Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20924 | 2gqe RC | 7158 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 0 1H GLY 0 -13.300 7.060 1.470
2 1HA GLY 0 1HA GLY 0 -12.342 6.938 4.263
3 2HA GLY 0 2HA GLY 0 -13.171 8.345 3.618
4 H HIS 1 H HIS 1 -14.422 5.486 2.354
5 HA HIS 1 HA HIS 1 -16.371 5.124 4.493
6 1HB HIS 1 1HB HIS 1 -17.234 6.882 2.889
7 2HB HIS 1 2HB HIS 1 -17.276 5.626 1.656
8 HD1 HIS 1 HD1 HIS 1 -19.753 5.378 1.359
9 HD2 HIS 1 HD2 HIS 1 -18.597 5.158 5.343
10 HE1 HIS 1 HE1 HIS 1 -21.815 4.685 2.620
11 H MET 2 H MET 2 -16.642 3.025 4.835
12 HA MET 2 HA MET 2 -16.362 0.765 4.569
13 1HB MET 2 1HB MET 2 -17.734 -0.167 2.757
14 2HB MET 2 2HB MET 2 -18.574 1.123 3.607
15 1HG MET 2 1HG MET 2 -18.055 2.672 1.814
16 2HG MET 2 2HG MET 2 -17.150 1.417 0.972
17 1HE MET 2 1HE MET 2 -18.420 -0.865 -0.058
18 2HE MET 2 2HE MET 2 -19.616 -0.226 -1.185
19 3HE MET 2 3HE MET 2 -18.051 0.570 -1.014
20 H VAL 3 H VAL 3 -14.037 2.061 3.847
21 HA VAL 3 HA VAL 3 -13.122 0.458 1.548
22 HB VAL 3 HB VAL 3 -13.184 3.044 1.302
23 1HG1 VAL 3 1HG1 VAL 3 -10.467 3.123 2.402
24 2HG1 VAL 3 2HG1 VAL 3 -11.756 4.325 2.470
25 3HG1 VAL 3 3HG1 VAL 3 -11.745 2.977 3.608
26 1HG2 VAL 3 1HG2 VAL 3 -11.264 1.036 0.434
27 2HG2 VAL 3 2HG2 VAL 3 -12.100 2.279 -0.496
28 3HG2 VAL 3 3HG2 VAL 3 -10.619 2.675 0.374
29 H ILE 4 H ILE 4 -13.117 0.245 4.653
30 HA ILE 4 HA ILE 4 -10.560 0.383 5.674
31 HB ILE 4 HB ILE 4 -11.205 -1.174 7.345
32 1HG1 ILE 4 1HG1 ILE 4 -11.945 -3.033 6.016
33 2HG1 ILE 4 2HG1 ILE 4 -13.272 -2.578 7.079
34 1HG2 ILE 4 1HG2 ILE 4 -12.976 0.903 6.482
35 2HG2 ILE 4 2HG2 ILE 4 -13.902 -0.392 7.237
36 3HG2 ILE 4 3HG2 ILE 4 -12.586 0.381 8.121
37 1HD1 ILE 4 1HD1 ILE 4 -14.222 -1.275 5.157
38 2HD1 ILE 4 2HD1 ILE 4 -12.995 -2.033 4.141
39 3HD1 ILE 4 3HD1 ILE 4 -14.202 -3.027 4.957
40 H GLY 5 H GLY 5 -9.434 -1.841 6.422
41 1HA GLY 5 1HA GLY 5 -8.765 -4.042 5.634
42 2HA GLY 5 2HA GLY 5 -9.050 -3.476 3.995
43 H THR 6 H THR 6 -7.665 -0.925 5.434
44 HA THR 6 HA THR 6 -5.319 -0.910 4.039
45 HB THR 6 HB THR 6 -4.420 0.659 5.755
46 HG1 THR 6 1HG THR 6 -5.987 1.185 7.467
47 1HG2 THR 6 1HG2 THR 6 -5.579 2.109 4.517
48 2HG2 THR 6 2HG2 THR 6 -6.906 1.940 5.665
49 3HG2 THR 6 3HG2 THR 6 -6.850 0.923 4.225
50 H TRP 7 H TRP 7 -3.260 -1.651 4.292
51 HA TRP 7 HA TRP 7 -2.864 -3.651 6.410
52 1HB TRP 7 1HB TRP 7 -0.913 -4.348 4.866
53 2HB TRP 7 2HB TRP 7 -2.556 -4.718 4.348
54 HD1 TRP 7 1HD TRP 7 -3.621 -2.819 2.543
55 HE1 TRP 7 1HE TRP 7 -2.419 -1.683 0.571
56 HE3 TRP 7 3HE TRP 7 1.220 -3.566 4.005
57 HZ2 TRP 7 2HZ TRP 7 0.231 -1.171 -0.255
58 HZ3 TRP 7 3HZ TRP 7 3.030 -2.722 2.568
59 HH2 TRP 7 2HH TRP 7 2.544 -1.551 0.482
60 H ASP 8 H ASP 8 -1.105 -3.589 7.756
61 HA ASP 8 HA ASP 8 0.320 -1.036 7.845
62 1HB ASP 8 1HB ASP 8 0.567 -3.145 9.959
63 2HB ASP 8 2HB ASP 8 0.653 -1.393 10.118
64 H CYS 9 H CYS 9 2.479 -0.838 7.582
65 HA CYS 9 HA CYS 9 3.900 -2.867 6.225
66 1HB CYS 9 1HB CYS 9 4.235 -0.276 6.239
67 2HB CYS 9 2HB CYS 9 5.283 -0.598 7.616
68 H ASP 10 H ASP 10 6.218 -3.443 7.023
69 HA ASP 10 HA ASP 10 6.202 -4.095 9.882
70 1HB ASP 10 1HB ASP 10 6.794 -6.094 7.688
71 2HB ASP 10 2HB ASP 10 6.917 -6.395 9.420
72 H THR 11 H THR 11 7.696 -2.406 7.710
73 HA THR 11 HA THR 11 10.379 -3.046 8.737
74 HB THR 11 HB THR 11 9.522 -3.084 5.989
75 HG1 THR 11 1HG THR 11 11.811 -3.793 5.829
76 1HG2 THR 11 1HG2 THR 11 10.149 -0.731 5.933
77 2HG2 THR 11 2HG2 THR 11 11.320 -1.698 5.036
78 3HG2 THR 11 3HG3 THR 11 11.713 -1.113 6.652
79 H CYS 12 H CYS 12 8.166 -0.617 7.476
80 HA CYS 12 HA CYS 12 9.875 1.473 8.659
81 1HB CYS 12 1HB CYS 12 9.350 2.924 6.952
82 2HB CYS 12 2HB CYS 12 9.294 1.395 6.080
83 H LEU 13 H LEU 13 7.008 -0.206 8.991
84 HA LEU 13 HA LEU 13 5.191 0.028 10.337
85 1HB LEU 13 1HB LEU 13 7.144 1.932 11.527
86 2HB LEU 13 2HB LEU 13 5.474 1.979 12.089
87 HG LEU 13 HG LEU 13 5.781 -0.551 12.508
88 1HD1 LEU 13 1HD1 LEU 13 8.670 0.307 12.528
89 2HD1 LEU 13 2HD1 LEU 13 7.929 -0.691 11.278
90 3HD1 LEU 13 3HD1 LEU 13 8.027 -1.284 12.935
91 1HD2 LEU 13 1HD2 LEU 13 7.310 0.294 14.614
92 2HD2 LEU 13 2HD2 LEU 13 5.554 0.414 14.513
93 3HD2 LEU 13 3HD2 LEU 13 6.560 1.793 14.067
94 H VAL 14 H VAL 14 4.128 0.741 8.329
95 HA VAL 14 HA VAL 14 2.816 3.287 8.760
96 HB VAL 14 HB VAL 14 4.465 2.748 6.297
97 1HG1 VAL 14 1HG1 VAL 14 2.640 3.542 5.203
98 2HG1 VAL 14 2HG1 VAL 14 2.013 4.380 6.624
99 3HG1 VAL 14 3HG1 VAL 14 3.337 5.085 5.695
100 1HG2 VAL 14 1HG2 VAL 14 5.407 4.946 6.786
101 2HG2 VAL 14 2HG2 VAL 14 4.342 5.102 8.182
102 3HG2 VAL 14 3HG2 VAL 14 5.595 3.862 8.163
103 H GLN 15 H GLN 15 0.723 3.177 8.212
104 HA GLN 15 HA GLN 15 -0.276 0.719 7.069
105 1HB GLN 15 1HB GLN 15 -1.740 3.181 8.034
106 2HB GLN 15 2HB GLN 15 -2.502 1.668 7.560
107 1HG GLN 15 1HG GLN 15 -0.956 0.638 9.383
108 2HG GLN 15 2HG GLN 15 -0.883 2.295 9.982
109 1HE2 GLN 15 2HE2 GLN 15 -2.222 2.561 11.606
110 2HE2 GLN 15 1HE2 GLN 15 -3.818 1.912 11.734
111 H ASN 16 H ASN 16 -1.628 0.582 5.226
112 HA ASN 16 HA ASN 16 -1.742 2.882 3.444
113 1HB ASN 16 1HB ASN 16 -0.754 0.343 2.225
114 2HB ASN 16 2HB ASN 16 -0.493 2.008 1.713
115 1HD2 ASN 16 2HD2 ASN 16 0.190 -0.033 4.538
116 2HD2 ASN 16 1HD2 ASN 16 1.824 0.495 4.734
117 H LYS 17 H LYS 17 -3.151 2.513 1.580
118 HA LYS 17 HA LYS 17 -5.507 1.089 2.344
119 1HB LYS 17 1HB LYS 17 -6.540 2.080 0.490
120 2HB LYS 17 2HB LYS 17 -5.343 3.267 0.990
121 1HG LYS 17 1HG LYS 17 -3.882 2.661 -0.789
122 2HG LYS 17 2HG LYS 17 -4.876 1.262 -1.202
123 1HD LYS 17 1HD LYS 17 -6.675 2.689 -1.923
124 2HD LYS 17 2HD LYS 17 -5.819 4.124 -1.354
125 1HE LYS 17 1HE LYS 17 -4.549 2.327 -3.378
126 2HE LYS 17 2HE LYS 17 -5.774 3.490 -3.882
127 1HZ LYS 17 1HZ LYS 17 -3.659 4.510 -4.113
128 2HZ LYS 17 2HZ LYS 17 -3.189 4.071 -2.549
129 3HZ LYS 17 3HZ LYS 17 -4.403 5.227 -2.774
130 HA PRO 18 HA PRO 18 -4.762 -2.813 0.458
131 1HB PRO 18 1HB PRO 18 -7.317 -3.583 -0.039
132 2HB PRO 18 2HB PRO 18 -6.622 -3.554 1.587
133 1HG PRO 18 1HG PRO 18 -8.393 -1.546 0.250
134 2HG PRO 18 2HG PRO 18 -8.461 -2.168 1.909
135 1HD PRO 18 1HD PRO 18 -7.371 0.234 1.297
136 2HD PRO 18 2HD PRO 18 -6.777 -0.770 2.635
137 H GLU 19 H GLU 19 -6.144 -0.192 -1.205
138 HA GLU 19 HA GLU 19 -6.471 -1.604 -3.720
139 1HB GLU 19 1HB GLU 19 -6.555 1.380 -3.453
140 2HB GLU 19 2HB GLU 19 -7.448 0.340 -4.553
141 1HG GLU 19 1HG GLU 19 -7.923 0.702 -1.607
142 2HG GLU 19 2HG GLU 19 -8.957 1.234 -2.930
143 H ALA 20 H ALA 20 -3.924 -0.306 -2.027
144 HA ALA 20 HA ALA 20 -2.456 0.690 -4.329
145 1HB ALA 20 1HB ALA 20 -2.199 1.881 -2.244
146 2HB ALA 20 2HB ALA 20 -1.658 0.410 -1.434
147 3HB ALA 20 3HB ALA 20 -0.662 1.139 -2.694
148 H ILE 21 H ILE 21 -0.104 -0.091 -4.505
149 HA ILE 21 HA ILE 21 -0.124 -3.035 -4.461
150 HB ILE 21 HB ILE 21 0.199 -1.457 -6.641
151 1HG1 ILE 21 1HG1 ILE 21 1.218 -4.206 -5.983
152 2HG1 ILE 21 2HG1 ILE 21 -0.186 -3.748 -6.942
153 1HG2 ILE 21 1HG2 ILE 21 2.986 -2.141 -5.717
154 2HG2 ILE 21 2HG2 ILE 21 2.546 -1.427 -7.268
155 3HG2 ILE 21 3HG2 ILE 21 2.295 -0.519 -5.777
156 1HD1 ILE 21 1HD1 ILE 21 1.542 -2.754 -8.574
157 2HD1 ILE 21 2HD1 ILE 21 2.699 -3.768 -7.710
158 3HD1 ILE 21 3HD1 ILE 21 1.317 -4.503 -8.524
159 H LYS 22 H LYS 22 1.478 -0.214 -3.335
160 HA LYS 22 HA LYS 22 3.368 -1.877 -1.862
161 1HB LYS 22 1HB LYS 22 5.252 -0.363 -2.423
162 2HB LYS 22 2HB LYS 22 4.650 -1.254 -3.815
163 1HG LYS 22 1HG LYS 22 3.455 0.695 -4.594
164 2HG LYS 22 2HG LYS 22 3.935 1.596 -3.153
165 1HD LYS 22 1HD LYS 22 5.395 2.271 -4.899
166 2HD LYS 22 2HD LYS 22 6.327 1.207 -3.845
167 1HE LYS 22 1HE LYS 22 5.764 -0.669 -5.422
168 2HE LYS 22 2HE LYS 22 5.095 0.543 -6.513
169 1HZ LYS 22 1HZ LYS 22 7.294 0.163 -7.210
170 2HZ LYS 22 2HZ LYS 22 7.908 0.243 -5.636
171 3HZ LYS 22 3HZ LYS 22 7.338 1.645 -6.393
172 H CYS 23 H CYS 23 4.783 -0.183 -0.463
173 HA CYS 23 HA CYS 23 2.889 1.039 1.286
174 1HB CYS 23 1HB CYS 23 5.243 -0.035 1.779
175 2HB CYS 23 2HB CYS 23 5.824 1.598 1.473
176 H VAL 24 H VAL 24 2.921 3.281 1.968
177 HA VAL 24 HA VAL 24 3.488 5.084 -0.286
178 HB VAL 24 HB VAL 24 1.106 4.818 0.694
179 1HG1 VAL 24 1HG1 VAL 24 1.839 6.951 2.611
180 2HG1 VAL 24 2HG1 VAL 24 0.582 5.716 2.710
181 3HG1 VAL 24 3HG1 VAL 24 2.261 5.298 3.056
182 1HG2 VAL 24 1HG2 VAL 24 2.410 7.504 0.279
183 2HG2 VAL 24 2HG2 VAL 24 1.622 6.499 -0.938
184 3HG2 VAL 24 2HG3 VAL 24 0.666 7.247 0.341
185 H ALA 25 H ALA 25 5.257 4.135 2.031
186 HA ALA 25 HA ALA 25 6.214 6.818 2.745
187 1HB ALA 25 1HB ALA 25 6.874 5.456 4.983
188 2HB ALA 25 2HB ALA 25 5.419 6.439 4.815
189 3HB ALA 25 3HB ALA 25 5.336 4.693 4.578
190 H CYS 26 H CYS 26 6.936 3.349 2.608
191 HA CYS 26 HA CYS 26 9.774 4.027 2.195
192 1HB CYS 26 1HB CYS 26 10.383 1.940 3.136
193 2HB CYS 26 2HB CYS 26 9.142 2.591 4.201
194 H GLU 27 H GLU 27 6.990 2.907 0.684
195 HA GLU 27 HA GLU 27 6.576 2.140 -1.419
196 1HB GLU 27 1HB GLU 27 9.512 2.304 -2.040
197 2HB GLU 27 2HB GLU 27 8.147 2.509 -3.129
198 1HG GLU 27 1HG GLU 27 7.792 4.671 -2.508
199 2HG GLU 27 2HG GLU 27 8.442 4.430 -0.887
200 H THR 28 H THR 28 6.772 0.254 0.513
201 HA THR 28 HA THR 28 8.541 -1.868 -0.385
202 HB THR 28 HB THR 28 7.006 -1.311 2.033
203 HG1 THR 28 1HG THR 28 9.161 -3.106 1.521
204 1HG2 THR 28 1HG2 THR 28 6.611 -3.677 2.614
205 2HG2 THR 28 2HG2 THR 28 7.044 -4.137 0.968
206 3HG2 THR 28 3HG2 THR 28 5.614 -3.147 1.260
207 HA PRO 29 HA PRO 29 5.627 -3.862 -3.011
208 1HB PRO 29 1HB PRO 29 6.582 -6.400 -2.886
209 2HB PRO 29 2HB PRO 29 7.395 -5.110 -3.780
210 1HG PRO 29 1HG PRO 29 7.989 -6.190 -1.052
211 2HG PRO 29 2HG PRO 29 9.113 -5.762 -2.355
212 1HD PRO 29 1HD PRO 29 8.639 -4.132 -0.245
213 2HD PRO 29 2HD PRO 29 9.022 -3.512 -1.864
214 H LYS 30 H LYS 30 3.592 -4.057 -2.284
215 HA LYS 30 HA LYS 30 2.740 -5.053 0.151
216 1HB LYS 30 1HB LYS 30 1.231 -3.774 -1.190
217 2HB LYS 30 2HB LYS 30 1.332 -4.925 -2.515
218 1HG LYS 30 1HG LYS 30 0.376 -6.584 -0.715
219 2HG LYS 30 2HG LYS 30 -0.192 -5.089 0.031
220 1HD LYS 30 1HD LYS 30 -0.669 -5.307 -2.864
221 2HD LYS 30 2HD LYS 30 -1.552 -6.467 -1.869
222 1HE LYS 30 1HE LYS 30 -2.384 -4.592 -0.491
223 2HE LYS 30 2HE LYS 30 -1.560 -3.465 -1.567
224 1HZ LYS 30 1HZ LYS 30 -3.545 -3.451 -2.590
225 2HZ LYS 30 2HZ LYS 30 -4.015 -4.953 -1.975
226 3HZ LYS 30 3HZ LYS 30 -2.987 -4.874 -3.316
227 HA PRO 31 HA PRO 31 3.248 -9.420 -0.093
228 1HB PRO 31 1HB PRO 31 1.407 -10.167 1.757
229 2HB PRO 31 2HB PRO 31 2.955 -9.429 2.185
230 1HG PRO 31 1HG PRO 31 0.249 -8.167 1.974
231 2HG PRO 31 2HG PRO 31 1.496 -7.938 3.213
232 1HD PRO 31 1HD PRO 31 1.105 -6.174 1.197
233 2HD PRO 31 2HD PRO 31 2.705 -6.474 1.906
Start of MODEL 2
1 1H GLY 0 1H GLY 0 -17.114 7.238 2.602
2 1HA GLY 0 1HA GLY 0 -16.915 9.822 3.904
3 2HA GLY 0 2HA GLY 0 -17.076 8.455 4.996
4 H HIS 1 H HIS 1 -15.519 6.559 4.280
5 HA HIS 1 HA HIS 1 -12.876 7.755 3.761
6 1HB HIS 1 1HB HIS 1 -13.731 5.755 5.829
7 2HB HIS 1 2HB HIS 1 -12.069 5.768 5.245
8 HD1 HIS 1 HD1 HIS 1 -14.422 8.567 6.329
9 HD2 HIS 1 HD2 HIS 1 -10.598 7.116 7.054
10 HE1 HIS 1 HE1 HIS 1 -13.403 10.158 7.989
11 H MET 2 H MET 2 -11.719 6.868 2.167
12 HA MET 2 HA MET 2 -12.848 4.647 0.698
13 1HB MET 2 1HB MET 2 -10.643 6.611 0.222
14 2HB MET 2 2HB MET 2 -10.685 5.126 -0.718
15 1HG MET 2 1HG MET 2 -12.866 7.194 -0.562
16 2HG MET 2 2HG MET 2 -11.758 6.941 -1.909
17 1HE MET 2 1HE MET 2 -11.703 4.077 -2.955
18 2HE MET 2 2HE MET 2 -13.171 4.191 -3.926
19 3HE MET 2 3HE MET 2 -12.111 5.591 -3.761
20 H VAL 3 H VAL 3 -12.369 3.385 2.837
21 HA VAL 3 HA VAL 3 -9.895 1.890 2.356
22 HB VAL 3 HB VAL 3 -10.706 3.168 4.942
23 1HG1 VAL 3 1HG1 VAL 3 -9.154 0.614 4.601
24 2HG1 VAL 3 2HG1 VAL 3 -9.000 1.638 6.030
25 3HG1 VAL 3 3HG1 VAL 3 -10.557 0.915 5.627
26 1HG2 VAL 3 1HG2 VAL 3 -8.141 3.426 4.989
27 2HG2 VAL 3 2HG2 VAL 3 -8.214 2.976 3.286
28 3HG2 VAL 3 3HG2 VAL 3 -9.063 4.413 3.855
29 H ILE 4 H ILE 4 -10.130 -0.268 2.504
30 HA ILE 4 HA ILE 4 -12.622 -1.302 3.688
31 HB ILE 4 HB ILE 4 -11.277 -2.416 1.226
32 1HG1 ILE 4 1HG1 ILE 4 -12.361 -0.156 0.918
33 2HG1 ILE 4 2HG1 ILE 4 -13.025 -1.443 -0.082
34 1HG2 ILE 4 1HG2 ILE 4 -13.220 -3.465 3.041
35 2HG2 ILE 4 2HG2 ILE 4 -13.959 -3.239 1.457
36 3HG2 ILE 4 3HG2 ILE 4 -12.504 -4.222 1.619
37 1HD1 ILE 4 1HD1 ILE 4 -15.031 -0.913 0.671
38 2HD1 ILE 4 2HD1 ILE 4 -14.532 -1.433 2.280
39 3HD1 ILE 4 3HD1 ILE 4 -14.342 0.253 1.800
40 H GLY 5 H GLY 5 -9.246 -1.402 3.594
41 1HA GLY 5 1HA GLY 5 -8.965 -3.161 5.723
42 2HA GLY 5 2HA GLY 5 -8.789 -4.122 4.261
43 H THR 6 H THR 6 -7.630 -1.008 5.560
44 HA THR 6 HA THR 6 -5.292 -0.880 4.038
45 HB THR 6 HB THR 6 -4.440 0.670 5.805
46 HG1 THR 6 1HG THR 6 -5.666 -0.514 7.516
