYS 35 1HZ LYS 35 -2.779 -17.639 0.993
278 2HZ LYS 35 2HZ LYS 35 -2.019 -18.435 -0.292
279 3HZ LYS 35 3HZ LYS 35 -3.169 -17.235 -0.604
280 HA PRO 36 HA PRO 36 -6.434 -10.537 -0.944
281 1HB PRO 36 2HB PRO 36 -8.192 -12.449 -0.157
282 2HB PRO 36 1HB PRO 36 -7.985 -11.974 -1.846
283 1HG PRO 36 2HG PRO 36 -6.844 -14.326 -0.387
284 2HG PRO 36 1HG PRO 36 -7.558 -14.255 -2.008
285 1HD PRO 36 2HD PRO 36 -4.883 -14.275 -1.595
286 2HD PRO 36 1HD PRO 36 -5.631 -13.419 -2.958
Start of MODEL 11
1 1H GLY 1 1HT GLY 1 -19.699 12.866 -0.565
2 2H GLY 1 2HT GLY 1 -20.727 12.229 -1.746
3 3H GLY 1 3HT GLY 1 -20.155 13.814 -1.890
4 1HA GLY 1 1HA GLY 1 -17.839 12.529 -1.757
5 2HA GLY 1 2HA GLY 1 -18.840 11.294 -2.507
6 H SER 2 H SER 2 -16.758 13.707 -3.174
7 HA SER 2 HA SER 2 -17.874 14.056 -5.867
8 1HB SER 2 2HB SER 2 -16.672 16.433 -5.613
9 2HB SER 2 1HB SER 2 -18.358 16.181 -5.160
10 HG SER 2 HG SER 2 -17.756 16.820 -3.259
11 H ALA 3 H ALA 3 -16.089 15.147 -7.302
12 HA ALA 3 HA ALA 3 -14.088 14.904 -8.358
13 1HB ALA 3 1HB ALA 3 -13.454 15.804 -5.935
14 2HB ALA 3 2HB ALA 3 -12.233 15.380 -7.135
15 3HB ALA 3 3HB ALA 3 -12.646 14.238 -5.857
16 H ALA 4 H ALA 4 -14.533 13.043 -9.505
17 HA ALA 4 HA ALA 4 -14.511 10.434 -8.471
18 1HB ALA 4 1HB ALA 4 -14.139 9.784 -10.902
19 2HB ALA 4 2HB ALA 4 -14.147 11.512 -11.252
20 3HB ALA 4 3HB ALA 4 -15.572 10.749 -10.546
21 H GLU 5 H GLU 5 -12.077 11.729 -10.728
22 HA GLU 5 HA GLU 5 -9.839 11.378 -10.920
23 1HB GLU 5 2HB GLU 5 -9.843 12.438 -8.669
24 2HB GLU 5 1HB GLU 5 -9.958 10.839 -7.947
25 1HG GLU 5 2HG GLU 5 -7.804 10.231 -8.789
26 2HG GLU 5 1HG GLU 5 -7.701 11.718 -9.730
27 H VAL 6 H VAL 6 -8.119 9.717 -10.774
28 HA VAL 6 HA VAL 6 -9.108 7.177 -11.473
29 HB VAL 6 HB VAL 6 -6.289 7.822 -10.600
30 1HG1 VAL 6 1HG1 VAL 6 -5.847 5.981 -12.351
31 2HG1 VAL 6 2HG1 VAL 6 -7.545 5.567 -12.119
32 3HG1 VAL 6 3HG1 VAL 6 -6.429 5.506 -10.754
33 1HG2 VAL 6 1HG2 VAL 6 -6.895 7.739 -13.470
34 2HG2 VAL 6 2HG2 VAL 6 -5.862 8.839 -12.557
35 3HG2 VAL 6 3HG2 VAL 6 -7.604 9.103 -12.606
36 H MET 7 H MET 7 -8.658 5.126 -10.420
37 HA MET 7 HA MET 7 -8.881 5.352 -7.502
38 1HB MET 7 2HB MET 7 -9.876 3.081 -7.599
39 2HB MET 7 1HB MET 7 -10.792 4.268 -8.516
40 1HG MET 7 2HG MET 7 -10.310 3.309 -10.513
41 2HG MET 7 1HG MET 7 -8.740 2.714 -9.976
42 1HE MET 7 1HE MET 7 -8.154 0.753 -9.465
43 2HE MET 7 2HE MET 7 -9.101 -0.733 -9.542
44 3HE MET 7 3HE MET 7 -8.920 0.120 -8.009
45 H LYS 8 H LYS 8 -6.441 5.696 -7.913
46 HA LYS 8 HA LYS 8 -5.002 3.161 -8.115
47 1HB LYS 8 2HB LYS 8 -2.967 4.676 -7.998
48 2HB LYS 8 1HB LYS 8 -3.991 4.859 -9.415
49 1HG LYS 8 2HG LYS 8 -4.933 6.871 -8.585
50 2HG LYS 8 1HG LYS 8 -4.208 6.627 -6.994
51 1HD LYS 8 2HD LYS 8 -1.980 6.885 -7.963
52 2HD LYS 8 1HD LYS 8 -2.695 7.105 -9.562
53 1HE LYS 8 2HE LYS 8 -3.593 8.882 -7.351
54 2HE LYS 8 1HE LYS 8 -2.002 9.164 -8.057
55 1HZ LYS 8 1HZ LYS 8 -4.615 9.175 -9.464
56 2HZ LYS 8 2HZ LYS 8 -3.122 9.230 -10.259
57 3HZ LYS 8 3HZ LYS 8 -3.574 10.488 -9.222
58 H LYS 9 H LYS 9 -6.504 3.140 -5.904
59 HA LYS 9 HA LYS 9 -4.554 2.897 -3.827
60 1HB LYS 9 2HB LYS 9 -5.936 4.412 -2.254
61 2HB LYS 9 1HB LYS 9 -4.806 5.167 -3.367
62 1HG LYS 9 2HG LYS 9 -6.692 6.489 -3.554
63 2HG LYS 9 1HG LYS 9 -6.841 5.396 -4.932
64 1HD LYS 9 2HD LYS 9 -8.525 4.145 -3.909
65 2HD LYS 9 1HD LYS 9 -8.118 4.743 -2.299
66 1HE LYS 9 2HE LYS 9 -8.973 6.935 -2.858
67 2HE LYS 9 1HE LYS 9 -9.283 6.421 -4.517
68 1HZ LYS 9 1HZ LYS 9 -10.785 4.681 -3.470
69 2HZ LYS 9 2HZ LYS 9 -11.335 6.281 -3.448
70 3HZ LYS 9 3HZ LYS 9 -10.682 5.592 -2.048
71 H TYR 10 H TYR 10 -5.914 0.899 -4.817
72 HA TYR 10 HA TYR 10 -7.459 -0.058 -2.619
73 1HB TYR 10 2HB TYR 10 -9.185 1.272 -3.777
74 2HB TYR 10 1HB TYR 10 -8.895 0.353 -5.251
75 HD1 TYR 10 1HD TYR 10 -9.214 -2.231 -5.058
76 HD2 TYR 10 2HD TYR 10 -10.844 0.580 -2.311
77 HE1 TYR 10 1HE TYR 10 -10.882 -3.895 -4.354
78 HE2 TYR 10 2HE TYR 10 -12.516 -1.076 -1.599
79 HH TYR 10 HH TYR 10 -13.610 -3.223 -2.801
80 H CYS 11 H CYS 11 -6.453 -1.964 -2.447
81 HA CYS 11 HA CYS 11 -5.657 -3.430 -4.823
82 1HB CYS 11 2HB CYS 11 -4.332 -3.146 -2.573
83 2HB CYS 11 1HB CYS 11 -5.327 -4.499 -2.045
84 H SER 12 H SER 12 -7.399 -4.333 -5.788
85 HA SER 12 HA SER 12 -9.622 -5.435 -4.467
86 1HB SER 12 2HB SER 12 -9.825 -6.707 -6.765
87 2HB SER 12 1HB SER 12 -10.064 -4.961 -6.692
88 HG SER 12 HG SER 12 -8.490 -4.829 -8.061
89 H THR 13 H THR 13 -6.555 -6.814 -5.468
90 HA THR 13 HA THR 13 -7.199 -9.530 -5.147
91 HB THR 13 HB THR 13 -4.461 -8.499 -4.511
92 HG1 THR 13 1HG THR 13 -4.189 -7.701 -6.431
93 1HG2 THR 13 1HG2 THR 13 -5.451 -10.804 -6.169
94 2HG2 THR 13 2HG2 THR 13 -4.727 -10.893 -4.563
95 3HG2 THR 13 3HG2 THR 13 -3.759 -10.363 -5.940
96 H CYS 14 H CYS 14 -5.623 -7.264 -2.894
97 HA CYS 14 HA CYS 14 -5.664 -9.135 -0.735
98 1HB CYS 14 2HB CYS 14 -5.063 -6.179 -0.877
99 2HB CYS 14 1HB CYS 14 -4.940 -7.125 0.597
100 H ASP 15 H ASP 15 -7.755 -6.614 -1.913
101 HA ASP 15 HA ASP 15 -9.971 -6.249 -1.467
102 1HB ASP 15 2HB ASP 15 -9.830 -8.690 -0.489
103 2HB ASP 15 1HB ASP 15 -9.919 -7.853 1.057
104 H ILE 16 H ILE 16 -8.015 -4.468 -0.698
105 HA ILE 16 HA ILE 16 -9.352 -3.170 1.546
106 HB ILE 16 HB ILE 16 -6.345 -3.316 1.524
107 1HG1 ILE 16 2HG1 ILE 16 -6.907 -4.793 3.659
108 2HG1 ILE 16 1HG1 ILE 16 -8.349 -5.172 2.724
109 1HG2 ILE 16 1HG2 ILE 16 -8.419 -2.175 3.328
110 2HG2 ILE 16 2HG2 ILE 16 -6.895 -1.479 2.777
111 3HG2 ILE 16 3HG2 ILE 16 -6.894 -2.734 4.016
112 1HD1 ILE 16 1HD1 ILE 16 -5.491 -5.767 2.101
113 2HD1 ILE 16 2HD1 ILE 16 -6.712 -5.732 0.830
114 3HD1 ILE 16 3HD1 ILE 16 -6.870 -6.863 2.174
115 H SER 17 H SER 17 -8.655 -0.882 1.774
116 HA SER 17 HA SER 17 -7.588 0.256 -0.713
117 1HB SER 17 2HB SER 17 -10.204 0.271 -0.445
118 2HB SER 17 1HB SER 17 -9.885 1.612 0.655
119 HG SER 17 HG SER 17 -9.897 2.715 -1.144
120 H PHE 18 H PHE 18 -7.073 2.632 -0.425
121 HA PHE 18 HA PHE 18 -6.379 3.323 2.332
122 1HB PHE 18 2HB PHE 18 -4.358 3.603 0.114
123 2HB PHE 18 1HB PHE 18 -4.101 3.763 1.848
124 HD1 PHE 18 1HD PHE 18 -3.912 1.804 3.265
125 HD2 PHE 18 2HD PHE 18 -4.490 1.438 -0.935
126 HE1 PHE 18 1HE PHE 18 -3.262 -0.567 3.386
127 HE2 PHE 18 2HE PHE 18 -3.841 -0.934 -0.822
128 HZ PHE 18 HZ PHE 18 -3.226 -1.938 1.341
129 H ASN 19 H ASN 19 -6.608 5.435 2.797
130 HA ASN 19 HA ASN 19 -7.879 7.137 0.903
131 1HB ASN 19 2HB ASN 19 -6.716 7.829 3.610
132 2HB ASN 19 1HB ASN 19 -7.846 8.814 2.687
133 1HD2 ASN 19 1HD2 ASN 19 -7.554 6.565 5.096
134 2HD2 ASN 19 2HD2 ASN 19 -9.189 6.012 5.160
135 H TYR 20 H TYR 20 -4.594 6.655 1.909
136 HA TYR 20 HA TYR 20 -3.755 9.034 0.396
137 1HB TYR 20 2HB TYR 20 -2.191 7.403 2.408
138 2HB TYR 20 1HB TYR 20 -1.621 8.857 1.594
139 HD1 TYR 20 1HD TYR 20 -3.605 10.818 1.813
140 HD2 TYR 20 2HD TYR 20 -2.671 7.767 4.626
141 HE1 TYR 20 1HE TYR 20 -4.549 12.200 3.615
142 HE2 TYR 20 2HE TYR 20 -3.613 9.139 6.436
143 HH TYR 20 HH TYR 20 -5.460 11.961 5.832
144 H VAL 21 H VAL 21 -2.700 8.808 -1.471
145 HA VAL 21 HA VAL 21 -2.502 6.357 -2.794
146 HB VAL 21 HB VAL 21 -0.828 8.796 -3.399
147 1HG1 VAL 21 1HG1 VAL 21 -0.034 7.308 -4.903
148 2HG1 VAL 21 2HG1 VAL 21 -1.497 7.748 -5.781
149 3HG1 VAL 21 3HG1 VAL 21 -1.463 6.280 -4.805
150 1HG2 VAL 21 1HG2 VAL 21 -2.837 9.826 -3.510
151 2HG2 VAL 21 2HG2 VAL 21 -3.726 8.312 -3.680
152 3HG2 VAL 21 3HG2 VAL 21 -2.916 9.020 -5.077
153 H LYS 22 H LYS 22 -0.166 8.113 -0.838
154 HA LYS 22 HA LYS 22 2.159 6.734 -1.486
155 1HB LYS 22 2HB LYS 22 1.201 8.229 0.901
156 2HB LYS 22 1HB LYS 22 2.617 7.209 1.105
157 1HG LYS 22 2HG LYS 22 3.200 9.530 0.581
158 2HG LYS 22 1HG LYS 22 3.777 8.401 -0.646
159 1HD LYS 22 2HD LYS 22 2.086 9.036 -2.166
160 2HD LYS 22 1HD LYS 22 1.169 9.875 -0.912
161 1HE LYS 22 2HE LYS 22 2.455 11.342 -2.519
162 2HE LYS 22 1HE LYS 22 2.738 11.635 -0.804
163 1HZ LYS 22 1HZ LYS 22 4.851 10.867 -0.926
164 2HZ LYS 22 2HZ LYS 22 4.704 11.389 -2.527
165 3HZ LYS 22 3HZ LYS 22 4.515 9.751 -2.151
166 H THR 23 H THR 23 -0.499 5.835 0.606
167 HA THR 23 HA THR 23 0.723 3.642 1.890
168 HB THR 23 HB THR 23 -2.202 3.678 1.248
169 HG1 THR 23 1HG THR 23 -2.536 5.425 2.365
170 1HG2 THR 23 1HG2 THR 23 -1.506 1.872 2.643
171 2HG2 THR 23 2HG2 THR 23 -2.387 3.036 3.635
172 3HG2 THR 23 3HG2 THR 23 -0.626 2.969 3.707
173 H TYR 24 H TYR 24 -1.350 3.830 -0.993
174 HA TYR 24 HA TYR 24 -1.365 1.093 -1.592
175 1HB TYR 24 2HB TYR 24 -2.756 3.048 -2.603
176 2HB TYR 24 1HB TYR 24 -1.417 3.197 -3.737
177 HD1 TYR 24 1HD TYR 24 -3.323 0.325 -2.273
178 HD2 TYR 24 2HD TYR 24 -1.900 2.264 -5.782
179 HE1 TYR 24 1HE TYR 24 -4.296 -1.465 -3.649
180 HE2 TYR 24 2HE TYR 24 -2.871 0.480 -7.169
181 HH TYR 24 HH TYR 24 -3.577 -1.829 -6.970
182 H LEU 25 H LEU 25 0.939 3.624 -2.287
183 HA LEU 25 HA LEU 25 2.478 2.192 -4.189
184 1HB LEU 25 2HB LEU 25 2.852 4.632 -2.537
185 2HB LEU 25 1HB LEU 25 4.297 3.873 -3.178
186 HG LEU 25 HG LEU 25 3.481 4.136 -5.449
187 1HD1 LEU 25 1HD1 LEU 25 1.099 5.604 -4.358
188 2HD1 LEU 25 2HD1 LEU 25 1.049 3.888 -4.761
189 3HD1 LEU 25 3HD1 LEU 25 1.403 5.078 -6.013
190 1HD2 LEU 25 1HD2 LEU 25 3.337 6.632 -3.770
191 2HD2 LEU 25 2HD2 LEU 25 3.393 6.631 -5.533
192 3HD2 LEU 25 3HD2 LEU 25 4.745 5.976 -4.606
193 H ALA 26 H ALA 26 3.105 2.894 -0.767
194 HA ALA 26 HA ALA 26 5.302 1.187 -0.507
195 1HB ALA 26 1HB ALA 26 4.233 3.046 1.082
196 2HB ALA 26 2HB ALA 26 5.336 1.804 1.675
197 3HB ALA 26 3HB ALA 26 3.594 1.603 1.869
198 H HIS 27 H HIS 27 1.949 0.538 -0.687
199 HA HIS 27 HA HIS 27 1.937 -1.940 0.724
200 1HB HIS 27 2HB HIS 27 -0.129 -0.702 0.441
201 2HB HIS 27 1HB HIS 27 0.021 -0.778 -1.309
202 HD1 HIS 27 1HD HIS 27 -1.209 -2.704 1.611
203 HD2 HIS 27 2HD HIS 27 -0.500 -3.327 -2.435
204 HE1 HIS 27 1HE HIS 27 -2.403 -4.849 1.003
205 H LYS 28 H LYS 28 1.620 -1.246 -2.768
206 HA LYS 28 HA LYS 28 2.022 -3.916 -3.570
207 1HB LYS 28 2HB LYS 28 2.525 -2.874 -5.825
208 2HB LYS 28 1HB LYS 28 0.969 -2.462 -5.117
209 1HG LYS 28 2HG LYS 28 1.480 -0.287 -4.940
210 2HG LYS 28 1HG LYS 28 3.144 -0.611 -4.454
211 1HD LYS 28 2HD LYS 28 3.180 0.498 -6.580
212 2HD LYS 28 1HD LYS 28 3.656 -1.183 -6.825
213 1HE LYS 28 2HE LYS 28 0.777 -0.691 -7.065
214 2HE LYS 28 1HE LYS 28 1.757 0.142 -8.271
215 1HZ LYS 28 1HZ LYS 28 2.336 -1.781 -9.257
216 2HZ LYS 28 2HZ LYS 28 0.917 -2.362 -8.542
217 3HZ LYS 28 3HZ LYS 28 2.414 -2.650 -7.808
218 H GLN 29 H GLN 29 4.216 -1.538 -2.475
219 HA GLN 29 HA GLN 29 6.540 -2.298 -3.870
220 1HB GLN 29 2HB GLN 29 6.091 -0.942 -1.219
221 2HB GLN 29 1HB GLN 29 7.706 -1.276 -1.829
222 1HG GLN 29 2HG GLN 29 5.902 0.090 -3.707
223 2HG GLN 29 1HG GLN 29 6.358 1.011 -2.274
224 1HE2 GLN 29 1HE2 GLN 29 7.188 2.122 -4.449
225 2HE2 GLN 29 2HE2 GLN 29 8.863 1.841 -4.761
226 H PHE 30 H PHE 30 5.782 -2.986 -0.444
227 HA PHE 30 HA PHE 30 6.795 -5.702 -0.801
228 1HB PHE 30 2HB PHE 30 8.001 -5.189 1.525
229 2HB PHE 30 1HB PHE 30 8.804 -4.972 -0.025
230 HD1 PHE 30 1HD PHE 30 7.216 -3.273 2.808
231 HD2 PHE 30 2HD PHE 30 9.332 -2.784 -0.851
232 HE1 PHE 30 1HE PHE 30 7.623 -0.911 3.363
233 HE2 PHE 30 2HE PHE 30 9.744 -0.421 -0.302
234 HZ PHE 30 HZ PHE 30 8.889 0.518 1.808
235 H TYR 31 H TYR 31 4.252 -4.095 0.036
236 HA TYR 31 HA TYR 31 3.734 -5.575 2.525
237 1HB TYR 31 2HB TYR 31 3.342 -2.884 1.952
238 2HB TYR 31 1HB TYR 31 1.729 -3.580 1.832
239 HD1 TYR 31 1HD TYR 31 4.649 -4.158 4.101
240 HD2 TYR 31 2HD TYR 31 0.516 -3.213 3.753
241 HE1 TYR 31 1HE TYR 31 4.457 -4.117 6.552
242 HE2 TYR 31 2HE TYR 31 0.313 -3.169 6.202
243 HH TYR 31 HH TYR 31 2.554 -4.458 8.257
244 H CYS 32 H CYS 32 3.054 -5.545 -0.770
245 HA CYS 32 HA CYS 32 0.430 -6.786 -0.472
246 1HB CYS 32 2HB CYS 32 0.894 -5.029 -2.227
247 2HB CYS 32 1HB CYS 32 1.926 -6.207 -3.030
248 H LYS 33 H LYS 33 -0.045 -8.823 -1.501
249 HA LYS 33 HA LYS 33 2.219 -10.670 -1.312
250 1HB LYS 33 2HB LYS 33 0.497 -12.436 -1.198
251 2HB LYS 33 1HB LYS 33 0.296 -11.224 0.061
252 1HG LYS 33 2HG LYS 33 -1.822 -11.054 -0.562
253 2HG LYS 33 1HG LYS 33 -1.256 -10.306 -2.056
254 1HD LYS 33 2HD LYS 33 -2.742 -12.158 -2.559
255 2HD LYS 33 1HD LYS 33 -1.102 -12.534 -3.090
256 1HE LYS 33 2HE LYS 33 -1.056 -13.532 -0.577
257 2HE LYS 33 1HE LYS 33 -2.751 -13.779 -0.992
258 1HZ LYS 33 1HZ LYS 33 -1.614 -14.693 -3.191
259 2HZ LYS 33 2HZ LYS 33 -1.907 -15.676 -1.847
260 3HZ LYS 33 3HZ LYS 33 -0.364 -15.029 -2.101
261 H ASN 34 H ASN 34 1.747 -8.928 -3.642
262 HA ASN 34 HA ASN 34 1.574 -11.046 -5.676
263 1HB ASN 34 2HB ASN 34 -0.451 -9.387 -5.470
264 2HB ASN 34 1HB ASN 34 0.628 -8.273 -6.306
265 1HD2 ASN 34 1HD2 ASN 34 1.717 -9.285 -8.274
266 2HD2 ASN 34 2HD2 ASN 34 0.690 -10.203 -9.316
267 H LYS 35 H LYS 35 3.911 -11.037 -5.463
268 HA LYS 35 HA LYS 35 6.002 -10.507 -6.181
269 1HB LYS 35 2HB LYS 35 4.925 -10.476 -8.387
270 2HB LYS 35 1HB LYS 35 4.494 -8.786 -8.159
271 1HG LYS 35 2HG LYS 35 6.576 -8.047 -8.624
272 2HG LYS 35 1HG LYS 35 7.356 -9.452 -7.893
273 1HD LYS 35 2HD LYS 35 5.789 -10.010 -10.320
274 2HD LYS 35 1HD LYS 35 7.213 -8.996 -10.562
275 1HE LYS 35 2HE LYS 35 7.250 -11.637 -9.114
276 2HE LYS 35 1HE LYS 35 7.619 -11.450 -10.828
277 1HZ LYS 35 1HZ LYS 35 9.485 -11.399 -8.989
278 2HZ LYS 35 2HZ LYS 35 9.074 -9.759 -8.941
279 3HZ LYS 35 3HZ LYS 35 9.596 -10.457 -10.390
280 HA PRO 36 HA PRO 36 6.036 -6.644 -3.668
281 1HB PRO 36 2HB PRO 36 8.117 -7.399 -2.098
282 2HB PRO 36 1HB PRO 36 6.445 -7.871 -1.767
283 1HG PRO 36 2HG PRO 36 8.628 -9.434 -3.092
284 2HG PRO 36 1HG PRO 36 7.447 -9.967 -1.881
285 1HD PRO 36 2HD PRO 36 7.164 -10.492 -4.523
286 2HD PRO 36 1HD PRO 36 5.775 -10.235 -3.446
Start of MODEL 12
1 1H GLY 1 1HT GLY 1 -17.551 3.256 -11.032
2 2H GLY 1 2HT GLY 1 -17.634 1.955 -12.108
3 3H GLY 1 3HT GLY 1 -19.042 2.527 -11.364
4 1HA GLY 1 1HA GLY 1 -18.972 3.282 -13.638
5 2HA GLY 1 2HA GLY 1 -18.836 4.637 -12.527
6 H SER 2 H SER 2 -17.618 3.343 -15.292
7 HA SER 2 HA SER 2 -14.842 3.991 -14.951
8 1HB SER 2 2HB SER 2 -16.562 2.996 -17.163
9 2HB SER 2 1HB SER 2 -15.081 3.838 -17.621
10 HG SER 2 HG SER 2 -14.013 2.354 -16.106
11 H ALA 3 H ALA 3 -13.708 5.643 -16.144
12 HA ALA 3 HA ALA 3 -13.336 7.798 -16.772
13 1HB ALA 3 1HB ALA 3 -16.160 7.894 -17.789
14 2HB ALA 3 2HB ALA 3 -14.888 7.008 -18.631
15 3HB ALA 3 3HB ALA 3 -14.742 8.749 -18.394
16 H ALA 4 H ALA 4 -14.407 7.227 -14.126
17 HA ALA 4 HA ALA 4 -15.552 9.876 -13.553
18 1HB ALA 4 1HB ALA 4 -17.100 9.006 -12.007
19 2HB ALA 4 2HB ALA 4 -16.345 7.413 -12.024
20 3HB ALA 4 3HB ALA 4 -17.239 7.981 -13.435
21 H GLU 5 H GLU 5 -13.355 10.486 -13.089
22 HA GLU 5 HA GLU 5 -11.650 10.970 -11.666
23 1HB GLU 5 2HB GLU 5 -13.536 11.341 -10.076
24 2HB GLU 5 1HB GLU 5 -13.375 9.671 -9.552
25 1HG GLU 5 2HG GLU 5 -10.858 10.467 -9.177
26 2HG GLU 5 1HG GLU 5 -11.676 12.016 -8.974
27 H VAL 6 H VAL 6 -9.764 10.047 -10.870
28 HA VAL 6 HA VAL 6 -9.360 7.296 -11.566
29 HB VAL 6 HB VAL 6 -7.428 9.115 -10.130
30 1HG1 VAL 6 1HG1 VAL 6 -6.615 6.918 -10.030
31 2HG1 VAL 6 2HG1 VAL 6 -5.783 7.639 -11.407
32 3HG1 VAL 6 3HG1 VAL 6 -7.148 6.554 -11.671
33 1HG2 VAL 6 1HG2 VAL 6 -6.518 9.440 -12.503
34 2HG2 VAL 6 2HG2 VAL 6 -7.972 10.332 -12.053
35 3HG2 VAL 6 3HG2 VAL 6 -8.100 8.879 -13.045
36 H MET 7 H MET 7 -8.696 5.607 -10.193
37 HA MET 7 HA MET 7 -9.120 6.026 -7.319
38 1HB MET 7 2HB MET 7 -10.219 3.643 -8.812
39 2HB MET 7 1HB MET 7 -10.482 4.060 -7.124
40 1HG MET 7 2HG MET 7 -11.921 5.812 -7.654
41 2HG MET 7 1HG MET 7 -11.362 5.887 -9.324
42 1HE MET 7 1HE MET 7 -13.158 3.157 -11.157
43 2HE MET 7 2HE MET 7 -11.600 3.959 -10.953
44 3HE MET 7 3HE MET 7 -13.053 4.915 -11.249
45 H LYS 8 H LYS 8 -6.699 6.048 -7.668
46 HA LYS 8 HA LYS 8 -5.553 3.378 -7.969
47 1HB LYS 8 2HB LYS 8 -4.192 6.062 -7.666
48 2HB LYS 8 1HB LYS 8 -3.381 4.534 -7.981
49 1HG LYS 8 2HG LYS 8 -5.506 5.258 -9.883
50 2HG LYS 8 1HG LYS 8 -4.079 6.297 -9.890
51 1HD LYS 8 2HD LYS 8 -3.847 3.305 -9.983
52 2HD LYS 8 1HD LYS 8 -4.093 4.257 -11.449
53 1HE LYS 8 2HE LYS 8 -1.821 4.554 -9.487
54 2HE LYS 8 1HE LYS 8 -1.725 3.818 -11.086
55 1HZ LYS 8 1HZ LYS 8 -0.933 5.992 -11.338
56 2HZ LYS 8 2HZ LYS 8 -2.180 6.663 -10.414
57 3HZ LYS 8 3HZ LYS 8 -2.509 6.041 -11.952
58 H LYS 9 H LYS 9 -7.061 3.489 -5.750
59 HA LYS 9 HA LYS 9 -5.064 3.202 -3.650
60 1HB LYS 9 2HB LYS 9 -7.432 5.057 -3.486
61 2HB LYS 9 1HB LYS 9 -6.652 4.412 -2.049
62 1HG LYS 9 2HG LYS 9 -5.548 6.391 -2.245
63 2HG LYS 9 1HG LYS 9 -4.486 5.359 -3.205
64 1HD LYS 9 2HD LYS 9 -4.734 6.929 -4.790