47 1HG2 THR 6 1HG2 THR 6 -6.898 1.969 5.657
48 2HG2 THR 6 2HG2 THR 6 -6.854 0.939 4.227
49 3HG2 THR 6 3HG2 THR 6 -5.562 2.105 4.514
50 H TRP 7 H TRP 7 -3.267 -1.677 4.267
51 HA TRP 7 HA TRP 7 -2.867 -3.649 6.408
52 1HB TRP 7 1HB TRP 7 -0.922 -4.360 4.853
53 2HB TRP 7 2HB TRP 7 -2.570 -4.750 4.369
54 HD1 TRP 7 1HD TRP 7 -3.674 -2.957 2.512
55 HE1 TRP 7 1HE TRP 7 -2.514 -1.821 0.516
56 HE3 TRP 7 3HE TRP 7 1.189 -3.487 3.995
57 HZ2 TRP 7 2HZ TRP 7 0.117 -1.228 -0.319
58 HZ3 TRP 7 3HZ TRP 7 2.968 -2.609 2.539
59 HH2 TRP 7 2HH TRP 7 2.441 -1.504 0.427
60 H ASP 8 H ASP 8 -1.154 -3.538 7.786
61 HA ASP 8 HA ASP 8 0.312 -1.011 7.813
62 1HB ASP 8 1HB ASP 8 0.514 -3.087 9.968
63 2HB ASP 8 2HB ASP 8 0.651 -1.335 10.095
64 H CYS 9 H CYS 9 2.444 -0.839 7.450
65 HA CYS 9 HA CYS 9 3.860 -2.857 6.134
66 1HB CYS 9 1HB CYS 9 4.260 -0.267 6.286
67 2HB CYS 9 2HB CYS 9 5.306 -0.704 7.634
68 H ASP 10 H ASP 10 6.176 -3.480 6.970
69 HA ASP 10 HA ASP 10 6.028 -4.315 9.781
70 1HB ASP 10 1HB ASP 10 5.290 -6.226 8.454
71 2HB ASP 10 2HB ASP 10 6.734 -6.111 7.452
72 H THR 11 H THR 11 7.628 -2.517 7.700
73 HA THR 11 HA THR 11 10.249 -3.125 8.901
74 HB THR 11 HB THR 11 9.579 -2.537 6.044
75 HG1 THR 11 1HG THR 11 10.314 -4.648 7.245
76 1HG2 THR 11 1HG2 THR 11 11.114 -0.862 6.106
77 2HG2 THR 11 2HG2 THR 11 12.241 -2.213 5.988
78 3HG2 THR 11 3HG3 THR 11 11.897 -1.486 7.557
79 H CYS 12 H CYS 12 8.458 -0.583 7.150
80 HA CYS 12 HA CYS 12 9.955 1.462 8.594
81 1HB CYS 12 1HB CYS 12 9.328 2.947 6.948
82 2HB CYS 12 2HB CYS 12 9.296 1.439 6.039
83 H LEU 13 H LEU 13 6.928 -0.139 8.690
84 HA LEU 13 HA LEU 13 5.214 -0.020 10.189
85 1HB LEU 13 1HB LEU 13 6.461 2.345 11.523
86 2HB LEU 13 2HB LEU 13 5.481 1.059 12.224
87 HG LEU 13 HG LEU 13 8.392 0.992 11.475
88 1HD1 LEU 13 1HD1 LEU 13 8.787 1.006 13.677
89 2HD1 LEU 13 2HD1 LEU 13 7.456 -0.096 14.023
90 3HD1 LEU 13 3HD1 LEU 13 7.141 1.627 13.814
91 1HD2 LEU 13 1HD2 LEU 13 8.098 -1.123 10.820
92 2HD2 LEU 13 2HD2 LEU 13 6.452 -1.186 11.453
93 3HD2 LEU 13 3HD2 LEU 13 7.822 -1.477 12.526
94 H VAL 14 H VAL 14 4.210 0.778 8.133
95 HA VAL 14 HA VAL 14 2.864 3.302 8.677
96 HB VAL 14 HB VAL 14 4.370 2.779 6.114
97 1HG1 VAL 14 1HG1 VAL 14 2.636 3.807 5.127
98 2HG1 VAL 14 2HG1 VAL 14 2.003 4.424 6.654
99 3HG1 VAL 14 3HG1 VAL 14 3.318 5.270 5.838
100 1HG2 VAL 14 1HG2 VAL 14 4.535 5.181 7.913
101 2HG2 VAL 14 2HG2 VAL 14 5.555 3.761 8.141
102 3HG2 VAL 14 3HG2 VAL 14 5.651 4.683 6.641
103 H GLN 15 H GLN 15 0.759 3.222 8.162
104 HA GLN 15 HA GLN 15 -0.298 0.772 7.065
105 1HB GLN 15 1HB GLN 15 -1.758 3.276 7.921
106 2HB GLN 15 2HB GLN 15 -2.484 1.707 7.603
107 1HG GLN 15 1HG GLN 15 -2.362 1.787 9.910
108 2HG GLN 15 2HG GLN 15 -0.943 0.843 9.462
109 1HE2 GLN 15 2HE2 GLN 15 -0.227 1.467 11.621
110 2HE2 GLN 15 1HE2 GLN 15 0.570 2.987 11.827
111 H ASN 16 H ASN 16 -1.560 0.570 5.199
112 HA ASN 16 HA ASN 16 -1.698 2.848 3.381
113 1HB ASN 16 1HB ASN 16 -0.722 0.280 2.214
114 2HB ASN 16 2HB ASN 16 -0.452 1.932 1.670
115 1HD2 ASN 16 2HD2 ASN 16 0.280 -0.192 4.412
116 2HD2 ASN 16 1HD2 ASN 16 1.892 0.383 4.647
117 H LYS 17 H LYS 17 -3.162 2.511 1.591
118 HA LYS 17 HA LYS 17 -5.495 1.069 2.369
119 1HB LYS 17 1HB LYS 17 -6.551 2.059 0.525
120 2HB LYS 17 2HB LYS 17 -5.356 3.250 1.020
121 1HG LYS 17 1HG LYS 17 -3.903 2.642 -0.772
122 2HG LYS 17 2HG LYS 17 -4.914 1.258 -1.191
123 1HD LYS 17 1HD LYS 17 -6.706 2.709 -1.879
124 2HD LYS 17 2HD LYS 17 -5.829 4.130 -1.306
125 1HE LYS 17 1HE LYS 17 -4.738 2.303 -3.431
126 2HE LYS 17 2HE LYS 17 -5.780 3.674 -3.809
127 1HZ LYS 17 1HZ LYS 17 -3.016 3.664 -3.295
128 2HZ LYS 17 2HZ LYS 17 -3.781 4.593 -2.107
129 3HZ LYS 17 3HZ LYS 17 -4.001 4.964 -3.743
130 HA PRO 18 HA PRO 18 -4.779 -2.828 0.463
131 1HB PRO 18 1HB PRO 18 -7.340 -3.587 -0.025
132 2HB PRO 18 2HB PRO 18 -6.636 -3.565 1.596
133 1HG PRO 18 1HG PRO 18 -8.407 -1.546 0.274
134 2HG PRO 18 2HG PRO 18 -8.469 -2.173 1.931
135 1HD PRO 18 1HD PRO 18 -7.374 0.227 1.321
136 2HD PRO 18 2HD PRO 18 -6.778 -0.784 2.654
137 H GLU 19 H GLU 19 -6.149 -0.196 -1.187
138 HA GLU 19 HA GLU 19 -6.496 -1.598 -3.705
139 1HB GLU 19 1HB GLU 19 -6.570 1.385 -3.413
140 2HB GLU 19 2HB GLU 19 -7.456 0.360 -4.534
141 1HG GLU 19 1HG GLU 19 -7.942 0.503 -1.567
142 2HG GLU 19 2HG GLU 19 -8.885 1.343 -2.796
143 H ALA 20 H ALA 20 -3.936 -0.313 -2.018
144 HA ALA 20 HA ALA 20 -2.475 0.681 -4.323
145 1HB ALA 20 1HB ALA 20 -0.673 1.122 -2.694
146 2HB ALA 20 2HB ALA 20 -2.205 1.868 -2.238
147 3HB ALA 20 3HB ALA 20 -1.666 0.394 -1.433
148 H ILE 21 H ILE 21 -0.096 -0.104 -4.444
149 HA ILE 21 HA ILE 21 -0.130 -3.051 -4.410
150 HB ILE 21 HB ILE 21 -0.007 -2.394 -6.670
151 1HG1 ILE 21 1HG1 ILE 21 2.265 -3.090 -7.362
152 2HG1 ILE 21 2HG1 ILE 21 2.820 -2.884 -5.705
153 1HG2 ILE 21 1HG2 ILE 21 0.452 -0.195 -6.903
154 2HG2 ILE 21 2HG2 ILE 21 1.651 -0.196 -5.610
155 3HG2 ILE 21 3HG2 ILE 21 2.081 -0.796 -7.212
156 1HD1 ILE 21 1HD1 ILE 21 2.435 -5.209 -6.147
157 2HD1 ILE 21 2HD1 ILE 21 1.228 -4.630 -4.999
158 3HD1 ILE 21 3HD1 ILE 21 0.792 -4.873 -6.690
159 H LYS 22 H LYS 22 1.454 -0.227 -3.293
160 HA LYS 22 HA LYS 22 3.363 -1.863 -1.825
161 1HB LYS 22 1HB LYS 22 5.237 -0.308 -2.441
162 2HB LYS 22 2HB LYS 22 4.682 -1.344 -3.749
163 1HG LYS 22 1HG LYS 22 3.260 0.602 -4.512
164 2HG LYS 22 2HG LYS 22 4.162 1.589 -3.359
165 1HD LYS 22 1HD LYS 22 6.245 1.033 -4.481
166 2HD LYS 22 2HD LYS 22 5.382 -0.028 -5.598
167 1HE LYS 22 1HE LYS 22 4.626 2.859 -5.348
168 2HE LYS 22 2HE LYS 22 6.001 2.380 -6.343
169 1HZ LYS 22 1HZ LYS 22 3.447 2.472 -7.187
170 2HZ LYS 22 2HZ LYS 22 3.613 0.833 -6.806
171 3HZ LYS 22 3HZ LYS 22 4.667 1.553 -7.914
172 H CYS 23 H CYS 23 4.758 -0.253 -0.402
173 HA CYS 23 HA CYS 23 2.904 1.086 1.284
174 1HB CYS 23 1HB CYS 23 5.231 -0.042 1.806
175 2HB CYS 23 2HB CYS 23 5.847 1.577 1.488
176 H VAL 24 H VAL 24 2.858 3.318 1.849
177 HA VAL 24 HA VAL 24 3.570 5.067 -0.402
178 HB VAL 24 HB VAL 24 1.148 4.858 0.473
179 1HG1 VAL 24 1HG1 VAL 24 0.527 6.102 2.371
180 2HG1 VAL 24 2HG1 VAL 24 1.933 5.161 2.875
181 3HG1 VAL 24 3HG1 VAL 24 2.109 6.872 2.485
182 1HG2 VAL 24 1HG2 VAL 24 2.510 6.832 -0.844
183 2HG2 VAL 24 2HG2 VAL 24 0.761 6.772 -0.625
184 3HG2 VAL 24 2HG3 VAL 24 1.758 7.716 0.483
185 H ALA 25 H ALA 25 5.246 4.152 1.986
186 HA ALA 25 HA ALA 25 6.179 6.842 2.712
187 1HB ALA 25 1HB ALA 25 6.752 5.810 4.996
188 2HB ALA 25 2HB ALA 25 5.076 6.260 4.678
189 3HB ALA 25 3HB ALA 25 5.572 4.571 4.570
190 H CYS 26 H CYS 26 6.941 3.374 2.653
191 HA CYS 26 HA CYS 26 9.779 4.072 2.300
192 1HB CYS 26 1HB CYS 26 10.370 1.983 3.244
193 2HB CYS 26 2HB CYS 26 9.084 2.610 4.270
194 H GLU 27 H GLU 27 7.036 2.860 0.731
195 HA GLU 27 HA GLU 27 6.701 2.156 -1.412
196 1HB GLU 27 1HB GLU 27 9.611 2.182 -2.058
197 2HB GLU 27 2HB GLU 27 8.240 2.674 -3.042
198 1HG GLU 27 1HG GLU 27 8.048 4.571 -1.230
199 2HG GLU 27 2HG GLU 27 9.756 4.203 -0.997
200 H THR 28 H THR 28 6.799 0.258 0.507
201 HA THR 28 HA THR 28 8.576 -1.878 -0.364
202 HB THR 28 HB THR 28 7.023 -1.311 2.046
203 HG1 THR 28 1HG THR 28 8.763 -2.987 2.694
204 1HG2 THR 28 1HG2 THR 28 5.616 -3.114 1.495
205 2HG2 THR 28 2HG2 THR 28 6.833 -3.811 2.564
206 3HG2 THR 28 3HG2 THR 28 6.945 -4.055 0.821
207 HA PRO 29 HA PRO 29 5.641 -3.833 -2.999
208 1HB PRO 29 1HB PRO 29 6.579 -6.377 -2.890
209 2HB PRO 29 2HB PRO 29 7.399 -5.089 -3.779
210 1HG PRO 29 1HG PRO 29 7.992 -6.186 -1.058
211 2HG PRO 29 2HG PRO 29 9.116 -5.760 -2.361
212 1HD PRO 29 1HD PRO 29 8.659 -4.137 -0.242
213 2HD PRO 29 2HD PRO 29 9.042 -3.511 -1.858
214 H LYS 30 H LYS 30 3.600 -4.089 -2.337
215 HA LYS 30 HA LYS 30 2.770 -5.106 0.125
216 1HB LYS 30 1HB LYS 30 1.275 -3.736 -1.145
217 2HB LYS 30 2HB LYS 30 1.318 -4.846 -2.509
218 1HG LYS 30 1HG LYS 30 0.366 -6.524 -0.694
219 2HG LYS 30 2HG LYS 30 -0.193 -5.017 0.034
220 1HD LYS 30 1HD LYS 30 -0.658 -5.242 -2.859
221 2HD LYS 30 2HD LYS 30 -1.542 -6.408 -1.872
222 1HE LYS 30 1HE LYS 30 -2.352 -4.513 -0.477
223 2HE LYS 30 2HE LYS 30 -1.576 -3.403 -1.606
224 1HZ LYS 30 1HZ LYS 30 -3.578 -3.447 -2.588
225 2HZ LYS 30 2HZ LYS 30 -4.024 -4.925 -1.896
226 3HZ LYS 30 3HZ LYS 30 -3.034 -4.898 -3.268
227 HA PRO 31 HA PRO 31 3.167 -9.471 -0.301
228 1HB PRO 31 1HB PRO 31 1.343 -10.248 1.553
229 2HB PRO 31 2HB PRO 31 2.916 -9.564 1.980
230 1HG PRO 31 1HG PRO 31 0.239 -8.230 1.872
231 2HG PRO 31 2HG PRO 31 1.514 -8.081 3.095
232 1HD PRO 31 1HD PRO 31 1.128 -6.229 1.158
233 2HD PRO 31 2HD PRO 31 2.733 -6.595 1.823
Start of MODEL 3
1 1H GLY 0 1H GLY 0 -20.982 3.538 3.893
2 1HA GLY 0 1HA GLY 0 -21.921 2.225 5.790
3 2HA GLY 0 2HA GLY 0 -20.622 1.078 5.493
4 H HIS 1 H HIS 1 -18.419 2.587 5.237
5 HA HIS 1 HA HIS 1 -18.129 4.709 7.059
6 1HB HIS 1 1HB HIS 1 -16.786 3.440 8.799
7 2HB HIS 1 2HB HIS 1 -18.529 3.188 8.842
8 HD1 HIS 1 HD1 HIS 1 -15.336 1.414 8.486
9 HD2 HIS 1 HD2 HIS 1 -19.356 0.629 7.794
10 HE1 HIS 1 HE1 HIS 1 -15.501 -1.083 8.244
11 H MET 2 H MET 2 -15.604 4.657 7.841
12 HA MET 2 HA MET 2 -14.124 5.063 5.505
13 1HB MET 2 1HB MET 2 -13.662 6.026 7.794
14 2HB MET 2 2HB MET 2 -12.962 4.473 8.229
15 1HG MET 2 1HG MET 2 -11.179 5.910 7.637
16 2HG MET 2 2HG MET 2 -11.372 4.749 6.325
17 1HE MET 2 1HE MET 2 -11.724 8.900 6.993
18 2HE MET 2 2HE MET 2 -10.379 7.778 7.198
19 3HE MET 2 3HE MET 2 -10.477 8.783 5.752
20 H VAL 3 H VAL 3 -12.225 3.936 4.741
21 HA VAL 3 HA VAL 3 -12.654 1.217 4.256
22 HB VAL 3 HB VAL 3 -10.385 1.163 3.331
23 1HG1 VAL 3 1HG1 VAL 3 -10.653 3.177 1.774
24 2HG1 VAL 3 2HG1 VAL 3 -11.968 2.000 1.822
25 3HG1 VAL 3 3HG1 VAL 3 -12.119 3.528 2.690
26 1HG2 VAL 3 1HG2 VAL 3 -9.413 3.716 3.447
27 2HG2 VAL 3 2HG2 VAL 3 -10.064 3.494 5.071
28 3HG2 VAL 3 3HG2 VAL 3 -8.857 2.370 4.443
29 H ILE 4 H ILE 4 -12.219 -0.568 5.374
30 HA ILE 4 HA ILE 4 -10.389 -0.358 7.677
31 HB ILE 4 HB ILE 4 -12.837 -0.676 8.237
32 1HG1 ILE 4 1HG1 ILE 4 -11.276 -3.048 9.194
33 2HG1 ILE 4 2HG1 ILE 4 -10.710 -1.428 9.583
34 1HG2 ILE 4 1HG2 ILE 4 -12.680 -2.639 6.283
35 2HG2 ILE 4 2HG2 ILE 4 -12.782 -3.535 7.799
36 3HG2 ILE 4 3HG2 ILE 4 -14.026 -2.355 7.387
37 1HD1 ILE 4 1HD1 ILE 4 -12.004 -1.697 11.390
38 2HD1 ILE 4 2HD1 ILE 4 -13.305 -1.231 10.294
39 3HD1 ILE 4 3HD1 ILE 4 -12.999 -2.936 10.625
40 H GLY 5 H GLY 5 -9.518 -1.036 5.075
41 1HA GLY 5 1HA GLY 5 -8.789 -3.868 5.501
42 2HA GLY 5 2HA GLY 5 -9.160 -3.238 3.903
43 H THR 6 H THR 6 -7.583 -0.900 5.687
44 HA THR 6 HA THR 6 -5.308 -0.874 4.049
45 HB THR 6 HB THR 6 -4.353 0.715 5.727
46 HG1 THR 6 1HG THR 6 -5.547 1.200 7.550
47 1HG2 THR 6 1HG2 THR 6 -6.772 0.993 4.187
48 2HG2 THR 6 2HG2 THR 6 -5.484 2.166 4.467
49 3HG2 THR 6 3HG2 THR 6 -6.821 2.036 5.608
50 H TRP 7 H TRP 7 -3.281 -1.689 4.251
51 HA TRP 7 HA TRP 7 -2.871 -3.646 6.398
52 1HB TRP 7 1HB TRP 7 -0.923 -4.349 4.847
53 2HB TRP 7 2HB TRP 7 -2.569 -4.726 4.345
54 HD1 TRP 7 1HD TRP 7 -3.655 -2.884 2.516
55 HE1 TRP 7 1HE TRP 7 -2.473 -1.742 0.534
56 HE3 TRP 7 3HE TRP 7 1.199 -3.511 3.993
57 HZ2 TRP 7 2HZ TRP 7 0.167 -1.182 -0.294
58 HZ3 TRP 7 3HZ TRP 7 2.993 -2.644 2.549
59 HH2 TRP 7 2HH TRP 7 2.486 -1.504 0.451
60 H ASP 8 H ASP 8 -1.146 -3.562 7.769
61 HA ASP 8 HA ASP 8 0.306 -1.027 7.839
62 1HB ASP 8 1HB ASP 8 0.341 -3.209 9.925
63 2HB ASP 8 2HB ASP 8 0.806 -1.521 10.122
64 H CYS 9 H CYS 9 2.454 -0.836 7.532
65 HA CYS 9 HA CYS 9 3.868 -2.864 6.186
66 1HB CYS 9 1HB CYS 9 4.222 -0.273 6.235
67 2HB CYS 9 2HB CYS 9 5.275 -0.626 7.601
68 H ASP 10 H ASP 10 6.183 -3.463 6.982
69 HA ASP 10 HA ASP 10 6.155 -4.146 9.834
70 1HB ASP 10 1HB ASP 10 6.321 -6.049 7.524
71 2HB ASP 10 2HB ASP 10 7.156 -6.430 9.028
72 H THR 11 H THR 11 7.665 -2.441 7.686
73 HA THR 11 HA THR 11 10.341 -3.106 8.716
74 HB THR 11 HB THR 11 9.501 -3.149 5.973
75 HG1 THR 11 1HG THR 11 11.580 -4.043 5.756
76 1HG2 THR 11 1HG2 THR 11 10.071 -0.788 5.892
77 2HG2 THR 11 2HG2 THR 11 11.281 -1.729 5.019
78 3HG2 THR 11 3HG3 THR 11 11.636 -1.118 6.634
79 H CYS 12 H CYS 12 8.142 -0.657 7.472
80 HA CYS 12 HA CYS 12 9.858 1.416 8.673
81 1HB CYS 12 1HB CYS 12 9.350 2.882 6.975
82 2HB CYS 12 2HB CYS 12 9.288 1.360 6.092
83 H LEU 13 H LEU 13 6.989 -0.255 8.992
84 HA LEU 13 HA LEU 13 5.166 -0.021 10.329
85 1HB LEU 13 1HB LEU 13 7.124 1.867 11.538
86 2HB LEU 13 2HB LEU 13 5.452 1.921 12.093
87 HG LEU 13 HG LEU 13 5.773 -0.635 12.467
88 1HD1 LEU 13 1HD1 LEU 13 8.597 0.364 12.260
89 2HD1 LEU 13 2HD1 LEU 13 7.860 -1.023 11.459
90 3HD1 LEU 13 3HD1 LEU 13 8.165 -1.066 13.195
91 1HD2 LEU 13 1HD2 LEU 13 5.360 0.912 14.262
92 2HD2 LEU 13 2HD2 LEU 13 7.031 1.475 14.215
93 3HD2 LEU 13 3HD2 LEU 13 6.669 -0.172 14.731
94 H VAL 14 H VAL 14 4.101 0.704 8.332