65 2HD LYS 9 1HD LYS 9 -6.302 6.171 -5.070
66 1HE LYS 9 2HE LYS 9 -5.929 8.373 -3.062
67 2HE LYS 9 1HE LYS 9 -6.260 8.705 -4.761
68 1HZ LYS 9 1HZ LYS 9 -8.244 8.625 -3.247
69 2HZ LYS 9 2HZ LYS 9 -7.989 6.958 -3.108
70 3HZ LYS 9 3HZ LYS 9 -8.337 7.636 -4.618
71 H TYR 10 H TYR 10 -6.115 1.092 -4.839
72 HA TYR 10 HA TYR 10 -7.543 -0.217 -2.743
73 1HB TYR 10 2HB TYR 10 -9.269 1.103 -4.244
74 2HB TYR 10 1HB TYR 10 -9.048 -0.267 -5.326
75 HD1 TYR 10 1HD TYR 10 -8.852 -2.542 -3.540
76 HD2 TYR 10 2HD TYR 10 -11.350 0.890 -3.259
77 HE1 TYR 10 1HE TYR 10 -10.478 -3.840 -2.230
78 HE2 TYR 10 2HE TYR 10 -12.983 -0.399 -1.948
79 HH TYR 10 HH TYR 10 -12.484 -2.917 -0.351
80 H CYS 11 H CYS 11 -6.329 -1.998 -2.669
81 HA CYS 11 HA CYS 11 -5.245 -3.169 -5.087
82 1HB CYS 11 2HB CYS 11 -3.940 -2.992 -2.943
83 2HB CYS 11 1HB CYS 11 -5.021 -4.198 -2.253
84 H SER 12 H SER 12 -7.020 -3.974 -6.195
85 HA SER 12 HA SER 12 -9.149 -5.419 -5.196
86 1HB SER 12 2HB SER 12 -9.519 -6.211 -7.435
87 2HB SER 12 1HB SER 12 -8.880 -4.572 -7.552
88 HG SER 12 HG SER 12 -6.881 -5.416 -8.090
89 H THR 13 H THR 13 -5.883 -6.472 -5.837
90 HA THR 13 HA THR 13 -6.369 -9.263 -5.754
91 HB THR 13 HB THR 13 -3.777 -8.001 -4.902
92 HG1 THR 13 1HG THR 13 -3.284 -7.827 -7.134
93 1HG2 THR 13 1HG2 THR 13 -4.314 -10.579 -5.162
94 2HG2 THR 13 2HG2 THR 13 -2.751 -9.891 -5.599
95 3HG2 THR 13 3HG2 THR 13 -3.951 -10.219 -6.849
96 H CYS 14 H CYS 14 -5.658 -6.853 -3.293
97 HA CYS 14 HA CYS 14 -5.576 -8.884 -1.207
98 1HB CYS 14 2HB CYS 14 -4.988 -5.942 -1.315
99 2HB CYS 14 1HB CYS 14 -5.213 -6.755 0.224
100 H ASP 15 H ASP 15 -7.753 -6.595 -2.598
101 HA ASP 15 HA ASP 15 -9.977 -6.238 -2.248
102 1HB ASP 15 2HB ASP 15 -9.744 -8.760 -1.392
103 2HB ASP 15 1HB ASP 15 -10.120 -7.997 0.149
104 H ILE 16 H ILE 16 -8.098 -4.521 -1.178
105 HA ILE 16 HA ILE 16 -9.604 -3.418 1.064
106 HB ILE 16 HB ILE 16 -6.612 -3.491 1.283
107 1HG1 ILE 16 2HG1 ILE 16 -8.541 -5.526 2.427
108 2HG1 ILE 16 1HG1 ILE 16 -7.352 -5.832 1.164
109 1HG2 ILE 16 1HG2 ILE 16 -7.512 -1.899 2.721
110 2HG2 ILE 16 2HG2 ILE 16 -7.310 -3.317 3.750
111 3HG2 ILE 16 3HG2 ILE 16 -8.904 -2.905 3.119
112 1HD1 ILE 16 1HD1 ILE 16 -5.578 -5.732 2.635
113 2HD1 ILE 16 2HD1 ILE 16 -6.832 -6.518 3.594
114 3HD1 ILE 16 3HD1 ILE 16 -6.486 -4.805 3.830
115 H SER 17 H SER 17 -8.948 -1.158 1.543
116 HA SER 17 HA SER 17 -7.771 0.174 -0.804
117 1HB SER 17 2HB SER 17 -9.556 2.034 0.139
118 2HB SER 17 1HB SER 17 -9.852 0.952 -1.222
119 HG SER 17 HG SER 17 -11.325 0.005 -0.078
120 H PHE 18 H PHE 18 -6.825 2.257 -0.386
121 HA PHE 18 HA PHE 18 -6.153 2.727 2.441
122 1HB PHE 18 2HB PHE 18 -4.182 3.082 0.184
123 2HB PHE 18 1HB PHE 18 -3.861 3.116 1.915
124 HD1 PHE 18 1HD PHE 18 -4.962 0.794 3.029
125 HD2 PHE 18 2HD PHE 18 -3.225 1.270 -0.827
126 HE1 PHE 18 1HE PHE 18 -4.428 -1.607 2.978
127 HE2 PHE 18 2HE PHE 18 -2.689 -1.131 -0.885
128 HZ PHE 18 HZ PHE 18 -3.290 -2.573 1.019
129 H ASN 19 H ASN 19 -6.825 4.668 3.041
130 HA ASN 19 HA ASN 19 -7.816 6.633 1.336
131 1HB ASN 19 2HB ASN 19 -8.245 6.398 3.818
132 2HB ASN 19 1HB ASN 19 -6.677 7.152 4.086
133 1HD2 ASN 19 1HD2 ASN 19 -6.359 9.302 3.194
134 2HD2 ASN 19 2HD2 ASN 19 -7.707 10.377 3.097
135 H TYR 20 H TYR 20 -4.584 6.174 2.647
136 HA TYR 20 HA TYR 20 -3.652 8.650 1.420
137 1HB TYR 20 2HB TYR 20 -1.968 6.641 2.909
138 2HB TYR 20 1HB TYR 20 -1.631 8.346 2.630
139 HD1 TYR 20 1HD TYR 20 -3.559 9.955 3.604
140 HD2 TYR 20 2HD TYR 20 -2.655 6.048 5.023
141 HE1 TYR 20 1HE TYR 20 -4.578 10.514 5.771
142 HE2 TYR 20 2HE TYR 20 -3.673 6.594 7.195
143 HH TYR 20 HH TYR 20 -5.437 8.252 8.036
144 H VAL 21 H VAL 21 -2.794 8.716 -0.543
145 HA VAL 21 HA VAL 21 -2.605 6.506 -2.237
146 HB VAL 21 HB VAL 21 -1.037 9.067 -2.545
147 1HG1 VAL 21 1HG1 VAL 21 -0.697 8.499 -4.712
148 2HG1 VAL 21 2HG1 VAL 21 -2.230 7.637 -4.842
149 3HG1 VAL 21 3HG1 VAL 21 -0.850 6.868 -4.057
150 1HG2 VAL 21 1HG2 VAL 21 -3.103 9.685 -3.973
151 2HG2 VAL 21 2HG2 VAL 21 -3.195 9.863 -2.220
152 3HG2 VAL 21 3HG2 VAL 21 -3.935 8.467 -3.005
153 H LYS 22 H LYS 22 -0.165 8.074 -0.227
154 HA LYS 22 HA LYS 22 2.122 6.834 -1.204
155 1HB LYS 22 2HB LYS 22 2.963 7.104 1.208
156 2HB LYS 22 1HB LYS 22 2.475 8.558 0.348
157 1HG LYS 22 2HG LYS 22 0.280 7.349 1.814
158 2HG LYS 22 1HG LYS 22 1.637 7.781 2.853
159 1HD LYS 22 2HD LYS 22 0.371 9.658 0.861
160 2HD LYS 22 1HD LYS 22 -0.066 9.589 2.569
161 1HE LYS 22 2HE LYS 22 2.576 9.840 2.831
162 2HE LYS 22 1HE LYS 22 2.384 10.636 1.269
163 1HZ LYS 22 1HZ LYS 22 0.589 11.392 3.462
164 2HZ LYS 22 2HZ LYS 22 1.165 12.324 2.174
165 3HZ LYS 22 3HZ LYS 22 2.176 11.974 3.483
166 H THR 23 H THR 23 -0.386 5.619 0.893
167 HA THR 23 HA THR 23 0.958 3.328 1.856
168 HB THR 23 HB THR 23 -2.008 3.632 1.386
169 HG1 THR 23 1HG THR 23 -0.375 4.569 3.497
170 1HG2 THR 23 1HG2 THR 23 -0.418 1.947 3.297
171 2HG2 THR 23 2HG2 THR 23 -1.551 1.412 2.055
172 3HG2 THR 23 3HG2 THR 23 -2.143 2.265 3.480
173 H TYR 24 H TYR 24 -1.297 3.792 -0.852
174 HA TYR 24 HA TYR 24 -1.308 1.153 -1.777
175 1HB TYR 24 2HB TYR 24 -2.823 3.088 -2.480
176 2HB TYR 24 1HB TYR 24 -1.523 3.577 -3.560
177 HD1 TYR 24 1HD TYR 24 -3.598 0.586 -2.724
178 HD2 TYR 24 2HD TYR 24 -1.499 2.755 -5.721
179 HE1 TYR 24 1HE TYR 24 -4.432 -0.976 -4.431
180 HE2 TYR 24 2HE TYR 24 -2.329 1.202 -7.436
181 HH TYR 24 HH TYR 24 -4.468 -0.382 -7.608
182 H LEU 25 H LEU 25 0.878 3.821 -2.381
183 HA LEU 25 HA LEU 25 2.345 2.576 -4.466
184 1HB LEU 25 2HB LEU 25 2.698 4.938 -2.712
185 2HB LEU 25 1HB LEU 25 4.155 4.275 -3.429
186 HG LEU 25 HG LEU 25 3.152 6.139 -4.732
187 1HD1 LEU 25 1HD1 LEU 25 3.805 5.248 -6.717
188 2HD1 LEU 25 2HD1 LEU 25 2.888 3.759 -6.480
189 3HD1 LEU 25 3HD1 LEU 25 4.423 3.993 -5.644
190 1HD2 LEU 25 1HD2 LEU 25 0.885 4.178 -4.999
191 2HD2 LEU 25 2HD2 LEU 25 1.127 5.529 -6.107
192 3HD2 LEU 25 3HD2 LEU 25 0.829 5.835 -4.396
193 H ALA 26 H ALA 26 3.144 3.081 -1.045
194 HA ALA 26 HA ALA 26 5.412 1.434 -1.044
195 1HB ALA 26 1HB ALA 26 5.163 1.469 1.432
196 2HB ALA 26 2HB ALA 26 3.627 2.308 1.216
197 3HB ALA 26 3HB ALA 26 5.128 3.067 0.687
198 H HIS 27 H HIS 27 2.078 0.711 -1.053
199 HA HIS 27 HA HIS 27 2.192 -1.813 0.266
200 1HB HIS 27 2HB HIS 27 0.095 -0.560 0.086
201 2HB HIS 27 1HB HIS 27 0.148 -0.698 -1.668
202 HD1 HIS 27 1HD HIS 27 -0.826 -2.563 1.397
203 HD2 HIS 27 2HD HIS 27 -0.422 -3.273 -2.676
204 HE1 HIS 27 1HE HIS 27 -2.016 -4.746 0.935
205 H LYS 28 H LYS 28 1.757 -0.975 -3.180
206 HA LYS 28 HA LYS 28 2.168 -3.624 -4.084
207 1HB LYS 28 2HB LYS 28 2.338 -0.971 -5.516
208 2HB LYS 28 1HB LYS 28 2.480 -2.523 -6.331
209 1HG LYS 28 2HG LYS 28 0.088 -1.652 -4.724
210 2HG LYS 28 1HG LYS 28 0.225 -1.526 -6.479
211 1HD LYS 28 2HD LYS 28 0.540 -3.970 -6.600
212 2HD LYS 28 1HD LYS 28 0.319 -4.065 -4.852
213 1HE LYS 28 2HE LYS 28 -1.685 -3.283 -6.951
214 2HE LYS 28 1HE LYS 28 -1.773 -4.609 -5.792
215 1HZ LYS 28 1HZ LYS 28 -1.885 -1.717 -5.126
216 2HZ LYS 28 2HZ LYS 28 -1.963 -2.985 -4.010
217 3HZ LYS 28 3HZ LYS 28 -3.202 -2.780 -5.141
218 H GLN 29 H GLN 29 4.330 -1.186 -3.054
219 HA GLN 29 HA GLN 29 6.597 -1.824 -4.593
220 1HB GLN 29 2HB GLN 29 6.085 -0.388 -2.042
221 2HB GLN 29 1HB GLN 29 7.732 -0.925 -2.343
222 1HG GLN 29 2HG GLN 29 7.991 0.454 -4.174
223 2HG GLN 29 1HG GLN 29 6.254 0.593 -4.443
224 1HE2 GLN 29 1HE2 GLN 29 5.848 2.694 -4.287
225 2HE2 GLN 29 2HE2 GLN 29 6.283 3.704 -2.954
226 H PHE 30 H PHE 30 5.986 -2.683 -1.175
227 HA PHE 30 HA PHE 30 6.981 -5.361 -1.637
228 1HB PHE 30 2HB PHE 30 8.532 -4.872 0.466
229 2HB PHE 30 1HB PHE 30 9.094 -4.657 -1.187
230 HD1 PHE 30 1HD PHE 30 6.935 -2.540 0.987
231 HD2 PHE 30 2HD PHE 30 10.569 -2.884 -1.202
232 HE1 PHE 30 1HE PHE 30 7.450 -0.186 1.480
233 HE2 PHE 30 2HE PHE 30 11.091 -0.529 -0.712
234 HZ PHE 30 HZ PHE 30 9.529 0.823 0.630
235 H TYR 31 H TYR 31 4.556 -3.873 -0.557
236 HA TYR 31 HA TYR 31 4.451 -5.136 2.098
237 1HB TYR 31 2HB TYR 31 3.771 -2.547 1.317
238 2HB TYR 31 1HB TYR 31 2.225 -3.365 1.513
239 HD1 TYR 31 1HD TYR 31 4.925 -1.742 3.180
240 HD2 TYR 31 2HD TYR 31 1.827 -4.605 3.730
241 HE1 TYR 31 1HE TYR 31 5.084 -1.437 5.615
242 HE2 TYR 31 2HE TYR 31 1.976 -4.307 6.166
243 HH TYR 31 HH TYR 31 4.548 -2.678 7.665
244 H CYS 32 H CYS 32 2.988 -5.030 -1.052
245 HA CYS 32 HA CYS 32 0.584 -6.379 -0.434
246 1HB CYS 32 2HB CYS 32 1.080 -5.098 -2.548
247 2HB CYS 32 1HB CYS 32 2.062 -6.462 -3.068
248 H LYS 33 H LYS 33 0.433 -8.345 0.394
249 HA LYS 33 HA LYS 33 2.470 -10.344 -0.304
250 1HB LYS 33 2HB LYS 33 1.375 -11.582 1.692
251 2HB LYS 33 1HB LYS 33 2.431 -10.215 2.019
252 1HG LYS 33 2HG LYS 33 0.421 -10.175 3.406
253 2HG LYS 33 1HG LYS 33 0.510 -8.772 2.339
254 1HD LYS 33 2HD LYS 33 -1.158 -9.619 0.914
255 2HD LYS 33 1HD LYS 33 -1.026 -11.244 1.590
256 1HE LYS 33 2HE LYS 33 -2.231 -8.793 2.849
257 2HE LYS 33 1HE LYS 33 -3.021 -10.321 2.465
258 1HZ LYS 33 1HZ LYS 33 -2.658 -10.401 4.748
259 2HZ LYS 33 2HZ LYS 33 -1.106 -9.740 4.638
260 3HZ LYS 33 3HZ LYS 33 -1.388 -11.324 4.118
261 H ASN 34 H ASN 34 0.163 -9.572 -1.982
262 HA ASN 34 HA ASN 34 -1.283 -12.140 -2.007
263 1HB ASN 34 2HB ASN 34 -2.165 -9.382 -2.336
264 2HB ASN 34 1HB ASN 34 -2.683 -10.407 -3.671
265 1HD2 ASN 34 1HD2 ASN 34 -2.771 -9.981 -0.196
266 2HD2 ASN 34 2HD2 ASN 34 -4.191 -10.929 0.074
267 H LYS 35 H LYS 35 0.621 -12.995 -3.141
268 HA LYS 35 HA LYS 35 1.648 -13.752 -5.023
269 1HB LYS 35 2HB LYS 35 -0.751 -12.566 -6.428
270 2HB LYS 35 1HB LYS 35 0.380 -13.720 -7.121
271 1HG LYS 35 2HG LYS 35 -0.523 -15.477 -6.027
272 2HG LYS 35 1HG LYS 35 -0.933 -14.521 -4.601
273 1HD LYS 35 2HD LYS 35 -2.890 -13.680 -5.594
274 2HD LYS 35 1HD LYS 35 -2.381 -14.174 -7.211
275 1HE LYS 35 2HE LYS 35 -4.066 -15.698 -6.511
276 2HE LYS 35 1HE LYS 35 -2.525 -16.551 -6.426
277 1HZ LYS 35 1HZ LYS 35 -2.538 -16.529 -4.140
278 2HZ LYS 35 2HZ LYS 35 -4.186 -16.716 -4.472
279 3HZ LYS 35 3HZ LYS 35 -3.579 -15.199 -4.035
280 HA PRO 36 HA PRO 36 4.048 -10.409 -6.596
281 1HB PRO 36 2HB PRO 36 5.071 -11.479 -8.869
282 2HB PRO 36 1HB PRO 36 5.601 -11.971 -7.257
283 1HG PRO 36 2HG PRO 36 3.657 -13.307 -9.102
284 2HG PRO 36 1HG PRO 36 4.942 -14.030 -8.116
285 1HD PRO 36 2HD PRO 36 2.340 -14.055 -7.365
286 2HD PRO 36 1HD PRO 36 3.671 -13.976 -6.194
Start of MODEL 13
1 1H GLY 1 1HT GLY 1 -12.403 13.612 -19.212
2 2H GLY 1 2HT GLY 1 -13.624 12.515 -18.804
3 3H GLY 1 3HT GLY 1 -12.730 12.296 -20.224
4 1HA GLY 1 1HA GLY 1 -10.701 12.018 -18.845
5 2HA GLY 1 2HA GLY 1 -11.750 12.040 -17.436
6 H SER 2 H SER 2 -10.125 10.053 -19.452
7 HA SER 2 HA SER 2 -11.303 7.702 -18.442
8 1HB SER 2 2HB SER 2 -12.412 6.793 -20.353
9 2HB SER 2 1HB SER 2 -13.060 8.419 -20.127
10 HG SER 2 HG SER 2 -12.577 8.328 -22.246
11 H ALA 3 H ALA 3 -10.629 5.822 -20.277
12 HA ALA 3 HA ALA 3 -8.868 4.629 -21.084
13 1HB ALA 3 1HB ALA 3 -7.720 5.605 -22.766
14 2HB ALA 3 2HB ALA 3 -7.262 6.999 -21.789
15 3HB ALA 3 3HB ALA 3 -8.872 6.915 -22.503
16 H ALA 4 H ALA 4 -8.871 5.280 -18.320
17 HA ALA 4 HA ALA 4 -6.238 4.544 -17.623
18 1HB ALA 4 1HB ALA 4 -6.968 7.432 -17.199
19 2HB ALA 4 2HB ALA 4 -5.565 6.773 -18.040
20 3HB ALA 4 3HB ALA 4 -5.695 6.619 -16.288
21 H GLU 5 H GLU 5 -6.887 3.083 -16.168
22 HA GLU 5 HA GLU 5 -9.114 2.957 -14.663
23 1HB GLU 5 2HB GLU 5 -6.360 1.909 -14.288
24 2HB GLU 5 1HB GLU 5 -7.466 1.782 -12.928
25 1HG GLU 5 2HG GLU 5 -8.573 0.906 -15.496
26 2HG GLU 5 1HG GLU 5 -7.220 -0.054 -14.901
27 H VAL 6 H VAL 6 -9.871 4.816 -13.727
28 HA VAL 6 HA VAL 6 -8.232 6.499 -12.091
29 HB VAL 6 HB VAL 6 -10.125 7.428 -13.313
30 1HG1 VAL 6 1HG1 VAL 6 -12.169 6.370 -11.490
31 2HG1 VAL 6 2HG1 VAL 6 -11.484 5.196 -12.614
32 3HG1 VAL 6 3HG1 VAL 6 -12.239 6.667 -13.227
33 1HG2 VAL 6 1HG2 VAL 6 -9.333 8.445 -11.161
34 2HG2 VAL 6 2HG2 VAL 6 -10.683 7.638 -10.363
35 3HG2 VAL 6 3HG2 VAL 6 -10.991 8.846 -11.609
36 H MET 7 H MET 7 -8.703 6.981 -9.830
37 HA MET 7 HA MET 7 -8.892 6.387 -7.642
38 1HB MET 7 2HB MET 7 -11.288 5.819 -8.669
39 2HB MET 7 1HB MET 7 -10.801 4.185 -8.240
40 1HG MET 7 2HG MET 7 -10.260 5.198 -5.931
41 2HG MET 7 1HG MET 7 -11.274 6.538 -6.463
42 1HE MET 7 1HE MET 7 -12.336 2.381 -5.170
43 2HE MET 7 2HE MET 7 -10.807 2.951 -5.840
44 3HE MET 7 3HE MET 7 -12.075 2.362 -6.914
45 H LYS 8 H LYS 8 -6.668 5.541 -8.113
46 HA LYS 8 HA LYS 8 -6.484 2.627 -8.081
47 1HB LYS 8 2HB LYS 8 -4.214 4.617 -8.142
48 2HB LYS 8 1HB LYS 8 -4.143 2.904 -8.533
49 1HG LYS 8 2HG LYS 8 -4.250 3.661 -10.644
50 2HG LYS 8 1HG LYS 8 -5.984 3.710 -10.320
51 1HD LYS 8 2HD LYS 8 -6.044 5.969 -10.274
52 2HD LYS 8 1HD LYS 8 -4.461 6.099 -9.505
53 1HE LYS 8 2HE LYS 8 -4.816 5.302 -12.384
54 2HE LYS 8 1HE LYS 8 -4.643 6.981 -11.874
55 1HZ LYS 8 1HZ LYS 8 -2.668 4.837 -11.304
56 2HZ LYS 8 2HZ LYS 8 -2.495 6.484 -10.960
57 3HZ LYS 8 3HZ LYS 8 -2.533 5.957 -12.566
58 H LYS 9 H LYS 9 -7.635 3.512 -5.820
59 HA LYS 9 HA LYS 9 -5.505 3.187 -3.809
60 1HB LYS 9 2HB LYS 9 -7.156 4.468 -2.282
61 2HB LYS 9 1HB LYS 9 -6.187 5.381 -3.429
62 1HG LYS 9 2HG LYS 9 -8.788 4.494 -4.454
63 2HG LYS 9 1HG LYS 9 -8.864 5.640 -3.114
64 1HD LYS 9 2HD LYS 9 -6.974 6.820 -4.615
65 2HD LYS 9 1HD LYS 9 -7.897 6.011 -5.883
66 1HE LYS 9 2HE LYS 9 -9.956 7.057 -4.991
67 2HE LYS 9 1HE LYS 9 -8.971 7.929 -3.817
68 1HZ LYS 9 1HZ LYS 9 -9.631 9.049 -6.043
69 2HZ LYS 9 2HZ LYS 9 -8.344 8.157 -6.681
70 3HZ LYS 9 3HZ LYS 9 -8.067 9.264 -5.432
71 H TYR 10 H TYR 10 -6.621 0.964 -4.838
72 HA TYR 10 HA TYR 10 -7.817 -0.244 -2.548
73 1HB TYR 10 2HB TYR 10 -9.820 0.807 -3.496
74 2HB TYR 10 1HB TYR 10 -9.512 0.022 -5.041
75 HD1 TYR 10 1HD TYR 10 -10.659 -1.925 -5.505
76 HD2 TYR 10 2HD TYR 10 -9.970 -0.877 -1.440
77 HE1 TYR 10 1HE TYR 10 -11.985 -3.867 -4.785
78 HE2 TYR 10 2HE TYR 10 -11.294 -2.816 -0.709
79 HH TYR 10 HH TYR 10 -13.273 -4.588 -2.808
80 H CYS 11 H CYS 11 -6.538 -1.981 -2.499
81 HA CYS 11 HA CYS 11 -5.695 -3.286 -4.944
82 1HB CYS 11 2HB CYS 11 -4.230 -2.919 -2.877
83 2HB CYS 11 1HB CYS 11 -5.142 -4.226 -2.132
84 H SER 12 H SER 12 -7.603 -4.152 -5.772
85 HA SER 12 HA SER 12 -9.563 -5.571 -4.465
86 1HB SER 12 2HB SER 12 -10.240 -6.388 -6.569
87 2HB SER 12 1HB SER 12 -9.431 -4.866 -6.936
88 HG SER 12 HG SER 12 -7.834 -5.919 -7.871
89 H THR 13 H THR 13 -6.483 -6.783 -5.722
90 HA THR 13 HA THR 13 -6.898 -9.507 -5.303
91 HB THR 13 HB THR 13 -4.207 -8.293 -4.809
92 HG1 THR 13 1HG THR 13 -5.631 -8.277 -7.249
93 1HG2 THR 13 1HG2 THR 13 -5.250 -10.775 -6.076
94 2HG2 THR 13 2HG2 THR 13 -3.957 -10.566 -4.894
95 3HG2 THR 13 3HG2 THR 13 -3.690 -10.126 -6.582
96 H CYS 14 H CYS 14 -5.880 -6.984 -3.071
97 HA CYS 14 HA CYS 14 -5.527 -8.913 -0.920
98 1HB CYS 14 2HB CYS 14 -4.985 -5.972 -1.222
99 2HB CYS 14 1HB CYS 14 -4.961 -6.745 0.355
100 H ASP 15 H ASP 15 -7.856 -6.657 -2.113
101 HA ASP 15 HA ASP 15 -10.020 -6.278 -1.501
102 1HB ASP 15 2HB ASP 15 -9.860 -8.730 -0.696
103 2HB ASP 15 1HB ASP 15 -9.677 -8.040 0.914
104 H ILE 16 H ILE 16 -7.984 -4.544 -0.753
105 HA ILE 16 HA ILE 16 -9.146 -3.382 1.675
106 HB ILE 16 HB ILE 16 -6.176 -3.267 1.251
107 1HG1 ILE 16 2HG1 ILE 16 -6.838 -5.658 1.383
108 2HG1 ILE 16 1HG1 ILE 16 -5.879 -5.143 2.766
109 1HG2 ILE 16 1HG2 ILE 16 -6.599 -1.732 2.855
110 2HG2 ILE 16 2HG2 ILE 16 -6.557 -3.154 3.898
111 3HG2 ILE 16 3HG2 ILE 16 -8.104 -2.505 3.353
112 1HD1 ILE 16 1HD1 ILE 16 -8.694 -4.809 3.277
113 2HD1 ILE 16 2HD1 ILE 16 -7.482 -5.723 4.176
114 3HD1 ILE 16 3HD1 ILE 16 -8.315 -6.467 2.812
115 H SER 17 H SER 17 -8.561 -1.068 1.935
116 HA SER 17 HA SER 17 -7.945 0.242 -0.626
117 1HB SER 17 2HB SER 17 -10.476 0.136 0.203
118 2HB SER 17 1HB SER 17 -9.956 1.512 1.175
119 HG SER 17 HG SER 17 -9.482 1.359 -1.609
120 H PHE 18 H PHE 18 -7.050 2.358 -0.453
121 HA PHE 18 HA PHE 18 -6.203 3.201 2.217
122 1HB PHE 18 2HB PHE 18 -4.239 3.046 -0.067
123 2HB PHE 18 1HB PHE 18 -3.903 3.375 1.629
124 HD1 PHE 18 1HD PHE 18 -3.677 1.607 3.213
125 HD2 PHE 18 2HD PHE 18 -4.800 0.775 -0.806
126 HE1 PHE 18 1HE PHE 18 -3.252 -0.786 3.594
127 HE2 PHE 18 2HE PHE 18 -4.378 -1.620 -0.433
128 HZ PHE 18 HZ PHE 18 -3.603 -2.403 1.770
129 H ASN 19 H ASN 19 -7.017 5.184 2.378
130 HA ASN 19 HA ASN 19 -7.752 6.849 0.269
131 1HB ASN 19 2HB ASN 19 -7.347 7.200 3.193
132 2HB ASN 19 1HB ASN 19 -7.420 8.661 2.212
133 1HD2 ASN 19 1HD2 ASN 19 -9.321 8.556 3.947
134 2HD2 ASN 19 2HD2 ASN 19 -10.833 8.069 3.269
135 H TYR 20 H TYR 20 -4.734 6.669 2.087
136 HA TYR 20 HA TYR 20 -3.601 8.929 0.675
137 1HB TYR 20 2HB TYR 20 -2.129 7.006 2.472