95 HA VAL 14 HA VAL 14 2.803 3.256 8.772
96 HB VAL 14 HB VAL 14 4.410 2.718 6.277
97 1HG1 VAL 14 1HG1 VAL 14 3.412 4.670 5.283
98 2HG1 VAL 14 2HG1 VAL 14 2.133 3.541 5.734
99 3HG1 VAL 14 3HG1 VAL 14 2.449 4.962 6.731
100 1HG2 VAL 14 1HG2 VAL 14 5.664 3.722 8.096
101 2HG2 VAL 14 2HG2 VAL 14 5.419 4.900 6.806
102 3HG2 VAL 14 3HG2 VAL 14 4.441 4.981 8.272
103 H GLN 15 H GLN 15 0.713 3.165 8.210
104 HA GLN 15 HA GLN 15 -0.300 0.713 7.061
105 1HB GLN 15 1HB GLN 15 -1.669 3.180 8.136
106 2HB GLN 15 2HB GLN 15 -2.536 1.798 7.480
107 1HG GLN 15 1HG GLN 15 -1.297 0.401 9.203
108 2HG GLN 15 2HG GLN 15 -0.843 1.932 9.949
109 1HE2 GLN 15 2HE2 GLN 15 -2.619 3.380 10.550
110 2HE2 GLN 15 1HE2 GLN 15 -4.100 2.685 11.103
111 H ASN 16 H ASN 16 -1.600 0.567 5.197
112 HA ASN 16 HA ASN 16 -1.712 2.877 3.424
113 1HB ASN 16 1HB ASN 16 -0.721 0.339 2.205
114 2HB ASN 16 2HB ASN 16 -0.450 2.005 1.702
115 1HD2 ASN 16 2HD2 ASN 16 0.223 -0.092 4.487
116 2HD2 ASN 16 1HD2 ASN 16 1.849 0.446 4.712
117 H LYS 17 H LYS 17 -3.151 2.564 1.601
118 HA LYS 17 HA LYS 17 -5.503 1.137 2.330
119 1HB LYS 17 1HB LYS 17 -6.516 2.138 0.481
120 2HB LYS 17 2HB LYS 17 -5.285 3.305 0.947
121 1HG LYS 17 1HG LYS 17 -3.876 2.673 -0.843
122 2HG LYS 17 2HG LYS 17 -4.846 1.241 -1.192
123 1HD LYS 17 1HD LYS 17 -5.597 2.667 -2.826
124 2HD LYS 17 2HD LYS 17 -6.755 3.014 -1.540
125 1HE LYS 17 1HE LYS 17 -4.220 4.590 -1.923
126 2HE LYS 17 2HE LYS 17 -5.735 5.016 -2.718
127 1HZ LYS 17 1HZ LYS 17 -6.705 4.973 -0.374
128 2HZ LYS 17 2HZ LYS 17 -5.722 6.286 -0.790
129 3HZ LYS 17 3HZ LYS 17 -5.103 5.035 0.167
130 HA PRO 18 HA PRO 18 -4.760 -2.787 0.490
131 1HB PRO 18 1HB PRO 18 -7.318 -3.557 0.009
132 2HB PRO 18 2HB PRO 18 -6.617 -3.514 1.631
133 1HG PRO 18 1HG PRO 18 -8.389 -1.515 0.280
134 2HG PRO 18 2HG PRO 18 -8.452 -2.121 1.945
135 1HD PRO 18 1HD PRO 18 -7.360 0.273 1.306
136 2HD PRO 18 2HD PRO 18 -6.764 -0.719 2.652
137 H GLU 19 H GLU 19 -6.145 -0.181 -1.195
138 HA GLU 19 HA GLU 19 -6.480 -1.618 -3.695
139 1HB GLU 19 1HB GLU 19 -8.086 0.016 -3.614
140 2HB GLU 19 2HB GLU 19 -7.063 1.128 -2.715
141 1HG GLU 19 1HG GLU 19 -5.886 1.765 -4.673
142 2HG GLU 19 2HG GLU 19 -6.623 0.467 -5.612
143 H ALA 20 H ALA 20 -3.929 -0.301 -2.023
144 HA ALA 20 HA ALA 20 -2.469 0.677 -4.337
145 1HB ALA 20 1HB ALA 20 -0.666 1.131 -2.707
146 2HB ALA 20 2HB ALA 20 -2.198 1.887 -2.268
147 3HB ALA 20 3HB ALA 20 -1.669 0.422 -1.442
148 H ILE 21 H ILE 21 -0.102 -0.102 -4.483
149 HA ILE 21 HA ILE 21 -0.123 -3.047 -4.424
150 HB ILE 21 HB ILE 21 1.431 -1.218 -6.259
151 1HG1 ILE 21 1HG1 ILE 21 -0.902 -1.205 -6.865
152 2HG1 ILE 21 2HG1 ILE 21 -0.041 -2.218 -8.019
153 1HG2 ILE 21 1HG2 ILE 21 2.005 -3.317 -7.444
154 2HG2 ILE 21 2HG2 ILE 21 2.681 -3.225 -5.819
155 3HG2 ILE 21 3HG2 ILE 21 1.261 -4.224 -6.128
156 1HD1 ILE 21 1HD1 ILE 21 -0.758 -4.144 -6.410
157 2HD1 ILE 21 2HD1 ILE 21 -1.988 -2.984 -5.906
158 3HD1 ILE 21 3HD1 ILE 21 -1.891 -3.490 -7.592
159 H LYS 22 H LYS 22 1.471 -0.211 -3.331
160 HA LYS 22 HA LYS 22 3.373 -1.849 -1.849
161 1HB LYS 22 1HB LYS 22 5.240 -0.284 -2.443
162 2HB LYS 22 2HB LYS 22 4.688 -1.297 -3.770
163 1HG LYS 22 1HG LYS 22 3.265 0.657 -4.502
164 2HG LYS 22 2HG LYS 22 4.158 1.626 -3.328
165 1HD LYS 22 1HD LYS 22 6.263 0.981 -4.457
166 2HD LYS 22 2HD LYS 22 5.317 0.110 -5.667
167 1HE LYS 22 1HE LYS 22 5.876 2.253 -6.567
168 2HE LYS 22 2HE LYS 22 4.154 2.253 -6.192
169 1HZ LYS 22 1HZ LYS 22 5.689 3.159 -3.977
170 2HZ LYS 22 2HZ LYS 22 4.429 3.935 -4.794
171 3HZ LYS 22 3HZ LYS 22 6.018 4.087 -5.352
172 H CYS 23 H CYS 23 4.763 -0.214 -0.426
173 HA CYS 23 HA CYS 23 2.894 1.076 1.283
174 1HB CYS 23 1HB CYS 23 5.252 -0.005 1.776
175 2HB CYS 23 2HB CYS 23 5.827 1.631 1.468
176 H VAL 24 H VAL 24 2.963 3.330 1.943
177 HA VAL 24 HA VAL 24 3.551 5.098 -0.336
178 HB VAL 24 HB VAL 24 1.179 5.004 0.329
179 1HG1 VAL 24 1HG1 VAL 24 0.556 4.980 2.459
180 2HG1 VAL 24 2HG1 VAL 24 2.251 5.089 2.938
181 3HG1 VAL 24 3HG1 VAL 24 1.297 6.558 2.722
182 1HG2 VAL 24 1HG2 VAL 24 2.604 7.177 -0.358
183 2HG2 VAL 24 2HG2 VAL 24 0.859 7.202 -0.102
184 3HG2 VAL 24 2HG3 VAL 24 1.946 7.724 1.184
185 H ALA 25 H ALA 25 5.267 4.171 2.039
186 HA ALA 25 HA ALA 25 6.231 6.859 2.726
187 1HB ALA 25 1HB ALA 25 5.169 6.364 4.719
188 2HB ALA 25 2HB ALA 25 5.550 4.644 4.616
189 3HB ALA 25 3HB ALA 25 6.815 5.805 5.022
190 H CYS 26 H CYS 26 6.918 3.392 2.570
191 HA CYS 26 HA CYS 26 9.774 4.040 2.241
192 1HB CYS 26 1HB CYS 26 10.353 1.975 3.222
193 2HB CYS 26 2HB CYS 26 9.055 2.604 4.234
194 H GLU 27 H GLU 27 7.005 2.905 0.692
195 HA GLU 27 HA GLU 27 6.627 2.139 -1.419
196 1HB GLU 27 1HB GLU 27 9.568 2.286 -2.008
197 2HB GLU 27 2HB GLU 27 8.213 2.521 -3.103
198 1HG GLU 27 1HG GLU 27 9.337 4.399 -1.068
199 2HG GLU 27 2HG GLU 27 9.055 4.658 -2.788
200 H THR 28 H THR 28 6.756 0.251 0.494
201 HA THR 28 HA THR 28 8.548 -1.873 -0.368
202 HB THR 28 HB THR 28 6.987 -1.309 2.036
203 HG1 THR 28 1HG THR 28 9.209 -3.010 1.477
204 1HG2 THR 28 1HG2 THR 28 6.755 -3.777 2.579
205 2HG2 THR 28 2HG2 THR 28 6.954 -4.079 0.853
206 3HG2 THR 28 3HG2 THR 28 5.588 -3.123 1.430
207 HA PRO 29 HA PRO 29 5.642 -3.859 -3.012
208 1HB PRO 29 1HB PRO 29 6.606 -6.394 -2.896
209 2HB PRO 29 2HB PRO 29 7.416 -5.097 -3.784
210 1HG PRO 29 1HG PRO 29 8.011 -6.186 -1.059
211 2HG PRO 29 2HG PRO 29 9.135 -5.749 -2.360
212 1HD PRO 29 1HD PRO 29 8.654 -4.128 -0.244
213 2HD PRO 29 2HD PRO 29 9.036 -3.501 -1.860
214 H LYS 30 H LYS 30 3.606 -4.075 -2.298
215 HA LYS 30 HA LYS 30 2.779 -5.115 0.142
216 1HB LYS 30 1HB LYS 30 1.272 -3.765 -1.130
217 2HB LYS 30 2HB LYS 30 1.332 -4.873 -2.494
218 1HG LYS 30 1HG LYS 30 0.387 -6.566 -0.699
219 2HG LYS 30 2HG LYS 30 -0.175 -5.071 0.053
220 1HD LYS 30 1HD LYS 30 -0.651 -5.279 -2.844
221 2HD LYS 30 2HD LYS 30 -1.543 -6.433 -1.850
222 1HE LYS 30 1HE LYS 30 -2.331 -4.530 -0.458
223 2HE LYS 30 2HE LYS 30 -1.541 -3.429 -1.584
224 1HZ LYS 30 1HZ LYS 30 -3.551 -3.446 -2.556
225 2HZ LYS 30 2HZ LYS 30 -4.004 -4.929 -1.882
226 3HZ LYS 30 3HZ LYS 30 -3.014 -4.891 -3.253
227 HA PRO 31 HA PRO 31 3.214 -9.478 -0.264
228 1HB PRO 31 1HB PRO 31 1.391 -10.261 1.589
229 2HB PRO 31 2HB PRO 31 2.957 -9.564 2.018
230 1HG PRO 31 1HG PRO 31 0.269 -8.253 1.897
231 2HG PRO 31 2HG PRO 31 1.540 -8.087 3.122
232 1HD PRO 31 1HD PRO 31 1.144 -6.247 1.176
233 2HD PRO 31 2HD PRO 31 2.751 -6.597 1.847
Start of MODEL 4
1 1H GLY 0 1H GLY 0 -10.453 -11.488 -3.862
2 1HA GLY 0 1HA GLY 0 -13.042 -10.847 -2.758
3 2HA GLY 0 2HA GLY 0 -12.130 -11.998 -1.793
4 H HIS 1 H HIS 1 -12.887 -9.545 -0.771
5 HA HIS 1 HA HIS 1 -10.395 -7.982 -0.774
6 1HB HIS 1 1HB HIS 1 -13.261 -7.262 -0.281
7 2HB HIS 1 2HB HIS 1 -11.984 -6.284 0.438
8 HD1 HIS 1 HD1 HIS 1 -13.527 -4.689 -1.396
9 HD2 HIS 1 HD2 HIS 1 -10.533 -7.194 -2.818
10 HE1 HIS 1 HE1 HIS 1 -12.912 -3.783 -3.660
11 H MET 2 H MET 2 -10.184 -10.251 0.645
12 HA MET 2 HA MET 2 -11.026 -10.466 3.220
13 1HB MET 2 1HB MET 2 -8.548 -11.289 3.635
14 2HB MET 2 2HB MET 2 -9.658 -12.210 2.629
15 1HG MET 2 1HG MET 2 -8.577 -11.667 0.691
16 2HG MET 2 2HG MET 2 -7.943 -10.157 1.340
17 1HE MET 2 1HE MET 2 -5.357 -10.516 3.314
18 2HE MET 2 2HE MET 2 -4.568 -10.727 1.751
19 3HE MET 2 3HE MET 2 -5.997 -9.701 1.887
20 H VAL 3 H VAL 3 -8.759 -8.144 1.941
21 HA VAL 3 HA VAL 3 -7.496 -7.264 4.246
22 HB VAL 3 HB VAL 3 -7.278 -5.062 3.108
23 1HG1 VAL 3 1HG1 VAL 3 -5.618 -6.682 2.621
24 2HG1 VAL 3 2HG1 VAL 3 -6.696 -7.563 1.536
25 3HG1 VAL 3 3HG1 VAL 3 -6.090 -5.971 1.079
26 1HG2 VAL 3 1HG2 VAL 3 -9.087 -4.555 1.849
27 2HG2 VAL 3 2HG2 VAL 3 -8.149 -5.348 0.583
28 3HG2 VAL 3 3HG2 VAL 3 -9.409 -6.240 1.437
29 H ILE 4 H ILE 4 -8.326 -6.562 6.090
30 HA ILE 4 HA ILE 4 -10.965 -5.958 6.605
31 HB ILE 4 HB ILE 4 -8.426 -5.223 8.009
32 1HG1 ILE 4 1HG1 ILE 4 -10.839 -6.812 8.900
33 2HG1 ILE 4 2HG1 ILE 4 -9.419 -7.520 8.138
34 1HG2 ILE 4 1HG2 ILE 4 -9.959 -4.368 9.875
35 2HG2 ILE 4 2HG2 ILE 4 -9.649 -3.298 8.509
36 3HG2 ILE 4 3HG2 ILE 4 -11.172 -4.181 8.610
37 1HD1 ILE 4 1HD1 ILE 4 -8.153 -6.327 10.085
38 2HD1 ILE 4 2HD1 ILE 4 -9.738 -6.369 10.860
39 3HD1 ILE 4 3HD1 ILE 4 -8.965 -7.869 10.350
40 H GLY 5 H GLY 5 -8.666 -4.057 4.956
41 1HA GLY 5 1HA GLY 5 -9.957 -2.204 3.735
42 2HA GLY 5 2HA GLY 5 -10.264 -1.615 5.362
43 H THR 6 H THR 6 -7.286 -2.964 5.483
44 HA THR 6 HA THR 6 -5.599 -1.156 4.180
45 HB THR 6 HB THR 6 -4.902 -0.035 6.516
46 HG1 THR 6 1HG THR 6 -7.159 -1.140 7.151
47 1HG2 THR 6 1HG2 THR 6 -7.011 1.593 5.521
48 2HG2 THR 6 2HG2 THR 6 -6.256 0.778 4.151
49 3HG2 THR 6 3HG2 THR 6 -5.277 1.754 5.247
50 H TRP 7 H TRP 7 -3.411 -1.560 4.586
51 HA TRP 7 HA TRP 7 -2.872 -3.740 6.494
52 1HB TRP 7 1HB TRP 7 -1.086 -4.470 4.844
53 2HB TRP 7 2HB TRP 7 -2.754 -4.735 4.340
54 HD1 TRP 7 1HD TRP 7 -3.744 -2.825 2.558
55 HE1 TRP 7 1HE TRP 7 -2.513 -1.638 0.634
56 HE3 TRP 7 3HE TRP 7 1.074 -3.621 4.068
57 HZ2 TRP 7 2HZ TRP 7 0.150 -1.111 -0.140
58 HZ3 TRP 7 3HZ TRP 7 2.906 -2.743 2.679
59 HH2 TRP 7 2HH TRP 7 2.451 -1.515 0.618
60 H ASP 8 H ASP 8 -1.105 -3.547 7.775
61 HA ASP 8 HA ASP 8 0.299 -0.985 7.683
62 1HB ASP 8 1HB ASP 8 0.642 -3.035 9.851
63 2HB ASP 8 2HB ASP 8 0.802 -1.283 9.948
64 H CYS 9 H CYS 9 2.570 -0.827 7.762
65 HA CYS 9 HA CYS 9 3.924 -2.812 6.205
66 1HB CYS 9 1HB CYS 9 4.289 -0.239 6.246
67 2HB CYS 9 2HB CYS 9 5.311 -0.567 7.641
68 H ASP 10 H ASP 10 6.197 -3.507 6.935
69 HA ASP 10 HA ASP 10 6.152 -4.281 9.774
70 1HB ASP 10 1HB ASP 10 6.600 -6.505 9.323
71 2HB ASP 10 2HB ASP 10 5.523 -6.098 7.990
72 H THR 11 H THR 11 7.707 -2.541 7.533
73 HA THR 11 HA THR 11 10.356 -3.058 8.723
74 HB THR 11 HB THR 11 9.607 -2.353 5.903
75 HG1 THR 11 1HG THR 11 10.052 -4.478 6.095
76 1HG2 THR 11 1HG2 THR 11 11.992 -1.821 5.482
77 2HG2 THR 11 2HG2 THR 11 12.277 -1.846 7.223
78 3HG2 THR 11 3HG3 THR 11 11.200 -0.639 6.522
79 H CYS 12 H CYS 12 8.420 -0.524 7.125
80 HA CYS 12 HA CYS 12 9.891 1.505 8.640
81 1HB CYS 12 1HB CYS 12 9.343 3.027 7.003
82 2HB CYS 12 2HB CYS 12 9.351 1.545 6.053
83 H LEU 13 H LEU 13 7.042 -0.257 8.792
84 HA LEU 13 HA LEU 13 5.195 -0.148 10.112
85 1HB LEU 13 1HB LEU 13 7.110 1.664 11.483
86 2HB LEU 13 2HB LEU 13 5.425 1.699 11.998
87 HG LEU 13 HG LEU 13 5.762 -0.902 12.182
88 1HD1 LEU 13 1HD1 LEU 13 8.116 -1.293 13.073
89 2HD1 LEU 13 2HD1 LEU 13 8.554 0.196 12.236
90 3HD1 LEU 13 3HD1 LEU 13 7.925 -1.175 11.323
91 1HD2 LEU 13 1HD2 LEU 13 6.924 -0.251 14.527
92 2HD2 LEU 13 2HD2 LEU 13 5.207 -0.041 14.188
93 3HD2 LEU 13 3HD2 LEU 13 6.311 1.326 14.026
94 H VAL 14 H VAL 14 3.990 0.632 8.295
95 HA VAL 14 HA VAL 14 2.740 3.179 8.828
96 HB VAL 14 HB VAL 14 4.266 2.726 6.264
97 1HG1 VAL 14 1HG1 VAL 14 2.354 4.976 6.870
98 2HG1 VAL 14 2HG1 VAL 14 3.248 4.707 5.372
99 3HG1 VAL 14 3HG1 VAL 14 1.970 3.590 5.851
100 1HG2 VAL 14 1HG2 VAL 14 4.393 4.875 8.376
101 2HG2 VAL 14 2HG2 VAL 14 5.614 3.648 8.042
102 3HG2 VAL 14 3HG2 VAL 14 5.282 4.907 6.853
103 H GLN 15 H GLN 15 0.654 3.234 8.145
104 HA GLN 15 HA GLN 15 -0.438 0.776 7.078
105 1HB GLN 15 1HB GLN 15 -1.862 3.322 7.868
106 2HB GLN 15 2HB GLN 15 -2.612 1.763 7.551
107 1HG GLN 15 1HG GLN 15 -2.548 1.874 9.861
108 2HG GLN 15 2HG GLN 15 -1.142 0.890 9.460
109 1HE2 GLN 15 2HE2 GLN 15 -2.113 4.225 10.122
110 2HE2 GLN 15 1HE2 GLN 15 -0.646 4.682 10.912
111 H ASN 16 H ASN 16 -1.618 0.572 5.171
112 HA ASN 16 HA ASN 16 -1.689 2.838 3.336
113 1HB ASN 16 1HB ASN 16 -0.678 0.263 2.217
114 2HB ASN 16 2HB ASN 16 -0.388 1.912 1.673
115 1HD2 ASN 16 2HD2 ASN 16 0.218 -0.134 4.508
116 2HD2 ASN 16 1HD2 ASN 16 1.835 0.416 4.770
117 H LYS 17 H LYS 17 -3.224 2.643 1.676
118 HA LYS 17 HA LYS 17 -5.537 1.173 2.329
119 1HB LYS 17 1HB LYS 17 -6.535 2.172 0.470
120 2HB LYS 17 2HB LYS 17 -5.303 3.335 0.940
121 1HG LYS 17 1HG LYS 17 -3.883 2.689 -0.839
122 2HG LYS 17 2HG LYS 17 -4.862 1.263 -1.192
123 1HD LYS 17 1HD LYS 17 -5.524 2.748 -2.844
124 2HD LYS 17 2HD LYS 17 -6.762 2.981 -1.607
125 1HE LYS 17 1HE LYS 17 -4.292 4.690 -1.836
126 2HE LYS 17 2HE LYS 17 -5.824 5.089 -2.612
127 1HZ LYS 17 1HZ LYS 17 -6.581 4.620 -0.077
128 2HZ LYS 17 2HZ LYS 17 -6.235 6.152 -0.704
129 3HZ LYS 17 3HZ LYS 17 -5.053 5.306 0.161
130 HA PRO 18 HA PRO 18 -4.797 -2.760 0.505
131 1HB PRO 18 1HB PRO 18 -7.355 -3.522 0.010
132 2HB PRO 18 2HB PRO 18 -6.665 -3.476 1.637
133 1HG PRO 18 1HG PRO 18 -8.421 -1.475 0.268
134 2HG PRO 18 2HG PRO 18 -8.497 -2.075 1.935
135 1HD PRO 18 1HD PRO 18 -7.392 0.312 1.294
136 2HD PRO 18 2HD PRO 18 -6.808 -0.677 2.648
137 H GLU 19 H GLU 19 -6.148 -0.151 -1.198
138 HA GLU 19 HA GLU 19 -6.479 -1.595 -3.695
139 1HB GLU 19 1HB GLU 19 -8.083 0.062 -3.560
140 2HB GLU 19 2HB GLU 19 -6.998 1.194 -2.763