138 2HB TYR 20 1HB TYR 20 -1.694 8.665 2.074
139 HD1 TYR 20 1HD TYR 20 -4.189 10.115 2.514
140 HD2 TYR 20 2HD TYR 20 -2.457 6.950 4.770
141 HE1 TYR 20 1HE TYR 20 -5.366 10.909 4.522
142 HE2 TYR 20 2HE TYR 20 -3.630 7.735 6.783
143 HH TYR 20 HH TYR 20 -5.127 10.765 6.975
144 H VAL 21 H VAL 21 -2.510 8.828 -1.170
145 HA VAL 21 HA VAL 21 -2.259 6.468 -2.664
146 HB VAL 21 HB VAL 21 -0.622 8.974 -3.056
147 1HG1 VAL 21 1HG1 VAL 21 -1.636 7.424 -5.344
148 2HG1 VAL 21 2HG1 VAL 21 -0.412 6.620 -4.362
149 3HG1 VAL 21 3HG1 VAL 21 -0.066 8.187 -5.093
150 1HG2 VAL 21 1HG2 VAL 21 -2.803 9.799 -2.963
151 2HG2 VAL 21 2HG2 VAL 21 -3.477 8.368 -3.742
152 3HG2 VAL 21 3HG2 VAL 21 -2.534 9.523 -4.684
153 H LYS 22 H LYS 22 0.013 8.157 -0.566
154 HA LYS 22 HA LYS 22 2.366 6.839 -1.236
155 1HB LYS 22 2HB LYS 22 1.531 7.714 1.534
156 2HB LYS 22 1HB LYS 22 3.176 7.445 0.976
157 1HG LYS 22 2HG LYS 22 1.582 9.399 -0.555
158 2HG LYS 22 1HG LYS 22 2.028 9.859 1.090
159 1HD LYS 22 2HD LYS 22 4.170 8.681 -0.571
160 2HD LYS 22 1HD LYS 22 3.603 10.284 -1.045
161 1HE LYS 22 2HE LYS 22 4.485 9.547 1.743
162 2HE LYS 22 1HE LYS 22 5.528 10.306 0.540
163 1HZ LYS 22 1HZ LYS 22 4.102 11.676 2.306
164 2HZ LYS 22 2HZ LYS 22 2.985 11.622 1.038
165 3HZ LYS 22 3HZ LYS 22 4.518 12.288 0.784
166 H THR 23 H THR 23 -0.281 5.831 0.839
167 HA THR 23 HA THR 23 0.966 3.572 1.978
168 HB THR 23 HB THR 23 -1.980 3.802 1.404
169 HG1 THR 23 1HG THR 23 -0.500 5.051 3.473
170 1HG2 THR 23 1HG2 THR 23 -0.398 2.500 3.597
171 2HG2 THR 23 2HG2 THR 23 -1.477 1.735 2.431
172 3HG2 THR 23 3HG2 THR 23 -2.137 2.783 3.687
173 H TYR 24 H TYR 24 -1.154 3.929 -0.851
174 HA TYR 24 HA TYR 24 -1.203 1.219 -1.584
175 1HB TYR 24 2HB TYR 24 -2.600 3.251 -2.457
176 2HB TYR 24 1HB TYR 24 -1.301 3.409 -3.634
177 HD1 TYR 24 1HD TYR 24 -3.379 0.641 -2.203
178 HD2 TYR 24 2HD TYR 24 -1.716 2.444 -5.679
179 HE1 TYR 24 1HE TYR 24 -4.444 -1.081 -3.598
180 HE2 TYR 24 2HE TYR 24 -2.776 0.728 -7.084
181 HH TYR 24 HH TYR 24 -3.737 -2.042 -6.197
182 H LEU 25 H LEU 25 1.103 3.771 -2.185
183 HA LEU 25 HA LEU 25 2.582 2.448 -4.209
184 1HB LEU 25 2HB LEU 25 2.999 4.782 -2.431
185 2HB LEU 25 1HB LEU 25 4.441 4.043 -3.102
186 HG LEU 25 HG LEU 25 3.450 4.341 -5.384
187 1HD1 LEU 25 1HD1 LEU 25 1.099 4.695 -4.145
188 2HD1 LEU 25 2HD1 LEU 25 1.452 5.325 -5.755
189 3HD1 LEU 25 3HD1 LEU 25 1.584 6.379 -4.346
190 1HD2 LEU 25 1HD2 LEU 25 4.967 6.006 -3.986
191 2HD2 LEU 25 2HD2 LEU 25 3.549 7.041 -4.156
192 3HD2 LEU 25 3HD2 LEU 25 4.361 6.417 -5.592
193 H ALA 26 H ALA 26 3.369 2.969 -0.788
194 HA ALA 26 HA ALA 26 5.508 1.177 -0.701
195 1HB ALA 26 1HB ALA 26 3.787 1.774 1.678
196 2HB ALA 26 2HB ALA 26 4.859 2.992 0.986
197 3HB ALA 26 3HB ALA 26 5.526 1.486 1.617
198 H HIS 27 H HIS 27 2.129 0.652 -0.742
199 HA HIS 27 HA HIS 27 2.037 -1.848 0.591
200 1HB HIS 27 2HB HIS 27 0.018 -0.533 0.284
201 2HB HIS 27 1HB HIS 27 0.187 -0.622 -1.465
202 HD1 HIS 27 1HD HIS 27 -1.233 -2.431 1.416
203 HD2 HIS 27 2HD HIS 27 -0.308 -3.220 -2.556
204 HE1 HIS 27 1HE HIS 27 -2.462 -4.557 0.810
205 H LYS 28 H LYS 28 1.897 -1.068 -2.891
206 HA LYS 28 HA LYS 28 2.184 -3.757 -3.722
207 1HB LYS 28 2HB LYS 28 2.868 -1.278 -5.307
208 2HB LYS 28 1HB LYS 28 2.477 -2.867 -5.948
209 1HG LYS 28 2HG LYS 28 0.253 -2.580 -5.684
210 2HG LYS 28 1HG LYS 28 0.440 -1.619 -4.216
211 1HD LYS 28 2HD LYS 28 -0.444 -0.246 -6.013
212 2HD LYS 28 1HD LYS 28 1.181 0.288 -5.580
213 1HE LYS 28 2HE LYS 28 0.991 -1.736 -7.721
214 2HE LYS 28 1HE LYS 28 0.377 -0.130 -8.110
215 1HZ LYS 28 1HZ LYS 28 2.532 0.196 -8.642
216 2HZ LYS 28 2HZ LYS 28 3.107 -1.000 -7.593
217 3HZ LYS 28 3HZ LYS 28 2.680 0.520 -6.987
218 H GLN 29 H GLN 29 4.431 -1.510 -2.509
219 HA GLN 29 HA GLN 29 6.751 -2.336 -3.899
220 1HB GLN 29 2HB GLN 29 6.302 -0.941 -1.272
221 2HB GLN 29 1HB GLN 29 7.917 -1.360 -1.826
222 1HG GLN 29 2HG GLN 29 6.302 0.037 -3.818
223 2HG GLN 29 1HG GLN 29 6.619 0.973 -2.358
224 1HE2 GLN 29 1HE2 GLN 29 8.140 2.370 -2.950
225 2HE2 GLN 29 2HE2 GLN 29 9.653 1.957 -3.674
226 H PHE 30 H PHE 30 5.870 -3.002 -0.500
227 HA PHE 30 HA PHE 30 6.769 -5.754 -0.819
228 1HB PHE 30 2HB PHE 30 8.010 -5.290 1.491
229 2HB PHE 30 1HB PHE 30 8.817 -5.112 -0.061
230 HD1 PHE 30 1HD PHE 30 6.473 -2.933 1.856
231 HD2 PHE 30 2HD PHE 30 10.292 -3.355 0.028
232 HE1 PHE 30 1HE PHE 30 6.989 -0.591 2.406
233 HE2 PHE 30 2HE PHE 30 10.817 -1.014 0.576
234 HZ PHE 30 HZ PHE 30 9.163 0.372 1.765
235 H TYR 31 H TYR 31 4.298 -4.064 -0.045
236 HA TYR 31 HA TYR 31 3.708 -5.469 2.474
237 1HB TYR 31 2HB TYR 31 3.456 -2.751 1.850
238 2HB TYR 31 1HB TYR 31 1.811 -3.377 1.838
239 HD1 TYR 31 1HD TYR 31 4.220 -1.912 3.850
240 HD2 TYR 31 2HD TYR 31 1.337 -5.039 3.917
241 HE1 TYR 31 1HE TYR 31 4.170 -1.805 6.306
242 HE2 TYR 31 2HE TYR 31 1.279 -4.941 6.373
243 HH TYR 31 HH TYR 31 3.587 -3.240 8.201
244 H CYS 32 H CYS 32 3.105 -5.572 -0.788
245 HA CYS 32 HA CYS 32 0.346 -6.480 -0.539
246 1HB CYS 32 2HB CYS 32 1.101 -4.966 -2.413
247 2HB CYS 32 1HB CYS 32 2.030 -6.322 -3.041
248 H LYS 33 H LYS 33 -0.329 -8.543 -1.341
249 HA LYS 33 HA LYS 33 1.694 -10.607 -0.889
250 1HB LYS 33 2HB LYS 33 -0.180 -12.138 -0.595
251 2HB LYS 33 1HB LYS 33 -0.369 -10.728 0.439
252 1HG LYS 33 2HG LYS 33 -2.223 -10.023 -0.629
253 2HG LYS 33 1HG LYS 33 -1.653 -10.565 -2.208
254 1HD LYS 33 2HD LYS 33 -3.591 -11.860 -1.499
255 2HD LYS 33 1HD LYS 33 -2.157 -12.883 -1.586
256 1HE LYS 33 2HE LYS 33 -2.038 -12.061 0.990
257 2HE LYS 33 1HE LYS 33 -3.783 -12.087 0.735
258 1HZ LYS 33 1HZ LYS 33 -1.970 -14.365 0.153
259 2HZ LYS 33 2HZ LYS 33 -3.659 -14.373 0.074
260 3HZ LYS 33 3HZ LYS 33 -2.884 -14.207 1.568
261 H ASN 34 H ASN 34 1.546 -9.094 -3.391
262 HA ASN 34 HA ASN 34 1.441 -11.375 -5.194
263 1HB ASN 34 2HB ASN 34 -0.812 -10.033 -5.136
264 2HB ASN 34 1HB ASN 34 0.081 -8.866 -6.107
265 1HD2 ASN 34 1HD2 ASN 34 -1.920 -11.449 -6.251
266 2HD2 ASN 34 2HD2 ASN 34 -1.544 -12.026 -7.835
267 H LYS 35 H LYS 35 3.653 -11.219 -5.444
268 HA LYS 35 HA LYS 35 4.554 -9.270 -7.343
269 1HB LYS 35 2HB LYS 35 6.381 -8.360 -5.966
270 2HB LYS 35 1HB LYS 35 4.801 -7.945 -5.315
271 1HG LYS 35 2HG LYS 35 6.278 -10.335 -4.295
272 2HG LYS 35 1HG LYS 35 6.663 -8.716 -3.708
273 1HD LYS 35 2HD LYS 35 4.156 -8.481 -3.258
274 2HD LYS 35 1HD LYS 35 4.077 -10.231 -3.479
275 1HE LYS 35 2HE LYS 35 6.185 -9.958 -1.757
276 2HE LYS 35 1HE LYS 35 5.114 -8.656 -1.239
277 1HZ LYS 35 1HZ LYS 35 3.583 -10.099 -0.483
278 2HZ LYS 35 2HZ LYS 35 4.896 -11.162 -0.389
279 3HZ LYS 35 3HZ LYS 35 3.849 -11.227 -1.716
280 HA PRO 36 HA PRO 36 6.769 -13.419 -7.107
281 1HB PRO 36 2HB PRO 36 5.681 -14.621 -9.255
282 2HB PRO 36 1HB PRO 36 4.916 -14.679 -7.663
283 1HG PRO 36 2HG PRO 36 4.278 -12.935 -10.009
284 2HG PRO 36 1HG PRO 36 3.173 -13.779 -8.909
285 1HD PRO 36 2HD PRO 36 3.780 -11.121 -8.700
286 2HD PRO 36 1HD PRO 36 3.297 -12.129 -7.322
Start of MODEL 14
1 1H GLY 1 1HT GLY 1 -14.108 8.750 -11.706
2 2H GLY 1 2HT GLY 1 -15.108 8.033 -10.545
3 3H GLY 1 3HT GLY 1 -14.392 9.532 -10.233
4 1HA GLY 1 1HA GLY 1 -15.659 10.473 -12.136
5 2HA GLY 1 2HA GLY 1 -16.507 8.937 -12.226
6 H SER 2 H SER 2 -17.197 8.242 -9.814
7 HA SER 2 HA SER 2 -19.287 9.971 -9.112
8 1HB SER 2 2HB SER 2 -19.573 7.696 -8.546
9 2HB SER 2 1HB SER 2 -18.022 7.622 -7.709
10 HG SER 2 HG SER 2 -18.990 8.252 -5.964
11 H ALA 3 H ALA 3 -19.620 11.264 -7.266
12 HA ALA 3 HA ALA 3 -17.232 12.644 -6.381
13 1HB ALA 3 1HB ALA 3 -18.755 14.260 -5.403
14 2HB ALA 3 2HB ALA 3 -20.125 13.196 -5.729
15 3HB ALA 3 3HB ALA 3 -19.223 13.909 -7.068
16 H ALA 4 H ALA 4 -16.950 10.222 -5.373
17 HA ALA 4 HA ALA 4 -17.219 10.659 -2.517
18 1HB ALA 4 1HB ALA 4 -18.756 8.610 -3.993
19 2HB ALA 4 2HB ALA 4 -19.140 9.460 -2.496
20 3HB ALA 4 3HB ALA 4 -18.011 8.105 -2.476
21 H GLU 5 H GLU 5 -14.930 10.834 -2.685
22 HA GLU 5 HA GLU 5 -12.807 10.054 -2.460
23 1HB GLU 5 2HB GLU 5 -13.912 8.472 -0.877
24 2HB GLU 5 1HB GLU 5 -14.089 7.330 -2.202
25 1HG GLU 5 2HG GLU 5 -11.425 7.900 -2.303
26 2HG GLU 5 1HG GLU 5 -11.756 7.978 -0.573
27 H VAL 6 H VAL 6 -11.318 9.838 -3.997
28 HA VAL 6 HA VAL 6 -11.981 9.099 -6.632
29 HB VAL 6 HB VAL 6 -9.198 9.228 -5.475
30 1HG1 VAL 6 1HG1 VAL 6 -10.302 9.498 -8.262
31 2HG1 VAL 6 2HG1 VAL 6 -9.162 8.296 -7.658
32 3HG1 VAL 6 3HG1 VAL 6 -8.664 9.981 -7.815
33 1HG2 VAL 6 1HG2 VAL 6 -11.165 11.352 -6.046
34 2HG2 VAL 6 2HG2 VAL 6 -9.524 11.635 -6.624
35 3HG2 VAL 6 3HG2 VAL 6 -9.814 11.329 -4.912
36 H MET 7 H MET 7 -11.005 7.372 -7.909
37 HA MET 7 HA MET 7 -10.810 4.892 -6.348
38 1HB MET 7 2HB MET 7 -11.668 5.443 -9.183
39 2HB MET 7 1HB MET 7 -11.254 3.822 -8.642
40 1HG MET 7 2HG MET 7 -13.458 3.711 -8.229
41 2HG MET 7 1HG MET 7 -12.991 4.493 -6.721
42 1HE MET 7 1HE MET 7 -13.964 6.165 -10.554
43 2HE MET 7 2HE MET 7 -15.618 5.860 -10.021
44 3HE MET 7 3HE MET 7 -14.441 4.547 -10.040
45 H LYS 8 H LYS 8 -8.568 5.943 -6.033
46 HA LYS 8 HA LYS 8 -6.764 4.573 -7.882
47 1HB LYS 8 2HB LYS 8 -5.227 6.485 -7.933
48 2HB LYS 8 1HB LYS 8 -6.790 6.906 -8.623
49 1HG LYS 8 2HG LYS 8 -7.405 8.146 -6.699
50 2HG LYS 8 1HG LYS 8 -6.033 7.523 -5.781
51 1HD LYS 8 2HD LYS 8 -4.585 8.989 -6.704
52 2HD LYS 8 1HD LYS 8 -5.351 8.901 -8.292
53 1HE LYS 8 2HE LYS 8 -6.766 10.618 -7.854
54 2HE LYS 8 1HE LYS 8 -6.908 10.207 -6.146
55 1HZ LYS 8 1HZ LYS 8 -4.975 11.339 -5.628
56 2HZ LYS 8 2HZ LYS 8 -5.672 12.339 -6.799
57 3HZ LYS 8 3HZ LYS 8 -4.394 11.314 -7.217
58 H LYS 9 H LYS 9 -7.531 3.579 -5.497
59 HA LYS 9 HA LYS 9 -5.097 3.127 -4.173
60 1HB LYS 9 2HB LYS 9 -5.839 4.161 -1.936
61 2HB LYS 9 1HB LYS 9 -5.167 5.233 -3.157
62 1HG LYS 9 2HG LYS 9 -8.072 4.933 -3.307
63 2HG LYS 9 1HG LYS 9 -7.494 5.648 -1.802
64 1HD LYS 9 2HD LYS 9 -6.008 7.042 -3.533
65 2HD LYS 9 1HD LYS 9 -7.391 6.693 -4.571
66 1HE LYS 9 2HE LYS 9 -7.922 8.736 -3.558
67 2HE LYS 9 1HE LYS 9 -8.831 7.537 -2.637
68 1HZ LYS 9 1HZ LYS 9 -7.305 9.395 -1.514
69 2HZ LYS 9 2HZ LYS 9 -6.168 8.151 -1.650
70 3HZ LYS 9 3HZ LYS 9 -7.606 7.892 -0.799
71 H TYR 10 H TYR 10 -6.189 1.088 -4.791
72 HA TYR 10 HA TYR 10 -7.392 -0.115 -2.501
73 1HB TYR 10 2HB TYR 10 -9.387 0.962 -3.437
74 2HB TYR 10 1HB TYR 10 -9.092 0.182 -4.986
75 HD1 TYR 10 1HD TYR 10 -9.084 -2.403 -5.004
76 HD2 TYR 10 2HD TYR 10 -10.730 -0.080 -1.843
77 HE1 TYR 10 1HE TYR 10 -10.425 -4.336 -4.291
78 HE2 TYR 10 2HE TYR 10 -12.076 -2.006 -1.121
79 HH TYR 10 HH TYR 10 -12.079 -4.423 -1.302
80 H CYS 11 H CYS 11 -6.493 -2.054 -2.411
81 HA CYS 11 HA CYS 11 -5.370 -3.260 -4.794
82 1HB CYS 11 2HB CYS 11 -4.263 -3.186 -2.475
83 2HB CYS 11 1HB CYS 11 -5.379 -4.474 -2.035
84 H SER 12 H SER 12 -6.673 -4.383 -6.082
85 HA SER 12 HA SER 12 -9.148 -5.483 -5.305
86 1HB SER 12 2HB SER 12 -8.087 -4.888 -7.688
87 2HB SER 12 1HB SER 12 -7.750 -6.619 -7.674
88 HG SER 12 HG SER 12 -10.270 -5.347 -7.405
89 H THR 13 H THR 13 -5.914 -6.826 -5.491
90 HA THR 13 HA THR 13 -6.666 -9.549 -5.224
91 HB THR 13 HB THR 13 -4.053 -8.214 -4.491
92 HG1 THR 13 1HG THR 13 -3.525 -8.373 -6.542
93 1HG2 THR 13 1HG2 THR 13 -3.364 -10.205 -3.831
94 2HG2 THR 13 2HG2 THR 13 -3.600 -10.781 -5.481
95 3HG2 THR 13 3HG2 THR 13 -4.895 -10.946 -4.295
96 H CYS 14 H CYS 14 -5.382 -7.205 -2.863
97 HA CYS 14 HA CYS 14 -5.774 -8.963 -0.650
98 1HB CYS 14 2HB CYS 14 -5.129 -6.021 -0.848
99 2HB CYS 14 1HB CYS 14 -5.238 -6.887 0.675
100 H ASP 15 H ASP 15 -7.663 -6.521 -2.247
101 HA ASP 15 HA ASP 15 -9.870 -5.977 -2.061
102 1HB ASP 15 2HB ASP 15 -9.963 -8.492 -1.251
103 2HB ASP 15 1HB ASP 15 -10.273 -7.748 0.314
104 H ILE 16 H ILE 16 -8.163 -4.243 -1.040
105 HA ILE 16 HA ILE 16 -9.615 -3.154 1.238
106 HB ILE 16 HB ILE 16 -6.617 -3.181 1.386
107 1HG1 ILE 16 2HG1 ILE 16 -8.477 -5.218 2.634
108 2HG1 ILE 16 1HG1 ILE 16 -7.365 -5.536 1.306
109 1HG2 ILE 16 1HG2 ILE 16 -8.869 -2.356 3.095
110 2HG2 ILE 16 2HG2 ILE 16 -7.245 -1.684 2.950
111 3HG2 ILE 16 3HG2 ILE 16 -7.517 -3.133 3.918
112 1HD1 ILE 16 1HD1 ILE 16 -6.217 -6.332 3.137
113 2HD1 ILE 16 2HD1 ILE 16 -6.774 -5.027 4.185
114 3HD1 ILE 16 3HD1 ILE 16 -5.552 -4.708 2.954
115 H SER 17 H SER 17 -8.983 -0.880 1.680
116 HA SER 17 HA SER 17 -7.923 0.447 -0.726
117 1HB SER 17 2HB SER 17 -9.752 2.189 0.608
118 2HB SER 17 1HB SER 17 -9.868 1.516 -1.017
119 HG SER 17 HG SER 17 -11.572 1.032 0.697
120 H PHE 18 H PHE 18 -7.041 2.603 -0.346
121 HA PHE 18 HA PHE 18 -6.168 3.055 2.423
122 1HB PHE 18 2HB PHE 18 -4.345 3.302 0.024
123 2HB PHE 18 1HB PHE 18 -3.905 3.501 1.717
124 HD1 PHE 18 1HD PHE 18 -5.213 1.193 2.960
125 HD2 PHE 18 2HD PHE 18 -3.104 1.500 -0.722
126 HE1 PHE 18 1HE PHE 18 -4.643 -1.196 3.093
127 HE2 PHE 18 2HE PHE 18 -2.530 -0.889 -0.597
128 HZ PHE 18 HZ PHE 18 -3.301 -2.241 1.311
129 H ASN 19 H ASN 19 -6.668 5.038 3.064
130 HA ASN 19 HA ASN 19 -7.805 6.986 1.419
131 1HB ASN 19 2HB ASN 19 -7.811 6.704 4.025
132 2HB ASN 19 1HB ASN 19 -6.397 7.751 3.953
133 1HD2 ASN 19 1HD2 ASN 19 -9.545 7.625 2.310
134 2HD2 ASN 19 2HD2 ASN 19 -9.957 9.276 2.612
135 H TYR 20 H TYR 20 -4.473 6.443 2.367
136 HA TYR 20 HA TYR 20 -3.639 8.866 0.940
137 1HB TYR 20 2HB TYR 20 -1.901 7.024 2.583
138 2HB TYR 20 1HB TYR 20 -1.530 8.661 2.052
139 HD1 TYR 20 1HD TYR 20 -2.498 10.587 3.182
140 HD2 TYR 20 2HD TYR 20 -3.369 6.628 4.475
141 HE1 TYR 20 1HE TYR 20 -3.396 11.479 5.291
142 HE2 TYR 20 2HE TYR 20 -4.270 7.509 6.586
143 HH TYR 20 HH TYR 20 -5.264 9.676 7.402
144 H VAL 21 H VAL 21 -2.806 8.758 -1.036
145 HA VAL 21 HA VAL 21 -2.698 6.398 -2.527
146 HB VAL 21 HB VAL 21 -1.125 8.906 -3.123
147 1HG1 VAL 21 1HG1 VAL 21 -2.400 7.098 -5.136
148 2HG1 VAL 21 2HG1 VAL 21 -0.829 6.694 -4.443
149 3HG1 VAL 21 3HG1 VAL 21 -1.040 8.204 -5.328
150 1HG2 VAL 21 1HG2 VAL 21 -3.254 9.375 -4.545
151 2HG2 VAL 21 2HG2 VAL 21 -3.247 9.775 -2.828
152 3HG2 VAL 21 3HG2 VAL 21 -4.042 8.304 -3.387
153 H LYS 22 H LYS 22 -0.195 8.117 -0.737
154 HA LYS 22 HA LYS 22 2.063 6.786 -1.666
155 1HB LYS 22 2HB LYS 22 1.498 7.799 1.128
156 2HB LYS 22 1HB LYS 22 3.087 7.364 0.514
157 1HG LYS 22 2HG LYS 22 3.296 9.264 -0.688
158 2HG LYS 22 1HG LYS 22 1.573 9.348 -1.061
159 1HD LYS 22 2HD LYS 22 2.712 9.914 1.670
160 2HD LYS 22 1HD LYS 22 2.442 11.163 0.452
161 1HE LYS 22 2HE LYS 22 0.032 10.188 0.375
162 2HE LYS 22 1HE LYS 22 0.449 9.507 1.947
163 1HZ LYS 22 1HZ LYS 22 -0.596 11.925 1.633
164 2HZ LYS 22 2HZ LYS 22 1.047 12.326 1.581
165 3HZ LYS 22 3HZ LYS 22 0.417 11.519 2.927
166 H THR 23 H THR 23 -0.401 5.761 0.578
167 HA THR 23 HA THR 23 0.964 3.560 1.707
168 HB THR 23 HB THR 23 -2.013 3.795 1.282
169 HG1 THR 23 1HG THR 23 -2.091 5.022 3.106
170 1HG2 THR 23 1HG2 THR 23 -0.719 1.718 2.363
171 2HG2 THR 23 2HG2 THR 23 -2.319 2.248 2.882
172 3HG2 THR 23 3HG2 THR 23 -0.891 2.741 3.790
173 H TYR 24 H TYR 24 -1.339 3.796 -0.992
174 HA TYR 24 HA TYR 24 -1.376 1.085 -1.679
175 1HB TYR 24 2HB TYR 24 -2.831 3.069 -2.534
176 2HB TYR 24 1HB TYR 24 -1.576 3.248 -3.755
177 HD1 TYR 24 1HD TYR 24 -3.133 0.201 -2.257
178 HD2 TYR 24 2HD TYR 24 -2.455 2.509 -5.765
179 HE1 TYR 24 1HE TYR 24 -4.207 -1.550 -3.609
180 HE2 TYR 24 2HE TYR 24 -3.528 0.766 -7.127
181 HH TYR 24 HH TYR 24 -5.188 -1.076 -6.787
182 H LEU 25 H LEU 25 0.875 3.642 -2.457
183 HA LEU 25 HA LEU 25 2.285 2.237 -4.487
184 1HB LEU 25 2HB LEU 25 2.293 4.784 -3.773
185 2HB LEU 25 1HB LEU 25 3.639 4.270 -2.776
186 HG LEU 25 HG LEU 25 3.631 3.619 -5.697
187 1HD1 LEU 25 1HD1 LEU 25 4.273 5.690 -6.375
188 2HD1 LEU 25 2HD1 LEU 25 4.947 6.119 -4.802
189 3HD1 LEU 25 3HD1 LEU 25 3.201 6.158 -5.053
190 1HD2 LEU 25 1HD2 LEU 25 5.296 2.716 -3.987
191 2HD2 LEU 25 2HD2 LEU 25 5.930 4.360 -3.913
192 3HD2 LEU 25 3HD2 LEU 25 5.956 3.472 -5.436
193 H ALA 26 H ALA 26 3.141 2.948 -1.118
194 HA ALA 26 HA ALA 26 5.354 1.236 -1.022
195 1HB ALA 26 1HB ALA 26 3.699 1.966 1.371
196 2HB ALA 26 2HB ALA 26 4.762 3.126 0.574
197 3HB ALA 26 3HB ALA 26 5.434 1.659 1.286
198 H HIS 27 H HIS 27 2.000 0.605 -0.942
199 HA HIS 27 HA HIS 27 2.044 -1.811 0.557
200 1HB HIS 27 2HB HIS 27 -0.030 -0.574 0.278
201 2HB HIS 27 1HB HIS 27 0.057 -0.759 -1.470
202 HD1 HIS 27 1HD HIS 27 -1.032 -2.518 1.616
203 HD2 HIS 27 2HD HIS 27 -0.537 -3.352 -2.423
204 HE1 HIS 27 1HE HIS 27 -2.250 -4.692 1.186
205 H LYS 28 H LYS 28 1.747 -1.215 -2.951
206 HA LYS 28 HA LYS 28 2.075 -3.944 -3.646
207 1HB LYS 28 2HB LYS 28 2.056 -1.355 -5.127
208 2HB LYS 28 1HB LYS 28 2.716 -2.769 -5.940
209 1HG LYS 28 2HG LYS 28 0.024 -2.871 -4.639
210 2HG LYS 28 1HG LYS 28 0.229 -2.196 -6.256