141 1HG GLU 19 1HG GLU 19 -7.535 1.935 -5.006
142 2HG GLU 19 2HG GLU 19 -5.819 1.559 -4.862
143 H ALA 20 H ALA 20 -3.929 -0.293 -2.010
144 HA ALA 20 HA ALA 20 -2.448 0.671 -4.315
145 1HB ALA 20 1HB ALA 20 -1.646 0.400 -1.421
146 2HB ALA 20 2HB ALA 20 -0.660 1.133 -2.686
147 3HB ALA 20 3HB ALA 20 -2.196 1.869 -2.227
148 H ILE 21 H ILE 21 -0.096 -0.127 -4.466
149 HA ILE 21 HA ILE 21 -0.133 -3.072 -4.389
150 HB ILE 21 HB ILE 21 1.429 -1.265 -6.238
151 1HG1 ILE 21 1HG1 ILE 21 -0.099 -2.552 -7.929
152 2HG1 ILE 21 2HG1 ILE 21 -1.129 -2.805 -6.525
153 1HG2 ILE 21 1HG2 ILE 21 2.615 -3.338 -5.713
154 2HG2 ILE 21 2HG2 ILE 21 1.198 -4.271 -6.187
155 3HG2 ILE 21 3HG2 ILE 21 2.068 -3.320 -7.389
156 1HD1 ILE 21 1HD1 ILE 21 -1.512 -0.503 -6.267
157 2HD1 ILE 21 2HD1 ILE 21 -0.196 -0.082 -7.366
158 3HD1 ILE 21 3HD1 ILE 21 -1.667 -0.825 -7.995
159 H LYS 22 H LYS 22 1.477 -0.241 -3.312
160 HA LYS 22 HA LYS 22 3.382 -1.885 -1.836
161 1HB LYS 22 1HB LYS 22 5.250 -0.334 -2.430
162 2HB LYS 22 2HB LYS 22 4.676 -1.312 -3.775
163 1HG LYS 22 1HG LYS 22 3.313 0.633 -4.520
164 2HG LYS 22 2HG LYS 22 4.087 1.593 -3.257
165 1HD LYS 22 1HD LYS 22 5.301 2.026 -5.238
166 2HD LYS 22 2HD LYS 22 6.299 0.919 -4.292
167 1HE LYS 22 1HE LYS 22 6.339 0.156 -6.545
168 2HE LYS 22 2HE LYS 22 5.323 -0.959 -5.634
169 1HZ LYS 22 1HZ LYS 22 3.614 0.978 -6.562
170 2HZ LYS 22 2HZ LYS 22 3.776 -0.595 -7.163
171 3HZ LYS 22 3HZ LYS 22 4.650 0.672 -7.865
172 H CYS 23 H CYS 23 4.787 -0.225 -0.433
173 HA CYS 23 HA CYS 23 2.917 1.044 1.298
174 1HB CYS 23 1HB CYS 23 5.283 -0.031 1.774
175 2HB CYS 23 2HB CYS 23 5.847 1.609 1.474
176 H VAL 24 H VAL 24 2.941 3.289 1.945
177 HA VAL 24 HA VAL 24 3.517 5.066 -0.327
178 HB VAL 24 HB VAL 24 1.151 4.944 0.400
179 1HG1 VAL 24 1HG1 VAL 24 1.339 4.539 2.731
180 2HG1 VAL 24 2HG1 VAL 24 2.284 6.009 2.977
181 3HG1 VAL 24 3HG1 VAL 24 0.576 6.118 2.550
182 1HG2 VAL 24 1HG2 VAL 24 2.702 7.218 -0.137
183 2HG2 VAL 24 2HG2 VAL 24 0.962 7.028 -0.353
184 3HG2 VAL 24 2HG3 VAL 24 1.596 7.678 1.158
185 H ALA 25 H ALA 25 5.252 4.137 2.044
186 HA ALA 25 HA ALA 25 6.210 6.829 2.730
187 1HB ALA 25 1HB ALA 25 5.310 6.375 4.771
188 2HB ALA 25 2HB ALA 25 5.471 4.629 4.578
189 3HB ALA 25 3HB ALA 25 6.882 5.606 4.982
190 H CYS 26 H CYS 26 6.973 3.362 2.650
191 HA CYS 26 HA CYS 26 9.800 4.064 2.215
192 1HB CYS 26 1HB CYS 26 10.421 1.972 3.143
193 2HB CYS 26 2HB CYS 26 9.181 2.617 4.213
194 H GLU 27 H GLU 27 7.021 2.892 0.711
195 HA GLU 27 HA GLU 27 6.621 2.157 -1.409
196 1HB GLU 27 1HB GLU 27 9.569 2.325 -1.992
197 2HB GLU 27 2HB GLU 27 8.221 2.499 -3.108
198 1HG GLU 27 1HG GLU 27 7.837 4.665 -2.534
199 2HG GLU 27 2HG GLU 27 8.438 4.454 -0.890
200 H THR 28 H THR 28 6.804 0.268 0.528
201 HA THR 28 HA THR 28 8.563 -1.862 -0.374
202 HB THR 28 HB THR 28 7.050 -1.293 2.053
203 HG1 THR 28 1HG THR 28 8.754 -2.762 2.835
204 1HG2 THR 28 1HG2 THR 28 6.791 -3.765 2.588
205 2HG2 THR 28 2HG2 THR 28 6.935 -4.052 0.855
206 3HG2 THR 28 3HG2 THR 28 5.606 -3.076 1.480
207 HA PRO 29 HA PRO 29 5.620 -3.843 -2.979
208 1HB PRO 29 1HB PRO 29 6.565 -6.385 -2.861
209 2HB PRO 29 2HB PRO 29 7.378 -5.098 -3.761
210 1HG PRO 29 1HG PRO 29 7.987 -6.181 -1.038
211 2HG PRO 29 2HG PRO 29 9.103 -5.758 -2.349
212 1HD PRO 29 1HD PRO 29 8.652 -4.125 -0.236
213 2HD PRO 29 2HD PRO 29 9.026 -3.507 -1.858
214 H LYS 30 H LYS 30 3.584 -4.086 -2.293
215 HA LYS 30 HA LYS 30 2.770 -5.098 0.175
216 1HB LYS 30 1HB LYS 30 1.266 -3.736 -1.092
217 2HB LYS 30 2HB LYS 30 1.302 -4.851 -2.451
218 1HG LYS 30 1HG LYS 30 0.363 -6.522 -0.623
219 2HG LYS 30 2HG LYS 30 -0.192 -5.013 0.103
220 1HD LYS 30 1HD LYS 30 -0.675 -5.266 -2.788
221 2HD LYS 30 2HD LYS 30 -1.566 -6.404 -1.775
222 1HE LYS 30 1HE LYS 30 -2.346 -4.479 -0.408
223 2HE LYS 30 2HE LYS 30 -1.562 -3.396 -1.557
224 1HZ LYS 30 1HZ LYS 30 -3.571 -3.430 -2.525
225 2HZ LYS 30 2HZ LYS 30 -4.029 -4.894 -1.814
226 3HZ LYS 30 3HZ LYS 30 -3.046 -4.893 -3.191
227 HA PRO 31 HA PRO 31 3.169 -9.465 -0.236
228 1HB PRO 31 1HB PRO 31 1.358 -10.234 1.634
229 2HB PRO 31 2HB PRO 31 2.933 -9.548 2.049
230 1HG PRO 31 1HG PRO 31 0.254 -8.217 1.951
231 2HG PRO 31 2HG PRO 31 1.537 -8.062 3.165
232 1HD PRO 31 1HD PRO 31 1.137 -6.217 1.223
233 2HD PRO 31 2HD PRO 31 2.746 -6.580 1.879
Start of MODEL 5
1 1H GLY 0 1H GLY 0 -16.250 7.923 13.086
2 1HA GLY 0 1HA GLY 0 -15.116 5.656 12.961
3 2HA GLY 0 2HA GLY 0 -16.716 5.710 12.234
4 H HIS 1 H HIS 1 -13.891 4.385 11.733
5 HA HIS 1 HA HIS 1 -13.254 5.145 9.057
6 1HB HIS 1 1HB HIS 1 -12.460 2.792 10.771
7 2HB HIS 1 2HB HIS 1 -11.892 2.991 9.116
8 HD1 HIS 1 HD1 HIS 1 -10.950 3.727 12.480
9 HD2 HIS 1 HD2 HIS 1 -10.522 5.655 8.824
10 HE1 HIS 1 HE1 HIS 1 -9.089 5.387 12.808
11 H MET 2 H MET 2 -13.788 4.186 7.135
12 HA MET 2 HA MET 2 -16.037 2.300 7.241
13 1HB MET 2 1HB MET 2 -15.210 4.433 5.327
14 2HB MET 2 2HB MET 2 -16.103 3.054 4.700
15 1HG MET 2 1HG MET 2 -17.744 3.573 6.648
16 2HG MET 2 2HG MET 2 -16.977 5.160 6.618
17 1HE MET 2 1HE MET 2 -18.053 7.116 4.939
18 2HE MET 2 2HE MET 2 -16.536 6.385 4.417
19 3HE MET 2 3HE MET 2 -17.838 6.641 3.253
20 H VAL 3 H VAL 3 -12.942 2.893 5.627
21 HA VAL 3 HA VAL 3 -13.011 0.193 4.493
22 HB VAL 3 HB VAL 3 -11.028 2.419 4.000
23 1HG1 VAL 3 1HG1 VAL 3 -10.524 -0.176 3.644
24 2HG1 VAL 3 2HG1 VAL 3 -11.359 0.151 2.125
25 3HG1 VAL 3 3HG1 VAL 3 -9.915 1.069 2.555
26 1HG2 VAL 3 1HG2 VAL 3 -12.437 1.932 1.667
27 2HG2 VAL 3 2HG2 VAL 3 -13.671 1.889 2.926
28 3HG2 VAL 3 3HG2 VAL 3 -12.643 3.312 2.746
29 H ILE 4 H ILE 4 -12.652 -0.926 6.467
30 HA ILE 4 HA ILE 4 -10.143 -0.458 7.867
31 HB ILE 4 HB ILE 4 -10.987 -2.486 9.234
32 1HG1 ILE 4 1HG1 ILE 4 -13.697 -1.677 8.273
33 2HG1 ILE 4 2HG1 ILE 4 -12.778 -2.826 7.306
34 1HG2 ILE 4 1HG2 ILE 4 -12.286 -1.051 10.646
35 2HG2 ILE 4 2HG2 ILE 4 -10.974 -0.103 9.948
36 3HG2 ILE 4 3HG2 ILE 4 -12.610 0.052 9.308
37 1HD1 ILE 4 1HD1 ILE 4 -13.807 -4.326 8.617
38 2HD1 ILE 4 2HD1 ILE 4 -12.508 -3.931 9.743
39 3HD1 ILE 4 3HD1 ILE 4 -14.085 -3.163 9.913
40 H GLY 5 H GLY 5 -9.468 -1.148 5.391
41 1HA GLY 5 1HA GLY 5 -8.728 -4.003 5.592
42 2HA GLY 5 2HA GLY 5 -9.038 -3.191 4.064
43 H THR 6 H THR 6 -7.593 -0.774 5.280
44 HA THR 6 HA THR 6 -5.238 -0.841 3.983
45 HB THR 6 HB THR 6 -4.301 0.724 5.673
46 HG1 THR 6 1HG THR 6 -5.852 -0.527 7.329
47 1HG2 THR 6 1HG2 THR 6 -6.746 1.020 4.179
48 2HG2 THR 6 2HG2 THR 6 -5.461 2.195 4.464
49 3HG2 THR 6 3HG2 THR 6 -6.779 2.031 5.623
50 H TRP 7 H TRP 7 -3.212 -1.659 4.213
51 HA TRP 7 HA TRP 7 -2.858 -3.671 6.319
52 1HB TRP 7 1HB TRP 7 -0.876 -4.339 4.789
53 2HB TRP 7 2HB TRP 7 -2.514 -4.710 4.255
54 HD1 TRP 7 1HD TRP 7 -3.574 -2.836 2.444
55 HE1 TRP 7 1HE TRP 7 -2.365 -1.651 0.505
56 HE3 TRP 7 3HE TRP 7 1.257 -3.476 3.989
57 HZ2 TRP 7 2HZ TRP 7 0.286 -1.066 -0.267
58 HZ3 TRP 7 3HZ TRP 7 3.071 -2.574 2.592
59 HH2 TRP 7 2HH TRP 7 2.594 -1.394 0.509
60 H ASP 8 H ASP 8 -1.191 -3.604 7.750
61 HA ASP 8 HA ASP 8 0.237 -1.077 7.956
62 1HB ASP 8 1HB ASP 8 0.534 -3.338 9.906
63 2HB ASP 8 2HB ASP 8 0.622 -1.602 10.195
64 H CYS 9 H CYS 9 2.433 -0.830 7.856
65 HA CYS 9 HA CYS 9 3.879 -2.840 6.389
66 1HB CYS 9 1HB CYS 9 4.070 -0.317 6.066
67 2HB CYS 9 2HB CYS 9 5.018 -0.299 7.549
68 H ASP 10 H ASP 10 5.824 -3.845 7.044
69 HA ASP 10 HA ASP 10 6.133 -4.052 9.967
70 1HB ASP 10 1HB ASP 10 5.299 -6.085 8.538
71 2HB ASP 10 2HB ASP 10 7.000 -6.233 8.103
72 H THR 11 H THR 11 7.473 -2.386 7.748
73 HA THR 11 HA THR 11 10.235 -3.018 8.558
74 HB THR 11 HB THR 11 9.193 -2.326 5.827
75 HG1 THR 11 1HG THR 11 9.596 -4.525 6.374
76 1HG2 THR 11 1HG2 THR 11 10.892 -0.673 6.160
77 2HG2 THR 11 2HG2 THR 11 11.587 -1.955 5.166
78 3HG2 THR 11 3HG3 THR 11 11.980 -1.856 6.883
79 H CYS 12 H CYS 12 8.115 -0.479 7.241
80 HA CYS 12 HA CYS 12 9.775 1.520 8.625
81 1HB CYS 12 1HB CYS 12 9.311 3.049 6.966
82 2HB CYS 12 2HB CYS 12 9.274 1.556 6.035
83 H LEU 13 H LEU 13 7.011 -0.187 9.021
84 HA LEU 13 HA LEU 13 5.141 0.037 10.297
85 1HB LEU 13 1HB LEU 13 6.356 2.426 11.616
86 2HB LEU 13 2HB LEU 13 5.363 1.151 12.317
87 HG LEU 13 HG LEU 13 8.146 0.596 11.340
88 1HD1 LEU 13 1HD1 LEU 13 8.969 1.934 12.914
89 2HD1 LEU 13 2HD1 LEU 13 8.283 0.822 14.098
90 3HD1 LEU 13 3HD1 LEU 13 7.369 2.242 13.591
91 1HD2 LEU 13 1HD2 LEU 13 7.974 -1.175 13.081
92 2HD2 LEU 13 2HD2 LEU 13 6.810 -1.346 11.768
93 3HD2 LEU 13 3HD2 LEU 13 6.291 -0.706 13.328
94 H VAL 14 H VAL 14 3.726 0.662 8.668
95 HA VAL 14 HA VAL 14 2.474 3.179 9.006
96 HB VAL 14 HB VAL 14 4.641 3.191 7.176
97 1HG1 VAL 14 1HG1 VAL 14 3.559 3.855 5.102
98 2HG1 VAL 14 2HG1 VAL 14 3.095 2.211 5.541
99 3HG1 VAL 14 3HG1 VAL 14 1.975 3.546 5.811
100 1HG2 VAL 14 1HG2 VAL 14 2.648 5.377 7.121
101 2HG2 VAL 14 2HG2 VAL 14 3.348 4.979 8.691
102 3HG2 VAL 14 3HG2 VAL 14 4.395 5.439 7.349
103 H GLN 15 H GLN 15 0.414 3.093 8.292
104 HA GLN 15 HA GLN 15 -0.472 0.621 7.070
105 1HB GLN 15 1HB GLN 15 -2.004 3.014 8.097
106 2HB GLN 15 2HB GLN 15 -2.751 1.555 7.461
107 1HG GLN 15 1HG GLN 15 -2.101 0.273 9.271
108 2HG GLN 15 2HG GLN 15 -0.807 1.384 9.720
109 1HE2 GLN 15 2HE2 GLN 15 -3.379 0.214 10.992
110 2HE2 GLN 15 1HE2 GLN 15 -4.082 1.589 11.766
111 H ASN 16 H ASN 16 -1.565 0.433 5.118
112 HA ASN 16 HA ASN 16 -1.714 2.801 3.405
113 1HB ASN 16 1HB ASN 16 -0.635 0.290 2.196
114 2HB ASN 16 2HB ASN 16 -0.392 1.964 1.704
115 1HD2 ASN 16 2HD2 ASN 16 0.198 -0.022 4.591
116 2HD2 ASN 16 1HD2 ASN 16 1.821 0.518 4.835
117 H LYS 17 H LYS 17 -3.261 2.686 1.769
118 HA LYS 17 HA LYS 17 -5.559 1.191 2.308
119 1HB LYS 17 1HB LYS 17 -6.506 2.205 0.437
120 2HB LYS 17 2HB LYS 17 -5.260 3.351 0.912
121 1HG LYS 17 1HG LYS 17 -3.825 2.656 -0.839
122 2HG LYS 17 2HG LYS 17 -4.836 1.254 -1.198
123 1HD LYS 17 1HD LYS 17 -5.222 2.963 -2.858
124 2HD LYS 17 2HD LYS 17 -6.664 2.791 -1.854
125 1HE LYS 17 1HE LYS 17 -5.941 4.740 -0.531
126 2HE LYS 17 2HE LYS 17 -4.545 4.923 -1.592
127 1HZ LYS 17 1HZ LYS 17 -6.616 6.332 -2.046
128 2HZ LYS 17 2HZ LYS 17 -7.283 4.918 -2.690
129 3HZ LYS 17 3HZ LYS 17 -5.872 5.568 -3.360
130 HA PRO 18 HA PRO 18 -4.751 -2.750 0.525
131 1HB PRO 18 1HB PRO 18 -7.302 -3.547 0.047
132 2HB PRO 18 2HB PRO 18 -6.604 -3.482 1.670
133 1HG PRO 18 1HG PRO 18 -8.392 -1.512 0.298
134 2HG PRO 18 2HG PRO 18 -8.451 -2.103 1.969
135 1HD PRO 18 1HD PRO 18 -7.380 0.295 1.309
136 2HD PRO 18 2HD PRO 18 -6.777 -0.680 2.665
137 H GLU 19 H GLU 19 -6.149 -0.170 -1.185
138 HA GLU 19 HA GLU 19 -6.472 -1.631 -3.673
139 1HB GLU 19 1HB GLU 19 -6.581 1.357 -3.442
140 2HB GLU 19 2HB GLU 19 -7.447 0.300 -4.549
141 1HG GLU 19 1HG GLU 19 -7.962 0.612 -1.600
142 2HG GLU 19 2HG GLU 19 -8.960 1.227 -2.915
143 H ALA 20 H ALA 20 -3.932 -0.278 -2.009
144 HA ALA 20 HA ALA 20 -2.476 0.699 -4.321
145 1HB ALA 20 1HB ALA 20 -1.650 0.418 -1.434
146 2HB ALA 20 2HB ALA 20 -0.677 1.166 -2.701
147 3HB ALA 20 3HB ALA 20 -2.215 1.887 -2.230
148 H ILE 21 H ILE 21 -0.107 -0.076 -4.473
149 HA ILE 21 HA ILE 21 -0.117 -3.022 -4.412
150 HB ILE 21 HB ILE 21 1.364 -1.179 -6.292
151 1HG1 ILE 21 1HG1 ILE 21 -0.118 -2.529 -7.959
152 2HG1 ILE 21 2HG1 ILE 21 -1.107 -2.869 -6.543
153 1HG2 ILE 21 1HG2 ILE 21 2.757 -3.046 -5.974
154 2HG2 ILE 21 2HG2 ILE 21 1.394 -4.164 -5.964
155 3HG2 ILE 21 3HG2 ILE 21 1.875 -3.375 -7.465
156 1HD1 ILE 21 1HD1 ILE 21 -0.368 -0.056 -7.198
157 2HD1 ILE 21 2HD1 ILE 21 -1.681 -0.858 -8.063
158 3HD1 ILE 21 3HD1 ILE 21 -1.760 -0.675 -6.311
159 H LYS 22 H LYS 22 1.479 -0.171 -3.362
160 HA LYS 22 HA LYS 22 3.425 -1.794 -1.915
161 1HB LYS 22 1HB LYS 22 5.231 -0.117 -2.529
162 2HB LYS 22 2HB LYS 22 4.746 -1.233 -3.799
163 1HG LYS 22 1HG LYS 22 4.820 0.741 -4.951
164 2HG LYS 22 2HG LYS 22 3.121 0.699 -4.473
165 1HD LYS 22 1HD LYS 22 3.583 2.169 -2.600
166 2HD LYS 22 2HD LYS 22 5.307 2.153 -2.983
167 1HE LYS 22 1HE LYS 22 4.526 3.026 -5.303
168 2HE LYS 22 2HE LYS 22 3.048 3.460 -4.447
169 1HZ LYS 22 1HZ LYS 22 5.546 4.787 -4.465
170 2HZ LYS 22 2HZ LYS 22 5.142 4.355 -2.881
171 3HZ LYS 22 3HZ LYS 22 4.077 5.295 -3.799
172 H CYS 23 H CYS 23 4.797 -0.183 -0.477
173 HA CYS 23 HA CYS 23 2.919 1.114 1.230
174 1HB CYS 23 1HB CYS 23 5.246 -0.035 1.743
175 2HB CYS 23 2HB CYS 23 5.856 1.597 1.486
176 H VAL 24 H VAL 24 2.891 3.336 1.845
177 HA VAL 24 HA VAL 24 3.594 5.121 -0.377
178 HB VAL 24 HB VAL 24 1.216 5.056 0.331
179 1HG1 VAL 24 1HG1 VAL 24 1.151 6.626 2.603
180 2HG1 VAL 24 2HG1 VAL 24 0.816 4.896 2.520
181 3HG1 VAL 24 3HG1 VAL 24 2.434 5.463 2.935
182 1HG2 VAL 24 1HG2 VAL 24 0.918 7.257 -0.128
183 2HG2 VAL 24 2HG2 VAL 24 2.090 7.783 1.079
184 3HG2 VAL 24 2HG3 VAL 24 2.645 7.167 -0.477
185 H ALA 25 H ALA 25 5.248 4.121 2.043