211 1HD LYS 28 2HD LYS 28 0.831 -4.224 -7.172
212 2HD LYS 28 1HD LYS 28 1.404 -4.867 -5.631
213 1HE LYS 28 2HE LYS 28 -0.540 -6.030 -5.775
214 2HE LYS 28 1HE LYS 28 -1.168 -4.571 -5.011
215 1HZ LYS 28 1HZ LYS 28 -2.615 -4.771 -6.732
216 2HZ LYS 28 2HZ LYS 28 -1.496 -5.520 -7.757
217 3HZ LYS 28 3HZ LYS 28 -1.427 -3.848 -7.510
218 H GLN 29 H GLN 29 4.288 -1.579 -2.634
219 HA GLN 29 HA GLN 29 6.576 -2.385 -4.094
220 1HB GLN 29 2HB GLN 29 6.059 -0.747 -1.662
221 2HB GLN 29 1HB GLN 29 7.695 -1.340 -1.913
222 1HG GLN 29 2HG GLN 29 6.094 0.375 -3.798
223 2HG GLN 29 1HG GLN 29 7.474 0.877 -2.821
224 1HE2 GLN 29 1HE2 GLN 29 6.423 -0.810 -5.649
225 2HE2 GLN 29 2HE2 GLN 29 7.983 -1.030 -6.357
226 H PHE 30 H PHE 30 5.863 -2.919 -0.631
227 HA PHE 30 HA PHE 30 6.856 -5.649 -0.866
228 1HB PHE 30 2HB PHE 30 8.165 -5.035 1.370
229 2HB PHE 30 1HB PHE 30 8.903 -4.896 -0.220
230 HD1 PHE 30 1HD PHE 30 6.863 -2.864 2.153
231 HD2 PHE 30 2HD PHE 30 10.000 -2.942 -0.722
232 HE1 PHE 30 1HE PHE 30 7.310 -0.483 2.581
233 HE2 PHE 30 2HE PHE 30 10.454 -0.562 -0.298
234 HZ PHE 30 HZ PHE 30 9.107 0.671 1.355
235 H TYR 31 H TYR 31 4.351 -4.007 -0.053
236 HA TYR 31 HA TYR 31 3.936 -5.280 2.567
237 1HB TYR 31 2HB TYR 31 3.485 -2.653 1.780
238 2HB TYR 31 1HB TYR 31 1.880 -3.377 1.777
239 HD1 TYR 31 1HD TYR 31 4.661 -2.250 3.822
240 HD2 TYR 31 2HD TYR 31 0.951 -4.331 3.862
241 HE1 TYR 31 1HE TYR 31 4.555 -1.999 6.266
242 HE2 TYR 31 2HE TYR 31 0.834 -4.087 6.306
243 HH TYR 31 HH TYR 31 2.134 -2.093 8.020
244 H CYS 32 H CYS 32 3.105 -5.483 -0.704
245 HA CYS 32 HA CYS 32 0.538 -6.773 -0.187
246 1HB CYS 32 2HB CYS 32 0.854 -5.115 -2.067
247 2HB CYS 32 1HB CYS 32 1.877 -6.312 -2.854
248 H LYS 33 H LYS 33 0.126 -8.919 -0.577
249 HA LYS 33 HA LYS 33 2.486 -10.632 -0.780
250 1HB LYS 33 2HB LYS 33 0.735 -10.842 1.078
251 2HB LYS 33 1HB LYS 33 -0.320 -11.525 -0.150
252 1HG LYS 33 2HG LYS 33 1.486 -13.226 -0.588
253 2HG LYS 33 1HG LYS 33 2.282 -12.623 0.867
254 1HD LYS 33 2HD LYS 33 -0.556 -13.216 1.241
255 2HD LYS 33 1HD LYS 33 0.406 -14.623 0.786
256 1HE LYS 33 2HE LYS 33 1.268 -12.762 2.978
257 2HE LYS 33 1HE LYS 33 0.157 -14.096 3.281
258 1HZ LYS 33 1HZ LYS 33 1.786 -15.608 3.088
259 2HZ LYS 33 2HZ LYS 33 2.813 -14.305 3.424
260 3HZ LYS 33 3HZ LYS 33 2.563 -14.793 1.824
261 H ASN 34 H ASN 34 1.495 -9.315 -3.137
262 HA ASN 34 HA ASN 34 1.159 -11.654 -4.812
263 1HB ASN 34 2HB ASN 34 -1.153 -10.590 -4.051
264 2HB ASN 34 1HB ASN 34 -0.790 -9.460 -5.351
265 1HD2 ASN 34 1HD2 ASN 34 -0.664 -12.961 -4.765
266 2HD2 ASN 34 2HD2 ASN 34 -1.364 -13.409 -6.279
267 H LYS 35 H LYS 35 3.316 -10.908 -5.358
268 HA LYS 35 HA LYS 35 3.339 -8.520 -7.076
269 1HB LYS 35 2HB LYS 35 4.983 -9.010 -5.020
270 2HB LYS 35 1HB LYS 35 5.878 -9.847 -6.280
271 1HG LYS 35 2HG LYS 35 6.150 -7.869 -7.538
272 2HG LYS 35 1HG LYS 35 4.962 -7.001 -6.563
273 1HD LYS 35 2HD LYS 35 7.161 -6.284 -5.912
274 2HD LYS 35 1HD LYS 35 6.475 -7.252 -4.605
275 1HE LYS 35 2HE LYS 35 8.632 -8.079 -4.768
276 2HE LYS 35 1HE LYS 35 7.707 -9.222 -5.742
277 1HZ LYS 35 1HZ LYS 35 9.491 -7.053 -6.667
278 2HZ LYS 35 2HZ LYS 35 8.347 -7.758 -7.695
279 3HZ LYS 35 3HZ LYS 35 9.574 -8.705 -7.018
280 HA PRO 36 HA PRO 36 3.755 -11.167 -10.605
281 1HB PRO 36 2HB PRO 36 4.827 -9.401 -12.364
282 2HB PRO 36 1HB PRO 36 3.129 -9.356 -11.876
283 1HG PRO 36 2HG PRO 36 5.428 -7.711 -10.890
284 2HG PRO 36 1HG PRO 36 3.780 -7.199 -11.296
285 1HD PRO 36 2HD PRO 36 4.589 -7.610 -8.746
286 2HD PRO 36 1HD PRO 36 2.924 -7.919 -9.279
Start of MODEL 15
1 1H GLY 1 1HT GLY 1 -11.991 13.585 -12.227
2 2H GLY 1 2HT GLY 1 -11.399 12.568 -11.012
3 3H GLY 1 3HT GLY 1 -12.464 13.822 -10.620
4 1HA GLY 1 1HA GLY 1 -13.241 11.306 -10.934
5 2HA GLY 1 2HA GLY 1 -14.287 12.688 -11.223
6 H SER 2 H SER 2 -11.726 10.928 -12.978
7 HA SER 2 HA SER 2 -13.560 10.741 -15.268
8 1HB SER 2 2HB SER 2 -10.602 11.290 -15.554
9 2HB SER 2 1HB SER 2 -11.831 11.318 -16.819
10 HG SER 2 HG SER 2 -11.551 13.412 -16.279
11 H ALA 3 H ALA 3 -12.090 9.301 -17.004
12 HA ALA 3 HA ALA 3 -11.472 7.176 -17.532
13 1HB ALA 3 1HB ALA 3 -10.078 6.055 -15.554
14 2HB ALA 3 2HB ALA 3 -10.005 7.735 -15.023
15 3HB ALA 3 3HB ALA 3 -9.399 7.287 -16.618
16 H ALA 4 H ALA 4 -14.031 7.655 -16.193
17 HA ALA 4 HA ALA 4 -15.799 6.477 -15.379
18 1HB ALA 4 1HB ALA 4 -14.601 4.829 -17.132
19 2HB ALA 4 2HB ALA 4 -16.062 4.405 -16.239
20 3HB ALA 4 3HB ALA 4 -14.488 3.849 -15.669
21 H GLU 5 H GLU 5 -15.666 7.154 -13.247
22 HA GLU 5 HA GLU 5 -15.315 7.044 -11.000
23 1HB GLU 5 2HB GLU 5 -16.740 4.960 -11.644
24 2HB GLU 5 1HB GLU 5 -15.279 4.060 -11.267
25 1HG GLU 5 2HG GLU 5 -16.887 4.199 -9.397
26 2HG GLU 5 1HG GLU 5 -15.292 4.843 -9.013
27 H VAL 6 H VAL 6 -13.280 7.841 -10.672
28 HA VAL 6 HA VAL 6 -10.889 6.419 -11.187
29 HB VAL 6 HB VAL 6 -11.260 8.679 -9.217
30 1HG1 VAL 6 1HG1 VAL 6 -8.918 7.315 -10.420
31 2HG1 VAL 6 2HG1 VAL 6 -9.122 8.016 -8.815
32 3HG1 VAL 6 3HG1 VAL 6 -8.824 9.063 -10.204
33 1HG2 VAL 6 1HG2 VAL 6 -10.267 9.203 -11.954
34 2HG2 VAL 6 2HG2 VAL 6 -11.254 10.207 -10.892
35 3HG2 VAL 6 3HG2 VAL 6 -11.992 8.877 -11.783
36 H MET 7 H MET 7 -9.412 5.476 -9.718
37 HA MET 7 HA MET 7 -9.972 5.090 -6.971
38 1HB MET 7 2HB MET 7 -10.351 2.593 -7.126
39 2HB MET 7 1HB MET 7 -11.705 3.600 -7.621
40 1HG MET 7 2HG MET 7 -11.317 3.168 -9.906
41 2HG MET 7 1HG MET 7 -9.736 2.459 -9.578
42 1HE MET 7 1HE MET 7 -10.328 0.327 -11.073
43 2HE MET 7 2HE MET 7 -11.879 1.081 -11.442
44 3HE MET 7 3HE MET 7 -11.822 -0.593 -10.890
45 H LYS 8 H LYS 8 -7.744 5.954 -7.479
46 HA LYS 8 HA LYS 8 -5.833 3.869 -8.209
47 1HB LYS 8 2HB LYS 8 -5.664 6.849 -7.901
48 2HB LYS 8 1HB LYS 8 -4.200 5.876 -7.879
49 1HG LYS 8 2HG LYS 8 -4.391 6.533 -10.094
50 2HG LYS 8 1HG LYS 8 -5.056 4.899 -10.091
51 1HD LYS 8 2HD LYS 8 -6.783 5.845 -11.179
52 2HD LYS 8 1HD LYS 8 -7.277 6.374 -9.569
53 1HE LYS 8 2HE LYS 8 -5.513 7.983 -11.408
54 2HE LYS 8 1HE LYS 8 -7.263 8.176 -11.305
55 1HZ LYS 8 1HZ LYS 8 -5.356 8.546 -9.058
56 2HZ LYS 8 2HZ LYS 8 -7.032 8.756 -8.977
57 3HZ LYS 8 3HZ LYS 8 -6.096 9.791 -9.932
58 H LYS 9 H LYS 9 -7.048 3.232 -5.903
59 HA LYS 9 HA LYS 9 -4.908 2.925 -4.102
60 1HB LYS 9 2HB LYS 9 -5.749 4.262 -2.210
61 2HB LYS 9 1HB LYS 9 -5.287 5.269 -3.575
62 1HG LYS 9 2HG LYS 9 -8.112 4.460 -3.509
63 2HG LYS 9 1HG LYS 9 -7.592 5.531 -2.205
64 1HD LYS 9 2HD LYS 9 -6.592 6.345 -4.821
65 2HD LYS 9 1HD LYS 9 -8.354 6.312 -4.735
66 1HE LYS 9 2HE LYS 9 -7.899 8.452 -4.018
67 2HE LYS 9 1HE LYS 9 -7.990 7.581 -2.488
68 1HZ LYS 9 1HZ LYS 9 -5.708 8.818 -3.782
69 2HZ LYS 9 2HZ LYS 9 -5.405 7.316 -3.065
70 3HZ LYS 9 3HZ LYS 9 -6.027 8.586 -2.137
71 H TYR 10 H TYR 10 -6.121 0.903 -4.899
72 HA TYR 10 HA TYR 10 -7.571 -0.151 -2.679
73 1HB TYR 10 2HB TYR 10 -9.464 0.940 -3.668
74 2HB TYR 10 1HB TYR 10 -9.037 0.361 -5.273
75 HD1 TYR 10 1HD TYR 10 -10.496 -1.223 -6.078
76 HD2 TYR 10 2HD TYR 10 -9.581 -1.226 -1.923
77 HE1 TYR 10 1HE TYR 10 -11.955 -3.177 -5.764
78 HE2 TYR 10 2HE TYR 10 -11.037 -3.180 -1.598
79 HH TYR 10 HH TYR 10 -13.297 -4.167 -3.743
80 H CYS 11 H CYS 11 -6.457 -1.996 -2.509
81 HA CYS 11 HA CYS 11 -5.524 -3.400 -4.865
82 1HB CYS 11 2HB CYS 11 -4.271 -3.101 -2.604
83 2HB CYS 11 1HB CYS 11 -5.273 -4.439 -2.058
84 H SER 12 H SER 12 -7.184 -4.360 -5.917
85 HA SER 12 HA SER 12 -9.442 -5.530 -4.765
86 1HB SER 12 2HB SER 12 -9.460 -6.855 -7.014
87 2HB SER 12 1HB SER 12 -9.652 -5.102 -7.046
88 HG SER 12 HG SER 12 -7.656 -4.876 -7.832
89 H THR 13 H THR 13 -6.299 -6.920 -5.571
90 HA THR 13 HA THR 13 -6.943 -9.616 -5.140
91 HB THR 13 HB THR 13 -4.291 -8.224 -4.716
92 HG1 THR 13 1HG THR 13 -4.332 -8.041 -6.791
93 1HG2 THR 13 1HG2 THR 13 -4.783 -10.742 -3.959
94 2HG2 THR 13 2HG2 THR 13 -3.233 -10.203 -4.607
95 3HG2 THR 13 3HG2 THR 13 -4.396 -11.009 -5.659
96 H CYS 14 H CYS 14 -5.494 -7.231 -2.930
97 HA CYS 14 HA CYS 14 -5.572 -9.006 -0.691
98 1HB CYS 14 2HB CYS 14 -5.004 -6.064 -0.998
99 2HB CYS 14 1HB CYS 14 -5.006 -6.865 0.566
100 H ASP 15 H ASP 15 -7.731 -6.699 -2.103
101 HA ASP 15 HA ASP 15 -9.933 -6.269 -1.685
102 1HB ASP 15 2HB ASP 15 -9.754 -8.728 -0.679
103 2HB ASP 15 1HB ASP 15 -9.992 -7.860 0.836
104 H ILE 16 H ILE 16 -7.889 -4.587 -0.783
105 HA ILE 16 HA ILE 16 -9.250 -3.312 1.479
106 HB ILE 16 HB ILE 16 -6.252 -3.324 1.388
107 1HG1 ILE 16 2HG1 ILE 16 -7.024 -5.687 1.490
108 2HG1 ILE 16 1HG1 ILE 16 -6.192 -5.176 2.954
109 1HG2 ILE 16 1HG2 ILE 16 -6.753 -3.043 3.923
110 2HG2 ILE 16 2HG2 ILE 16 -8.366 -2.599 3.366
111 3HG2 ILE 16 3HG2 ILE 16 -6.963 -1.674 2.832
112 1HD1 ILE 16 1HD1 ILE 16 -7.977 -5.561 4.221
113 2HD1 ILE 16 2HD1 ILE 16 -8.607 -6.455 2.837
114 3HD1 ILE 16 3HD1 ILE 16 -9.067 -4.769 3.083
115 H SER 17 H SER 17 -8.622 -1.022 1.738
116 HA SER 17 HA SER 17 -7.613 0.194 -0.740
117 1HB SER 17 2HB SER 17 -9.930 0.482 -1.033
118 2HB SER 17 1HB SER 17 -10.200 0.792 0.682
119 HG SER 17 HG SER 17 -9.695 2.825 0.399
120 H PHE 18 H PHE 18 -6.986 2.485 -0.448
121 HA PHE 18 HA PHE 18 -6.301 3.173 2.321
122 1HB PHE 18 2HB PHE 18 -4.309 3.443 0.071
123 2HB PHE 18 1HB PHE 18 -4.025 3.646 1.797
124 HD1 PHE 18 1HD PHE 18 -4.044 1.661 3.287
125 HD2 PHE 18 2HD PHE 18 -4.205 1.317 -0.952
126 HE1 PHE 18 1HE PHE 18 -3.376 -0.700 3.457
127 HE2 PHE 18 2HE PHE 18 -3.538 -1.046 -0.789
128 HZ PHE 18 HZ PHE 18 -3.122 -2.057 1.418
129 H ASN 19 H ASN 19 -6.620 5.257 2.808
130 HA ASN 19 HA ASN 19 -7.841 6.984 0.904
131 1HB ASN 19 2HB ASN 19 -6.759 7.743 3.622
132 2HB ASN 19 1HB ASN 19 -8.007 8.577 2.701
133 1HD2 ASN 19 1HD2 ASN 19 -9.912 7.131 2.121
134 2HD2 ASN 19 2HD2 ASN 19 -10.512 6.124 3.390
135 H TYR 20 H TYR 20 -4.594 6.559 2.079
136 HA TYR 20 HA TYR 20 -3.718 8.990 0.684
137 1HB TYR 20 2HB TYR 20 -2.052 7.222 2.476
138 2HB TYR 20 1HB TYR 20 -1.691 8.861 1.946
139 HD1 TYR 20 1HD TYR 20 -2.866 10.774 2.936
140 HD2 TYR 20 2HD TYR 20 -3.558 6.807 4.309
141 HE1 TYR 20 1HE TYR 20 -3.929 11.669 4.965
142 HE2 TYR 20 2HE TYR 20 -4.624 7.691 6.342
143 HH TYR 20 HH TYR 20 -5.514 10.962 6.677
144 H VAL 21 H VAL 21 -2.737 8.867 -1.222
145 HA VAL 21 HA VAL 21 -2.496 6.504 -2.679
146 HB VAL 21 HB VAL 21 -0.862 8.997 -3.155
147 1HG1 VAL 21 1HG1 VAL 21 -1.983 7.364 -5.353
148 2HG1 VAL 21 2HG1 VAL 21 -0.647 6.666 -4.439
149 3HG1 VAL 21 3HG1 VAL 21 -0.446 8.221 -5.245
150 1HG2 VAL 21 1HG2 VAL 21 -3.758 8.460 -3.515
151 2HG2 VAL 21 2HG2 VAL 21 -2.928 9.360 -4.785
152 3HG2 VAL 21 3HG2 VAL 21 -2.924 9.965 -3.129
153 H LYS 22 H LYS 22 -0.143 8.217 -0.691
154 HA LYS 22 HA LYS 22 2.178 6.873 -1.422
155 1HB LYS 22 2HB LYS 22 2.894 7.356 0.989
156 2HB LYS 22 1HB LYS 22 2.451 8.732 -0.011
157 1HG LYS 22 2HG LYS 22 0.102 7.830 1.286
158 2HG LYS 22 1HG LYS 22 1.382 7.931 2.496
159 1HD LYS 22 2HD LYS 22 0.958 10.173 0.560
160 2HD LYS 22 1HD LYS 22 -0.068 10.026 1.989
161 1HE LYS 22 2HE LYS 22 1.858 10.124 3.436
162 2HE LYS 22 1HE LYS 22 2.945 10.114 2.048
163 1HZ LYS 22 1HZ LYS 22 2.612 12.341 2.999
164 2HZ LYS 22 2HZ LYS 22 0.966 12.252 2.620
165 3HZ LYS 22 3HZ LYS 22 2.120 12.252 1.382
166 H THR 23 H THR 23 -0.460 5.876 0.634
167 HA THR 23 HA THR 23 0.803 3.666 1.863
168 HB THR 23 HB THR 23 -2.137 3.850 1.235
169 HG1 THR 23 1HG THR 23 -2.316 5.084 3.137
170 1HG2 THR 23 1HG2 THR 23 -1.537 1.798 2.312
171 2HG2 THR 23 2HG2 THR 23 -2.374 2.831 3.471
172 3HG2 THR 23 3HG2 THR 23 -0.620 2.664 3.543
173 H TYR 24 H TYR 24 -1.295 3.916 -0.999
174 HA TYR 24 HA TYR 24 -1.297 1.196 -1.669
175 1HB TYR 24 2HB TYR 24 -2.685 3.200 -2.622
176 2HB TYR 24 1HB TYR 24 -1.366 3.325 -3.782
177 HD1 TYR 24 1HD TYR 24 -3.075 0.357 -2.289
178 HD2 TYR 24 2HD TYR 24 -2.133 2.539 -5.818
179 HE1 TYR 24 1HE TYR 24 -4.111 -1.409 -3.649
180 HE2 TYR 24 2HE TYR 24 -3.167 0.779 -7.188
181 HH TYR 24 HH TYR 24 -3.631 -1.763 -6.878
182 H LEU 25 H LEU 25 1.006 3.746 -2.289
183 HA LEU 25 HA LEU 25 2.536 2.340 -4.232
184 1HB LEU 25 2HB LEU 25 2.844 4.806 -2.626
185 2HB LEU 25 1HB LEU 25 4.331 4.059 -3.178
186 HG LEU 25 HG LEU 25 2.164 4.533 -5.171
187 1HD1 LEU 25 1HD1 LEU 25 2.115 6.671 -4.287
188 2HD1 LEU 25 2HD1 LEU 25 3.352 6.804 -5.537
189 3HD1 LEU 25 3HD1 LEU 25 3.821 6.640 -3.845
190 1HD2 LEU 25 1HD2 LEU 25 3.863 4.450 -6.706
191 2HD2 LEU 25 2HD2 LEU 25 4.508 3.382 -5.458
192 3HD2 LEU 25 3HD2 LEU 25 5.070 5.050 -5.569
193 H ALA 26 H ALA 26 3.122 3.020 -0.800
194 HA ALA 26 HA ALA 26 5.357 1.348 -0.556
195 1HB ALA 26 1HB ALA 26 4.562 1.417 1.963
196 2HB ALA 26 2HB ALA 26 3.520 2.698 1.343
197 3HB ALA 26 3HB ALA 26 5.271 2.828 1.178
198 H HIS 27 H HIS 27 2.022 0.664 -0.755
199 HA HIS 27 HA HIS 27 2.019 -1.797 0.688
200 1HB HIS 27 2HB HIS 27 -0.053 -0.562 0.364
201 2HB HIS 27 1HB HIS 27 0.107 -0.698 -1.383
202 HD1 HIS 27 1HD HIS 27 -1.061 -2.568 1.613
203 HD2 HIS 27 2HD HIS 27 -0.448 -3.251 -2.438
204 HE1 HIS 27 1HE HIS 27 -2.246 -4.736 1.072
205 H LYS 28 H LYS 28 1.768 -1.119 -2.812
206 HA LYS 28 HA LYS 28 2.190 -3.804 -3.581
207 1HB LYS 28 2HB LYS 28 2.611 -2.844 -5.846
208 2HB LYS 28 1HB LYS 28 1.114 -2.293 -5.107
209 1HG LYS 28 2HG LYS 28 1.801 -0.259 -5.711
210 2HG LYS 28 1HG LYS 28 2.858 -0.367 -4.302
211 1HD LYS 28 2HD LYS 28 4.302 0.256 -6.023
212 2HD LYS 28 1HD LYS 28 4.529 -1.490 -5.904
213 1HE LYS 28 2HE LYS 28 2.388 -0.703 -7.731
214 2HE LYS 28 1HE LYS 28 3.977 -0.104 -8.204
215 1HZ LYS 28 1HZ LYS 28 3.883 -2.885 -7.382
216 2HZ LYS 28 2HZ LYS 28 4.706 -2.163 -8.672
217 3HZ LYS 28 3HZ LYS 28 3.061 -2.529 -8.818
218 H GLN 29 H GLN 29 4.339 -1.424 -2.444
219 HA GLN 29 HA GLN 29 6.684 -2.160 -3.837
220 1HB GLN 29 2HB GLN 29 5.953 -0.350 -1.733
221 2HB GLN 29 1HB GLN 29 7.404 -1.225 -1.265
222 1HG GLN 29 2HG GLN 29 8.247 0.629 -2.343
223 2HG GLN 29 1HG GLN 29 8.269 -0.598 -3.609
224 1HE2 GLN 29 1HE2 GLN 29 7.206 2.471 -2.710
225 2HE2 GLN 29 2HE2 GLN 29 6.172 2.784 -4.059
226 H PHE 30 H PHE 30 5.882 -2.815 -0.412
227 HA PHE 30 HA PHE 30 6.943 -5.517 -0.715
228 1HB PHE 30 2HB PHE 30 8.130 -4.959 1.606
229 2HB PHE 30 1HB PHE 30 8.938 -4.744 0.057
230 HD1 PHE 30 1HD PHE 30 6.673 -2.822 2.322
231 HD2 PHE 30 2HD PHE 30 10.068 -2.776 -0.243
232 HE1 PHE 30 1HE PHE 30 7.039 -0.448 2.856
233 HE2 PHE 30 2HE PHE 30 10.441 -0.401 0.287
234 HZ PHE 30 HZ PHE 30 8.924 0.766 1.837
235 H TYR 31 H TYR 31 4.361 -3.964 0.062
236 HA TYR 31 HA TYR 31 3.868 -5.355 2.606
237 1HB TYR 31 2HB TYR 31 3.368 -2.728 1.927
238 2HB TYR 31 1HB TYR 31 1.795 -3.488 1.719
239 HD1 TYR 31 1HD TYR 31 4.544 -2.978 4.159
240 HD2 TYR 31 2HD TYR 31 0.460 -4.020 3.581
241 HE1 TYR 31 1HE TYR 31 4.179 -2.869 6.589
242 HE2 TYR 31 2HE TYR 31 0.083 -3.913 6.009
243 HH TYR 31 HH TYR 31 1.326 -4.046 8.073
244 H CYS 32 H CYS 32 3.063 -5.283 -0.721
245 HA CYS 32 HA CYS 32 0.605 -6.797 -0.384
246 1HB CYS 32 2HB CYS 32 0.950 -4.986 -2.140
247 2HB CYS 32 1HB CYS 32 1.998 -6.127 -2.973
248 H LYS 33 H LYS 33 0.292 -8.840 -1.515
249 HA LYS 33 HA LYS 33 2.760 -10.377 -1.918
250 1HB LYS 33 2HB LYS 33 1.847 -12.267 -0.680
251 2HB LYS 33 1HB LYS 33 1.944 -10.847 0.352
252 1HG LYS 33 2HG LYS 33 -0.489 -10.452 -0.142
253 2HG LYS 33 1HG LYS 33 -0.508 -12.042 -0.908
254 1HD LYS 33 2HD LYS 33 -0.105 -13.150 1.101
255 2HD LYS 33 1HD LYS 33 0.520 -11.698 1.886
256 1HE LYS 33 2HE LYS 33 -1.779 -12.441 2.616
257 2HE LYS 33 1HE LYS 33 -1.642 -10.763 2.093
258 1HZ LYS 33 1HZ LYS 33 -3.601 -12.106 1.233
259 2HZ LYS 33 2HZ LYS 33 -2.490 -12.896 0.231
260 3HZ LYS 33 3HZ LYS 33 -2.716 -11.226 0.092
261 H ASN 34 H ASN 34 0.719 -9.165 -3.701
262 HA ASN 34 HA ASN 34 -0.800 -11.348 -4.791
263 1HB ASN 34 2HB ASN 34 -1.636 -9.046 -4.928
264 2HB ASN 34 1HB ASN 34 -0.245 -8.588 -5.906
265 1HD2 ASN 34 1HD2 ASN 34 -2.365 -11.425 -6.012
266 2HD2 ASN 34 2HD2 ASN 34 -2.871 -11.201 -7.648
267 H LYS 35 H LYS 35 1.419 -12.554 -4.843
268 HA LYS 35 HA LYS 35 3.294 -12.021 -6.853
269 1HB LYS 35 2HB LYS 35 3.987 -14.356 -6.586
270 2HB LYS 35 1HB LYS 35 3.725 -13.588 -5.026
271 1HG LYS 35 2HG LYS 35 1.432 -14.636 -5.028
272 2HG LYS 35 1HG LYS 35 1.960 -15.574 -6.427
273 1HD LYS 35 2HD LYS 35 3.595 -16.710 -5.188
274 2HD LYS 35 1HD LYS 35 3.540 -15.533 -3.875
275 1HE LYS 35 2HE LYS 35 1.007 -16.922 -4.451
276 2HE LYS 35 1HE LYS 35 2.302 -17.936 -3.816
277 1HZ LYS 35 1HZ LYS 35 2.231 -16.929 -1.817
278 2HZ LYS 35 2HZ LYS 35 0.644 -16.562 -2.274
279 3HZ LYS 35 3HZ LYS 35 1.865 -15.404 -2.453
280 HA PRO 36 HA PRO 36 1.265 -13.166 -10.596
281 1HB PRO 36 2HB PRO 36 3.343 -14.108 -12.066
282 2HB PRO 36 1HB PRO 36 3.121 -12.391 -11.711
283 1HG PRO 36 2HG PRO 36 4.913 -14.384 -10.376
284 2HG PRO 36 1HG PRO 36 5.259 -12.711 -10.852
285 1HD PRO 36 2HD PRO 36 4.657 -13.406 -8.305
286 2HD PRO 36 1HD PRO 36 4.211 -11.833 -8.997
Start of MODEL 16
1 1H GLY 1 1HT GLY 1 -18.810 8.607 -20.987
2 2H GLY 1 2HT GLY 1 -18.294 7.513 -19.807
3 3H GLY 1 3HT GLY 1 -18.788 6.949 -21.322
4 1HA GLY 1 1HA GLY 1 -16.462 6.851 -21.385
5 2HA GLY 1 2HA GLY 1 -16.916 8.271 -22.315
6 H SER 2 H SER 2 -17.630 9.738 -19.825
7 HA SER 2 HA SER 2 -14.943 10.143 -18.702
8 1HB SER 2 2HB SER 2 -16.816 12.401 -19.435
9 2HB SER 2 1HB SER 2 -15.151 12.533 -18.867
10 HG SER 2 HG SER 2 -14.443 11.669 -20.793
11 H ALA 3 H ALA 3 -15.446 12.132 -16.930
12 HA ALA 3 HA ALA 3 -16.224 12.534 -14.830
13 1HB ALA 3 1HB ALA 3 -18.825 11.209 -15.328
14 2HB ALA 3 2HB ALA 3 -18.402 12.571 -16.368
15 3HB ALA 3 3HB ALA 3 -18.469 12.785 -14.619
16 H ALA 4 H ALA 4 -14.837 10.059 -15.367
17 HA ALA 4 HA ALA 4 -16.145 8.076 -13.685
18 1HB ALA 4 1HB ALA 4 -15.153 6.942 -15.397
19 2HB ALA 4 2HB ALA 4 -13.839 6.893 -14.222
20 3HB ALA 4 3HB ALA 4 -13.814 8.081 -15.525
21 H GLU 5 H GLU 5 -13.472 10.336 -13.585
22 HA GLU 5 HA GLU 5 -12.155 11.081 -11.886
23 1HB GLU 5 2HB GLU 5 -14.388 11.253 -10.740
24 2HB GLU 5 1HB GLU 5 -14.084 9.669 -10.040
25 1HG GLU 5 2HG GLU 5 -12.260 10.470 -8.775
26 2HG GLU 5 1HG GLU 5 -12.219 11.991 -9.667
27 H VAL 6 H VAL 6 -10.207 10.316 -11.427
28 HA VAL 6 HA VAL 6 -9.531 7.604 -11.556
29 HB VAL 6 HB VAL 6 -7.887 9.347 -11.965
30 1HG1 VAL 6 1HG1 VAL 6 -7.497 9.931 -9.092
31 2HG1 VAL 6 2HG1 VAL 6 -8.892 10.670 -9.878
32 3HG1 VAL 6 3HG1 VAL 6 -7.269 10.966 -10.502
33 1HG2 VAL 6 1HG2 VAL 6 -6.019 8.337 -10.929
34 2HG2 VAL 6 2HG2 VAL 6 -7.218 7.058 -11.125
35 3HG2 VAL 6 3HG2 VAL 6 -6.979 7.808 -9.547
36 H MET 7 H MET 7 -8.586 6.268 -9.877
37 HA MET 7 HA MET 7 -8.924 6.795 -7.125
38 1HB MET 7 2HB MET 7 -10.728 5.062 -6.727
39 2HB MET 7 1HB MET 7 -11.266 6.580 -7.432
40 1HG MET 7 2HG MET 7 -11.134 5.456 -9.676
41 2HG MET 7 1HG MET 7 -10.887 3.940 -8.811
42 1HE MET 7 1HE MET 7 -14.491 6.664 -8.275
43 2HE MET 7 2HE MET 7 -13.975 6.475 -9.950
44 3HE MET 7 3HE MET 7 -12.849 7.103 -8.747
45 H LYS 8 H LYS 8 -6.714 6.018 -7.885
46 HA LYS 8 HA LYS 8 -6.532 3.107 -8.047
47 1HB LYS 8 2HB LYS 8 -4.636 5.361 -8.583
48 2HB LYS 8 1HB LYS 8 -3.998 3.756 -8.254
49 1HG LYS 8 2HG LYS 8 -6.009 4.351 -10.411
50 2HG LYS 8 1HG LYS 8 -4.264 4.298 -10.670
51 1HD LYS 8 2HD LYS 8 -4.183 2.041 -10.542
52 2HD LYS 8 1HD LYS 8 -5.432 1.962 -9.298
53 1HE LYS 8 2HE LYS 8 -6.679 1.114 -10.972
54 2HE LYS 8 1HE LYS 8 -6.896 2.812 -11.396
55 1HZ LYS 8 1HZ LYS 8 -4.665 1.216 -12.499
56 2HZ LYS 8 2HZ LYS 8 -5.311 2.666 -13.081
57 3HZ LYS 8 3HZ LYS 8 -6.190 1.229 -13.232
58 H LYS 9 H LYS 9 -7.482 3.818 -5.645
59 HA LYS 9 HA LYS 9 -5.186 3.364 -3.858
60 1HB LYS 9 2HB LYS 9 -6.241 4.719 -2.146
61 2HB LYS 9 1HB LYS 9 -6.040 5.668 -3.611
62 1HG LYS 9 2HG LYS 9 -8.527 4.719 -4.003
63 2HG LYS 9 1HG LYS 9 -8.491 4.793 -2.241
64 1HD LYS 9 2HD LYS 9 -7.397 7.156 -3.605
65 2HD LYS 9 1HD LYS 9 -9.121 6.882 -3.863
66 1HE LYS 9 2HE LYS 9 -9.650 7.310 -1.704
67 2HE LYS 9 1HE LYS 9 -8.161 6.599 -1.087
68 1HZ LYS 9 1HZ LYS 9 -8.056 8.906 -0.667
69 2HZ LYS 9 2HZ LYS 9 -8.525 9.303 -2.243
70 3HZ LYS 9 3HZ LYS 9 -7.003 8.621 -1.961
71 H TYR 10 H TYR 10 -6.282 1.180 -4.785
72 HA TYR 10 HA TYR 10 -7.434 -0.057 -2.490
73 1HB TYR 10 2HB TYR 10 -9.419 1.063 -3.600
74 2HB TYR 10 1HB TYR 10 -9.169 -0.025 -4.961
75 HD1 TYR 10 1HD TYR 10 -9.006 -2.595 -4.262
76 HD2 TYR 10 2HD TYR 10 -10.940 0.436 -1.989
77 HE1 TYR 10 1HE TYR 10 -10.365 -4.311 -3.142
78 HE2 TYR 10 2HE TYR 10 -12.303 -1.272 -0.861
79 HH TYR 10 HH TYR 10 -12.609 -4.403 -1.962
80 H CYS 11 H CYS 11 -6.456 -1.960 -2.411
81 HA CYS 11 HA CYS 11 -5.330 -3.128 -4.811
82 1HB CYS 11 2HB CYS 11 -4.165 -3.019 -2.538
83 2HB CYS 11 1HB CYS 11 -5.255 -4.307 -2.036
84 H SER 12 H SER 12 -6.777 -4.135 -6.076
85 HA SER 12 HA SER 12 -9.136 -5.375 -5.241
86 1HB SER 12 2HB SER 12 -8.840 -6.627 -7.523
87 2HB SER 12 1HB SER 12 -9.102 -4.883 -7.512
88 HG SER 12 HG SER 12 -7.292 -4.767 -8.553
89 H THR 13 H THR 13 -5.884 -6.657 -5.665
90 HA THR 13 HA THR 13 -6.521 -9.389 -5.412
91 HB THR 13 HB THR 13 -3.950 -8.007 -4.621
92 HG1 THR 13 1HG THR 13 -4.811 -9.031 -7.120
93 1HG2 THR 13 1HG2 THR 13 -3.315 -10.049 -4.021
94 2HG2 THR 13 2HG2 THR 13 -3.301 -10.414 -5.746
95 3HG2 THR 13 3HG2 THR 13 -4.719 -10.805 -4.773
96 H CYS 14 H CYS 14 -5.319 -7.070 -2.986
97 HA CYS 14 HA CYS 14 -5.614 -8.913 -0.827
98 1HB CYS 14 2HB CYS 14 -5.065 -5.953 -0.974
99 2HB CYS 14 1HB CYS 14 -5.207 -6.813 0.550
100 H ASP 15 H ASP 15 -7.647 -6.563 -2.365
101 HA ASP 15 HA ASP 15 -9.877 -6.141 -2.148
102 1HB ASP 15 2HB ASP 15 -9.831 -8.658 -1.359
103 2HB ASP 15 1HB ASP 15 -10.139 -7.949 0.224
104 H ILE 16 H ILE 16 -8.233 -4.330 -1.126
105 HA ILE 16 HA ILE 16 -9.741 -3.300 1.136
106 HB ILE 16 HB ILE 16 -6.751 -3.237 1.360
107 1HG1 ILE 16 2HG1 ILE 16 -8.580 -5.364 2.499
108 2HG1 ILE 16 1HG1 ILE 16 -7.373 -5.612 1.241
109 1HG2 ILE 16 1HG2 ILE 16 -9.072 -2.768 3.193
110 2HG2 ILE 16 2HG2 ILE 16 -7.736 -1.689 2.793
111 3HG2 ILE 16 3HG2 ILE 16 -7.459 -3.092 3.824
112 1HD1 ILE 16 1HD1 ILE 16 -6.609 -4.572 3.940
113 2HD1 ILE 16 2HD1 ILE 16 -5.603 -5.364 2.728
114 3HD1 ILE 16 3HD1 ILE 16 -6.795 -6.299 3.632
115 H SER 17 H SER 17 -9.201 -1.017 1.595
116 HA SER 17 HA SER 17 -8.273 0.357 -0.840
117 1HB SER 17 2HB SER 17 -9.927 1.964 -0.581
118 2HB SER 17 1HB SER 17 -10.760 0.518 -0.014
119 HG SER 17 HG SER 17 -10.983 1.480 1.827
120 H PHE 18 H PHE 18 -7.566 2.684 -0.331
121 HA PHE 18 HA PHE 18 -6.212 2.907 2.248
122 1HB PHE 18 2HB PHE 18 -4.764 3.236 -0.388
123 2HB PHE 18 1HB PHE 18 -4.073 3.462 1.217
124 HD1 PHE 18 1HD PHE 18 -3.586 1.556 2.642
125 HD2 PHE 18 2HD PHE 18 -5.157 1.039 -1.279
126 HE1 PHE 18 1HE PHE 18 -2.952 -0.821 2.706
127 HE2 PHE 18 2HE PHE 18 -4.527 -1.339 -1.223
128 HZ PHE 18 HZ PHE 18 -3.424 -2.272 0.772
129 H ASN 19 H ASN 19 -6.521 4.866 3.068
130 HA ASN 19 HA ASN 19 -7.844 6.911 1.624
131 1HB ASN 19 2HB ASN 19 -7.727 6.405 4.206
132 2HB ASN 19 1HB ASN 19 -6.348 7.498 4.148
133 1HD2 ASN 19 1HD2 ASN 19 -9.390 7.465 4.996
134 2HD2 ASN 19 2HD2 ASN 19 -9.900 9.050 4.532
135 H TYR 20 H TYR 20 -4.484 6.283 2.387
136 HA TYR 20 HA TYR 20 -3.713 8.787 1.053
137 1HB TYR 20 2HB TYR 20 -1.945 6.979 2.705
138 2HB TYR 20 1HB TYR 20 -1.594 8.618 2.166
139 HD1 TYR 20 1HD TYR 20 -2.056 10.420 3.566
140 HD2 TYR 20 2HD TYR 20 -3.961 6.688 4.302
141 HE1 TYR 20 1HE TYR 20 -2.979 11.311 5.665
142 HE2 TYR 20 2HE TYR 20 -4.889 7.568 6.401
143 HH TYR 20 HH TYR 20 -4.384 9.345 8.037
144 H VAL 21 H VAL 21 -2.827 8.725 -0.907
145 HA VAL 21 HA VAL 21 -2.667 6.385 -2.428
146 HB VAL 21 HB VAL 21 -1.145 8.939 -2.956
147 1HG1 VAL 21 1HG1 VAL 21 -0.723 8.178 -5.033
148 2HG1 VAL 21 2HG1 VAL 21 -2.278 7.355 -5.161
149 3HG1 VAL 21 3HG1 VAL 21 -0.949 6.597 -4.286
150 1HG2 VAL 21 1HG2 VAL 21 -3.683 8.560 -4.352
151 2HG2 VAL 21 2HG2 VAL 21 -3.029 9.991 -3.556
152 3HG2 VAL 21 3HG2 VAL 21 -3.858 8.757 -2.608
153 H LYS 22 H LYS 22 -0.225 8.097 -0.556
154 HA LYS 22 HA LYS 22 2.070 6.826 -1.470
155 1HB LYS 22 2HB LYS 22 1.437 7.749 1.339
156 2HB LYS 22 1HB LYS 22 3.043 7.365 0.740
157 1HG LYS 22 2HG LYS 22 3.221 9.293 -0.436
158 2HG LYS 22 1HG LYS 22 1.490 9.377 -0.773
159 1HD LYS 22 2HD LYS 22 1.018 10.209 1.397
160 2HD LYS 22 1HD LYS 22 2.645 9.835 1.968
161 1HE LYS 22 2HE LYS 22 2.494 12.199 1.591
162 2HE LYS 22 1HE LYS 22 3.533 11.498 0.352
163 1HZ LYS 22 1HZ LYS 22 2.223 12.726 -0.986
164 2HZ LYS 22 2HZ LYS 22 0.921 12.749 0.094
165 3HZ LYS 22 3HZ LYS 22 1.188 11.392 -0.879
166 H THR 23 H THR 23 -0.433 5.699 0.674
167 HA THR 23 HA THR 23 0.936 3.498 1.795
168 HB THR 23 HB THR 23 -2.026 3.590 1.266
169 HG1 THR 23 1HG THR 23 -2.166 4.763 3.236
170 1HG2 THR 23 1HG2 THR 23 -1.385 1.554 2.293
171 2HG2 THR 23 2HG2 THR 23 -2.114 2.566 3.540
172 3HG2 THR 23 3HG2 THR 23 -0.360 2.392 3.458
173 H TYR 24 H TYR 24 -1.282 3.745 -0.976
174 HA TYR 24 HA TYR 24 -1.220 1.048 -1.720
175 1HB TYR 24 2HB TYR 24 -2.727 2.985 -2.570
176 2HB TYR 24 1HB TYR 24 -1.440 3.267 -3.738
177 HD1 TYR 24 1HD TYR 24 -3.204 0.250 -2.393
178 HD2 TYR 24 2HD TYR 24 -1.908 2.412 -5.820
179 HE1 TYR 24 1HE TYR 24 -4.146 -1.498 -3.843
180 HE2 TYR 24 2HE TYR 24 -2.847 0.670 -7.280
181 HH TYR 24 HH TYR 24 -5.001 -1.297 -6.649
182 H LEU 25 H LEU 25 0.956 3.699 -2.408
183 HA LEU 25 HA LEU 25 2.455 2.407 -4.434
184 1HB LEU 25 2HB LEU 25 2.426 4.923 -3.289
185 2HB LEU 25 1HB LEU 25 3.970 4.272 -2.774
186 HG LEU 25 HG LEU 25 4.110 3.653 -5.378
187 1HD1 LEU 25 1HD1 LEU 25 2.382 6.117 -5.241
188 2HD1 LEU 25 2HD1 LEU 25 1.962 4.567 -5.971
189 3HD1 LEU 25 3HD1 LEU 25 3.235 5.561 -6.681
190 1HD2 LEU 25 1HD2 LEU 25 4.769 6.296 -4.089
191 2HD2 LEU 25 2HD2 LEU 25 5.376 5.776 -5.661
192 3HD2 LEU 25 3HD2 LEU 25 5.807 4.876 -4.208
193 H ALA 26 H ALA 26 3.304 3.028 -1.043
194 HA ALA 26 HA ALA 26 5.511 1.312 -0.988
195 1HB ALA 26 1HB ALA 26 5.025 1.364 1.562
196 2HB ALA 26 2HB ALA 26 3.800 2.553 1.122
197 3HB ALA 26 3HB ALA 26 5.495 2.850 0.739
198 H HIS 27 H HIS 27 2.153 0.680 -0.915
199 HA HIS 27 HA HIS 27 2.221 -1.803 0.479
200 1HB HIS 27 2HB HIS 27 0.150 -0.530 0.300
201 2HB HIS 27 1HB HIS 27 0.190 -0.666 -1.454
202 HD1 HIS 27 1HD HIS 27 -0.853 -2.488 1.604
203 HD2 HIS 27 2HD HIS 27 -0.419 -3.245 -2.458
204 HE1 HIS 27 1HE HIS 27 -2.096 -4.643 1.147
205 H LYS 28 H LYS 28 1.779 -1.065 -2.988
206 HA LYS 28 HA LYS 28 2.106 -3.754 -3.808
207 1HB LYS 28 2HB LYS 28 2.299 -1.142 -5.307
208 2HB LYS 28 1HB LYS 28 2.463 -2.706 -6.093
209 1HG LYS 28 2HG LYS 28 0.050 -1.900 -4.490
210 2HG LYS 28 1HG LYS 28 0.192 -1.669 -6.234
211 1HD LYS 28 2HD LYS 28 0.433 -4.325 -4.821
212 2HD LYS 28 1HD LYS 28 -1.029 -3.736 -5.616
213 1HE LYS 28 2HE LYS 28 -0.220 -4.851 -7.394
214 2HE LYS 28 1HE LYS 28 0.786 -3.419 -7.597
215 1HZ LYS 28 1HZ LYS 28 1.769 -5.873 -7.455
216 2HZ LYS 28 2HZ LYS 28 1.813 -5.473 -5.812
217 3HZ LYS 28 3HZ LYS 28 2.629 -4.510 -6.939
218 H GLN 29 H GLN 29 4.349 -1.410 -2.797
219 HA GLN 29 HA GLN 29 6.585 -2.148 -4.361
220 1HB GLN 29 2HB GLN 29 6.042 -0.438 -2.074
221 2HB GLN 29 1HB GLN 29 7.589 -1.258 -1.920
222 1HG GLN 29 2HG GLN 29 8.401 0.412 -3.139
223 2HG GLN 29 1HG GLN 29 7.649 -0.397 -4.512
224 1HE2 GLN 29 1HE2 GLN 29 6.082 0.617 -5.593
225 2HE2 GLN 29 2HE2 GLN 29 5.371 2.122 -5.132
226 H PHE 30 H PHE 30 5.987 -2.858 -0.908
227 HA PHE 30 HA PHE 30 6.920 -5.581 -1.299
228 1HB PHE 30 2HB PHE 30 8.410 -5.073 0.848
229 2HB PHE 30 1HB PHE 30 9.029 -4.901 -0.790
230 HD1 PHE 30 1HD PHE 30 6.946 -2.766 1.454
231 HD2 PHE 30 2HD PHE 30 10.423 -3.093 -0.976
232 HE1 PHE 30 1HE PHE 30 7.486 -0.410 1.916
233 HE2 PHE 30 2HE PHE 30 10.970 -0.738 -0.517
234 HZ PHE 30 HZ PHE 30 9.500 0.606 0.930
235 H TYR 31 H TYR 31 4.504 -3.975 -0.289
236 HA TYR 31 HA TYR 31 4.275 -5.248 2.353
237 1HB TYR 31 2HB TYR 31 3.732 -2.628 1.576
238 2HB TYR 31 1HB TYR 31 2.146 -3.377 1.713
239 HD1 TYR 31 1HD TYR 31 4.846 -1.878 3.484
240 HD2 TYR 31 2HD TYR 31 1.629 -4.630 3.905
241 HE1 TYR 31 1HE TYR 31 4.935 -1.600 5.924
242 HE2 TYR 31 2HE TYR 31 1.709 -4.359 6.347
243 HH TYR 31 HH TYR 31 4.290 -2.760 7.935
244 H CYS 32 H CYS 32 3.021 -5.193 -0.854
245 HA CYS 32 HA CYS 32 0.523 -6.458 -0.268
246 1HB CYS 32 2HB CYS 32 1.020 -5.056 -2.310
247 2HB CYS 32 1HB CYS 32 1.972 -6.407 -2.917
248 H LYS 33 H LYS 33 -0.026 -8.591 -0.348
249 HA LYS 33 HA LYS 33 2.212 -10.488 -0.420
250 1HB LYS 33 2HB LYS 33 -0.566 -10.713 0.747
251 2HB LYS 33 1HB LYS 33 0.586 -12.042 0.698
252 1HG LYS 33 2HG LYS 33 1.909 -11.142 2.323
253 2HG LYS 33 1HG LYS 33 1.449 -9.483 1.934
254 1HD LYS 33 2HD LYS 33 -0.927 -10.478 2.756
255 2HD LYS 33 1HD LYS 33 0.181 -11.430 3.747
256 1HE LYS 33 2HE LYS 33 0.965 -9.593 4.878
257 2HE LYS 33 1HE LYS 33 0.604 -8.489 3.552
258 1HZ LYS 33 1HZ LYS 33 -1.062 -7.927 4.955
259 2HZ LYS 33 2HZ LYS 33 -1.127 -9.446 5.696
260 3HZ LYS 33 3HZ LYS 33 -1.845 -9.214 4.182
261 H ASN 34 H ASN 34 1.188 -9.479 -2.864
262 HA ASN 34 HA ASN 34 -0.488 -11.592 -3.962
263 1HB ASN 34 2HB ASN 34 -0.508 -10.228 -6.006
264 2HB ASN 34 1HB ASN 34 -0.966 -9.272 -4.599
265 1HD2 ASN 34 1HD2 ASN 34 0.445 -8.843 -7.328
266 2HD2 ASN 34 2HD2 ASN 34 1.759 -7.801 -6.916
267 H LYS 35 H LYS 35 1.764 -12.759 -3.168
268 HA LYS 35 HA LYS 35 3.479 -14.097 -3.831
269 1HB LYS 35 2HB LYS 35 1.582 -14.378 -5.734
270 2HB LYS 35 1HB LYS 35 2.908 -13.773 -6.718
271 1HG LYS 35 2HG LYS 35 3.244 -16.096 -4.849
272 2HG LYS 35 1HG LYS 35 2.671 -16.291 -6.507
273 1HD LYS 35 2HD LYS 35 4.698 -15.794 -7.410
274 2HD LYS 35 1HD LYS 35 5.127 -14.681 -6.111
275 1HE LYS 35 2HE LYS 35 4.896 -17.569 -5.453
276 2HE LYS 35 1HE LYS 35 6.297 -17.046 -6.387
277 1HZ LYS 35 1HZ LYS 35 6.577 -17.060 -3.908
278 2HZ LYS 35 2HZ LYS 35 5.496 -15.760 -3.840
279 3HZ LYS 35 3HZ LYS 35 6.962 -15.597 -4.669
280 HA PRO 36 HA PRO 36 6.102 -10.465 -4.903
281 1HB PRO 36 2HB PRO 36 8.034 -11.017 -3.081
282 2HB PRO 36 1HB PRO 36 6.563 -10.127 -2.676
283 1HG PRO 36 2HG PRO 36 7.207 -13.018 -2.240
284 2HG PRO 36 1HG PRO 36 6.420 -11.869 -1.142
285 1HD PRO 36 2HD PRO 36 5.029 -13.680 -2.597
286 2HD PRO 36 1HD PRO 36 4.374 -12.084 -2.180
Start of MODEL 17
1 1H GLY 1 1HT GLY 1 -0.460 2.673 -14.924
2 2H GLY 1 2HT GLY 1 0.383 1.290 -14.435
3 3H GLY 1 3HT GLY 1 -0.628 1.230 -15.790
4 1HA GLY 1 1HA GLY 1 2.064 2.332 -15.516
5 2HA GLY 1 2HA GLY 1 1.360 1.425 -16.846
6 H SER 2 H SER 2 2.602 4.308 -16.129
7 HA SER 2 HA SER 2 2.526 6.383 -17.055
8 1HB SER 2 2HB SER 2 2.073 6.522 -19.348
9 2HB SER 2 1HB SER 2 2.501 4.825 -19.133
10 HG SER 2 HG SER 2 0.477 4.248 -19.492
11 H ALA 3 H ALA 3 0.704 7.874 -18.357
12 HA ALA 3 HA ALA 3 -1.159 9.146 -18.064
13 1HB ALA 3 1HB ALA 3 -2.330 7.103 -18.699
14 2HB ALA 3 2HB ALA 3 -3.248 8.009 -17.496
15 3HB ALA 3 3HB ALA 3 -2.340 6.576 -17.016
16 H ALA 4 H ALA 4 -0.377 10.558 -16.530
17 HA ALA 4 HA ALA 4 -0.127 9.983 -13.780
18 1HB ALA 4 1HB ALA 4 0.659 12.089 -13.586
19 2HB ALA 4 2HB ALA 4 -0.658 12.783 -14.533
20 3HB ALA 4 3HB ALA 4 0.701 12.009 -15.347
21 H GLU 5 H GLU 5 -1.350 11.506 -12.152
22 HA GLU 5 HA GLU 5 -3.274 11.905 -11.010
23 1HB GLU 5 2HB GLU 5 -3.625 13.397 -13.032
24 2HB GLU 5 1HB GLU 5 -4.624 12.114 -13.701
25 1HG GLU 5 2HG GLU 5 -5.322 12.918 -10.970
26 2HG GLU 5 1HG GLU 5 -5.542 14.167 -12.195
27 H VAL 6 H VAL 6 -2.795 9.408 -10.792
28 HA VAL 6 HA VAL 6 -5.195 7.928 -11.645
29 HB VAL 6 HB VAL 6 -2.571 6.756 -10.722
30 1HG1 VAL 6 1HG1 VAL 6 -4.354 5.215 -10.378
31 2HG1 VAL 6 2HG1 VAL 6 -3.504 4.709 -11.838
32 3HG1 VAL 6 3HG1 VAL 6 -5.043 5.563 -11.965
33 1HG2 VAL 6 1HG2 VAL 6 -3.464 7.708 -13.370
34 2HG2 VAL 6 2HG2 VAL 6 -2.678 6.129 -13.333
35 3HG2 VAL 6 3HG2 VAL 6 -1.837 7.546 -12.707
36 H MET 7 H MET 7 -6.073 6.366 -10.119
37 HA MET 7 HA MET 7 -5.477 6.952 -7.307
38 1HB MET 7 2HB MET 7 -8.113 6.642 -7.074
39 2HB MET 7 1HB MET 7 -7.380 8.213 -7.358
40 1HG MET 7 2HG MET 7 -9.336 7.829 -8.771
41 2HG MET 7 1HG MET 7 -7.867 8.057 -9.717
42 1HE MET 7 1HE MET 7 -7.400 6.626 -11.718
43 2HE MET 7 2HE MET 7 -9.090 7.115 -11.842
44 3HE MET 7 3HE MET 7 -8.620 5.460 -12.232
45 H LYS 8 H LYS 8 -4.326 4.864 -7.939
46 HA LYS 8 HA LYS 8 -6.096 2.540 -7.869
47 1HB LYS 8 2HB LYS 8 -3.085 2.535 -8.071
48 2HB LYS 8 1HB LYS 8 -4.189 1.226 -8.467
49 1HG LYS 8 2HG LYS 8 -5.069 3.195 -10.124
50 2HG LYS 8 1HG LYS 8 -3.336 3.524 -10.065
51 1HD LYS 8 2HD LYS 8 -3.699 2.030 -11.880
52 2HD LYS 8 1HD LYS 8 -2.962 1.091 -10.581
53 1HE LYS 8 2HE LYS 8 -5.914 1.188 -10.624
54 2HE LYS 8 1HE LYS 8 -5.142 0.296 -11.935
55 1HZ LYS 8 1HZ LYS 8 -3.798 -0.644 -9.843
56 2HZ LYS 8 2HZ LYS 8 -5.210 -1.363 -10.437
57 3HZ LYS 8 3HZ LYS 8 -5.286 -0.325 -9.102
58 H LYS 9 H LYS 9 -6.305 3.873 -5.564
59 HA LYS 9 HA LYS 9 -4.492 2.629 -3.636
60 1HB LYS 9 2HB LYS 9 -6.690 4.585 -2.994
61 2HB LYS 9 1HB LYS 9 -5.257 4.208 -2.046
62 1HG LYS 9 2HG LYS 9 -4.414 6.076 -2.919
63 2HG LYS 9 1HG LYS 9 -4.170 5.118 -4.380
64 1HD LYS 9 2HD LYS 9 -5.293 7.207 -4.913
65 2HD LYS 9 1HD LYS 9 -6.372 5.840 -5.202
66 1HE LYS 9 2HE LYS 9 -7.776 6.416 -3.515
67 2HE LYS 9 1HE LYS 9 -6.480 7.074 -2.517
68 1HZ LYS 9 1HZ LYS 9 -6.511 9.082 -3.683
69 2HZ LYS 9 2HZ LYS 9 -8.146 8.705 -3.468
70 3HZ LYS 9 3HZ LYS 9 -7.410 8.444 -4.968