186 HA ALA 25 HA ALA 25 6.273 6.784 2.761
187 1HB ALA 25 1HB ALA 25 6.377 4.548 4.742
188 2HB ALA 25 2HB ALA 25 6.450 6.291 5.011
189 3HB ALA 25 3HB ALA 25 4.918 5.528 4.584
190 H CYS 26 H CYS 26 6.982 3.303 2.661
191 HA CYS 26 HA CYS 26 9.817 3.966 2.218
192 1HB CYS 26 1HB CYS 26 10.406 1.850 3.131
193 2HB CYS 26 2HB CYS 26 9.201 2.533 4.219
194 H GLU 27 H GLU 27 7.034 2.920 0.680
195 HA GLU 27 HA GLU 27 6.613 2.157 -1.423
196 1HB GLU 27 1HB GLU 27 9.538 2.248 -2.077
197 2HB GLU 27 2HB GLU 27 8.159 2.569 -3.120
198 1HG GLU 27 1HG GLU 27 7.775 4.680 -2.097
199 2HG GLU 27 2HG GLU 27 8.948 4.342 -0.825
200 H THR 28 H THR 28 6.843 0.266 0.540
201 HA THR 28 HA THR 28 8.575 -1.870 -0.367
202 HB THR 28 HB THR 28 6.971 -1.332 2.022
203 HG1 THR 28 1HG THR 28 9.270 -2.911 1.430
204 1HG2 THR 28 1HG2 THR 28 6.972 -4.072 0.780
205 2HG2 THR 28 2HG2 THR 28 5.612 -3.159 1.435
206 3HG2 THR 28 3HG2 THR 28 6.823 -3.837 2.521
207 HA PRO 29 HA PRO 29 5.681 -3.809 -3.060
208 1HB PRO 29 1HB PRO 29 6.638 -6.347 -2.971
209 2HB PRO 29 2HB PRO 29 7.456 -5.043 -3.837
210 1HG PRO 29 1HG PRO 29 8.031 -6.168 -1.124
211 2HG PRO 29 2HG PRO 29 9.164 -5.716 -2.410
212 1HD PRO 29 1HD PRO 29 8.673 -4.123 -0.277
213 2HD PRO 29 2HD PRO 29 9.068 -3.475 -1.882
214 H LYS 30 H LYS 30 3.645 -3.984 -2.315
215 HA LYS 30 HA LYS 30 2.779 -5.035 0.083
216 1HB LYS 30 1HB LYS 30 1.277 -3.730 -1.237
217 2HB LYS 30 2HB LYS 30 1.385 -4.853 -2.585
218 1HG LYS 30 1HG LYS 30 0.415 -6.551 -0.835
219 2HG LYS 30 2HG LYS 30 -0.148 -5.075 -0.047
220 1HD LYS 30 1HD LYS 30 -0.631 -5.138 -2.932
221 2HD LYS 30 2HD LYS 30 -1.467 -6.412 -2.040
222 1HE LYS 30 1HE LYS 30 -2.371 -4.688 -0.512
223 2HE LYS 30 2HE LYS 30 -1.605 -3.447 -1.502
224 1HZ LYS 30 1HZ LYS 30 -3.549 -3.438 -2.576
225 2HZ LYS 30 2HZ LYS 30 -4.019 -4.950 -1.980
226 3HZ LYS 30 3HZ LYS 30 -2.997 -4.851 -3.324
227 HA PRO 31 HA PRO 31 3.280 -9.397 -0.237
228 1HB PRO 31 1HB PRO 31 1.430 -10.175 1.590
229 2HB PRO 31 2HB PRO 31 2.977 -9.448 2.039
230 1HG PRO 31 1HG PRO 31 0.273 -8.178 1.838
231 2HG PRO 31 2HG PRO 31 1.515 -7.974 3.087
232 1HD PRO 31 1HD PRO 31 1.136 -6.172 1.102
233 2HD PRO 31 2HD PRO 31 2.732 -6.488 1.813
Start of MODEL 6
1 1H GLY 0 1H GLY 0 -17.389 10.135 5.642
2 1HA GLY 0 1HA GLY 0 -19.632 8.215 5.682
3 2HA GLY 0 2HA GLY 0 -18.442 8.193 4.387
4 H HIS 1 H HIS 1 -18.732 5.889 5.629
5 HA HIS 1 HA HIS 1 -17.338 5.419 7.992
6 1HB HIS 1 1HB HIS 1 -17.253 3.104 7.329
7 2HB HIS 1 2HB HIS 1 -18.797 3.772 6.806
8 HD1 HIS 1 HD1 HIS 1 -16.081 1.777 5.611
9 HD2 HIS 1 HD2 HIS 1 -18.640 4.579 3.917
10 HE1 HIS 1 HE1 HIS 1 -15.961 1.384 3.130
11 H MET 2 H MET 2 -15.259 4.131 8.138
12 HA MET 2 HA MET 2 -13.252 5.370 6.377
13 1HB MET 2 1HB MET 2 -12.976 4.392 9.224
14 2HB MET 2 2HB MET 2 -11.660 5.034 8.250
15 1HG MET 2 1HG MET 2 -14.123 6.657 8.724
16 2HG MET 2 2HG MET 2 -12.857 6.567 9.945
17 1HE MET 2 1HE MET 2 -10.789 9.430 9.033
18 2HE MET 2 2HE MET 2 -12.387 9.333 9.773
19 3HE MET 2 3HE MET 2 -11.164 8.120 10.154
20 H VAL 3 H VAL 3 -11.361 4.104 5.846
21 HA VAL 3 HA VAL 3 -12.060 1.348 5.280
22 HB VAL 3 HB VAL 3 -9.554 2.869 4.552
23 1HG1 VAL 3 1HG1 VAL 3 -10.471 0.575 2.946
24 2HG1 VAL 3 2HG1 VAL 3 -8.839 1.065 3.399
25 3HG1 VAL 3 3HG1 VAL 3 -9.850 0.191 4.550
26 1HG2 VAL 3 1HG2 VAL 3 -10.575 3.695 2.723
27 2HG2 VAL 3 2HG2 VAL 3 -11.549 2.245 2.482
28 3HG2 VAL 3 3HG2 VAL 3 -12.044 3.454 3.668
29 H ILE 4 H ILE 4 -11.357 -0.382 6.358
30 HA ILE 4 HA ILE 4 -9.256 0.014 8.383
31 HB ILE 4 HB ILE 4 -11.643 -1.814 8.351
32 1HG1 ILE 4 1HG1 ILE 4 -12.034 0.388 9.278
33 2HG1 ILE 4 2HG1 ILE 4 -12.009 -0.785 10.589
34 1HG2 ILE 4 1HG2 ILE 4 -9.111 -2.053 9.936
35 2HG2 ILE 4 2HG2 ILE 4 -10.644 -2.659 10.562
36 3HG2 ILE 4 3HG2 ILE 4 -9.991 -3.301 9.054
37 1HD1 ILE 4 1HD1 ILE 4 -10.274 1.496 10.078
38 2HD1 ILE 4 2HD1 ILE 4 -10.628 0.648 11.583
39 3HD1 ILE 4 3HD1 ILE 4 -9.403 0.017 10.483
40 H GLY 5 H GLY 5 -10.175 -1.721 5.564
41 1HA GLY 5 1HA GLY 5 -8.719 -4.082 5.809
42 2HA GLY 5 2HA GLY 5 -9.067 -3.272 4.288
43 H THR 6 H THR 6 -7.600 -0.842 5.296
44 HA THR 6 HA THR 6 -5.271 -0.963 3.989
45 HB THR 6 HB THR 6 -4.290 0.650 5.623
46 HG1 THR 6 1HG THR 6 -6.375 -0.356 7.155
47 1HG2 THR 6 1HG2 THR 6 -6.736 2.000 5.521
48 2HG2 THR 6 2HG2 THR 6 -6.745 0.916 4.129
49 3HG2 THR 6 3HG2 THR 6 -5.431 2.073 4.339
50 H TRP 7 H TRP 7 -3.208 -1.715 4.239
51 HA TRP 7 HA TRP 7 -2.823 -3.691 6.374
52 1HB TRP 7 1HB TRP 7 -0.834 -4.353 4.849
53 2HB TRP 7 2HB TRP 7 -2.466 -4.761 4.329
54 HD1 TRP 7 1HD TRP 7 -3.569 -2.876 2.524
55 HE1 TRP 7 1HE TRP 7 -2.387 -1.727 0.546
56 HE3 TRP 7 3HE TRP 7 1.286 -3.552 3.976
57 HZ2 TRP 7 2HZ TRP 7 0.253 -1.181 -0.288
58 HZ3 TRP 7 3HZ TRP 7 3.080 -2.687 2.532
59 HH2 TRP 7 2HH TRP 7 2.572 -1.527 0.444
60 H ASP 8 H ASP 8 -1.164 -3.571 7.808
61 HA ASP 8 HA ASP 8 0.280 -1.036 7.906
62 1HB ASP 8 1HB ASP 8 0.342 -3.200 10.003
63 2HB ASP 8 2HB ASP 8 0.677 -1.482 10.197
64 H CYS 9 H CYS 9 2.383 -0.836 7.472
65 HA CYS 9 HA CYS 9 3.850 -2.873 6.237
66 1HB CYS 9 1HB CYS 9 4.177 -0.288 6.206
67 2HB CYS 9 2HB CYS 9 5.194 -0.570 7.617
68 H ASP 10 H ASP 10 6.144 -3.463 7.052
69 HA ASP 10 HA ASP 10 6.121 -4.059 9.924
70 1HB ASP 10 1HB ASP 10 5.282 -5.999 8.406
71 2HB ASP 10 2HB ASP 10 6.979 -6.169 7.966
72 H THR 11 H THR 11 7.625 -2.386 7.772
73 HA THR 11 HA THR 11 10.304 -3.044 8.794
74 HB THR 11 HB THR 11 9.466 -3.169 6.065
75 HG1 THR 11 1HG THR 11 10.953 -4.614 6.752
76 1HG2 THR 11 1HG2 THR 11 11.191 -1.722 5.052
77 2HG2 THR 11 2HG2 THR 11 11.538 -1.049 6.645
78 3HG2 THR 11 3HG3 THR 11 9.957 -0.796 5.906
79 H CYS 12 H CYS 12 8.111 -0.613 7.501
80 HA CYS 12 HA CYS 12 9.827 1.477 8.672
81 1HB CYS 12 1HB CYS 12 9.330 2.913 6.946
82 2HB CYS 12 2HB CYS 12 9.267 1.376 6.090
83 H LEU 13 H LEU 13 6.970 -0.190 9.035
84 HA LEU 13 HA LEU 13 5.138 0.074 10.355
85 1HB LEU 13 1HB LEU 13 7.105 1.968 11.532
86 2HB LEU 13 2HB LEU 13 5.430 2.066 12.072
87 HG LEU 13 HG LEU 13 5.625 -0.418 12.608
88 1HD1 LEU 13 1HD1 LEU 13 7.662 -1.467 12.668
89 2HD1 LEU 13 2HD1 LEU 13 8.564 0.046 12.764
90 3HD1 LEU 13 3HD1 LEU 13 7.854 -0.460 11.232
91 1HD2 LEU 13 1HD2 LEU 13 6.114 1.844 14.087
92 2HD2 LEU 13 2HD2 LEU 13 7.541 0.857 14.400
93 3HD2 LEU 13 3HD2 LEU 13 5.932 0.212 14.730
94 H VAL 14 H VAL 14 4.053 0.754 8.363
95 HA VAL 14 HA VAL 14 2.764 3.316 8.743
96 HB VAL 14 HB VAL 14 4.391 2.733 6.272
97 1HG1 VAL 14 1HG1 VAL 14 1.867 4.055 6.448
98 2HG1 VAL 14 2HG1 VAL 14 3.114 5.238 6.048
99 3HG1 VAL 14 3HG1 VAL 14 2.896 3.810 5.036
100 1HG2 VAL 14 1HG2 VAL 14 5.601 3.806 8.087
101 2HG2 VAL 14 2HG2 VAL 14 5.371 4.933 6.750
102 3HG2 VAL 14 3HG2 VAL 14 4.365 5.059 8.193
103 H GLN 15 H GLN 15 0.671 3.189 8.215
104 HA GLN 15 HA GLN 15 -0.329 0.724 7.081
105 1HB GLN 15 1HB GLN 15 -1.684 3.178 8.197
106 2HB GLN 15 2HB GLN 15 -2.574 1.834 7.493
107 1HG GLN 15 1HG GLN 15 -2.645 1.261 9.695
108 2HG GLN 15 2HG GLN 15 -1.174 0.424 9.202
109 1HE2 GLN 15 2HE2 GLN 15 0.686 0.902 10.189
110 2HE2 GLN 15 1HE2 GLN 15 0.896 2.163 11.350
111 H ASN 16 H ASN 16 -1.545 0.521 5.196
112 HA ASN 16 HA ASN 16 -1.723 2.838 3.424
113 1HB ASN 16 1HB ASN 16 -0.712 0.296 2.224
114 2HB ASN 16 2HB ASN 16 -0.468 1.959 1.697
115 1HD2 ASN 16 2HD2 ASN 16 0.262 -0.116 4.482
116 2HD2 ASN 16 1HD2 ASN 16 1.878 0.456 4.699
117 H LYS 17 H LYS 17 -3.168 2.506 1.611
118 HA LYS 17 HA LYS 17 -5.499 1.046 2.358
119 1HB LYS 17 1HB LYS 17 -6.543 2.041 0.514
120 2HB LYS 17 2HB LYS 17 -5.346 3.231 1.008
121 1HG LYS 17 1HG LYS 17 -3.921 2.694 -0.790
122 2HG LYS 17 2HG LYS 17 -4.824 1.225 -1.164
123 1HD LYS 17 1HD LYS 17 -5.341 2.972 -2.773
124 2HD LYS 17 2HD LYS 17 -6.763 2.594 -1.797
125 1HE LYS 17 1HE LYS 17 -6.401 4.551 -0.434
126 2HE LYS 17 2HE LYS 17 -4.886 4.895 -1.268
127 1HZ LYS 17 1HZ LYS 17 -7.602 5.448 -2.077
128 2HZ LYS 17 2HZ LYS 17 -6.636 4.794 -3.302
129 3HZ LYS 17 3HZ LYS 17 -6.161 6.218 -2.520
130 HA PRO 18 HA PRO 18 -4.735 -2.844 0.457
131 1HB PRO 18 1HB PRO 18 -7.287 -3.626 -0.038
132 2HB PRO 18 2HB PRO 18 -6.588 -3.599 1.586
133 1HG PRO 18 1HG PRO 18 -8.375 -1.597 0.260
134 2HG PRO 18 2HG PRO 18 -8.434 -2.225 1.917
135 1HD PRO 18 1HD PRO 18 -7.360 0.185 1.311
136 2HD PRO 18 2HD PRO 18 -6.758 -0.821 2.644
137 H GLU 19 H GLU 19 -6.145 -0.228 -1.194
138 HA GLU 19 HA GLU 19 -6.460 -1.633 -3.714
139 1HB GLU 19 1HB GLU 19 -6.563 1.342 -3.518
140 2HB GLU 19 2HB GLU 19 -7.525 0.254 -4.508
141 1HG GLU 19 1HG GLU 19 -8.678 -0.496 -2.426
142 2HG GLU 19 2HG GLU 19 -7.816 0.776 -1.561
143 H ALA 20 H ALA 20 -3.926 -0.315 -2.021
144 HA ALA 20 HA ALA 20 -2.475 0.727 -4.309
145 1HB ALA 20 1HB ALA 20 -1.594 0.358 -1.448
146 2HB ALA 20 2HB ALA 20 -0.699 1.212 -2.705
147 3HB ALA 20 3HB ALA 20 -2.251 1.838 -2.148
148 H ILE 21 H ILE 21 -0.100 -0.033 -4.474
149 HA ILE 21 HA ILE 21 -0.091 -2.982 -4.466
150 HB ILE 21 HB ILE 21 1.301 -1.082 -6.356
151 1HG1 ILE 21 1HG1 ILE 21 -0.729 -3.207 -7.025
152 2HG1 ILE 21 2HG1 ILE 21 -1.208 -1.567 -6.603
153 1HG2 ILE 21 1HG2 ILE 21 1.471 -4.072 -6.080
154 2HG2 ILE 21 2HG2 ILE 21 1.956 -3.208 -7.538
155 3HG2 ILE 21 3HG2 ILE 21 2.784 -2.898 -6.013
156 1HD1 ILE 21 1HD1 ILE 21 0.678 -1.130 -8.520
157 2HD1 ILE 21 2HD1 ILE 21 -0.090 -2.617 -9.079
158 3HD1 ILE 21 3HD1 ILE 21 -1.064 -1.176 -8.788
159 H LYS 22 H LYS 22 1.363 -0.205 -3.204
160 HA LYS 22 HA LYS 22 3.379 -1.802 -1.871
161 1HB LYS 22 1HB LYS 22 5.213 -0.227 -2.481
162 2HB LYS 22 2HB LYS 22 4.617 -1.177 -3.836
163 1HG LYS 22 1HG LYS 22 3.182 0.805 -4.441
164 2HG LYS 22 2HG LYS 22 4.092 1.720 -3.237
165 1HD LYS 22 1HD LYS 22 5.005 2.040 -5.486
166 2HD LYS 22 2HD LYS 22 6.168 1.240 -4.426
167 1HE LYS 22 1HE LYS 22 5.887 0.320 -6.798
168 2HE LYS 22 2HE LYS 22 5.863 -0.832 -5.463
169 1HZ LYS 22 1HZ LYS 22 3.332 0.301 -6.440
170 2HZ LYS 22 2HZ LYS 22 3.620 -1.188 -5.692
171 3HZ LYS 22 3HZ LYS 22 4.067 -0.953 -7.306
172 H CYS 23 H CYS 23 4.793 -0.110 -0.492
173 HA CYS 23 HA CYS 23 2.900 1.141 1.256
174 1HB CYS 23 1HB CYS 23 5.232 -0.016 1.753
175 2HB CYS 23 2HB CYS 23 5.836 1.622 1.520
176 H VAL 24 H VAL 24 2.815 3.350 1.842
177 HA VAL 24 HA VAL 24 3.548 5.146 -0.358
178 HB VAL 24 HB VAL 24 1.159 5.037 0.406
179 1HG1 VAL 24 1HG1 VAL 24 2.063 4.989 2.898
180 2HG1 VAL 24 2HG1 VAL 24 1.848 6.733 2.743
181 3HG1 VAL 24 3HG1 VAL 24 0.480 5.649 2.492
182 1HG2 VAL 24 1HG2 VAL 24 2.207 7.794 0.902
183 2HG2 VAL 24 2HG2 VAL 24 2.400 7.046 -0.682
184 3HG2 VAL 24 2HG3 VAL 24 0.787 7.283 -0.010
185 H ALA 25 H ALA 25 5.289 4.156 1.938
186 HA ALA 25 HA ALA 25 6.290 6.809 2.694
187 1HB ALA 25 1HB ALA 25 6.819 5.905 4.968
188 2HB ALA 25 2HB ALA 25 5.099 6.116 4.636
189 3HB ALA 25 3HB ALA 25 5.819 4.506 4.575
190 H CYS 26 H CYS 26 6.961 3.320 2.625
191 HA CYS 26 HA CYS 26 9.806 3.948 2.195
192 1HB CYS 26 1HB CYS 26 10.370 1.846 3.136
193 2HB CYS 26 2HB CYS 26 9.140 2.526 4.197
194 H GLU 27 H GLU 27 7.010 2.872 0.670
195 HA GLU 27 HA GLU 27 6.611 2.163 -1.459
196 1HB GLU 27 1HB GLU 27 9.578 2.164 -1.969
197 2HB GLU 27 2HB GLU 27 8.273 2.375 -3.128
198 1HG GLU 27 1HG GLU 27 8.908 4.532 -2.946
199 2HG GLU 27 2HG GLU 27 7.775 4.484 -1.596
200 H THR 28 H THR 28 6.945 0.326 0.681
201 HA THR 28 HA THR 28 8.517 -1.908 -0.158
202 HB THR 28 HB THR 28 6.770 -1.273 2.100
203 HG1 THR 28 1HG THR 28 8.793 -3.239 2.050
204 1HG2 THR 28 1HG2 THR 28 5.383 -3.055 1.396
205 2HG2 THR 28 2HG2 THR 28 6.443 -3.740 2.629
206 3HG2 THR 28 3HG2 THR 28 6.763 -4.043 0.922
207 HA PRO 29 HA PRO 29 5.761 -3.785 -3.032
208 1HB PRO 29 1HB PRO 29 6.608 -6.356 -2.835
209 2HB PRO 29 2HB PRO 29 7.540 -5.098 -3.655
210 1HG PRO 29 1HG PRO 29 7.866 -6.197 -0.890
211 2HG PRO 29 2HG PRO 29 9.109 -5.810 -2.094
212 1HD PRO 29 1HD PRO 29 8.521 -4.164 -0.026
213 2HD PRO 29 2HD PRO 29 9.060 -3.559 -1.606
214 H LYS 30 H LYS 30 3.668 -3.889 -2.460
215 HA LYS 30 HA LYS 30 2.551 -4.807 -0.128
216 1HB LYS 30 1HB LYS 30 1.210 -3.582 -1.685
217 2HB LYS 30 2HB LYS 30 1.430 -4.803 -2.930
218 1HG LYS 30 1HG LYS 30 0.257 -6.370 -1.210
219 2HG LYS 30 2HG LYS 30 -0.319 -4.852 -0.517
220 1HD LYS 30 1HD LYS 30 -0.766 -4.514 -3.211
221 2HD LYS 30 2HD LYS 30 -1.127 -6.223 -2.962
222 1HE LYS 30 1HE LYS 30 -2.776 -5.734 -1.340
223 2HE LYS 30 2HE LYS 30 -2.248 -4.058 -1.201
224 1HZ LYS 30 1HZ LYS 30 -3.600 -3.477 -2.839
225 2HZ LYS 30 2HZ LYS 30 -4.246 -5.041 -2.825
226 3HZ LYS 30 3HZ LYS 30 -2.974 -4.659 -3.874
227 HA PRO 31 HA PRO 31 3.033 -9.184 -0.115
228 1HB PRO 31 1HB PRO 31 1.004 -9.831 1.567
229 2HB PRO 31 2HB PRO 31 2.507 -9.083 2.119
230 1HG PRO 31 1HG PRO 31 -0.148 -7.815 1.570
231 2HG PRO 31 2HG PRO 31 0.967 -7.535 2.921
232 1HD PRO 31 1HD PRO 31 0.805 -5.866 0.794