71 H TYR 10 H TYR 10 -6.205 0.889 -4.939
72 HA TYR 10 HA TYR 10 -7.714 -0.147 -2.678
73 1HB TYR 10 2HB TYR 10 -9.382 1.159 -3.891
74 2HB TYR 10 1HB TYR 10 -8.967 0.337 -5.391
75 HD1 TYR 10 1HD TYR 10 -10.619 -1.111 -6.071
76 HD2 TYR 10 2HD TYR 10 -9.778 -0.788 -1.913
77 HE1 TYR 10 1HE TYR 10 -12.315 -2.830 -5.601
78 HE2 TYR 10 2HE TYR 10 -11.470 -2.506 -1.431
79 HH TYR 10 HH TYR 10 -13.813 -3.395 -3.439
80 H CYS 11 H CYS 11 -6.485 -1.950 -2.477
81 HA CYS 11 HA CYS 11 -5.734 -3.501 -4.806
82 1HB CYS 11 2HB CYS 11 -4.390 -3.096 -2.573
83 2HB CYS 11 1HB CYS 11 -5.324 -4.475 -2.007
84 H SER 12 H SER 12 -7.565 -4.378 -5.675
85 HA SER 12 HA SER 12 -9.705 -5.497 -4.272
86 1HB SER 12 2HB SER 12 -8.995 -6.685 -6.903
87 2HB SER 12 1HB SER 12 -10.543 -6.072 -6.324
88 HG SER 12 HG SER 12 -9.618 -3.940 -6.542
89 H THR 13 H THR 13 -6.728 -6.972 -5.485
90 HA THR 13 HA THR 13 -7.346 -9.646 -4.983
91 HB THR 13 HB THR 13 -4.583 -8.529 -4.586
92 HG1 THR 13 1HG THR 13 -4.550 -7.850 -6.554
93 1HG2 THR 13 1HG2 THR 13 -3.836 -10.580 -4.983
94 2HG2 THR 13 2HG2 THR 13 -4.938 -10.815 -6.339
95 3HG2 THR 13 3HG2 THR 13 -5.492 -11.110 -4.691
96 H CYS 14 H CYS 14 -5.834 -7.228 -2.874
97 HA CYS 14 HA CYS 14 -5.689 -9.057 -0.653
98 1HB CYS 14 2HB CYS 14 -5.060 -6.131 -1.002
99 2HB CYS 14 1HB CYS 14 -4.963 -6.933 0.557
100 H ASP 15 H ASP 15 -7.898 -6.692 -1.875
101 HA ASP 15 HA ASP 15 -10.048 -6.215 -1.273
102 1HB ASP 15 2HB ASP 15 -9.850 -8.658 -0.254
103 2HB ASP 15 1HB ASP 15 -9.896 -7.775 1.268
104 H ILE 16 H ILE 16 -8.256 -4.353 -0.788
105 HA ILE 16 HA ILE 16 -9.240 -3.103 1.644
106 HB ILE 16 HB ILE 16 -6.270 -3.088 1.209
107 1HG1 ILE 16 2HG1 ILE 16 -7.820 -5.040 2.930
108 2HG1 ILE 16 1HG1 ILE 16 -6.921 -5.445 1.472
109 1HG2 ILE 16 1HG2 ILE 16 -8.137 -2.365 3.436
110 2HG2 ILE 16 2HG2 ILE 16 -6.897 -1.382 2.657
111 3HG2 ILE 16 3HG2 ILE 16 -6.431 -2.689 3.746
112 1HD1 ILE 16 1HD1 ILE 16 -5.736 -6.007 3.561
113 2HD1 ILE 16 2HD1 ILE 16 -5.694 -4.290 3.963
114 3HD1 ILE 16 3HD1 ILE 16 -4.846 -4.882 2.535
115 H SER 17 H SER 17 -8.599 -0.796 1.769
116 HA SER 17 HA SER 17 -7.801 0.376 -0.791
117 1HB SER 17 2HB SER 17 -10.433 0.193 -0.284
118 2HB SER 17 1HB SER 17 -10.089 1.695 0.574
119 HG SER 17 HG SER 17 -9.981 2.654 -1.281
120 H PHE 18 H PHE 18 -7.154 2.618 -0.626
121 HA PHE 18 HA PHE 18 -6.627 3.562 2.099
122 1HB PHE 18 2HB PHE 18 -4.481 3.715 -0.004
123 2HB PHE 18 1HB PHE 18 -4.330 3.913 1.739
124 HD1 PHE 18 1HD PHE 18 -5.133 1.735 3.094
125 HD2 PHE 18 2HD PHE 18 -3.660 1.779 -0.898
126 HE1 PHE 18 1HE PHE 18 -4.497 -0.632 3.306
127 HE2 PHE 18 2HE PHE 18 -3.022 -0.589 -0.693
128 HZ PHE 18 HZ PHE 18 -3.440 -1.797 1.411
129 H ASN 19 H ASN 19 -6.792 5.725 2.364
130 HA ASN 19 HA ASN 19 -7.934 7.253 0.222
131 1HB ASN 19 2HB ASN 19 -7.040 8.256 2.929
132 2HB ASN 19 1HB ASN 19 -8.207 9.008 1.845
133 1HD2 ASN 19 1HD2 ASN 19 -9.849 7.057 1.123
134 2HD2 ASN 19 2HD2 ASN 19 -10.643 6.359 2.490
135 H TYR 20 H TYR 20 -4.777 6.848 1.584
136 HA TYR 20 HA TYR 20 -3.774 9.135 0.030
137 1HB TYR 20 2HB TYR 20 -2.411 7.607 2.258
138 2HB TYR 20 1HB TYR 20 -1.778 9.033 1.442
139 HD1 TYR 20 1HD TYR 20 -2.322 11.185 2.204
140 HD2 TYR 20 2HD TYR 20 -4.566 7.847 3.591
141 HE1 TYR 20 1HE TYR 20 -3.438 12.629 3.853
142 HE2 TYR 20 2HE TYR 20 -5.688 9.282 5.244
143 HH TYR 20 HH TYR 20 -5.538 12.661 5.150
144 H VAL 21 H VAL 21 -2.509 8.812 -1.692
145 HA VAL 21 HA VAL 21 -2.225 6.299 -2.877
146 HB VAL 21 HB VAL 21 -0.466 8.700 -3.395
147 1HG1 VAL 21 1HG1 VAL 21 0.507 7.024 -4.616
148 2HG1 VAL 21 2HG1 VAL 21 -0.689 7.606 -5.774
149 3HG1 VAL 21 3HG1 VAL 21 -1.010 6.150 -4.832
150 1HG2 VAL 21 1HG2 VAL 21 -3.208 8.669 -3.550
151 2HG2 VAL 21 2HG2 VAL 21 -2.721 8.269 -5.196
152 3HG2 VAL 21 3HG2 VAL 21 -2.141 9.753 -4.441
153 H LYS 22 H LYS 22 -0.086 8.094 -0.743
154 HA LYS 22 HA LYS 22 2.270 6.656 -1.072
155 1HB LYS 22 2HB LYS 22 1.219 7.774 1.532
156 2HB LYS 22 1HB LYS 22 2.898 7.437 1.138
157 1HG LYS 22 2HG LYS 22 2.992 9.612 0.639
158 2HG LYS 22 1HG LYS 22 2.216 9.130 -0.871
159 1HD LYS 22 2HD LYS 22 0.063 9.396 0.760
160 2HD LYS 22 1HD LYS 22 1.140 10.629 1.419
161 1HE LYS 22 2HE LYS 22 0.513 10.393 -1.515
162 2HE LYS 22 1HE LYS 22 -0.433 11.388 -0.407
163 1HZ LYS 22 1HZ LYS 22 2.004 12.254 0.154
164 2HZ LYS 22 2HZ LYS 22 1.046 12.940 -1.059
165 3HZ LYS 22 3HZ LYS 22 2.244 11.817 -1.462
166 H THR 23 H THR 23 -0.638 5.857 0.690
167 HA THR 23 HA THR 23 0.386 3.711 2.211
168 HB THR 23 HB THR 23 -2.433 4.005 1.170
169 HG1 THR 23 1HG THR 23 -2.818 5.291 2.941
170 1HG2 THR 23 1HG2 THR 23 -3.070 2.940 3.278
171 2HG2 THR 23 2HG2 THR 23 -1.366 2.716 3.670
172 3HG2 THR 23 3HG2 THR 23 -2.067 1.890 2.277
173 H TYR 24 H TYR 24 -1.310 3.798 -0.912
174 HA TYR 24 HA TYR 24 -1.217 1.017 -1.381
175 1HB TYR 24 2HB TYR 24 -2.624 2.846 -2.560
176 2HB TYR 24 1HB TYR 24 -1.210 3.062 -3.587
177 HD1 TYR 24 1HD TYR 24 -3.830 0.671 -2.561
178 HD2 TYR 24 2HD TYR 24 -0.676 1.490 -5.296
179 HE1 TYR 24 1HE TYR 24 -4.572 -1.203 -3.970
180 HE2 TYR 24 2HE TYR 24 -1.409 -0.381 -6.712
181 HH TYR 24 HH TYR 24 -3.175 -2.783 -5.819
182 H LEU 25 H LEU 25 1.016 3.630 -2.031
183 HA LEU 25 HA LEU 25 2.735 2.327 -3.813
184 1HB LEU 25 2HB LEU 25 3.245 4.482 -1.773
185 2HB LEU 25 1HB LEU 25 4.475 3.925 -2.891
186 HG LEU 25 HG LEU 25 1.849 5.196 -3.672
187 1HD1 LEU 25 1HD1 LEU 25 2.998 7.168 -4.093
188 2HD1 LEU 25 2HD1 LEU 25 4.571 6.371 -4.082
189 3HD1 LEU 25 3HD1 LEU 25 3.696 6.616 -2.570
190 1HD2 LEU 25 1HD2 LEU 25 2.274 3.975 -5.535
191 2HD2 LEU 25 2HD2 LEU 25 3.999 3.843 -5.192
192 3HD2 LEU 25 3HD2 LEU 25 3.347 5.332 -5.876
193 H ALA 26 H ALA 26 3.272 2.836 -0.339
194 HA ALA 26 HA ALA 26 5.407 1.080 -0.079
195 1HB ALA 26 1HB ALA 26 5.074 2.596 1.679
196 2HB ALA 26 2HB ALA 26 4.708 1.017 2.373
197 3HB ALA 26 3HB ALA 26 3.398 2.099 1.901
198 H HIS 27 H HIS 27 2.050 0.459 -0.393
199 HA HIS 27 HA HIS 27 2.043 -2.143 0.792
200 1HB HIS 27 2HB HIS 27 -0.016 -0.834 0.645
201 2HB HIS 27 1HB HIS 27 0.091 -0.827 -1.111
202 HD1 HIS 27 1HD HIS 27 -1.062 -2.893 1.748
203 HD2 HIS 27 2HD HIS 27 -0.490 -3.307 -2.347
204 HE1 HIS 27 1HE HIS 27 -2.285 -5.000 1.070
205 H LYS 28 H LYS 28 1.628 -1.116 -2.605
206 HA LYS 28 HA LYS 28 2.050 -3.696 -3.663
207 1HB LYS 28 2HB LYS 28 2.355 -2.504 -5.834
208 2HB LYS 28 1HB LYS 28 0.888 -2.054 -4.975
209 1HG LYS 28 2HG LYS 28 1.529 0.042 -5.400
210 2HG LYS 28 1HG LYS 28 2.644 -0.194 -4.053
211 1HD LYS 28 2HD LYS 28 4.456 -0.295 -5.400
212 2HD LYS 28 1HD LYS 28 3.588 -1.154 -6.675
213 1HE LYS 28 2HE LYS 28 2.378 1.274 -6.757
214 2HE LYS 28 1HE LYS 28 4.014 1.728 -6.281
215 1HZ LYS 28 1HZ LYS 28 4.690 0.184 -8.217
216 2HZ LYS 28 2HZ LYS 28 4.130 1.742 -8.566
217 3HZ LYS 28 3HZ LYS 28 3.100 0.413 -8.751
218 H GLN 29 H GLN 29 4.223 -1.378 -2.425
219 HA GLN 29 HA GLN 29 6.509 -1.937 -3.977
220 1HB GLN 29 2HB GLN 29 6.012 -0.711 -1.300
221 2HB GLN 29 1HB GLN 29 7.657 -1.161 -1.726
222 1HG GLN 29 2HG GLN 29 7.732 0.344 -3.511
223 2HG GLN 29 1HG GLN 29 5.980 0.537 -3.535
224 1HE2 GLN 29 1HE2 GLN 29 6.134 2.772 -3.387
225 2HE2 GLN 29 2HE2 GLN 29 6.582 3.570 -1.921
226 H PHE 30 H PHE 30 5.863 -2.979 -0.616
227 HA PHE 30 HA PHE 30 6.896 -5.625 -1.248
228 1HB PHE 30 2HB PHE 30 8.279 -5.299 1.000
229 2HB PHE 30 1HB PHE 30 8.956 -4.929 -0.580
230 HD1 PHE 30 1HD PHE 30 7.381 -3.452 2.417
231 HD2 PHE 30 2HD PHE 30 9.604 -2.735 -1.141
232 HE1 PHE 30 1HE PHE 30 7.813 -1.145 3.156
233 HE2 PHE 30 2HE PHE 30 10.041 -0.427 -0.407
234 HZ PHE 30 HZ PHE 30 9.145 0.370 1.744
235 H TYR 31 H TYR 31 4.395 -4.173 -0.147
236 HA TYR 31 HA TYR 31 4.104 -5.765 2.309
237 1HB TYR 31 2HB TYR 31 3.534 -3.084 1.844
238 2HB TYR 31 1HB TYR 31 1.957 -3.864 1.798
239 HD1 TYR 31 1HD TYR 31 5.067 -3.977 3.878
240 HD2 TYR 31 2HD TYR 31 0.813 -3.985 3.793
241 HE1 TYR 31 1HE TYR 31 5.024 -4.016 6.336
242 HE2 TYR 31 2HE TYR 31 0.758 -4.023 6.250
243 HH TYR 31 HH TYR 31 3.554 -4.622 8.144
244 H CYS 32 H CYS 32 3.015 -5.410 -0.926
245 HA CYS 32 HA CYS 32 0.554 -6.875 -0.532
246 1HB CYS 32 2HB CYS 32 0.872 -5.050 -2.256
247 2HB CYS 32 1HB CYS 32 1.888 -6.177 -3.148
248 H LYS 33 H LYS 33 0.098 -8.918 -1.496
249 HA LYS 33 HA LYS 33 2.455 -10.658 -1.584
250 1HB LYS 33 2HB LYS 33 -0.433 -11.520 -1.465
251 2HB LYS 33 1HB LYS 33 0.995 -12.478 -1.093
252 1HG LYS 33 2HG LYS 33 0.851 -10.106 0.554
253 2HG LYS 33 1HG LYS 33 -0.604 -11.094 0.700
254 1HD LYS 33 2HD LYS 33 2.161 -12.261 0.898
255 2HD LYS 33 1HD LYS 33 1.309 -11.611 2.300
256 1HE LYS 33 2HE LYS 33 -0.225 -13.300 2.326
257 2HE LYS 33 1HE LYS 33 -0.135 -13.555 0.583
258 1HZ LYS 33 1HZ LYS 33 2.006 -14.321 2.492
259 2HZ LYS 33 2HZ LYS 33 1.938 -14.687 0.842
260 3HZ LYS 33 3HZ LYS 33 0.826 -15.385 1.908
261 H ASN 34 H ASN 34 1.670 -8.941 -3.823
262 HA ASN 34 HA ASN 34 1.073 -11.020 -5.824
263 1HB ASN 34 2HB ASN 34 0.268 -8.137 -5.663
264 2HB ASN 34 1HB ASN 34 0.417 -8.915 -7.237
265 1HD2 ASN 34 1HD2 ASN 34 -0.752 -11.038 -7.417
266 2HD2 ASN 34 2HD2 ASN 34 -2.324 -11.126 -6.706
267 H LYS 35 H LYS 35 3.474 -11.347 -5.550
268 HA LYS 35 HA LYS 35 5.655 -11.038 -6.168
269 1HB LYS 35 2HB LYS 35 5.909 -10.611 -8.626
270 2HB LYS 35 1HB LYS 35 4.810 -11.920 -8.217
271 1HG LYS 35 2HG LYS 35 2.902 -10.532 -8.655
272 2HG LYS 35 1HG LYS 35 3.935 -9.121 -8.897
273 1HD LYS 35 2HD LYS 35 3.257 -9.992 -11.042
274 2HD LYS 35 1HD LYS 35 4.985 -10.270 -10.821
275 1HE LYS 35 2HE LYS 35 3.113 -12.412 -9.968
276 2HE LYS 35 1HE LYS 35 3.345 -12.166 -11.698
277 1HZ LYS 35 1HZ LYS 35 5.762 -12.270 -10.086
278 2HZ LYS 35 2HZ LYS 35 5.449 -12.926 -11.614
279 3HZ LYS 35 3HZ LYS 35 4.905 -13.723 -10.225
280 HA PRO 36 HA PRO 36 5.592 -6.407 -5.575
281 1HB PRO 36 2HB PRO 36 7.107 -6.398 -3.324
282 2HB PRO 36 1HB PRO 36 5.350 -6.583 -3.296
283 1HG PRO 36 2HG PRO 36 7.479 -8.679 -3.103
284 2HG PRO 36 1HG PRO 36 5.982 -8.516 -2.167
285 1HD PRO 36 2HD PRO 36 6.221 -10.234 -4.247
286 2HD PRO 36 1HD PRO 36 4.688 -9.435 -3.838
Start of MODEL 18
1 1H GLY 1 1HT GLY 1 -16.294 -4.857 -20.435
2 2H GLY 1 2HT GLY 1 -15.677 -3.360 -19.945
3 3H GLY 1 3HT GLY 1 -16.872 -3.431 -21.140
4 1HA GLY 1 1HA GLY 1 -18.197 -2.901 -19.399
5 2HA GLY 1 2HA GLY 1 -18.209 -4.652 -19.260
6 H SER 2 H SER 2 -18.807 -3.988 -17.001
7 HA SER 2 HA SER 2 -18.296 -3.885 -14.788
8 1HB SER 2 2HB SER 2 -15.869 -5.080 -16.019
9 2HB SER 2 1HB SER 2 -15.706 -4.473 -14.370
10 HG SER 2 HG SER 2 -16.450 -6.447 -14.006
11 H ALA 3 H ALA 3 -16.371 -2.948 -13.252
12 HA ALA 3 HA ALA 3 -15.219 -0.519 -14.319
13 1HB ALA 3 1HB ALA 3 -17.178 0.578 -13.900
14 2HB ALA 3 2HB ALA 3 -16.405 0.736 -12.323
15 3HB ALA 3 3HB ALA 3 -17.632 -0.504 -12.583
16 H ALA 4 H ALA 4 -13.332 -1.718 -13.651
17 HA ALA 4 HA ALA 4 -12.926 -1.797 -10.738
18 1HB ALA 4 1HB ALA 4 -11.297 -3.474 -11.056
19 2HB ALA 4 2HB ALA 4 -11.211 -3.170 -12.790
20 3HB ALA 4 3HB ALA 4 -12.651 -3.915 -12.096
21 H GLU 5 H GLU 5 -10.961 -1.255 -13.670
22 HA GLU 5 HA GLU 5 -9.284 0.211 -14.128
23 1HB GLU 5 2HB GLU 5 -11.157 1.821 -13.570
24 2HB GLU 5 1HB GLU 5 -10.463 1.948 -11.960
25 1HG GLU 5 2HG GLU 5 -8.282 2.543 -13.263
26 2HG GLU 5 1HG GLU 5 -9.406 2.934 -14.563
27 H VAL 6 H VAL 6 -7.431 -0.766 -13.518
28 HA VAL 6 HA VAL 6 -6.652 -1.328 -10.883
29 HB VAL 6 HB VAL 6 -5.648 -2.471 -12.781
30 1HG1 VAL 6 1HG1 VAL 6 -5.317 -1.120 -14.560
31 2HG1 VAL 6 2HG1 VAL 6 -3.706 -0.961 -13.860
32 3HG1 VAL 6 3HG1 VAL 6 -4.924 0.278 -13.561
33 1HG2 VAL 6 1HG2 VAL 6 -3.509 -0.920 -11.338
34 2HG2 VAL 6 2HG2 VAL 6 -3.388 -2.541 -12.020
35 3HG2 VAL 6 3HG2 VAL 6 -4.416 -2.250 -10.616
36 H MET 7 H MET 7 -4.842 -0.424 -9.698
37 HA MET 7 HA MET 7 -3.846 1.295 -8.588
38 1HB MET 7 2HB MET 7 -2.914 1.431 -11.079
39 2HB MET 7 1HB MET 7 -3.759 2.972 -11.049
40 1HG MET 7 2HG MET 7 -2.358 2.957 -8.674
41 2HG MET 7 1HG MET 7 -1.253 2.194 -9.815
42 1HE MET 7 1HE MET 7 -1.488 6.430 -9.044
43 2HE MET 7 2HE MET 7 -1.834 5.003 -8.067
44 3HE MET 7 3HE MET 7 -3.120 5.764 -9.005
45 H LYS 8 H LYS 8 -6.102 1.508 -7.687
46 HA LYS 8 HA LYS 8 -6.935 4.293 -7.992
47 1HB LYS 8 2HB LYS 8 -8.651 1.876 -8.393
48 2HB LYS 8 1HB LYS 8 -9.363 3.314 -7.675
49 1HG LYS 8 2HG LYS 8 -7.805 3.832 -10.096
50 2HG LYS 8 1HG LYS 8 -9.215 2.800 -10.341
51 1HD LYS 8 2HD LYS 8 -9.383 5.387 -8.822
52 2HD LYS 8 1HD LYS 8 -9.543 5.325 -10.579
53 1HE LYS 8 2HE LYS 8 -11.742 5.152 -9.956
54 2HE LYS 8 1HE LYS 8 -11.296 3.449 -10.031
55 1HZ LYS 8 1HZ LYS 8 -11.367 3.233 -7.783
56 2HZ LYS 8 2HZ LYS 8 -12.522 4.455 -7.957
57 3HZ LYS 8 3HZ LYS 8 -10.946 4.843 -7.483
58 H LYS 9 H LYS 9 -5.349 3.357 -6.005
59 HA LYS 9 HA LYS 9 -5.110 3.170 -3.745
60 1HB LYS 9 2HB LYS 9 -7.712 4.695 -3.622
61 2HB LYS 9 1HB LYS 9 -6.422 4.683 -2.427
62 1HG LYS 9 2HG LYS 9 -5.581 5.551 -5.092
63 2HG LYS 9 1HG LYS 9 -6.780 6.594 -4.324
64 1HD LYS 9 2HD LYS 9 -4.496 5.693 -2.661
65 2HD LYS 9 1HD LYS 9 -4.159 6.880 -3.923
66 1HE LYS 9 2HE LYS 9 -4.743 7.797 -1.632
67 2HE LYS 9 1HE LYS 9 -5.654 8.445 -2.996
68 1HZ LYS 9 1HZ LYS 9 -7.485 7.000 -2.448
69 2HZ LYS 9 2HZ LYS 9 -7.068 7.913 -1.085
70 3HZ LYS 9 3HZ LYS 9 -6.606 6.289 -1.188
71 H TYR 10 H TYR 10 -6.284 0.935 -4.890
72 HA TYR 10 HA TYR 10 -7.492 -0.265 -2.602
73 1HB TYR 10 2HB TYR 10 -9.452 0.903 -3.595
74 2HB TYR 10 1HB TYR 10 -9.213 -0.016 -5.077
75 HD1 TYR 10 1HD TYR 10 -9.189 -2.630 -4.777
76 HD2 TYR 10 2HD TYR 10 -10.918 0.090 -2.000
77 HE1 TYR 10 1HE TYR 10 -10.589 -4.442 -3.882
78 HE2 TYR 10 2HE TYR 10 -12.321 -1.714 -1.097
79 HH TYR 10 HH TYR 10 -12.784 -4.639 -2.652
80 H CYS 11 H CYS 11 -6.414 -2.120 -2.557
81 HA CYS 11 HA CYS 11 -5.506 -3.372 -5.008
82 1HB CYS 11 2HB CYS 11 -4.170 -3.189 -2.816
83 2HB CYS 11 1HB CYS 11 -5.189 -4.501 -2.232
84 H SER 12 H SER 12 -7.121 -4.353 -6.094
85 HA SER 12 HA SER 12 -9.375 -5.575 -4.997
86 1HB SER 12 2HB SER 12 -9.050 -4.901 -7.404
87 2HB SER 12 1HB SER 12 -8.068 -6.351 -7.610
88 HG SER 12 HG SER 12 -10.176 -6.816 -8.202
89 H THR 13 H THR 13 -6.199 -6.901 -5.756
90 HA THR 13 HA THR 13 -6.832 -9.618 -5.394
91 HB THR 13 HB THR 13 -4.122 -8.715 -4.608
92 HG1 THR 13 1HG THR 13 -3.864 -7.479 -6.261
93 1HG2 THR 13 1HG2 THR 13 -3.445 -10.387 -6.292
94 2HG2 THR 13 2HG2 THR 13 -5.149 -10.718 -6.601
95 3HG2 THR 13 3HG2 THR 13 -4.460 -11.051 -5.012
96 H CYS 14 H CYS 14 -5.372 -7.280 -3.137
97 HA CYS 14 HA CYS 14 -5.459 -9.100 -0.936
98 1HB CYS 14 2HB CYS 14 -4.891 -6.148 -1.162
99 2HB CYS 14 1HB CYS 14 -4.856 -7.010 0.366
100 H ASP 15 H ASP 15 -7.596 -6.713 -2.270
101 HA ASP 15 HA ASP 15 -9.785 -6.251 -1.823
102 1HB ASP 15 2HB ASP 15 -9.642 -8.770 -0.944
103 2HB ASP 15 1HB ASP 15 -9.891 -7.973 0.607
104 H ILE 16 H ILE 16 -8.064 -4.431 -1.044
105 HA ILE 16 HA ILE 16 -9.257 -3.371 1.386
106 HB ILE 16 HB ILE 16 -6.262 -3.316 1.194
107 1HG1 ILE 16 2HG1 ILE 16 -7.917 -5.385 2.661
108 2HG1 ILE 16 1HG1 ILE 16 -6.943 -5.689 1.226
109 1HG2 ILE 16 1HG2 ILE 16 -6.788 -1.797 2.788
110 2HG2 ILE 16 2HG2 ILE 16 -6.833 -3.239 3.804
111 3HG2 ILE 16 3HG2 ILE 16 -8.332 -2.563 3.166
112 1HD1 ILE 16 1HD1 ILE 16 -5.985 -6.316 3.514
113 2HD1 ILE 16 2HD1 ILE 16 -5.712 -4.585 3.717
114 3HD1 ILE 16 3HD1 ILE 16 -4.946 -5.448 2.383
115 H SER 17 H SER 17 -8.643 -1.077 1.741
116 HA SER 17 HA SER 17 -7.783 0.274 -0.725
117 1HB SER 17 2HB SER 17 -10.396 0.180 -0.088
118 2HB SER 17 1HB SER 17 -9.922 1.589 0.861
119 HG SER 17 HG SER 17 -9.150 2.546 -1.031
120 H PHE 18 H PHE 18 -6.903 2.384 -0.420
121 HA PHE 18 HA PHE 18 -6.263 3.108 2.351
122 1HB PHE 18 2HB PHE 18 -4.180 3.169 0.170
123 2HB PHE 18 1HB PHE 18 -3.942 3.379 1.901
124 HD1 PHE 18 1HD PHE 18 -5.266 1.179 3.131
125 HD2 PHE 18 2HD PHE 18 -3.106 1.270 -0.534
126 HE1 PHE 18 1HE PHE 18 -4.788 -1.224 3.358
127 HE2 PHE 18 2HE PHE 18 -2.627 -1.132 -0.316
128 HZ PHE 18 HZ PHE 18 -3.468 -2.383 1.632
129 H ASN 19 H ASN 19 -7.011 5.094 2.651
130 HA ASN 19 HA ASN 19 -7.762 6.866 0.621
131 1HB ASN 19 2HB ASN 19 -7.762 8.587 2.502
132 2HB ASN 19 1HB ASN 19 -8.768 7.162 2.744
133 1HD2 ASN 19 1HD2 ASN 19 -8.669 7.685 4.995
134 2HD2 ASN 19 2HD2 ASN 19 -7.296 7.215 5.932
135 H TYR 20 H TYR 20 -4.728 6.428 2.296
136 HA TYR 20 HA TYR 20 -3.586 8.845 1.148
137 1HB TYR 20 2HB TYR 20 -2.019 6.778 2.658
138 2HB TYR 20 1HB TYR 20 -1.746 8.513 2.552
139 HD1 TYR 20 1HD TYR 20 -3.993 9.866 3.420
140 HD2 TYR 20 2HD TYR 20 -2.647 6.055 4.747
141 HE1 TYR 20 1HE TYR 20 -5.190 10.190 5.543
142 HE2 TYR 20 2HE TYR 20 -3.842 6.367 6.873