233 2HD PRO 31 2HD PRO 31 2.320 -6.142 1.678
Start of MODEL 7
1 1H GLY 0 1H GLY 0 -17.901 4.674 2.140
2 1HA GLY 0 1HA GLY 0 -19.831 6.679 1.484
3 2HA GLY 0 2HA GLY 0 -19.946 6.199 3.171
4 H HIS 1 H HIS 1 -17.770 6.178 4.345
5 HA HIS 1 HA HIS 1 -16.158 8.481 3.461
6 1HB HIS 1 1HB HIS 1 -17.092 7.801 6.254
7 2HB HIS 1 2HB HIS 1 -15.853 9.004 5.905
8 HD1 HIS 1 HD1 HIS 1 -16.763 11.290 5.910
9 HD2 HIS 1 HD2 HIS 1 -19.578 8.524 4.609
10 HE1 HIS 1 HE1 HIS 1 -18.843 12.620 5.431
11 H MET 2 H MET 2 -16.257 5.289 4.780
12 HA MET 2 HA MET 2 -13.314 5.217 4.739
13 1HB MET 2 1HB MET 2 -13.521 3.455 6.564
14 2HB MET 2 2HB MET 2 -13.837 5.117 7.041
15 1HG MET 2 1HG MET 2 -16.065 3.284 6.250
16 2HG MET 2 2HG MET 2 -15.403 3.272 7.883
17 1HE MET 2 1HE MET 2 -18.969 5.241 7.560
18 2HE MET 2 2HE MET 2 -18.388 4.614 6.018
19 3HE MET 2 3HE MET 2 -18.290 3.615 7.469
20 H VAL 3 H VAL 3 -12.477 2.933 4.530
21 HA VAL 3 HA VAL 3 -14.199 1.428 2.669
22 HB VAL 3 HB VAL 3 -11.210 1.181 2.691
23 1HG1 VAL 3 1HG1 VAL 3 -12.579 -0.452 1.450
24 2HG1 VAL 3 2HG1 VAL 3 -13.255 0.869 0.495
25 3HG1 VAL 3 3HG1 VAL 3 -11.534 0.496 0.393
26 1HG2 VAL 3 1HG2 VAL 3 -11.811 3.595 2.496
27 2HG2 VAL 3 2HG2 VAL 3 -10.985 2.940 1.081
28 3HG2 VAL 3 3HG2 VAL 3 -12.729 3.196 1.044
29 H ILE 4 H ILE 4 -12.878 1.364 5.711
30 HA ILE 4 HA ILE 4 -12.491 -0.252 7.272
31 HB ILE 4 HB ILE 4 -14.261 -2.081 5.681
32 1HG1 ILE 4 1HG1 ILE 4 -15.077 0.354 7.273
33 2HG1 ILE 4 2HG1 ILE 4 -15.399 0.034 5.573
34 1HG2 ILE 4 1HG2 ILE 4 -14.639 -1.723 8.566
35 2HG2 ILE 4 2HG2 ILE 4 -14.539 -3.199 7.608
36 3HG2 ILE 4 3HG2 ILE 4 -13.064 -2.368 8.103
37 1HD1 ILE 4 1HD1 ILE 4 -16.758 -0.980 7.988
38 2HD1 ILE 4 2HD1 ILE 4 -17.414 -0.535 6.413
39 3HD1 ILE 4 3HD1 ILE 4 -16.609 -2.089 6.625
40 H GLY 5 H GLY 5 -10.578 -0.154 5.192
41 1HA GLY 5 1HA GLY 5 -9.486 -2.831 5.460
42 2HA GLY 5 2HA GLY 5 -9.828 -2.327 3.811
43 H THR 6 H THR 6 -7.315 -2.839 5.539
44 HA THR 6 HA THR 6 -5.598 -1.098 4.177
45 HB THR 6 HB THR 6 -4.826 0.043 6.470
46 HG1 THR 6 1HG THR 6 -6.400 -0.543 7.848
47 1HG2 THR 6 1HG2 THR 6 -6.197 0.854 4.133
48 2HG2 THR 6 2HG2 THR 6 -5.234 1.846 5.229
49 3HG2 THR 6 3HG2 THR 6 -6.967 1.665 5.496
50 H TRP 7 H TRP 7 -3.400 -1.513 4.603
51 HA TRP 7 HA TRP 7 -2.903 -3.714 6.498
52 1HB TRP 7 1HB TRP 7 -1.130 -4.470 4.842
53 2HB TRP 7 2HB TRP 7 -2.802 -4.709 4.344
54 HD1 TRP 7 1HD TRP 7 -3.771 -2.780 2.568
55 HE1 TRP 7 1HE TRP 7 -2.527 -1.611 0.642
56 HE3 TRP 7 3HE TRP 7 1.041 -3.655 4.058
57 HZ2 TRP 7 2HZ TRP 7 0.140 -1.125 -0.143
58 HZ3 TRP 7 3HZ TRP 7 2.880 -2.806 2.664
59 HH2 TRP 7 2HH TRP 7 2.438 -1.567 0.606
60 H ASP 8 H ASP 8 -1.159 -3.533 7.802
61 HA ASP 8 HA ASP 8 0.270 -0.997 7.749
62 1HB ASP 8 1HB ASP 8 0.771 -3.082 9.830
63 2HB ASP 8 2HB ASP 8 0.735 -1.327 9.988
64 H CYS 9 H CYS 9 2.577 -0.877 7.920
65 HA CYS 9 HA CYS 9 3.892 -2.821 6.236
66 1HB CYS 9 1HB CYS 9 4.218 -0.268 6.181
67 2HB CYS 9 2HB CYS 9 5.228 -0.496 7.606
68 H ASP 10 H ASP 10 6.099 -3.617 6.853
69 HA ASP 10 HA ASP 10 6.196 -4.311 9.715
70 1HB ASP 10 1HB ASP 10 5.484 -6.207 8.219
71 2HB ASP 10 2HB ASP 10 7.066 -6.113 7.450
72 H THR 11 H THR 11 7.678 -2.624 7.346
73 HA THR 11 HA THR 11 10.372 -3.107 8.441
74 HB THR 11 HB THR 11 9.488 -2.237 5.701
75 HG1 THR 11 1HG THR 11 9.867 -4.481 6.154
76 1HG2 THR 11 1HG2 THR 11 12.057 -1.644 7.106
77 2HG2 THR 11 2HG2 THR 11 11.140 -0.651 5.974
78 3HG2 THR 11 3HG3 THR 11 12.085 -2.017 5.383
79 H CYS 12 H CYS 12 8.388 -0.512 7.003
80 HA CYS 12 HA CYS 12 9.882 1.447 8.589
81 1HB CYS 12 1HB CYS 12 9.310 3.047 7.030
82 2HB CYS 12 2HB CYS 12 9.342 1.609 6.014
83 H LEU 13 H LEU 13 7.027 -0.310 8.686
84 HA LEU 13 HA LEU 13 5.198 -0.255 10.035
85 1HB LEU 13 1HB LEU 13 6.341 2.013 11.597
86 2HB LEU 13 2HB LEU 13 5.417 0.620 12.156
87 HG LEU 13 HG LEU 13 8.342 0.799 11.504
88 1HD1 LEU 13 1HD1 LEU 13 6.676 0.493 13.886
89 2HD1 LEU 13 2HD1 LEU 13 8.331 1.080 13.721
90 3HD1 LEU 13 3HD1 LEU 13 8.014 -0.654 13.789
91 1HD2 LEU 13 1HD2 LEU 13 8.242 -1.740 12.013
92 2HD2 LEU 13 2HD2 LEU 13 7.869 -1.173 10.385
93 3HD2 LEU 13 3HD2 LEU 13 6.564 -1.607 11.489
94 H VAL 14 H VAL 14 3.795 0.513 8.455
95 HA VAL 14 HA VAL 14 2.588 3.040 9.017
96 HB VAL 14 HB VAL 14 4.677 3.195 7.212
97 1HG1 VAL 14 1HG1 VAL 14 3.794 3.480 5.034
98 2HG1 VAL 14 2HG1 VAL 14 3.175 1.934 5.619
99 3HG1 VAL 14 3HG1 VAL 14 2.133 3.357 5.614
100 1HG2 VAL 14 1HG2 VAL 14 2.328 5.062 7.155
101 2HG2 VAL 14 2HG2 VAL 14 3.405 4.968 8.548
102 3HG2 VAL 14 3HG2 VAL 14 4.042 5.438 6.972
103 H GLN 15 H GLN 15 0.514 3.170 8.236
104 HA GLN 15 HA GLN 15 -0.556 0.715 7.112
105 1HB GLN 15 1HB GLN 15 -1.953 3.216 8.078
106 2HB GLN 15 2HB GLN 15 -2.757 1.735 7.573
107 1HG GLN 15 1HG GLN 15 -2.757 1.437 9.825
108 2HG GLN 15 2HG GLN 15 -1.226 0.664 9.418
109 1HE2 GLN 15 2HE2 GLN 15 -2.764 3.137 11.164
110 2HE2 GLN 15 1HE2 GLN 15 -1.349 3.883 11.818
111 H ASN 16 H ASN 16 -1.588 0.523 5.157
112 HA ASN 16 HA ASN 16 -1.727 2.879 3.425
113 1HB ASN 16 1HB ASN 16 -0.688 0.351 2.224
114 2HB ASN 16 2HB ASN 16 -0.413 2.020 1.734
115 1HD2 ASN 16 2HD2 ASN 16 0.124 0.060 4.648
116 2HD2 ASN 16 1HD2 ASN 16 1.763 0.553 4.881
117 H LYS 17 H LYS 17 -3.212 2.697 1.694
118 HA LYS 17 HA LYS 17 -5.552 1.254 2.287
119 1HB LYS 17 1HB LYS 17 -6.484 2.239 0.385
120 2HB LYS 17 2HB LYS 17 -5.255 3.397 0.879
121 1HG LYS 17 1HG LYS 17 -3.792 2.728 -0.849
122 2HG LYS 17 2HG LYS 17 -4.757 1.294 -1.208
123 1HD LYS 17 1HD LYS 17 -5.194 2.932 -2.900
124 2HD LYS 17 2HD LYS 17 -6.626 2.807 -1.876
125 1HE LYS 17 1HE LYS 17 -6.345 5.103 -2.138
126 2HE LYS 17 2HE LYS 17 -5.604 4.776 -0.573
127 1HZ LYS 17 1HZ LYS 17 -4.329 5.475 -3.122
128 2HZ LYS 17 2HZ LYS 17 -3.470 4.523 -2.018
129 3HZ LYS 17 3HZ LYS 17 -4.014 6.060 -1.565
130 HA PRO 18 HA PRO 18 -4.775 -2.713 0.548
131 1HB PRO 18 1HB PRO 18 -7.331 -3.488 0.062
132 2HB PRO 18 2HB PRO 18 -6.643 -3.414 1.688
133 1HG PRO 18 1HG PRO 18 -8.403 -1.441 0.285
134 2HG PRO 18 2HG PRO 18 -8.478 -2.013 1.962
135 1HD PRO 18 1HD PRO 18 -7.378 0.366 1.283
136 2HD PRO 18 2HD PRO 18 -6.794 -0.600 2.654
137 H GLU 19 H GLU 19 -6.147 -0.139 -1.199
138 HA GLU 19 HA GLU 19 -6.461 -1.624 -3.672
139 1HB GLU 19 1HB GLU 19 -6.544 1.364 -3.524
140 2HB GLU 19 2HB GLU 19 -7.460 0.275 -4.555
141 1HG GLU 19 1HG GLU 19 -7.876 0.723 -1.610
142 2HG GLU 19 2HG GLU 19 -8.907 1.297 -2.918
143 H ALA 20 H ALA 20 -3.923 -0.278 -2.007
144 HA ALA 20 HA ALA 20 -2.446 0.666 -4.321
145 1HB ALA 20 1HB ALA 20 -0.657 1.147 -2.697
146 2HB ALA 20 2HB ALA 20 -2.195 1.885 -2.247
147 3HB ALA 20 3HB ALA 20 -1.644 0.426 -1.425
148 H ILE 21 H ILE 21 -0.102 -0.125 -4.489
149 HA ILE 21 HA ILE 21 -0.119 -3.068 -4.369
150 HB ILE 21 HB ILE 21 1.348 -1.244 -6.276
151 1HG1 ILE 21 1HG1 ILE 21 -0.074 -2.582 -7.945
152 2HG1 ILE 21 2HG1 ILE 21 -1.024 -3.083 -6.550
153 1HG2 ILE 21 1HG2 ILE 21 2.840 -2.965 -6.147
154 2HG2 ILE 21 2HG2 ILE 21 1.613 -4.139 -5.675
155 3HG2 ILE 21 3HG2 ILE 21 1.740 -3.625 -7.357
156 1HD1 ILE 21 1HD1 ILE 21 -2.206 -1.228 -6.713
157 2HD1 ILE 21 2HD1 ILE 21 -0.750 -0.275 -6.426
158 3HD1 ILE 21 3HD1 ILE 21 -1.215 -0.701 -8.073
159 H LYS 22 H LYS 22 1.503 -0.206 -3.374
160 HA LYS 22 HA LYS 22 3.425 -1.818 -1.884
161 1HB LYS 22 1HB LYS 22 5.246 -0.162 -2.520
162 2HB LYS 22 2HB LYS 22 4.761 -1.304 -3.767
163 1HG LYS 22 1HG LYS 22 4.849 0.641 -4.965
164 2HG LYS 22 2HG LYS 22 3.149 0.623 -4.489
165 1HD LYS 22 1HD LYS 22 3.540 2.190 -2.740
166 2HD LYS 22 2HD LYS 22 5.290 2.045 -2.917
167 1HE LYS 22 1HE LYS 22 4.825 4.042 -4.001
168 2HE LYS 22 2HE LYS 22 4.880 2.882 -5.327
169 1HZ LYS 22 1HZ LYS 22 2.979 4.338 -5.539
170 2HZ LYS 22 2HZ LYS 22 2.423 3.897 -4.005
171 3HZ LYS 22 3HZ LYS 22 2.459 2.754 -5.252
172 H CYS 23 H CYS 23 4.756 -0.274 -0.404
173 HA CYS 23 HA CYS 23 2.918 1.060 1.278
174 1HB CYS 23 1HB CYS 23 5.297 -0.009 1.744
175 2HB CYS 23 2HB CYS 23 5.842 1.640 1.457
176 H VAL 24 H VAL 24 2.950 3.310 1.916
177 HA VAL 24 HA VAL 24 3.511 5.073 -0.371
178 HB VAL 24 HB VAL 24 1.138 4.844 0.605
179 1HG1 VAL 24 1HG1 VAL 24 0.625 5.685 2.638
180 2HG1 VAL 24 2HG1 VAL 24 2.318 5.320 2.974
181 3HG1 VAL 24 3HG1 VAL 24 1.838 6.960 2.537
182 1HG2 VAL 24 1HG2 VAL 24 1.583 6.526 -1.000
183 2HG2 VAL 24 2HG2 VAL 24 0.760 7.329 0.337
184 3HG2 VAL 24 2HG3 VAL 24 2.507 7.486 0.156
185 H ALA 25 H ALA 25 5.229 4.148 2.043
186 HA ALA 25 HA ALA 25 6.221 6.843 2.681
187 1HB ALA 25 1HB ALA 25 6.269 4.623 4.701
188 2HB ALA 25 2HB ALA 25 6.517 6.351 4.952
189 3HB ALA 25 3HB ALA 25 4.908 5.738 4.570
190 H CYS 26 H CYS 26 6.970 3.368 2.672
191 HA CYS 26 HA CYS 26 9.797 4.048 2.209
192 1HB CYS 26 1HB CYS 26 10.409 1.971 3.164
193 2HB CYS 26 2HB CYS 26 9.155 2.617 4.218
194 H GLU 27 H GLU 27 7.015 2.929 0.696
195 HA GLU 27 HA GLU 27 6.602 2.150 -1.402
196 1HB GLU 27 1HB GLU 27 9.528 2.292 -2.053
197 2HB GLU 27 2HB GLU 27 8.148 2.550 -3.110
198 1HG GLU 27 1HG GLU 27 7.797 4.699 -2.355
199 2HG GLU 27 2HG GLU 27 8.630 4.409 -0.829
200 H THR 28 H THR 28 6.797 0.267 0.529
201 HA THR 28 HA THR 28 8.574 -1.851 -0.362
202 HB THR 28 HB THR 28 7.030 -1.296 2.055
203 HG1 THR 28 1HG THR 28 9.458 -1.801 1.479
204 1HG2 THR 28 1HG2 THR 28 6.974 -4.051 0.847
205 2HG2 THR 28 2HG2 THR 28 5.633 -3.111 1.498
206 3HG2 THR 28 3HG2 THR 28 6.846 -3.786 2.585
207 HA PRO 29 HA PRO 29 5.662 -3.865 -2.974
208 1HB PRO 29 1HB PRO 29 6.617 -6.402 -2.834
209 2HB PRO 29 2HB PRO 29 7.431 -5.117 -3.736
210 1HG PRO 29 1HG PRO 29 8.024 -6.181 -1.001
211 2HG PRO 29 2HG PRO 29 9.148 -5.759 -2.306
212 1HD PRO 29 1HD PRO 29 8.673 -4.118 -0.206
213 2HD PRO 29 2HD PRO 29 9.056 -3.507 -1.829
214 H LYS 30 H LYS 30 3.620 -4.123 -2.310
215 HA LYS 30 HA LYS 30 2.804 -5.140 0.162
216 1HB LYS 30 1HB LYS 30 1.305 -3.757 -1.088
217 2HB LYS 30 2HB LYS 30 1.336 -4.856 -2.459
218 1HG LYS 30 1HG LYS 30 0.389 -6.545 -0.653
219 2HG LYS 30 2HG LYS 30 -0.159 -5.042 0.092
220 1HD LYS 30 1HD LYS 30 -0.646 -5.224 -2.796
221 2HD LYS 30 2HD LYS 30 -1.519 -6.413 -1.827
222 1HE LYS 30 1HE LYS 30 -2.339 -4.558 -0.394
223 2HE LYS 30 2HE LYS 30 -1.560 -3.416 -1.487
224 1HZ LYS 30 1HZ LYS 30 -3.546 -3.432 -2.493
225 2HZ LYS 30 2HZ LYS 30 -4.013 -4.912 -1.822
226 3HZ LYS 30 3HZ LYS 30 -3.017 -4.880 -3.189
227 HA PRO 31 HA PRO 31 3.179 -9.504 -0.293
228 1HB PRO 31 1HB PRO 31 1.364 -10.283 1.570
229 2HB PRO 31 2HB PRO 31 2.943 -9.609 1.990
230 1HG PRO 31 1HG PRO 31 0.270 -8.264 1.908
231 2HG PRO 31 2HG PRO 31 1.555 -8.127 3.123
232 1HD PRO 31 1HD PRO 31 1.165 -6.261 1.199
233 2HD PRO 31 2HD PRO 31 2.772 -6.639 1.852
Start of MODEL 8
1 1H GLY 0 1H GLY 0 -20.014 7.110 13.173
2 1HA GLY 0 1HA GLY 0 -20.919 6.437 10.667
3 2HA GLY 0 2HA GLY 0 -19.281 6.981 10.996
4 H HIS 1 H HIS 1 -18.757 5.583 9.154
5 HA HIS 1 HA HIS 1 -18.405 2.792 10.029
6 1HB HIS 1 1HB HIS 1 -18.917 3.722 7.197
7 2HB HIS 1 2HB HIS 1 -18.684 2.056 7.718
8 HD1 HIS 1 HD1 HIS 1 -21.295 3.848 6.517
9 HD2 HIS 1 HD2 HIS 1 -20.811 1.833 10.118
10 HE1 HIS 1 HE1 HIS 1 -23.624 3.373 7.340
11 H MET 2 H MET 2 -16.345 2.238 10.220
12 HA MET 2 HA MET 2 -14.346 3.706 8.628
13 1HB MET 2 1HB MET 2 -13.843 4.287 10.820
14 2HB MET 2 2HB MET 2 -14.311 2.714 11.453
15 1HG MET 2 1HG MET 2 -12.309 1.722 10.817
16 2HG MET 2 2HG MET 2 -11.931 3.003 9.667
17 1HE MET 2 1HE MET 2 -9.793 5.359 11.496
18 2HE MET 2 2HE MET 2 -9.589 4.017 10.371
19 3HE MET 2 3HE MET 2 -10.908 5.165 10.144
20 H VAL 3 H VAL 3 -13.527 2.506 7.052
21 HA VAL 3 HA VAL 3 -13.767 -0.332 6.974
22 HB VAL 3 HB VAL 3 -13.657 1.306 4.989
23 1HG1 VAL 3 1HG1 VAL 3 -11.264 2.000 5.995
24 2HG1 VAL 3 2HG1 VAL 3 -10.760 0.764 4.840
25 3HG1 VAL 3 3HG1 VAL 3 -11.685 2.162 4.291
26 1HG2 VAL 3 1HG2 VAL 3 -13.531 -0.547 3.758
27 2HG2 VAL 3 2HG2 VAL 3 -11.851 -0.824 4.216
28 3HG2 VAL 3 3HG2 VAL 3 -13.155 -1.411 5.249
29 H ILE 4 H ILE 4 -12.247 -1.911 7.273
30 HA ILE 4 HA ILE 4 -9.663 -1.045 8.398
31 HB ILE 4 HB ILE 4 -9.692 -3.126 9.759
32 1HG1 ILE 4 1HG1 ILE 4 -12.530 -3.300 8.725
33 2HG1 ILE 4 2HG1 ILE 4 -11.238 -4.466 8.465
34 1HG2 ILE 4 1HG2 ILE 4 -10.873 -0.708 10.265
35 2HG2 ILE 4 2HG2 ILE 4 -12.153 -1.850 10.673
36 3HG2 ILE 4 3HG2 ILE 4 -10.579 -1.973 11.458
37 1HD1 ILE 4 1HD1 ILE 4 -13.083 -4.204 10.673
38 2HD1 ILE 4 2HD1 ILE 4 -12.059 -5.562 10.206
39 3HD1 ILE 4 3HD1 ILE 4 -11.405 -4.270 11.213
40 H GLY 5 H GLY 5 -9.585 -1.308 5.785
41 1HA GLY 5 1HA GLY 5 -8.736 -4.062 5.189
42 2HA GLY 5 2HA GLY 5 -9.159 -2.846 3.993
43 H THR 6 H THR 6 -7.564 -0.797 5.466
44 HA THR 6 HA THR 6 -5.242 -0.840 3.999
45 HB THR 6 HB THR 6 -4.286 0.718 5.707
46 HG1 THR 6 1HG THR 6 -5.091 0.594 7.652