143 HH TYR 20 HH TYR 20 -6.194 8.595 7.352
144 H VAL 21 H VAL 21 -2.628 8.887 -0.765
145 HA VAL 21 HA VAL 21 -2.380 6.666 -2.442
146 HB VAL 21 HB VAL 21 -0.776 9.217 -2.647
147 1HG1 VAL 21 1HG1 VAL 21 -1.744 7.837 -5.056
148 2HG1 VAL 21 2HG1 VAL 21 -0.515 6.972 -4.132
149 3HG1 VAL 21 3HG1 VAL 21 -0.188 8.599 -4.729
150 1HG2 VAL 21 1HG2 VAL 21 -3.205 8.983 -4.262
151 2HG2 VAL 21 2HG2 VAL 21 -2.581 10.352 -3.341
152 3HG2 VAL 21 3HG2 VAL 21 -3.504 9.089 -2.527
153 H LYS 22 H LYS 22 -0.013 8.252 -0.349
154 HA LYS 22 HA LYS 22 2.279 6.904 -1.163
155 1HB LYS 22 2HB LYS 22 3.034 7.268 1.263
156 2HB LYS 22 1HB LYS 22 2.633 8.688 0.308
157 1HG LYS 22 2HG LYS 22 0.239 7.996 1.522
158 2HG LYS 22 1HG LYS 22 1.459 7.710 2.763
159 1HD LYS 22 2HD LYS 22 1.859 9.899 3.031
160 2HD LYS 22 1HD LYS 22 1.854 10.205 1.294
161 1HE LYS 22 2HE LYS 22 0.012 11.406 1.957
162 2HE LYS 22 1HE LYS 22 -0.726 9.860 1.542
163 1HZ LYS 22 1HZ LYS 22 -1.628 10.429 3.601
164 2HZ LYS 22 2HZ LYS 22 -0.146 10.953 4.227
165 3HZ LYS 22 3HZ LYS 22 -0.427 9.302 3.987
166 H THR 23 H THR 23 -0.377 5.831 0.811
167 HA THR 23 HA THR 23 0.886 3.560 1.950
168 HB THR 23 HB THR 23 -2.044 4.058 1.394
169 HG1 THR 23 1HG THR 23 -0.451 4.590 3.679
170 1HG2 THR 23 1HG2 THR 23 -0.703 2.108 3.247
171 2HG2 THR 23 2HG2 THR 23 -1.774 1.746 1.894
172 3HG2 THR 23 3HG2 THR 23 -2.409 2.546 3.332
173 H TYR 24 H TYR 24 -1.237 3.977 -0.873
174 HA TYR 24 HA TYR 24 -1.283 1.291 -1.675
175 1HB TYR 24 2HB TYR 24 -2.671 3.332 -2.514
176 2HB TYR 24 1HB TYR 24 -1.353 3.544 -3.661
177 HD1 TYR 24 1HD TYR 24 -3.665 0.888 -2.411
178 HD2 TYR 24 2HD TYR 24 -1.488 2.471 -5.705
179 HE1 TYR 24 1HE TYR 24 -4.689 -0.792 -3.886
180 HE2 TYR 24 2HE TYR 24 -2.507 0.797 -7.191
181 HH TYR 24 HH TYR 24 -4.309 -1.873 -5.991
182 H LEU 25 H LEU 25 1.037 3.846 -2.199
183 HA LEU 25 HA LEU 25 2.532 2.528 -4.225
184 1HB LEU 25 2HB LEU 25 2.538 5.040 -3.198
185 2HB LEU 25 1HB LEU 25 3.965 4.376 -2.427
186 HG LEU 25 HG LEU 25 4.485 3.624 -4.940
187 1HD1 LEU 25 1HD1 LEU 25 2.536 4.493 -5.979
188 2HD1 LEU 25 2HD1 LEU 25 3.871 5.558 -6.419
189 3HD1 LEU 25 3HD1 LEU 25 2.722 6.051 -5.175
190 1HD2 LEU 25 1HD2 LEU 25 6.076 4.848 -3.727
191 2HD2 LEU 25 2HD2 LEU 25 5.014 6.249 -3.580
192 3HD2 LEU 25 3HD2 LEU 25 5.727 5.842 -5.141
193 H ALA 26 H ALA 26 3.173 3.011 -0.770
194 HA ALA 26 HA ALA 26 5.390 1.318 -0.627
195 1HB ALA 26 1HB ALA 26 3.671 1.545 1.767
196 2HB ALA 26 2HB ALA 26 4.297 3.046 1.087
197 3HB ALA 26 3HB ALA 26 5.411 1.777 1.594
198 H HIS 27 H HIS 27 2.043 0.647 -0.855
199 HA HIS 27 HA HIS 27 2.036 -1.915 0.383
200 1HB HIS 27 2HB HIS 27 -0.024 -0.608 0.066
201 2HB HIS 27 1HB HIS 27 0.152 -0.750 -1.680
202 HD1 HIS 27 1HD HIS 27 -1.068 -2.595 1.305
203 HD2 HIS 27 2HD HIS 27 -0.370 -3.323 -2.725
204 HE1 HIS 27 1HE HIS 27 -2.244 -4.767 0.762
205 H LYS 28 H LYS 28 1.764 -1.034 -3.069
206 HA LYS 28 HA LYS 28 2.239 -3.642 -4.011
207 1HB LYS 28 2HB LYS 28 2.839 -1.089 -5.505
208 2HB LYS 28 1HB LYS 28 2.457 -2.661 -6.191
209 1HG LYS 28 2HG LYS 28 0.394 -1.621 -4.401
210 2HG LYS 28 1HG LYS 28 0.687 -0.620 -5.825
211 1HD LYS 28 2HD LYS 28 -0.679 -2.024 -6.902
212 2HD LYS 28 1HD LYS 28 0.657 -3.174 -6.856
213 1HE LYS 28 2HE LYS 28 -1.236 -4.317 -6.013
214 2HE LYS 28 1HE LYS 28 -0.228 -3.930 -4.619
215 1HZ LYS 28 1HZ LYS 28 -1.872 -1.781 -4.823
216 2HZ LYS 28 2HZ LYS 28 -2.084 -3.080 -3.760
217 3HZ LYS 28 3HZ LYS 28 -2.892 -3.064 -5.246
218 H GLN 29 H GLN 29 4.366 -1.231 -2.812
219 HA GLN 29 HA GLN 29 6.729 -1.877 -4.168
220 1HB GLN 29 2HB GLN 29 6.059 -0.551 -1.588
221 2HB GLN 29 1HB GLN 29 7.719 -1.077 -1.826
222 1HG GLN 29 2HG GLN 29 7.944 0.288 -3.774
223 2HG GLN 29 1HG GLN 29 6.228 0.691 -3.747
224 1HE2 GLN 29 1HE2 GLN 29 9.204 0.964 -1.864
225 2HE2 GLN 29 2HE2 GLN 29 8.806 2.472 -1.120
226 H PHE 30 H PHE 30 5.901 -2.824 -0.822
227 HA PHE 30 HA PHE 30 6.866 -5.513 -1.317
228 1HB PHE 30 2HB PHE 30 8.269 -5.122 0.911
229 2HB PHE 30 1HB PHE 30 8.953 -4.869 -0.689
230 HD1 PHE 30 1HD PHE 30 7.154 -3.041 2.011
231 HD2 PHE 30 2HD PHE 30 9.985 -2.861 -1.162
232 HE1 PHE 30 1HE PHE 30 7.674 -0.713 2.612
233 HE2 PHE 30 2HE PHE 30 10.512 -0.532 -0.565
234 HZ PHE 30 HZ PHE 30 9.355 0.544 1.324
235 H TYR 31 H TYR 31 4.398 -4.006 -0.353
236 HA TYR 31 HA TYR 31 4.072 -5.382 2.229
237 1HB TYR 31 2HB TYR 31 3.535 -2.734 1.538
238 2HB TYR 31 1HB TYR 31 1.952 -3.504 1.579
239 HD1 TYR 31 1HD TYR 31 5.039 -3.908 3.654
240 HD2 TYR 31 2HD TYR 31 0.883 -2.999 3.559
241 HE1 TYR 31 1HE TYR 31 5.025 -3.738 6.106
242 HE2 TYR 31 2HE TYR 31 0.859 -2.825 6.012
243 HH TYR 31 HH TYR 31 3.695 -2.673 7.872
244 H CYS 32 H CYS 32 2.848 -5.075 -1.005
245 HA CYS 32 HA CYS 32 0.350 -6.318 -0.671
246 1HB CYS 32 2HB CYS 32 1.169 -5.049 -2.702
247 2HB CYS 32 1HB CYS 32 2.084 -6.488 -3.136
248 H LYS 33 H LYS 33 -0.255 -8.387 -0.458
249 HA LYS 33 HA LYS 33 1.858 -10.410 -0.338
250 1HB LYS 33 2HB LYS 33 -1.007 -10.678 0.574
251 2HB LYS 33 1HB LYS 33 0.344 -11.729 0.976
252 1HG LYS 33 2HG LYS 33 1.171 -10.304 2.542
253 2HG LYS 33 1HG LYS 33 0.563 -8.868 1.717
254 1HD LYS 33 2HD LYS 33 -0.648 -9.221 3.792
255 2HD LYS 33 1HD LYS 33 -1.722 -9.457 2.412
256 1HE LYS 33 2HE LYS 33 -0.997 -11.962 2.673
257 2HE LYS 33 1HE LYS 33 -0.601 -11.462 4.317
258 1HZ LYS 33 1HZ LYS 33 -3.199 -11.741 3.037
259 2HZ LYS 33 2HZ LYS 33 -3.026 -10.431 4.091
260 3HZ LYS 33 3HZ LYS 33 -2.750 -12.004 4.648
261 H ASN 34 H ASN 34 0.944 -9.496 -2.892
262 HA ASN 34 HA ASN 34 0.293 -12.050 -4.056
263 1HB ASN 34 2HB ASN 34 -1.882 -10.586 -3.390
264 2HB ASN 34 1HB ASN 34 -1.562 -9.942 -4.997
265 1HD2 ASN 34 1HD2 ASN 34 -2.745 -12.573 -3.175
266 2HD2 ASN 34 2HD2 ASN 34 -3.169 -13.597 -4.500
267 H LYS 35 H LYS 35 2.332 -11.749 -5.024
268 HA LYS 35 HA LYS 35 2.288 -10.589 -7.582
269 1HB LYS 35 2HB LYS 35 2.602 -8.614 -5.791
270 2HB LYS 35 1HB LYS 35 4.283 -9.098 -5.966
271 1HG LYS 35 2HG LYS 35 2.573 -8.512 -8.356
272 2HG LYS 35 1HG LYS 35 3.397 -7.228 -7.469
273 1HD LYS 35 2HD LYS 35 5.004 -9.594 -8.257
274 2HD LYS 35 1HD LYS 35 4.515 -8.480 -9.536
275 1HE LYS 35 2HE LYS 35 5.877 -7.600 -6.999
276 2HE LYS 35 1HE LYS 35 6.750 -8.007 -8.477
277 1HZ LYS 35 1HZ LYS 35 5.146 -5.668 -7.856
278 2HZ LYS 35 2HZ LYS 35 4.962 -6.283 -9.422
279 3HZ LYS 35 3HZ LYS 35 6.493 -5.822 -8.869
280 HA PRO 36 HA PRO 36 5.512 -13.812 -6.803
281 1HB PRO 36 2HB PRO 36 4.989 -15.224 -9.061
282 2HB PRO 36 1HB PRO 36 4.098 -15.461 -7.553
283 1HG PRO 36 2HG PRO 36 3.331 -13.879 -9.977
284 2HG PRO 36 1HG PRO 36 2.339 -14.971 -8.993
285 1HD PRO 36 2HD PRO 36 2.235 -12.279 -8.731
286 2HD PRO 36 1HD PRO 36 1.981 -13.380 -7.362
Start of MODEL 19
1 1H GLY 1 1HT GLY 1 -10.881 -4.169 -25.125
2 2H GLY 1 2HT GLY 1 -10.212 -5.081 -23.867
3 3H GLY 1 3HT GLY 1 -9.649 -5.281 -25.449
4 1HA GLY 1 1HA GLY 1 -8.002 -3.978 -24.534
5 2HA GLY 1 2HA GLY 1 -9.042 -2.808 -25.334
6 H SER 2 H SER 2 -8.986 -1.031 -24.115
7 HA SER 2 HA SER 2 -8.696 -1.083 -21.279
8 1HB SER 2 2HB SER 2 -9.493 1.445 -21.729
9 2HB SER 2 1HB SER 2 -7.849 0.894 -22.049
10 HG SER 2 HG SER 2 -8.178 1.262 -24.081
11 H ALA 3 H ALA 3 -10.285 0.268 -19.909
12 HA ALA 3 HA ALA 3 -13.028 0.322 -20.603
13 1HB ALA 3 1HB ALA 3 -12.484 -1.795 -18.562
14 2HB ALA 3 2HB ALA 3 -12.469 -2.190 -20.281
15 3HB ALA 3 3HB ALA 3 -13.926 -1.527 -19.541
16 H ALA 4 H ALA 4 -11.112 2.058 -19.413
17 HA ALA 4 HA ALA 4 -11.009 3.636 -17.777
18 1HB ALA 4 1HB ALA 4 -13.007 4.381 -17.144
19 2HB ALA 4 2HB ALA 4 -13.327 2.921 -16.209
20 3HB ALA 4 3HB ALA 4 -13.705 2.965 -17.931
21 H GLU 5 H GLU 5 -12.659 1.068 -15.952
22 HA GLU 5 HA GLU 5 -12.065 -0.109 -14.101
23 1HB GLU 5 2HB GLU 5 -10.224 -0.820 -15.695
24 2HB GLU 5 1HB GLU 5 -9.201 0.378 -14.915
25 1HG GLU 5 2HG GLU 5 -10.534 -1.451 -13.062
26 2HG GLU 5 1HG GLU 5 -9.410 -2.228 -14.176
27 H VAL 6 H VAL 6 -12.438 0.803 -12.199
28 HA VAL 6 HA VAL 6 -11.492 3.365 -11.456
29 HB VAL 6 HB VAL 6 -12.567 1.254 -9.587
30 1HG1 VAL 6 1HG1 VAL 6 -13.382 3.243 -8.336
31 2HG1 VAL 6 2HG1 VAL 6 -12.484 4.264 -9.460
32 3HG1 VAL 6 3HG1 VAL 6 -11.623 3.127 -8.422
33 1HG2 VAL 6 1HG2 VAL 6 -14.763 2.541 -10.029
34 2HG2 VAL 6 2HG2 VAL 6 -14.229 1.344 -11.210
35 3HG2 VAL 6 3HG2 VAL 6 -13.972 3.061 -11.518
36 H MET 7 H MET 7 -10.008 3.963 -9.847
37 HA MET 7 HA MET 7 -8.281 1.938 -8.691
38 1HB MET 7 2HB MET 7 -7.292 3.989 -10.670
39 2HB MET 7 1HB MET 7 -6.227 3.166 -9.538
40 1HG MET 7 2HG MET 7 -7.971 1.749 -11.536
41 2HG MET 7 1HG MET 7 -6.289 2.188 -11.827
42 1HE MET 7 1HE MET 7 -4.178 0.648 -10.828
43 2HE MET 7 2HE MET 7 -4.389 0.123 -9.157
44 3HE MET 7 3HE MET 7 -4.677 1.807 -9.595
45 H LYS 8 H LYS 8 -9.621 3.022 -6.956
46 HA LYS 8 HA LYS 8 -8.569 5.622 -6.140
47 1HB LYS 8 2HB LYS 8 -10.777 3.958 -4.915
48 2HB LYS 8 1HB LYS 8 -10.349 5.600 -4.455
49 1HG LYS 8 2HG LYS 8 -10.965 5.222 -7.302
50 2HG LYS 8 1HG LYS 8 -12.313 4.961 -6.193
51 1HD LYS 8 2HD LYS 8 -10.599 7.382 -5.861
52 2HD LYS 8 1HD LYS 8 -11.809 7.352 -7.145
53 1HE LYS 8 2HE LYS 8 -13.268 6.438 -5.060
54 2HE LYS 8 1HE LYS 8 -12.144 7.508 -4.223
55 1HZ LYS 8 1HZ LYS 8 -13.050 9.331 -5.153
56 2HZ LYS 8 2HZ LYS 8 -14.412 8.342 -5.316
57 3HZ LYS 8 3HZ LYS 8 -13.375 8.575 -6.631
58 H LYS 9 H LYS 9 -6.630 3.767 -6.031
59 HA LYS 9 HA LYS 9 -5.053 2.830 -4.686
60 1HB LYS 9 2HB LYS 9 -6.322 4.416 -2.454
61 2HB LYS 9 1HB LYS 9 -4.659 3.853 -2.554
62 1HG LYS 9 2HG LYS 9 -5.947 5.958 -4.279
63 2HG LYS 9 1HG LYS 9 -4.761 6.220 -2.998
64 1HD LYS 9 2HD LYS 9 -3.040 5.200 -4.237
65 2HD LYS 9 1HD LYS 9 -4.180 4.473 -5.373
66 1HE LYS 9 2HE LYS 9 -4.756 6.708 -6.206
67 2HE LYS 9 1HE LYS 9 -3.595 7.419 -5.085
68 1HZ LYS 9 1HZ LYS 9 -2.004 5.731 -6.309
69 2HZ LYS 9 2HZ LYS 9 -2.305 7.275 -6.928
70 3HZ LYS 9 3HZ LYS 9 -3.125 5.937 -7.558
71 H TYR 10 H TYR 10 -7.286 1.268 -5.109
72 HA TYR 10 HA TYR 10 -7.612 -0.103 -2.525
73 1HB TYR 10 2HB TYR 10 -9.740 0.790 -3.289
74 2HB TYR 10 1HB TYR 10 -9.526 0.035 -4.864
75 HD1 TYR 10 1HD TYR 10 -9.782 -2.393 -5.122
76 HD2 TYR 10 2HD TYR 10 -10.476 -0.486 -1.385
77 HE1 TYR 10 1HE TYR 10 -10.952 -4.402 -4.322
78 HE2 TYR 10 2HE TYR 10 -11.648 -2.489 -0.572
79 HH TYR 10 HH TYR 10 -12.932 -4.467 -1.728
80 H CYS 11 H CYS 11 -6.627 -2.000 -2.408
81 HA CYS 11 HA CYS 11 -5.626 -3.276 -4.808
82 1HB CYS 11 2HB CYS 11 -4.321 -3.046 -2.633
83 2HB CYS 11 1HB CYS 11 -5.376 -4.293 -1.977
84 H SER 12 H SER 12 -7.158 -4.331 -5.933
85 HA SER 12 HA SER 12 -9.439 -5.560 -4.894
86 1HB SER 12 2HB SER 12 -7.987 -5.626 -7.481
87 2HB SER 12 1HB SER 12 -9.102 -6.956 -7.172
88 HG SER 12 HG SER 12 -10.641 -5.198 -6.608
89 H THR 13 H THR 13 -6.211 -6.839 -5.482
90 HA THR 13 HA THR 13 -6.800 -9.560 -5.083
91 HB THR 13 HB THR 13 -4.179 -8.260 -4.364
92 HG1 THR 13 1HG THR 13 -3.659 -8.460 -6.575
93 1HG2 THR 13 1HG2 THR 13 -5.014 -10.988 -5.207
94 2HG2 THR 13 2HG2 THR 13 -3.899 -10.491 -3.934
95 3HG2 THR 13 3HG2 THR 13 -3.406 -10.397 -5.625
96 H CYS 14 H CYS 14 -5.623 -7.085 -2.816
97 HA CYS 14 HA CYS 14 -5.750 -8.878 -0.576
98 1HB CYS 14 2HB CYS 14 -5.186 -5.933 -0.863
99 2HB CYS 14 1HB CYS 14 -5.257 -6.733 0.699
100 H ASP 15 H ASP 15 -7.846 -6.565 -2.088
101 HA ASP 15 HA ASP 15 -10.061 -6.125 -1.771
102 1HB ASP 15 2HB ASP 15 -10.101 -8.578 -0.990
103 2HB ASP 15 1HB ASP 15 -10.077 -7.924 0.645
104 H ILE 16 H ILE 16 -8.350 -4.284 -0.910
105 HA ILE 16 HA ILE 16 -9.743 -3.137 1.367
106 HB ILE 16 HB ILE 16 -6.746 -3.124 1.475
107 1HG1 ILE 16 2HG1 ILE 16 -8.568 -5.156 2.787
108 2HG1 ILE 16 1HG1 ILE 16 -7.423 -5.489 1.492
109 1HG2 ILE 16 1HG2 ILE 16 -7.660 -1.488 2.865
110 2HG2 ILE 16 2HG2 ILE 16 -7.343 -2.842 3.950
111 3HG2 ILE 16 3HG2 ILE 16 -8.984 -2.535 3.380
112 1HD1 ILE 16 1HD1 ILE 16 -6.843 -5.973 4.006
113 2HD1 ILE 16 2HD1 ILE 16 -6.397 -4.267 3.994
114 3HD1 ILE 16 3HD1 ILE 16 -5.619 -5.389 2.877
115 H SER 17 H SER 17 -9.158 -0.850 1.705
116 HA SER 17 HA SER 17 -8.317 0.407 -0.822
117 1HB SER 17 2HB SER 17 -9.936 2.034 -0.563
118 2HB SER 17 1HB SER 17 -10.750 0.662 0.184
119 HG SER 17 HG SER 17 -10.726 2.714 1.395
120 H PHE 18 H PHE 18 -7.491 2.711 -0.467
121 HA PHE 18 HA PHE 18 -6.040 3.048 2.042
122 1HB PHE 18 2HB PHE 18 -4.677 2.965 -0.657
123 2HB PHE 18 1HB PHE 18 -3.910 3.478 0.842
124 HD1 PHE 18 1HD PHE 18 -3.902 1.767 2.776
125 HD2 PHE 18 2HD PHE 18 -4.597 0.745 -1.296
126 HE1 PHE 18 1HE PHE 18 -3.285 -0.565 3.261
127 HE2 PHE 18 2HE PHE 18 -3.981 -1.589 -0.819
128 HZ PHE 18 HZ PHE 18 -3.326 -2.247 1.462
129 H ASN 19 H ASN 19 -6.743 4.981 2.668
130 HA ASN 19 HA ASN 19 -7.737 6.995 1.004
131 1HB ASN 19 2HB ASN 19 -8.166 6.807 3.455
132 2HB ASN 19 1HB ASN 19 -6.518 7.355 3.750
133 1HD2 ASN 19 1HD2 ASN 19 -9.085 8.386 1.527
134 2HD2 ASN 19 2HD2 ASN 19 -9.075 10.043 2.016
135 H TYR 20 H TYR 20 -4.503 6.504 2.346
136 HA TYR 20 HA TYR 20 -3.521 8.888 0.984
137 1HB TYR 20 2HB TYR 20 -1.898 6.951 2.632
138 2HB TYR 20 1HB TYR 20 -1.514 8.623 2.237
139 HD1 TYR 20 1HD TYR 20 -2.366 10.427 3.546
140 HD2 TYR 20 2HD TYR 20 -3.683 6.448 4.283
141 HE1 TYR 20 1HE TYR 20 -3.403 11.166 5.650
142 HE2 TYR 20 2HE TYR 20 -4.724 7.177 6.388
143 HH TYR 20 HH TYR 20 -4.342 9.122 8.054
144 H VAL 21 H VAL 21 -2.618 8.826 -0.958
145 HA VAL 21 HA VAL 21 -2.444 6.524 -2.523
146 HB VAL 21 HB VAL 21 -0.791 9.013 -2.942
147 1HG1 VAL 21 1HG1 VAL 21 -1.501 8.263 -5.389
148 2HG1 VAL 21 2HG1 VAL 21 -1.572 6.685 -4.605
149 3HG1 VAL 21 3HG1 VAL 21 -0.072 7.612 -4.585
150 1HG2 VAL 21 1HG2 VAL 21 -3.708 8.531 -3.272
151 2HG2 VAL 21 2HG2 VAL 21 -2.880 9.527 -4.468
152 3HG2 VAL 21 3HG2 VAL 21 -2.854 9.988 -2.765
153 H LYS 22 H LYS 22 -0.010 8.144 -0.549
154 HA LYS 22 HA LYS 22 2.266 6.796 -1.399
155 1HB LYS 22 2HB LYS 22 3.070 7.194 1.000
156 2HB LYS 22 1HB LYS 22 2.611 8.606 0.058
157 1HG LYS 22 2HG LYS 22 0.435 7.426 1.629
158 2HG LYS 22 1HG LYS 22 1.769 8.080 2.581
159 1HD LYS 22 2HD LYS 22 1.411 10.056 0.753
160 2HD LYS 22 1HD LYS 22 -0.239 9.460 0.935
161 1HE LYS 22 2HE LYS 22 -0.415 10.204 3.061
162 2HE LYS 22 1HE LYS 22 1.269 9.844 3.436
163 1HZ LYS 22 1HZ LYS 22 1.203 12.136 3.472
164 2HZ LYS 22 2HZ LYS 22 0.130 12.247 2.170
165 3HZ LYS 22 3HZ LYS 22 1.748 11.833 1.898
166 H THR 23 H THR 23 -0.320 5.758 0.700
167 HA THR 23 HA THR 23 0.961 3.498 1.818
168 HB THR 23 HB THR 23 -1.995 3.822 1.304
169 HG1 THR 23 1HG THR 23 -0.384 4.869 3.382
170 1HG2 THR 23 1HG2 THR 23 -1.500 1.641 2.136
171 2HG2 THR 23 2HG2 THR 23 -2.208 2.592 3.441
172 3HG2 THR 23 3HG2 THR 23 -0.468 2.307 3.402
173 H TYR 24 H TYR 24 -1.230 3.866 -0.960
174 HA TYR 24 HA TYR 24 -1.288 1.168 -1.715
175 1HB TYR 24 2HB TYR 24 -2.701 3.198 -2.549
176 2HB TYR 24 1HB TYR 24 -1.419 3.382 -3.740
177 HD1 TYR 24 1HD TYR 24 -2.928 0.266 -2.360
178 HD2 TYR 24 2HD TYR 24 -2.391 2.762 -5.763
179 HE1 TYR 24 1HE TYR 24 -4.000 -1.437 -3.772
180 HE2 TYR 24 2HE TYR 24 -3.463 1.065 -7.185
181 HH TYR 24 HH TYR 24 -3.915 -1.320 -7.182
182 H LEU 25 H LEU 25 1.009 3.720 -2.346
183 HA LEU 25 HA LEU 25 2.452 2.389 -4.395
184 1HB LEU 25 2HB LEU 25 2.869 4.754 -2.666
185 2HB LEU 25 1HB LEU 25 4.318 4.012 -3.318
186 HG LEU 25 HG LEU 25 2.001 5.112 -4.909
187 1HD1 LEU 25 1HD1 LEU 25 4.785 6.084 -5.191
188 2HD1 LEU 25 2HD1 LEU 25 3.898 6.564 -3.745
189 3HD1 LEU 25 3HD1 LEU 25 3.257 6.952 -5.342
190 1HD2 LEU 25 1HD2 LEU 25 3.707 4.681 -6.810
191 2HD2 LEU 25 2HD2 LEU 25 2.725 3.342 -6.216
192 3HD2 LEU 25 3HD2 LEU 25 4.401 3.507 -5.692
193 H ALA 26 H ALA 26 3.282 2.938 -0.988
194 HA ALA 26 HA ALA 26 5.434 1.150 -0.936
195 1HB ALA 26 1HB ALA 26 5.560 2.569 0.837
196 2HB ALA 26 2HB ALA 26 4.795 1.196 1.638
197 3HB ALA 26 3HB ALA 26 3.816 2.562 1.104
198 H HIS 27 H HIS 27 2.061 0.634 -0.903
199 HA HIS 27 HA HIS 27 1.984 -1.823 0.512
200 1HB HIS 27 2HB HIS 27 -0.031 -0.481 0.172
201 2HB HIS 27 1HB HIS 27 0.096 -0.700 -1.570
202 HD1 HIS 27 1HD HIS 27 -1.181 -2.332 1.501
203 HD2 HIS 27 2HD HIS 27 -0.510 -3.322 -2.478
204 HE1 HIS 27 1HE HIS 27 -2.444 -4.483 1.081
205 H LYS 28 H LYS 28 1.876 -1.116 -2.985
206 HA LYS 28 HA LYS 28 2.135 -3.851 -3.726
207 1HB LYS 28 2HB LYS 28 2.214 -1.237 -5.163
208 2HB LYS 28 1HB LYS 28 2.844 -2.658 -5.983
209 1HG LYS 28 2HG LYS 28 0.733 -2.920 -6.671
210 2HG LYS 28 1HG LYS 28 0.474 -3.599 -5.062
211 1HD LYS 28 2HD LYS 28 -1.212 -2.048 -5.128
212 2HD LYS 28 1HD LYS 28 0.081 -1.075 -4.424
213 1HE LYS 28 2HE LYS 28 -0.860 -1.110 -7.284
214 2HE LYS 28 1HE LYS 28 -0.935 0.228 -6.138
215 1HZ LYS 28 1HZ LYS 28 1.472 0.340 -6.151