47 1HG2 THR 6 1HG2 THR 6 -5.387 2.186 4.438
48 2HG2 THR 6 2HG2 THR 6 -6.726 2.079 5.581
49 3HG2 THR 6 3HG2 THR 6 -6.698 1.040 4.157
50 H TRP 7 H TRP 7 -3.220 -1.668 4.212
51 HA TRP 7 HA TRP 7 -2.858 -3.683 6.311
52 1HB TRP 7 1HB TRP 7 -0.854 -4.311 4.789
53 2HB TRP 7 2HB TRP 7 -2.483 -4.695 4.241
54 HD1 TRP 7 1HD TRP 7 -3.556 -2.814 2.444
55 HE1 TRP 7 1HE TRP 7 -2.350 -1.594 0.525
56 HE3 TRP 7 3HE TRP 7 1.274 -3.416 4.009
57 HZ2 TRP 7 2HZ TRP 7 0.298 -0.970 -0.226
58 HZ3 TRP 7 3HZ TRP 7 3.085 -2.478 2.632
59 HH2 TRP 7 2HH TRP 7 2.605 -1.281 0.559
60 H ASP 8 H ASP 8 -1.176 -3.642 7.737
61 HA ASP 8 HA ASP 8 0.237 -1.103 7.974
62 1HB ASP 8 1HB ASP 8 0.254 -3.430 9.902
63 2HB ASP 8 2HB ASP 8 0.759 -1.774 10.225
64 H CYS 9 H CYS 9 2.385 -0.843 7.712
65 HA CYS 9 HA CYS 9 3.855 -2.864 6.341
66 1HB CYS 9 1HB CYS 9 4.066 -0.314 6.100
67 2HB CYS 9 2HB CYS 9 5.050 -0.381 7.558
68 H ASP 10 H ASP 10 5.915 -3.747 7.014
69 HA ASP 10 HA ASP 10 6.131 -4.052 9.937
70 1HB ASP 10 1HB ASP 10 5.268 -6.108 8.930
71 2HB ASP 10 2HB ASP 10 6.632 -6.149 7.815
72 H THR 11 H THR 11 7.505 -2.366 7.755
73 HA THR 11 HA THR 11 10.248 -2.996 8.616
74 HB THR 11 HB THR 11 9.262 -2.402 5.846
75 HG1 THR 11 1HG THR 11 9.776 -4.464 5.848
76 1HG2 THR 11 1HG2 THR 11 11.748 -2.075 5.293
77 2HG2 THR 11 2HG2 THR 11 11.946 -1.708 7.007
78 3HG2 THR 11 3HG3 THR 11 10.883 -0.716 6.010
79 H CYS 12 H CYS 12 8.108 -0.505 7.258
80 HA CYS 12 HA CYS 12 9.779 1.544 8.555
81 1HB CYS 12 1HB CYS 12 9.253 3.024 6.874
82 2HB CYS 12 2HB CYS 12 9.186 1.511 5.978
83 H LEU 13 H LEU 13 7.008 -0.177 9.015
84 HA LEU 13 HA LEU 13 5.177 0.052 10.343
85 1HB LEU 13 1HB LEU 13 7.142 1.953 11.511
86 2HB LEU 13 2HB LEU 13 5.479 2.015 12.091
87 HG LEU 13 HG LEU 13 5.802 -0.541 12.476
88 1HD1 LEU 13 1HD1 LEU 13 8.643 0.448 12.338
89 2HD1 LEU 13 2HD1 LEU 13 7.906 -0.837 11.383
90 3HD1 LEU 13 3HD1 LEU 13 8.154 -1.058 13.114
91 1HD2 LEU 13 1HD2 LEU 13 7.207 1.461 14.240
92 2HD2 LEU 13 2HD2 LEU 13 6.559 -0.106 14.726
93 3HD2 LEU 13 3HD2 LEU 13 5.466 1.182 14.216
94 H VAL 14 H VAL 14 3.839 0.692 8.601
95 HA VAL 14 HA VAL 14 2.538 3.194 9.003
96 HB VAL 14 HB VAL 14 4.710 3.271 7.213
97 1HG1 VAL 14 1HG1 VAL 14 3.239 2.176 5.564
98 2HG1 VAL 14 2HG1 VAL 14 2.086 3.501 5.741
99 3HG1 VAL 14 3HG1 VAL 14 3.695 3.810 5.084
100 1HG2 VAL 14 1HG2 VAL 14 3.630 5.574 6.709
101 2HG2 VAL 14 2HG2 VAL 14 2.458 5.104 7.942
102 3HG2 VAL 14 3HG2 VAL 14 4.170 5.218 8.351
103 H GLN 15 H GLN 15 0.479 3.121 8.269
104 HA GLN 15 HA GLN 15 -0.405 0.644 7.055
105 1HB GLN 15 1HB GLN 15 -2.044 3.031 7.917
106 2HB GLN 15 2HB GLN 15 -2.652 1.427 7.530
107 1HG GLN 15 1HG GLN 15 -2.645 1.429 9.835
108 2HG GLN 15 2HG GLN 15 -1.123 0.630 9.444
109 1HE2 GLN 15 2HE2 GLN 15 -2.234 3.992 9.722
110 2HE2 GLN 15 1HE2 GLN 15 -0.952 4.509 10.759
111 H ASN 16 H ASN 16 -1.598 0.486 5.129
112 HA ASN 16 HA ASN 16 -1.705 2.836 3.400
113 1HB ASN 16 1HB ASN 16 -0.634 0.330 2.180
114 2HB ASN 16 2HB ASN 16 -0.374 2.007 1.707
115 1HD2 ASN 16 2HD2 ASN 16 0.173 0.022 4.603
116 2HD2 ASN 16 1HD2 ASN 16 1.806 0.530 4.846
117 H LYS 17 H LYS 17 -3.244 2.709 1.751
118 HA LYS 17 HA LYS 17 -5.545 1.220 2.299
119 1HB LYS 17 1HB LYS 17 -6.480 2.186 0.376
120 2HB LYS 17 2HB LYS 17 -5.298 3.369 0.920
121 1HG LYS 17 1HG LYS 17 -3.788 2.803 -0.792
122 2HG LYS 17 2HG LYS 17 -4.665 1.322 -1.182
123 1HD LYS 17 1HD LYS 17 -5.092 3.042 -2.853
124 2HD LYS 17 2HD LYS 17 -6.567 2.662 -1.960
125 1HE LYS 17 1HE LYS 17 -6.019 5.131 -2.399
126 2HE LYS 17 2HE LYS 17 -6.503 4.666 -0.770
127 1HZ LYS 17 1HZ LYS 17 -4.137 4.577 -0.171
128 2HZ LYS 17 2HZ LYS 17 -4.613 6.121 -0.671
129 3HZ LYS 17 3HZ LYS 17 -3.727 5.129 -1.717
130 HA PRO 18 HA PRO 18 -4.732 -2.732 0.541
131 1HB PRO 18 1HB PRO 18 -7.284 -3.536 0.074
132 2HB PRO 18 2HB PRO 18 -6.581 -3.461 1.694
133 1HG PRO 18 1HG PRO 18 -8.376 -1.502 0.316
134 2HG PRO 18 2HG PRO 18 -8.430 -2.082 1.990
135 1HD PRO 18 1HD PRO 18 -7.364 0.313 1.313
136 2HD PRO 18 2HD PRO 18 -6.757 -0.653 2.674
137 H GLU 19 H GLU 19 -6.141 -0.165 -1.182
138 HA GLU 19 HA GLU 19 -6.468 -1.642 -3.659
139 1HB GLU 19 1HB GLU 19 -6.561 1.339 -3.551
140 2HB GLU 19 2HB GLU 19 -7.531 0.223 -4.503
141 1HG GLU 19 1HG GLU 19 -8.651 -0.466 -2.366
142 2HG GLU 19 2HG GLU 19 -7.814 0.873 -1.583
143 H ALA 20 H ALA 20 -3.925 -0.279 -2.011
144 HA ALA 20 HA ALA 20 -2.478 0.686 -4.336
145 1HB ALA 20 1HB ALA 20 -2.211 1.905 -2.271
146 2HB ALA 20 2HB ALA 20 -1.661 0.448 -1.443
147 3HB ALA 20 3HB ALA 20 -0.674 1.164 -2.717
148 H ILE 21 H ILE 21 -0.136 -0.087 -4.544
149 HA ILE 21 HA ILE 21 -0.129 -3.030 -4.440
150 HB ILE 21 HB ILE 21 1.409 -1.220 -6.307
151 1HG1 ILE 21 1HG1 ILE 21 -0.784 -1.100 -7.085
152 2HG1 ILE 21 2HG1 ILE 21 -0.136 -2.458 -7.997
153 1HG2 ILE 21 1HG2 ILE 21 1.428 -3.729 -7.391
154 2HG2 ILE 21 2HG2 ILE 21 2.748 -3.005 -6.472
155 3HG2 ILE 21 3HG2 ILE 21 1.589 -4.065 -5.668
156 1HD1 ILE 21 1HD1 ILE 21 -1.937 -2.555 -5.596
157 2HD1 ILE 21 2HD1 ILE 21 -2.299 -3.062 -7.247
158 3HD1 ILE 21 3HD1 ILE 21 -1.139 -3.971 -6.279
159 H LYS 22 H LYS 22 1.501 -0.160 -3.450
160 HA LYS 22 HA LYS 22 3.444 -1.785 -1.990
161 1HB LYS 22 1HB LYS 22 5.254 -0.157 -2.588
162 2HB LYS 22 2HB LYS 22 4.702 -1.156 -3.926
163 1HG LYS 22 1HG LYS 22 3.214 0.771 -4.591
164 2HG LYS 22 2HG LYS 22 4.093 1.740 -3.406
165 1HD LYS 22 1HD LYS 22 6.188 1.283 -4.571
166 2HD LYS 22 2HD LYS 22 5.329 0.276 -5.740
167 1HE LYS 22 1HE LYS 22 4.928 3.232 -5.289
168 2HE LYS 22 2HE LYS 22 5.757 2.489 -6.656
169 1HZ LYS 22 1HZ LYS 22 3.791 2.503 -7.659
170 2HZ LYS 22 2HZ LYS 22 2.963 2.894 -6.236
171 3HZ LYS 22 3HZ LYS 22 3.308 1.278 -6.597
172 H CYS 23 H CYS 23 4.813 -0.140 -0.560
173 HA CYS 23 HA CYS 23 2.908 1.114 1.163
174 1HB CYS 23 1HB CYS 23 5.224 -0.048 1.689
175 2HB CYS 23 2HB CYS 23 5.844 1.583 1.457
176 H VAL 24 H VAL 24 2.871 3.327 1.799
177 HA VAL 24 HA VAL 24 3.627 5.139 -0.386
178 HB VAL 24 HB VAL 24 1.200 4.940 0.466
179 1HG1 VAL 24 1HG1 VAL 24 2.262 5.330 2.899
180 2HG1 VAL 24 2HG1 VAL 24 1.865 6.997 2.479
181 3HG1 VAL 24 3HG1 VAL 24 0.603 5.764 2.487
182 1HG2 VAL 24 1HG2 VAL 24 0.788 7.291 0.034
183 2HG2 VAL 24 2HG2 VAL 24 2.488 7.666 0.325
184 3HG2 VAL 24 2HG3 VAL 24 2.027 6.683 -1.065
185 H ALA 25 H ALA 25 5.246 4.118 2.025
186 HA ALA 25 HA ALA 25 6.223 6.774 2.825
187 1HB ALA 25 1HB ALA 25 6.250 4.486 4.758
188 2HB ALA 25 2HB ALA 25 6.389 6.217 5.076
189 3HB ALA 25 3HB ALA 25 4.836 5.528 4.603
190 H CYS 26 H CYS 26 6.943 3.306 2.611
191 HA CYS 26 HA CYS 26 9.787 3.992 2.264
192 1HB CYS 26 1HB CYS 26 10.377 1.870 3.165
193 2HB CYS 26 2HB CYS 26 9.155 2.539 4.241
194 H GLU 27 H GLU 27 7.027 2.874 0.698
195 HA GLU 27 HA GLU 27 6.654 2.152 -1.430
196 1HB GLU 27 1HB GLU 27 9.559 2.183 -2.107
197 2HB GLU 27 2HB GLU 27 8.178 2.664 -3.081
198 1HG GLU 27 1HG GLU 27 7.978 4.571 -1.296
199 2HG GLU 27 2HG GLU 27 9.681 4.205 -1.032
200 H THR 28 H THR 28 6.811 0.245 0.501
201 HA THR 28 HA THR 28 8.562 -1.888 -0.410
202 HB THR 28 HB THR 28 7.008 -1.343 2.009
203 HG1 THR 28 1HG THR 28 8.742 -2.804 2.790
204 1HG2 THR 28 1HG2 THR 28 7.122 -4.170 0.948
205 2HG2 THR 28 2HG2 THR 28 5.664 -3.208 1.194
206 3HG2 THR 28 3HG2 THR 28 6.635 -3.706 2.579
207 HA PRO 29 HA PRO 29 5.612 -3.809 -3.054
208 1HB PRO 29 1HB PRO 29 6.569 -6.349 -2.996
209 2HB PRO 29 2HB PRO 29 7.371 -5.041 -3.872
210 1HG PRO 29 1HG PRO 29 7.999 -6.179 -1.175
211 2HG PRO 29 2HG PRO 29 9.106 -5.723 -2.483
212 1HD PRO 29 1HD PRO 29 8.660 -4.139 -0.334
213 2HD PRO 29 2HD PRO 29 9.023 -3.483 -1.943
214 H LYS 30 H LYS 30 3.589 -4.008 -2.293
215 HA LYS 30 HA LYS 30 2.767 -5.058 0.126
216 1HB LYS 30 1HB LYS 30 1.242 -3.754 -1.177
217 2HB LYS 30 2HB LYS 30 1.324 -4.887 -2.519
218 1HG LYS 30 1HG LYS 30 0.396 -6.568 -0.716
219 2HG LYS 30 2HG LYS 30 -0.174 -5.076 0.038
220 1HD LYS 30 1HD LYS 30 -0.674 -5.256 -2.848
221 2HD LYS 30 2HD LYS 30 -1.520 -6.465 -1.880
222 1HE LYS 30 1HE LYS 30 -2.422 -4.676 -0.461
223 2HE LYS 30 2HE LYS 30 -1.593 -3.478 -1.455
224 1HZ LYS 30 1HZ LYS 30 -3.534 -3.435 -2.546
225 2HZ LYS 30 2HZ LYS 30 -4.025 -4.954 -1.985
226 3HZ LYS 30 3HZ LYS 30 -2.967 -4.839 -3.300
227 HA PRO 31 HA PRO 31 3.278 -9.419 -0.207
228 1HB PRO 31 1HB PRO 31 1.464 -10.203 1.654
229 2HB PRO 31 2HB PRO 31 3.017 -9.470 2.075
230 1HG PRO 31 1HG PRO 31 0.306 -8.209 1.924
231 2HG PRO 31 2HG PRO 31 1.570 -8.002 3.151
232 1HD PRO 31 1HD PRO 31 1.149 -6.200 1.173
233 2HD PRO 31 2HD PRO 31 2.758 -6.511 1.855
Start of MODEL 9
1 1H GLY 0 1H GLY 0 -15.954 7.196 11.573
2 1HA GLY 0 1HA GLY 0 -17.364 9.374 10.837
3 2HA GLY 0 2HA GLY 0 -15.709 9.957 10.740
4 H HIS 1 H HIS 1 -15.691 10.237 8.529
5 HA HIS 1 HA HIS 1 -16.336 7.976 6.812
6 1HB HIS 1 1HB HIS 1 -17.151 9.936 5.860
7 2HB HIS 1 2HB HIS 1 -15.748 10.878 6.352
8 HD1 HIS 1 HD1 HIS 1 -13.564 10.571 4.895
9 HD2 HIS 1 HD2 HIS 1 -16.990 8.794 3.358
10 HE1 HIS 1 HE1 HIS 1 -13.035 10.058 2.491
11 H MET 2 H MET 2 -14.866 6.566 6.141
12 HA MET 2 HA MET 2 -12.224 7.316 5.386
13 1HB MET 2 1HB MET 2 -12.045 7.265 7.890
14 2HB MET 2 2HB MET 2 -12.444 5.553 7.831
15 1HG MET 2 1HG MET 2 -10.148 5.521 7.954
16 2HG MET 2 2HG MET 2 -10.432 5.382 6.221
17 1HE MET 2 1HE MET 2 -8.689 7.854 4.591
18 2HE MET 2 2HE MET 2 -7.620 6.804 5.520
19 3HE MET 2 3HE MET 2 -9.127 6.167 4.861
20 H VAL 3 H VAL 3 -11.270 5.782 4.104
21 HA VAL 3 HA VAL 3 -12.835 3.876 2.846
22 HB VAL 3 HB VAL 3 -10.564 4.856 2.121
23 1HG1 VAL 3 1HG1 VAL 3 -8.596 3.704 2.678
24 2HG1 VAL 3 2HG1 VAL 3 -9.441 3.917 4.213
25 3HG1 VAL 3 3HG1 VAL 3 -9.484 2.357 3.390
26 1HG2 VAL 3 1HG2 VAL 3 -11.529 3.476 0.556
27 2HG2 VAL 3 2HG2 VAL 3 -10.049 2.586 0.916
28 3HG2 VAL 3 3HG2 VAL 3 -11.575 2.091 1.647
29 H ILE 4 H ILE 4 -12.899 1.603 2.919
30 HA ILE 4 HA ILE 4 -12.442 0.518 5.596
31 HB ILE 4 HB ILE 4 -13.943 -0.718 3.284
32 1HG1 ILE 4 1HG1 ILE 4 -15.885 -0.113 4.993
33 2HG1 ILE 4 2HG1 ILE 4 -14.753 1.147 5.468
34 1HG2 ILE 4 1HG2 ILE 4 -14.898 -1.783 5.635
35 2HG2 ILE 4 2HG2 ILE 4 -13.772 -2.564 4.525
36 3HG2 ILE 4 3HG2 ILE 4 -13.161 -1.671 5.918
37 1HD1 ILE 4 1HD1 ILE 4 -15.737 0.702 2.662
38 2HD1 ILE 4 2HD1 ILE 4 -16.392 1.889 3.790
39 3HD1 ILE 4 3HD1 ILE 4 -14.725 2.028 3.233
40 H GLY 5 H GLY 5 -10.918 -0.951 6.044
41 1HA GLY 5 1HA GLY 5 -9.524 -2.804 5.607
42 2HA GLY 5 2HA GLY 5 -9.755 -2.542 3.884
43 H THR 6 H THR 6 -7.306 -2.894 5.565
44 HA THR 6 HA THR 6 -5.608 -1.147 4.185
45 HB THR 6 HB THR 6 -4.826 0.008 6.464
46 HG1 THR 6 1HG THR 6 -6.334 -0.011 7.939
47 1HG2 THR 6 1HG2 THR 6 -6.221 0.801 4.141
48 2HG2 THR 6 2HG2 THR 6 -5.274 1.810 5.235
49 3HG2 THR 6 3HG2 THR 6 -7.004 1.599 5.506
50 H TRP 7 H TRP 7 -3.392 -1.510 4.641
51 HA TRP 7 HA TRP 7 -2.875 -3.718 6.522
52 1HB TRP 7 1HB TRP 7 -1.099 -4.460 4.862
53 2HB TRP 7 2HB TRP 7 -2.771 -4.715 4.369
54 HD1 TRP 7 1HD TRP 7 -3.763 -2.781 2.605
55 HE1 TRP 7 1HE TRP 7 -2.537 -1.611 0.667
56 HE3 TRP 7 3HE TRP 7 1.061 -3.652 4.054
57 HZ2 TRP 7 2HZ TRP 7 0.123 -1.122 -0.140
58 HZ3 TRP 7 3HZ TRP 7 2.888 -2.800 2.643
59 HH2 TRP 7 2HH TRP 7 2.426 -1.562 0.590
60 H ASP 8 H ASP 8 -1.155 -3.495 7.843
61 HA ASP 8 HA ASP 8 0.270 -0.956 7.759
62 1HB ASP 8 1HB ASP 8 0.602 -3.088 9.859
63 2HB ASP 8 2HB ASP 8 0.869 -1.353 10.006
64 H CYS 9 H CYS 9 2.573 -0.826 7.939
65 HA CYS 9 HA CYS 9 3.905 -2.807 6.305
66 1HB CYS 9 1HB CYS 9 4.208 -0.251 6.177
67 2HB CYS 9 2HB CYS 9 5.224 -0.432 7.603
68 H ASP 10 H ASP 10 6.186 -3.460 6.975
69 HA ASP 10 HA ASP 10 6.289 -4.063 9.854
70 1HB ASP 10 1HB ASP 10 5.526 -6.019 8.418
71 2HB ASP 10 2HB ASP 10 7.140 -6.015 7.714
72 H THR 11 H THR 11 7.751 -2.582 7.316
73 HA THR 11 HA THR 11 10.458 -3.028 8.390
74 HB THR 11 HB THR 11 9.509 -3.005 5.704
75 HG1 THR 11 1HG THR 11 11.133 -4.362 6.013
76 1HG2 THR 11 1HG2 THR 11 11.524 -0.831 6.285
77 2HG2 THR 11 2HG2 THR 11 9.860 -0.572 5.760
78 3HG2 THR 11 3HG3 THR 11 11.009 -1.372 4.688
79 H CYS 12 H CYS 12 8.151 -0.582 7.320
80 HA CYS 12 HA CYS 12 9.789 1.456 8.680
81 1HB CYS 12 1HB CYS 12 9.336 3.008 7.043
82 2HB CYS 12 2HB CYS 12 9.346 1.538 6.075
83 H LEU 13 H LEU 13 7.054 -0.334 8.938
84 HA LEU 13 HA LEU 13 5.121 -0.183 10.129
85 1HB LEU 13 1HB LEU 13 6.260 2.115 11.654
86 2HB LEU 13 2HB LEU 13 5.280 0.767 12.228
87 HG LEU 13 HG LEU 13 8.070 0.275 11.271
88 1HD1 LEU 13 1HD1 LEU 13 7.245 1.676 13.755
89 2HD1 LEU 13 2HD1 LEU 13 8.701 1.862 12.778
90 3HD1 LEU 13 3HD1 LEU 13 8.538 0.481 13.863
91 1HD2 LEU 13 1HD2 LEU 13 6.107 -1.385 12.105
92 2HD2 LEU 13 2HD2 LEU 13 6.934 -1.066 13.630
93 3HD2 LEU 13 3HD2 LEU 13 7.829 -1.731 12.263
94 H VAL 14 H VAL 14 3.732 0.546 8.538
95 HA VAL 14 HA VAL 14 2.571 3.114 8.971