216 2HZ LYS 28 2HZ LYS 28 0.872 0.501 -7.724
217 3HZ LYS 28 3HZ LYS 28 1.558 -0.963 -7.226
218 H GLN 29 H GLN 29 4.362 -1.587 -2.568
219 HA GLN 29 HA GLN 29 6.670 -2.409 -4.003
220 1HB GLN 29 2HB GLN 29 6.284 -0.949 -1.395
221 2HB GLN 29 1HB GLN 29 7.877 -1.313 -2.042
222 1HG GLN 29 2HG GLN 29 5.936 0.065 -3.812
223 2HG GLN 29 1HG GLN 29 6.670 0.986 -2.499
224 1HE2 GLN 29 1HE2 GLN 29 7.440 2.156 -4.495
225 2HE2 GLN 29 2HE2 GLN 29 8.952 1.649 -5.157
226 H PHE 30 H PHE 30 5.824 -2.969 -0.573
227 HA PHE 30 HA PHE 30 6.765 -5.712 -0.798
228 1HB PHE 30 2HB PHE 30 8.047 -5.143 1.465
229 2HB PHE 30 1HB PHE 30 8.819 -5.020 -0.110
230 HD1 PHE 30 1HD PHE 30 6.410 -2.732 1.561
231 HD2 PHE 30 2HD PHE 30 10.360 -3.305 0.086
232 HE1 PHE 30 1HE PHE 30 6.915 -0.365 2.006
233 HE2 PHE 30 2HE PHE 30 10.873 -0.939 0.529
234 HZ PHE 30 HZ PHE 30 9.149 0.534 1.490
235 H TYR 31 H TYR 31 4.277 -4.048 -0.050
236 HA TYR 31 HA TYR 31 3.785 -5.300 2.568
237 1HB TYR 31 2HB TYR 31 3.395 -2.661 1.756
238 2HB TYR 31 1HB TYR 31 1.780 -3.360 1.762
239 HD1 TYR 31 1HD TYR 31 4.289 -1.848 3.734
240 HD2 TYR 31 2HD TYR 31 1.133 -4.696 3.914
241 HE1 TYR 31 1HE TYR 31 4.189 -1.575 6.176
242 HE2 TYR 31 2HE TYR 31 1.024 -4.430 6.357
243 HH TYR 31 HH TYR 31 1.977 -2.088 7.996
244 H CYS 32 H CYS 32 3.014 -5.482 -0.718
245 HA CYS 32 HA CYS 32 0.409 -6.715 -0.253
246 1HB CYS 32 2HB CYS 32 0.811 -5.060 -2.127
247 2HB CYS 32 1HB CYS 32 1.802 -6.294 -2.897
248 H LYS 33 H LYS 33 -0.087 -8.805 -1.197
249 HA LYS 33 HA LYS 33 2.179 -10.637 -0.929
250 1HB LYS 33 2HB LYS 33 0.507 -12.391 -0.662
251 2HB LYS 33 1HB LYS 33 0.197 -11.070 0.456
252 1HG LYS 33 2HG LYS 33 -1.762 -10.521 -0.519
253 2HG LYS 33 1HG LYS 33 -1.199 -10.936 -2.139
254 1HD LYS 33 2HD LYS 33 -2.567 -12.709 -1.898
255 2HD LYS 33 1HD LYS 33 -1.228 -13.379 -0.964
256 1HE LYS 33 2HE LYS 33 -2.227 -12.776 1.086
257 2HE LYS 33 1HE LYS 33 -3.396 -11.720 0.293
258 1HZ LYS 33 1HZ LYS 33 -4.530 -13.587 -0.595
259 2HZ LYS 33 2HZ LYS 33 -4.298 -13.897 1.052
260 3HZ LYS 33 3HZ LYS 33 -3.319 -14.660 -0.097
261 H ASN 34 H ASN 34 1.689 -9.004 -3.341
262 HA ASN 34 HA ASN 34 1.125 -11.123 -5.302
263 1HB ASN 34 2HB ASN 34 0.753 -8.171 -5.302
264 2HB ASN 34 1HB ASN 34 1.181 -8.926 -6.834
265 1HD2 ASN 34 1HD2 ASN 34 -0.178 -10.737 -7.533
266 2HD2 ASN 34 2HD2 ASN 34 -1.865 -10.691 -7.163
267 H LYS 35 H LYS 35 3.321 -11.928 -4.771
268 HA LYS 35 HA LYS 35 5.578 -12.106 -5.092
269 1HB LYS 35 2HB LYS 35 6.251 -11.801 -7.472
270 2HB LYS 35 1HB LYS 35 4.805 -12.780 -7.263
271 1HG LYS 35 2HG LYS 35 3.400 -10.971 -7.946
272 2HG LYS 35 1HG LYS 35 4.766 -9.853 -7.958
273 1HD LYS 35 2HD LYS 35 4.454 -10.408 -10.211
274 2HD LYS 35 1HD LYS 35 5.799 -11.426 -9.694
275 1HE LYS 35 2HE LYS 35 2.991 -12.446 -9.546
276 2HE LYS 35 1HE LYS 35 3.859 -12.460 -11.081
277 1HZ LYS 35 1HZ LYS 35 5.676 -13.550 -9.477
278 2HZ LYS 35 2HZ LYS 35 4.534 -14.456 -10.335
279 3HZ LYS 35 3HZ LYS 35 4.265 -14.080 -8.708
280 HA PRO 36 HA PRO 36 6.360 -7.507 -4.515
281 1HB PRO 36 2HB PRO 36 7.222 -7.658 -1.947
282 2HB PRO 36 1HB PRO 36 5.519 -7.454 -2.375
283 1HG PRO 36 2HG PRO 36 6.993 -9.942 -1.599
284 2HG PRO 36 1HG PRO 36 5.388 -9.387 -1.088
285 1HD PRO 36 2HD PRO 36 5.737 -11.267 -3.006
286 2HD PRO 36 1HD PRO 36 4.376 -10.127 -3.021
Start of MODEL 20
1 1H GLY 1 1HT GLY 1 -20.599 8.968 -15.914
2 2H GLY 1 2HT GLY 1 -20.912 8.240 -17.408
3 3H GLY 1 3HT GLY 1 -21.420 9.827 -17.120
4 1HA GLY 1 1HA GLY 1 -19.289 9.394 -18.508
5 2HA GLY 1 2HA GLY 1 -19.346 10.719 -17.355
6 H SER 2 H SER 2 -17.521 8.196 -18.407
7 HA SER 2 HA SER 2 -16.015 8.132 -15.882
8 1HB SER 2 2HB SER 2 -16.939 5.834 -17.562
9 2HB SER 2 1HB SER 2 -15.401 5.704 -16.710
10 HG SER 2 HG SER 2 -17.005 4.938 -15.367
11 H ALA 3 H ALA 3 -13.743 7.182 -16.305
12 HA ALA 3 HA ALA 3 -12.680 7.680 -18.946
13 1HB ALA 3 1HB ALA 3 -11.537 9.603 -18.587
14 2HB ALA 3 2HB ALA 3 -11.301 9.274 -16.871
15 3HB ALA 3 3HB ALA 3 -12.852 9.885 -17.446
16 H ALA 4 H ALA 4 -12.686 5.302 -17.769
17 HA ALA 4 HA ALA 4 -11.358 3.539 -17.219
18 1HB ALA 4 1HB ALA 4 -9.442 5.530 -18.258
19 2HB ALA 4 2HB ALA 4 -9.717 3.857 -18.742
20 3HB ALA 4 3HB ALA 4 -8.761 4.214 -17.302
21 H GLU 5 H GLU 5 -9.198 6.054 -15.962
22 HA GLU 5 HA GLU 5 -8.287 6.339 -13.892
23 1HB GLU 5 2HB GLU 5 -10.752 7.175 -13.770
24 2HB GLU 5 1HB GLU 5 -11.000 5.760 -12.756
25 1HG GLU 5 2HG GLU 5 -10.558 7.837 -11.495
26 2HG GLU 5 1HG GLU 5 -9.411 6.542 -11.156
27 H VAL 6 H VAL 6 -6.941 4.553 -13.727
28 HA VAL 6 HA VAL 6 -8.039 2.199 -12.346
29 HB VAL 6 HB VAL 6 -5.388 2.400 -13.774
30 1HG1 VAL 6 1HG1 VAL 6 -6.868 0.241 -12.369
31 2HG1 VAL 6 2HG1 VAL 6 -5.136 0.576 -12.426
32 3HG1 VAL 6 3HG1 VAL 6 -5.934 -0.188 -13.802
33 1HG2 VAL 6 1HG2 VAL 6 -6.548 1.036 -15.546
34 2HG2 VAL 6 2HG2 VAL 6 -7.042 2.726 -15.445
35 3HG2 VAL 6 3HG2 VAL 6 -8.071 1.465 -14.767
36 H MET 7 H MET 7 -6.827 1.247 -10.621
37 HA MET 7 HA MET 7 -5.722 1.306 -8.636
38 1HB MET 7 2HB MET 7 -3.870 3.338 -9.871
39 2HB MET 7 1HB MET 7 -3.511 2.171 -8.606
40 1HG MET 7 2HG MET 7 -4.074 0.414 -10.431
41 2HG MET 7 1HG MET 7 -3.785 1.750 -11.545
42 1HE MET 7 1HE MET 7 -1.989 2.888 -11.965
43 2HE MET 7 2HE MET 7 -0.539 1.936 -12.279
44 3HE MET 7 3HE MET 7 -0.579 3.062 -10.921
45 H LYS 8 H LYS 8 -7.788 2.493 -8.062
46 HA LYS 8 HA LYS 8 -7.348 5.299 -7.381
47 1HB LYS 8 2HB LYS 8 -9.745 3.538 -7.619
48 2HB LYS 8 1HB LYS 8 -9.836 4.923 -6.539
49 1HG LYS 8 2HG LYS 8 -9.151 5.027 -9.469
50 2HG LYS 8 1HG LYS 8 -10.712 5.438 -8.756
51 1HD LYS 8 2HD LYS 8 -8.975 6.974 -7.295
52 2HD LYS 8 1HD LYS 8 -8.240 6.995 -8.898
53 1HE LYS 8 2HE LYS 8 -9.663 8.713 -9.230
54 2HE LYS 8 1HE LYS 8 -10.814 7.419 -9.559
55 1HZ LYS 8 1HZ LYS 8 -10.507 8.284 -6.784
56 2HZ LYS 8 2HZ LYS 8 -11.887 7.750 -7.602
57 3HZ LYS 8 3HZ LYS 8 -11.322 9.327 -7.838
58 H LYS 9 H LYS 9 -5.701 3.738 -5.948
59 HA LYS 9 HA LYS 9 -5.004 3.277 -3.833
60 1HB LYS 9 2HB LYS 9 -7.307 5.111 -3.161
61 2HB LYS 9 1HB LYS 9 -6.154 4.516 -1.975
62 1HG LYS 9 2HG LYS 9 -5.141 6.474 -2.434
63 2HG LYS 9 1HG LYS 9 -4.440 5.532 -3.751
64 1HD LYS 9 2HD LYS 9 -5.209 7.228 -5.025
65 2HD LYS 9 1HD LYS 9 -6.737 6.352 -4.908
66 1HE LYS 9 2HE LYS 9 -6.162 8.205 -2.694
67 2HE LYS 9 1HE LYS 9 -6.424 8.961 -4.265
68 1HZ LYS 9 1HZ LYS 9 -8.409 8.428 -2.659
69 2HZ LYS 9 2HZ LYS 9 -8.318 6.907 -3.393
70 3HZ LYS 9 3HZ LYS 9 -8.580 8.286 -4.337
71 H TYR 10 H TYR 10 -6.155 1.171 -4.770
72 HA TYR 10 HA TYR 10 -7.356 -0.090 -2.509
73 1HB TYR 10 2HB TYR 10 -9.352 1.010 -3.416
74 2HB TYR 10 1HB TYR 10 -9.054 0.275 -4.987
75 HD1 TYR 10 1HD TYR 10 -8.980 -2.338 -5.022
76 HD2 TYR 10 2HD TYR 10 -10.767 -0.048 -1.915
77 HE1 TYR 10 1HE TYR 10 -10.325 -4.289 -4.367
78 HE2 TYR 10 2HE TYR 10 -12.116 -1.993 -1.249
79 HH TYR 10 HH TYR 10 -12.891 -4.336 -2.870
80 H CYS 11 H CYS 11 -6.453 -2.033 -2.473
81 HA CYS 11 HA CYS 11 -5.331 -3.166 -4.894
82 1HB CYS 11 2HB CYS 11 -4.228 -3.161 -2.566
83 2HB CYS 11 1HB CYS 11 -5.331 -4.477 -2.182
84 H SER 12 H SER 12 -6.598 -4.288 -6.211
85 HA SER 12 HA SER 12 -9.083 -5.405 -5.470
86 1HB SER 12 2HB SER 12 -7.480 -6.232 -7.889
87 2HB SER 12 1HB SER 12 -9.233 -6.197 -7.703
88 HG SER 12 HG SER 12 -9.190 -3.985 -7.774
89 H THR 13 H THR 13 -5.842 -6.719 -5.675
90 HA THR 13 HA THR 13 -6.584 -9.456 -5.483
91 HB THR 13 HB THR 13 -3.953 -8.565 -4.425
92 HG1 THR 13 1HG THR 13 -4.815 -8.153 -7.085
93 1HG2 THR 13 1HG2 THR 13 -3.187 -10.297 -6.108
94 2HG2 THR 13 2HG2 THR 13 -4.892 -10.710 -6.294
95 3HG2 THR 13 3HG2 THR 13 -4.109 -10.879 -4.722
96 H CYS 14 H CYS 14 -5.279 -7.176 -3.073
97 HA CYS 14 HA CYS 14 -5.664 -8.985 -0.900
98 1HB CYS 14 2HB CYS 14 -5.025 -6.037 -1.019
99 2HB CYS 14 1HB CYS 14 -5.105 -6.956 0.473
100 H ASP 15 H ASP 15 -7.550 -6.490 -2.420
101 HA ASP 15 HA ASP 15 -9.755 -5.945 -2.211
102 1HB ASP 15 2HB ASP 15 -9.926 -8.453 -1.544
103 2HB ASP 15 1HB ASP 15 -10.068 -7.841 0.102
104 H ILE 16 H ILE 16 -7.989 -4.277 -1.128
105 HA ILE 16 HA ILE 16 -9.420 -3.255 1.207
106 HB ILE 16 HB ILE 16 -6.419 -3.212 1.234
107 1HG1 ILE 16 2HG1 ILE 16 -8.185 -5.335 2.472
108 2HG1 ILE 16 1HG1 ILE 16 -7.083 -5.579 1.121
109 1HG2 ILE 16 1HG2 ILE 16 -6.965 -3.104 3.744
110 2HG2 ILE 16 2HG2 ILE 16 -8.609 -2.742 3.221
111 3HG2 ILE 16 3HG2 ILE 16 -7.282 -1.678 2.755
112 1HD1 ILE 16 1HD1 ILE 16 -5.938 -6.405 2.966
113 2HD1 ILE 16 2HD1 ILE 16 -6.439 -5.064 3.996
114 3HD1 ILE 16 3HD1 ILE 16 -5.251 -4.799 2.720
115 H SER 17 H SER 17 -8.820 -0.979 1.686
116 HA SER 17 HA SER 17 -7.804 0.441 -0.680
117 1HB SER 17 2HB SER 17 -10.469 0.387 -0.005
118 2HB SER 17 1HB SER 17 -9.917 1.865 0.780
119 HG SER 17 HG SER 17 -9.897 2.755 -1.109
120 H PHE 18 H PHE 18 -6.950 2.555 -0.261
121 HA PHE 18 HA PHE 18 -6.284 3.054 2.563
122 1HB PHE 18 2HB PHE 18 -4.349 3.468 0.282
123 2HB PHE 18 1HB PHE 18 -4.015 3.574 2.007
124 HD1 PHE 18 1HD PHE 18 -3.838 1.553 3.365
125 HD2 PHE 18 2HD PHE 18 -4.456 1.356 -0.841
126 HE1 PHE 18 1HE PHE 18 -3.182 -0.818 3.383
127 HE2 PHE 18 2HE PHE 18 -3.801 -1.016 -0.830
128 HZ PHE 18 HZ PHE 18 -3.163 -2.106 1.284
129 H ASN 19 H ASN 19 -6.655 5.069 3.230
130 HA ASN 19 HA ASN 19 -7.938 6.958 1.591
131 1HB ASN 19 2HB ASN 19 -6.862 6.927 4.364
132 2HB ASN 19 1HB ASN 19 -7.169 8.502 3.638
133 1HD2 ASN 19 1HD2 ASN 19 -8.867 5.405 3.366
134 2HD2 ASN 19 2HD2 ASN 19 -10.395 5.999 3.912
135 H TYR 20 H TYR 20 -4.580 6.445 2.377
136 HA TYR 20 HA TYR 20 -3.854 8.905 0.939
137 1HB TYR 20 2HB TYR 20 -2.149 7.182 2.749
138 2HB TYR 20 1HB TYR 20 -1.653 8.693 1.995
139 HD1 TYR 20 1HD TYR 20 -3.392 10.703 2.504
140 HD2 TYR 20 2HD TYR 20 -2.749 7.294 4.967
141 HE1 TYR 20 1HE TYR 20 -4.238 11.954 4.445
142 HE2 TYR 20 2HE TYR 20 -3.594 8.534 6.914
143 HH TYR 20 HH TYR 20 -5.182 11.564 6.618
144 H VAL 21 H VAL 21 -2.901 8.798 -0.994
145 HA VAL 21 HA VAL 21 -2.758 6.411 -2.450
146 HB VAL 21 HB VAL 21 -1.213 8.939 -3.041
147 1HG1 VAL 21 1HG1 VAL 21 -0.415 7.476 -4.596
148 2HG1 VAL 21 2HG1 VAL 21 -1.869 8.015 -5.436
149 3HG1 VAL 21 3HG1 VAL 21 -1.871 6.479 -4.567
150 1HG2 VAL 21 1HG2 VAL 21 -3.925 8.798 -2.700
151 2HG2 VAL 21 2HG2 VAL 21 -3.750 8.531 -4.434
152 3HG2 VAL 21 3HG2 VAL 21 -3.083 9.986 -3.695
153 H LYS 22 H LYS 22 -0.342 8.133 -0.566
154 HA LYS 22 HA LYS 22 1.970 6.859 -1.435
155 1HB LYS 22 2HB LYS 22 1.235 7.880 1.312
156 2HB LYS 22 1HB LYS 22 2.852 7.351 0.870
157 1HG LYS 22 2HG LYS 22 3.242 9.179 -0.446
158 2HG LYS 22 1HG LYS 22 1.532 9.423 -0.804
159 1HD LYS 22 2HD LYS 22 2.259 11.201 0.629
160 2HD LYS 22 1HD LYS 22 1.210 10.134 1.564
161 1HE LYS 22 2HE LYS 22 3.609 9.008 2.059
162 2HE LYS 22 1HE LYS 22 4.093 10.690 1.844
163 1HZ LYS 22 1HZ LYS 22 2.031 9.706 3.743
164 2HZ LYS 22 2HZ LYS 22 2.470 11.325 3.527
165 3HZ LYS 22 3HZ LYS 22 3.590 10.221 4.150
166 H THR 23 H THR 23 -0.536 5.761 0.739
167 HA THR 23 HA THR 23 0.825 3.551 1.845
168 HB THR 23 HB THR 23 -2.139 3.608 1.352
169 HG1 THR 23 1HG THR 23 -0.769 4.998 3.407
170 1HG2 THR 23 1HG2 THR 23 -1.409 1.635 2.467
171 2HG2 THR 23 2HG2 THR 23 -2.205 2.674 3.650
172 3HG2 THR 23 3HG2 THR 23 -0.444 2.574 3.606
173 H TYR 24 H TYR 24 -1.410 3.809 -0.910
174 HA TYR 24 HA TYR 24 -1.363 1.104 -1.645
175 1HB TYR 24 2HB TYR 24 -2.891 3.037 -2.469
176 2HB TYR 24 1HB TYR 24 -1.628 3.319 -3.661
177 HD1 TYR 24 1HD TYR 24 -3.197 0.214 -2.282
178 HD2 TYR 24 2HD TYR 24 -2.298 2.545 -5.726
179 HE1 TYR 24 1HE TYR 24 -4.164 -1.536 -3.713
180 HE2 TYR 24 2HE TYR 24 -3.263 0.801 -7.166
181 HH TYR 24 HH TYR 24 -5.103 -1.114 -6.757
182 H LEU 25 H LEU 25 0.793 3.761 -2.354
183 HA LEU 25 HA LEU 25 2.262 2.511 -4.421
184 1HB LEU 25 2HB LEU 25 2.279 4.988 -3.138
185 2HB LEU 25 1HB LEU 25 3.854 4.304 -2.785
186 HG LEU 25 HG LEU 25 2.948 4.197 -5.610
187 1HD1 LEU 25 1HD1 LEU 25 3.619 6.480 -6.045
188 2HD1 LEU 25 2HD1 LEU 25 3.932 6.742 -4.330
189 3HD1 LEU 25 3HD1 LEU 25 2.285 6.454 -4.891
190 1HD2 LEU 25 1HD2 LEU 25 5.051 3.347 -5.465
191 2HD2 LEU 25 2HD2 LEU 25 5.475 4.333 -4.066
192 3HD2 LEU 25 3HD2 LEU 25 5.463 5.049 -5.678
193 H ALA 26 H ALA 26 3.179 3.050 -1.034
194 HA ALA 26 HA ALA 26 5.381 1.339 -1.049
195 1HB ALA 26 1HB ALA 26 3.674 2.448 1.145
196 2HB ALA 26 2HB ALA 26 5.328 2.868 0.706
197 3HB ALA 26 3HB ALA 26 4.990 1.325 1.491
198 H HIS 27 H HIS 27 2.026 0.674 -0.939
199 HA HIS 27 HA HIS 27 2.098 -1.819 0.405
200 1HB HIS 27 2HB HIS 27 0.014 -0.573 0.149
201 2HB HIS 27 1HB HIS 27 0.109 -0.732 -1.601
202 HD1 HIS 27 1HD HIS 27 -0.891 -2.593 1.474
203 HD2 HIS 27 2HD HIS 27 -0.513 -3.277 -2.607
204 HE1 HIS 27 1HE HIS 27 -2.086 -4.773 1.005
205 H LYS 28 H LYS 28 1.882 -1.034 -3.069
206 HA LYS 28 HA LYS 28 2.233 -3.731 -3.894
207 1HB LYS 28 2HB LYS 28 2.764 -1.256 -5.538
208 2HB LYS 28 1HB LYS 28 2.369 -2.864 -6.129
209 1HG LYS 28 2HG LYS 28 0.414 -1.557 -4.329
210 2HG LYS 28 1HG LYS 28 0.571 -0.923 -5.968
211 1HD LYS 28 2HD LYS 28 0.296 -3.299 -6.780
212 2HD LYS 28 1HD LYS 28 -0.149 -3.723 -5.126
213 1HE LYS 28 2HE LYS 28 -2.170 -2.724 -5.272
214 2HE LYS 28 1HE LYS 28 -1.567 -1.414 -6.287
215 1HZ LYS 28 1HZ LYS 28 -3.015 -2.673 -7.621
216 2HZ LYS 28 2HZ LYS 28 -2.350 -4.145 -7.121
217 3HZ LYS 28 3HZ LYS 28 -1.459 -3.111 -8.121
218 H GLN 29 H GLN 29 4.399 -1.426 -2.701
219 HA GLN 29 HA GLN 29 6.713 -2.129 -4.188
220 1HB GLN 29 2HB GLN 29 6.062 -0.432 -1.898
221 2HB GLN 29 1HB GLN 29 7.639 -1.193 -1.756
222 1HG GLN 29 2HG GLN 29 7.418 1.131 -2.877
223 2HG GLN 29 1HG GLN 29 8.496 -0.077 -3.570
224 1HE2 GLN 29 1HE2 GLN 29 5.629 1.782 -3.993
225 2HE2 GLN 29 2HE2 GLN 29 5.309 1.319 -5.627
226 H PHE 30 H PHE 30 5.947 -2.813 -0.761
227 HA PHE 30 HA PHE 30 7.000 -5.509 -1.087
228 1HB PHE 30 2HB PHE 30 8.258 -4.955 1.198
229 2HB PHE 30 1HB PHE 30 9.021 -4.750 -0.375
230 HD1 PHE 30 1HD PHE 30 6.885 -2.827 2.006
231 HD2 PHE 30 2HD PHE 30 10.111 -2.770 -0.769
232 HE1 PHE 30 1HE PHE 30 7.283 -0.454 2.522
233 HE2 PHE 30 2HE PHE 30 10.514 -0.397 -0.257
234 HZ PHE 30 HZ PHE 30 9.098 0.764 1.390
235 H TYR 31 H TYR 31 4.439 -3.980 -0.265
236 HA TYR 31 HA TYR 31 4.024 -5.331 2.316
237 1HB TYR 31 2HB TYR 31 3.489 -2.717 1.613
238 2HB TYR 31 1HB TYR 31 1.916 -3.492 1.458
239 HD1 TYR 31 1HD TYR 31 4.598 -2.563 3.778
240 HD2 TYR 31 2HD TYR 31 0.765 -4.370 3.401
241 HE1 TYR 31 1HE TYR 31 4.298 -2.421 6.214
242 HE2 TYR 31 2HE TYR 31 0.454 -4.233 5.837
243 HH TYR 31 HH TYR 31 1.973 -2.337 7.782
244 H CYS 32 H CYS 32 3.161 -5.353 -0.990
245 HA CYS 32 HA CYS 32 0.740 -6.916 -0.527
246 1HB CYS 32 2HB CYS 32 0.891 -5.058 -2.259
247 2HB CYS 32 1HB CYS 32 1.927 -6.134 -3.187
248 H LYS 33 H LYS 33 1.027 -9.020 -0.177
249 HA LYS 33 HA LYS 33 3.269 -10.398 -1.460
250 1HB LYS 33 2HB LYS 33 2.848 -12.201 0.129
251 2HB LYS 33 1HB LYS 33 3.029 -10.666 0.968
252 1HG LYS 33 2HG LYS 33 0.273 -11.422 0.252
253 2HG LYS 33 1HG LYS 33 1.064 -12.425 1.468
254 1HD LYS 33 2HD LYS 33 1.059 -10.780 3.013
255 2HD LYS 33 1HD LYS 33 1.395 -9.522 1.822
256 1HE LYS 33 2HE LYS 33 -0.793 -9.091 1.463
257 2HE LYS 33 1HE LYS 33 -1.262 -10.782 1.638
258 1HZ LYS 33 1HZ LYS 33 -0.626 -10.283 4.128
259 2HZ LYS 33 2HZ LYS 33 -2.166 -9.931 3.522
260 3HZ LYS 33 3HZ LYS 33 -1.016 -8.699 3.675
261 H ASN 34 H ASN 34 0.771 -9.597 -2.857
262 HA ASN 34 HA ASN 34 -0.754 -10.434 -4.329
263 1HB ASN 34 2HB ASN 34 1.624 -11.496 -4.962
264 2HB ASN 34 1HB ASN 34 0.751 -12.983 -4.603
265 1HD2 ASN 34 1HD2 ASN 34 1.755 -12.305 -7.127
266 2HD2 ASN 34 2HD2 ASN 34 0.420 -12.103 -8.206
267 H LYS 35 H LYS 35 -2.294 -10.661 -2.556
268 HA LYS 35 HA LYS 35 -2.919 -13.489 -2.009
269 1HB LYS 35 2HB LYS 35 -2.850 -11.128 -0.218
270 2HB LYS 35 1HB LYS 35 -4.187 -12.245 0.014
271 1HG LYS 35 2HG LYS 35 -2.124 -13.977 -0.108
272 2HG LYS 35 1HG LYS 35 -1.325 -12.569 0.596
273 1HD LYS 35 2HD LYS 35 -2.835 -12.520 2.427
274 2HD LYS 35 1HD LYS 35 -3.913 -13.684 1.655
275 1HE LYS 35 2HE LYS 35 -1.188 -14.161 2.834
276 2HE LYS 35 1HE LYS 35 -2.724 -14.881 3.312
277 1HZ LYS 35 1HZ LYS 35 -1.622 -16.518 2.084
278 2HZ LYS 35 2HZ LYS 35 -1.124 -15.432 0.887
279 3HZ LYS 35 3HZ LYS 35 -2.752 -15.877 1.000
280 HA PRO 36 HA PRO 36 -6.439 -11.623 -4.387
281 1HB PRO 36 2HB PRO 36 -6.866 -13.795 -5.956
282 2HB PRO 36 1HB PRO 36 -5.682 -12.543 -6.354
283 1HG PRO 36 2HG PRO 36 -5.253 -15.221 -5.084
284 2HG PRO 36 1HG PRO 36 -4.307 -14.419 -6.351
285 1HD PRO 36 2HD PRO 36 -3.537 -14.449 -3.755
286 2HD PRO 36 1HD PRO 36 -3.175 -13.093 -4.843