96 HB VAL 14 HB VAL 14 4.669 3.049 7.087
97 1HG1 VAL 14 1HG1 VAL 14 2.003 3.451 5.737
98 2HG1 VAL 14 2HG1 VAL 14 3.597 3.637 5.004
99 3HG1 VAL 14 3HG1 VAL 14 3.043 2.044 5.521
100 1HG2 VAL 14 1HG2 VAL 14 2.553 5.173 7.317
101 2HG2 VAL 14 2HG2 VAL 14 3.788 4.921 8.550
102 3HG2 VAL 14 3HG2 VAL 14 4.257 5.369 6.911
103 H GLN 15 H GLN 15 0.498 3.204 8.220
104 HA GLN 15 HA GLN 15 -0.575 0.742 7.119
105 1HB GLN 15 1HB GLN 15 -1.797 3.220 8.301
106 2HB GLN 15 2HB GLN 15 -2.783 2.051 7.434
107 1HG GLN 15 1HG GLN 15 -3.029 1.322 9.584
108 2HG GLN 15 2HG GLN 15 -1.665 0.339 9.054
109 1HE2 GLN 15 2HE2 GLN 15 -2.736 1.833 11.627
110 2HE2 GLN 15 1HE2 GLN 15 -1.269 2.414 12.330
111 H ASN 16 H ASN 16 -1.603 0.527 5.164
112 HA ASN 16 HA ASN 16 -1.739 2.861 3.403
113 1HB ASN 16 1HB ASN 16 -0.692 0.325 2.229
114 2HB ASN 16 2HB ASN 16 -0.412 1.991 1.731
115 1HD2 ASN 16 2HD2 ASN 16 0.121 0.010 4.631
116 2HD2 ASN 16 1HD2 ASN 16 1.754 0.516 4.880
117 H LYS 17 H LYS 17 -3.241 2.679 1.702
118 HA LYS 17 HA LYS 17 -5.563 1.210 2.298
119 1HB LYS 17 1HB LYS 17 -6.511 2.187 0.395
120 2HB LYS 17 2HB LYS 17 -5.306 3.362 0.908
121 1HG LYS 17 1HG LYS 17 -3.824 2.743 -0.820
122 2HG LYS 17 2HG LYS 17 -4.757 1.293 -1.200
123 1HD LYS 17 1HD LYS 17 -5.369 2.776 -2.885
124 2HD LYS 17 2HD LYS 17 -6.679 2.938 -1.713
125 1HE LYS 17 1HE LYS 17 -5.925 5.009 -0.974
126 2HE LYS 17 2HE LYS 17 -4.296 4.746 -1.592
127 1HZ LYS 17 1HZ LYS 17 -5.414 4.766 -3.871
128 2HZ LYS 17 2HZ LYS 17 -5.235 6.247 -3.074
129 3HZ LYS 17 3HZ LYS 17 -6.737 5.470 -3.087
130 HA PRO 18 HA PRO 18 -4.767 -2.740 0.531
131 1HB PRO 18 1HB PRO 18 -7.317 -3.529 0.040
132 2HB PRO 18 2HB PRO 18 -6.629 -3.460 1.666
133 1HG PRO 18 1HG PRO 18 -8.401 -1.489 0.276
134 2HG PRO 18 2HG PRO 18 -8.473 -2.072 1.949
135 1HD PRO 18 1HD PRO 18 -7.389 0.318 1.286
136 2HD PRO 18 2HD PRO 18 -6.798 -0.653 2.649
137 H GLU 19 H GLU 19 -6.150 -0.163 -1.199
138 HA GLU 19 HA GLU 19 -6.459 -1.634 -3.683
139 1HB GLU 19 1HB GLU 19 -8.077 -0.005 -3.614
140 2HB GLU 19 2HB GLU 19 -7.049 1.132 -2.754
141 1HG GLU 19 1HG GLU 19 -5.875 1.698 -4.745
142 2HG GLU 19 2HG GLU 19 -6.653 0.395 -5.641
143 H ALA 20 H ALA 20 -3.928 -0.281 -2.008
144 HA ALA 20 HA ALA 20 -2.457 0.694 -4.311
145 1HB ALA 20 1HB ALA 20 -0.659 1.135 -2.676
146 2HB ALA 20 2HB ALA 20 -2.193 1.884 -2.228
147 3HB ALA 20 3HB ALA 20 -1.660 0.410 -1.417
148 H ILE 21 H ILE 21 -0.108 -0.089 -4.494
149 HA ILE 21 HA ILE 21 -0.127 -3.034 -4.444
150 HB ILE 21 HB ILE 21 0.068 -2.534 -6.685
151 1HG1 ILE 21 1HG1 ILE 21 2.947 -2.454 -5.757
152 2HG1 ILE 21 2HG1 ILE 21 1.982 -3.917 -5.922
153 1HG2 ILE 21 1HG2 ILE 21 1.478 -0.081 -5.751
154 2HG2 ILE 21 2HG2 ILE 21 1.747 -0.651 -7.397
155 3HG2 ILE 21 3HG2 ILE 21 0.117 -0.246 -6.861
156 1HD1 ILE 21 1HD1 ILE 21 1.818 -2.559 -8.378
157 2HD1 ILE 21 2HD1 ILE 21 3.512 -2.542 -7.888
158 3HD1 ILE 21 3HD1 ILE 21 2.648 -4.073 -8.019
159 H LYS 22 H LYS 22 1.494 -0.201 -3.362
160 HA LYS 22 HA LYS 22 3.388 -1.853 -1.884
161 1HB LYS 22 1HB LYS 22 5.247 -0.254 -2.477
162 2HB LYS 22 2HB LYS 22 4.721 -1.312 -3.780
163 1HG LYS 22 1HG LYS 22 3.276 0.592 -4.581
164 2HG LYS 22 2HG LYS 22 4.125 1.611 -3.417
165 1HD LYS 22 1HD LYS 22 6.205 1.276 -4.507
166 2HD LYS 22 2HD LYS 22 5.552 -0.029 -5.501
167 1HE LYS 22 1HE LYS 22 4.413 2.739 -5.653
168 2HE LYS 22 2HE LYS 22 5.870 2.314 -6.550
169 1HZ LYS 22 1HZ LYS 22 3.839 2.045 -7.866
170 2HZ LYS 22 2HZ LYS 22 3.272 0.892 -6.766
171 3HZ LYS 22 3HZ LYS 22 4.663 0.580 -7.675
172 H CYS 23 H CYS 23 4.769 -0.264 -0.431
173 HA CYS 23 HA CYS 23 2.908 1.047 1.269
174 1HB CYS 23 1HB CYS 23 5.229 -0.078 1.790
175 2HB CYS 23 2HB CYS 23 5.853 1.538 1.473
176 H VAL 24 H VAL 24 2.942 3.285 1.915
177 HA VAL 24 HA VAL 24 3.598 5.063 -0.335
178 HB VAL 24 HB VAL 24 1.199 4.904 0.454
179 1HG1 VAL 24 1HG1 VAL 24 1.941 6.713 2.704
180 2HG1 VAL 24 2HG1 VAL 24 0.523 5.681 2.505
181 3HG1 VAL 24 3HG1 VAL 24 2.081 4.969 2.928
182 1HG2 VAL 24 1HG2 VAL 24 1.668 7.708 0.876
183 2HG2 VAL 24 2HG2 VAL 24 2.724 7.096 -0.397
184 3HG2 VAL 24 2HG3 VAL 24 0.977 6.888 -0.524
185 H ALA 25 H ALA 25 5.243 4.095 2.100
186 HA ALA 25 HA ALA 25 6.215 6.774 2.830
187 1HB ALA 25 1HB ALA 25 6.306 4.512 4.791
188 2HB ALA 25 2HB ALA 25 6.429 6.248 5.084
189 3HB ALA 25 3HB ALA 25 4.876 5.535 4.648
190 H CYS 26 H CYS 26 6.967 3.316 2.610
191 HA CYS 26 HA CYS 26 9.802 4.028 2.238
192 1HB CYS 26 1HB CYS 26 10.415 1.900 3.110
193 2HB CYS 26 2HB CYS 26 9.201 2.552 4.205
194 H GLU 27 H GLU 27 7.029 2.831 0.716
195 HA GLU 27 HA GLU 27 6.645 2.155 -1.427
196 1HB GLU 27 1HB GLU 27 9.589 2.312 -2.009
197 2HB GLU 27 2HB GLU 27 8.238 2.547 -3.108
198 1HG GLU 27 1HG GLU 27 7.887 4.699 -2.444
199 2HG GLU 27 2HG GLU 27 8.525 4.422 -0.826
200 H THR 28 H THR 28 6.826 0.236 0.488
201 HA THR 28 HA THR 28 8.580 -1.882 -0.456
202 HB THR 28 HB THR 28 7.063 -1.358 1.988
203 HG1 THR 28 1HG THR 28 9.030 -3.298 1.934
204 1HG2 THR 28 1HG2 THR 28 7.002 -4.091 0.734
205 2HG2 THR 28 2HG2 THR 28 5.668 -3.170 1.430
206 3HG2 THR 28 3HG2 THR 28 6.904 -3.861 2.479
207 HA PRO 29 HA PRO 29 5.605 -3.814 -3.064
208 1HB PRO 29 1HB PRO 29 6.561 -6.354 -3.012
209 2HB PRO 29 2HB PRO 29 7.356 -5.047 -3.897
210 1HG PRO 29 1HG PRO 29 8.009 -6.181 -1.205
211 2HG PRO 29 2HG PRO 29 9.105 -5.727 -2.523
212 1HD PRO 29 1HD PRO 29 8.678 -4.140 -0.372
213 2HD PRO 29 2HD PRO 29 9.026 -3.487 -1.986
214 H LYS 30 H LYS 30 3.579 -4.086 -2.358
215 HA LYS 30 HA LYS 30 2.807 -5.151 0.102
216 1HB LYS 30 1HB LYS 30 1.280 -3.766 -1.113
217 2HB LYS 30 2HB LYS 30 1.298 -4.853 -2.495
218 1HG LYS 30 1HG LYS 30 0.397 -6.562 -0.676
219 2HG LYS 30 2HG LYS 30 -0.165 -5.064 0.071
220 1HD LYS 30 1HD LYS 30 -0.668 -5.311 -2.823
221 2HD LYS 30 2HD LYS 30 -1.553 -6.443 -1.797
222 1HE LYS 30 1HE LYS 30 -2.341 -4.530 -0.440
223 2HE LYS 30 2HE LYS 30 -1.529 -3.437 -1.558
224 1HZ LYS 30 1HZ LYS 30 -3.538 -3.431 -2.538
225 2HZ LYS 30 2HZ LYS 30 -4.000 -4.923 -1.887
226 3HZ LYS 30 3HZ LYS 30 -2.998 -4.868 -3.248
227 HA PRO 31 HA PRO 31 3.215 -9.506 -0.409
228 1HB PRO 31 1HB PRO 31 1.434 -10.323 1.470
229 2HB PRO 31 2HB PRO 31 3.013 -9.640 1.876
230 1HG PRO 31 1HG PRO 31 0.328 -8.317 1.848
231 2HG PRO 31 2HG PRO 31 1.629 -8.183 3.045
232 1HD PRO 31 1HD PRO 31 1.194 -6.298 1.150
233 2HD PRO 31 2HD PRO 31 2.814 -6.668 1.774
Start of MODEL 10
1 1H GLY 0 1H GLY 0 -19.407 -9.596 -4.787
2 1HA GLY 0 1HA GLY 0 -18.600 -9.912 -7.372
3 2HA GLY 0 2HA GLY 0 -18.377 -8.194 -7.078
4 H HIS 1 H HIS 1 -16.696 -7.496 -5.815
5 HA HIS 1 HA HIS 1 -14.786 -9.581 -4.996
6 1HB HIS 1 1HB HIS 1 -13.016 -8.141 -5.516
7 2HB HIS 1 2HB HIS 1 -14.178 -7.835 -6.804
8 HD1 HIS 1 HD1 HIS 1 -15.383 -5.539 -6.792
9 HD2 HIS 1 HD2 HIS 1 -12.562 -6.006 -3.778
10 HE1 HIS 1 HE1 HIS 1 -15.004 -3.233 -5.863
11 H MET 2 H MET 2 -13.159 -8.451 -3.296
12 HA MET 2 HA MET 2 -14.513 -6.831 -1.335
13 1HB MET 2 1HB MET 2 -14.520 -8.412 0.460
14 2HB MET 2 2HB MET 2 -15.354 -9.153 -0.899
15 1HG MET 2 1HG MET 2 -12.452 -9.655 -0.340
16 2HG MET 2 2HG MET 2 -13.735 -10.602 0.407
17 1HE MET 2 1HE MET 2 -14.798 -13.078 -1.863
18 2HE MET 2 2HE MET 2 -13.232 -13.254 -1.072
19 3HE MET 2 3HE MET 2 -14.547 -12.417 -0.246
20 H VAL 3 H VAL 3 -13.102 -6.295 0.502
21 HA VAL 3 HA VAL 3 -10.249 -6.599 -0.180
22 HB VAL 3 HB VAL 3 -9.854 -4.366 0.774
23 1HG1 VAL 3 1HG1 VAL 3 -9.996 -4.262 -1.529
24 2HG1 VAL 3 2HG1 VAL 3 -11.704 -4.708 -1.550
25 3HG1 VAL 3 3HG1 VAL 3 -11.219 -3.090 -1.037
26 1HG2 VAL 3 1HG2 VAL 3 -11.598 -2.912 1.433
27 2HG2 VAL 3 2HG2 VAL 3 -12.841 -3.999 0.813
28 3HG2 VAL 3 3HG2 VAL 3 -11.913 -4.447 2.244
29 H ILE 4 H ILE 4 -8.765 -6.434 1.643
30 HA ILE 4 HA ILE 4 -9.892 -7.724 4.010
31 HB ILE 4 HB ILE 4 -7.319 -7.849 4.563
32 1HG1 ILE 4 1HG1 ILE 4 -7.210 -7.787 1.552
33 2HG1 ILE 4 2HG1 ILE 4 -6.842 -6.368 2.526
34 1HG2 ILE 4 1HG2 ILE 4 -8.137 -9.640 2.334
35 2HG2 ILE 4 2HG2 ILE 4 -7.381 -10.029 3.879
36 3HG2 ILE 4 3HG2 ILE 4 -9.100 -9.638 3.811
37 1HD1 ILE 4 1HD1 ILE 4 -5.229 -8.710 1.956
38 2HD1 ILE 4 2HD1 ILE 4 -4.750 -7.109 2.521
39 3HD1 ILE 4 3HD1 ILE 4 -5.298 -8.324 3.675
40 H GLY 5 H GLY 5 -8.735 -4.685 2.972
41 1HA GLY 5 1HA GLY 5 -9.182 -2.757 4.353
42 2HA GLY 5 2HA GLY 5 -8.796 -3.736 5.762
43 H THR 6 H THR 6 -7.672 -1.219 5.301
44 HA THR 6 HA THR 6 -5.280 -1.017 4.001
45 HB THR 6 HB THR 6 -4.543 0.528 5.843
46 HG1 THR 6 1HG THR 6 -5.452 0.093 7.708
47 1HG2 THR 6 1HG2 THR 6 -5.644 1.935 4.499
48 2HG2 THR 6 2HG2 THR 6 -7.023 1.754 5.584
49 3HG2 THR 6 3HG2 THR 6 -6.889 0.736 4.150
50 H TRP 7 H TRP 7 -3.254 -1.782 4.218
51 HA TRP 7 HA TRP 7 -2.783 -3.723 6.370
52 1HB TRP 7 1HB TRP 7 -0.814 -4.378 4.833
53 2HB TRP 7 2HB TRP 7 -2.445 -4.803 4.319
54 HD1 TRP 7 1HD TRP 7 -3.564 -2.973 2.484
55 HE1 TRP 7 1HE TRP 7 -2.395 -1.817 0.504
56 HE3 TRP 7 3HE TRP 7 1.294 -3.519 3.978
57 HZ2 TRP 7 2HZ TRP 7 0.238 -1.215 -0.316
58 HZ3 TRP 7 3HZ TRP 7 3.078 -2.625 2.538
59 HH2 TRP 7 2HH TRP 7 2.559 -1.497 0.436
60 H ASP 8 H ASP 8 -1.078 -3.549 7.754
61 HA ASP 8 HA ASP 8 0.320 -0.978 7.749
62 1HB ASP 8 1HB ASP 8 0.225 -3.059 9.940
63 2HB ASP 8 2HB ASP 8 0.809 -1.403 10.077
64 H CYS 9 H CYS 9 2.467 -0.785 7.467
65 HA CYS 9 HA CYS 9 3.944 -2.838 6.264
66 1HB CYS 9 1HB CYS 9 4.295 -0.233 6.310
67 2HB CYS 9 2HB CYS 9 5.319 -0.596 7.696
68 H ASP 10 H ASP 10 6.208 -3.453 7.158
69 HA ASP 10 HA ASP 10 6.026 -4.121 10.013
70 1HB ASP 10 1HB ASP 10 6.652 -6.389 9.644
71 2HB ASP 10 2HB ASP 10 5.327 -6.054 8.533
72 H THR 11 H THR 11 7.658 -2.435 7.864
73 HA THR 11 HA THR 11 10.263 -2.984 9.126
74 HB THR 11 HB THR 11 9.652 -2.417 6.239
75 HG1 THR 11 1HG THR 11 11.364 -4.277 7.565
76 1HG2 THR 11 1HG2 THR 11 11.297 -0.817 6.479
77 2HG2 THR 11 2HG2 THR 11 12.266 -2.248 6.125
78 3HG2 THR 11 3HG3 THR 11 12.099 -1.686 7.789
79 H CYS 12 H CYS 12 8.520 -0.510 7.234
80 HA CYS 12 HA CYS 12 9.988 1.589 8.623
81 1HB CYS 12 1HB CYS 12 9.401 2.999 6.905
82 2HB CYS 12 2HB CYS 12 9.353 1.455 6.059
83 H LEU 13 H LEU 13 6.989 -0.031 8.789
84 HA LEU 13 HA LEU 13 5.241 0.159 10.237
85 1HB LEU 13 1HB LEU 13 6.457 2.571 11.507
86 2HB LEU 13 2HB LEU 13 5.495 1.289 12.238
87 HG LEU 13 HG LEU 13 8.383 1.101 11.382
88 1HD1 LEU 13 1HD1 LEU 13 6.999 1.420 14.014
89 2HD1 LEU 13 2HD1 LEU 13 8.396 2.283 13.373
90 3HD1 LEU 13 3HD1 LEU 13 8.563 0.612 13.913
91 1HD2 LEU 13 1HD2 LEU 13 8.373 -1.130 11.812
92 2HD2 LEU 13 2HD2 LEU 13 6.711 -0.960 11.247
93 3HD2 LEU 13 3HD2 LEU 13 7.054 -1.016 12.977
94 H VAL 14 H VAL 14 4.195 0.857 8.201
95 HA VAL 14 HA VAL 14 2.883 3.417 8.615
96 HB VAL 14 HB VAL 14 4.385 2.779 6.075
97 1HG1 VAL 14 1HG1 VAL 14 2.582 3.746 5.107
98 2HG1 VAL 14 2HG1 VAL 14 2.081 4.557 6.592
99 3HG1 VAL 14 3HG1 VAL 14 3.392 5.225 5.619
100 1HG2 VAL 14 1HG2 VAL 14 5.646 4.742 6.517
101 2HG2 VAL 14 2HG2 VAL 14 4.578 5.213 7.839
102 3HG2 VAL 14 3HG2 VAL 14 5.626 3.805 8.011
103 H GLN 15 H GLN 15 0.776 3.298 8.139
104 HA GLN 15 HA GLN 15 -0.276 0.818 7.098
105 1HB GLN 15 1HB GLN 15 -1.656 3.334 8.048
106 2HB GLN 15 2HB GLN 15 -2.486 1.858 7.573
107 1HG GLN 15 1HG GLN 15 -1.130 0.691 9.368
108 2HG GLN 15 2HG GLN 15 -0.686 2.302 9.931
109 1HE2 GLN 15 2HE2 GLN 15 -3.549 0.405 9.043
110 2HE2 GLN 15 1HE2 GLN 15 -4.563 1.031 10.295
111 H ASN 16 H ASN 16 -1.589 0.592 5.263
112 HA ASN 16 HA ASN 16 -1.782 2.837 3.417
113 1HB ASN 16 1HB ASN 16 -0.746 0.287 2.261
114 2HB ASN 16 2HB ASN 16 -0.527 1.942 1.702
115 1HD2 ASN 16 2HD2 ASN 16 0.299 -0.155 4.437
116 2HD2 ASN 16 1HD2 ASN 16 1.894 0.473 4.657
117 H LYS 17 H LYS 17 -3.209 2.386 1.588
118 HA LYS 17 HA LYS 17 -5.493 0.861 2.422
119 1HB LYS 17 1HB LYS 17 -6.620 1.812 0.576
120 2HB LYS 17 2HB LYS 17 -5.539 3.070 1.162
121 1HG LYS 17 1HG LYS 17 -3.994 2.658 -0.623
122 2HG LYS 17 2HG LYS 17 -4.916 1.250 -1.153
123 1HD LYS 17 1HD LYS 17 -6.729 2.597 -1.873
124 2HD LYS 17 2HD LYS 17 -6.082 4.025 -1.059
125 1HE LYS 17 1HE LYS 17 -4.483 4.382 -2.671
126 2HE LYS 17 2HE LYS 17 -4.438 2.687 -3.155
127 1HZ LYS 17 1HZ LYS 17 -6.894 3.262 -3.878
128 2HZ LYS 17 2HZ LYS 17 -5.576 3.543 -4.899
129 3HZ LYS 17 3HZ LYS 17 -6.242 4.818 -4.011
130 HA PRO 18 HA PRO 18 -4.673 -2.945 0.386
131 1HB PRO 18 1HB PRO 18 -7.206 -3.770 -0.132
132 2HB PRO 18 2HB PRO 18 -6.509 -3.775 1.491
133 1HG PRO 18 1HG PRO 18 -8.340 -1.775 0.224
134 2HG PRO 18 2HG PRO 18 -8.385 -2.453 1.862
135 1HD PRO 18 1HD PRO 18 -7.366 -0.002 1.328
136 2HD PRO 18 2HD PRO 18 -6.741 -1.034 2.632
137 H GLU 19 H GLU 19 -6.135 -0.313 -1.188
138 HA GLU 19 HA GLU 19 -6.427 -1.649 -3.747
139 1HB GLU 19 1HB GLU 19 -6.575 1.318 -3.478
140 2HB GLU 19 2HB GLU 19 -7.532 0.236 -4.480
141 1HG GLU 19 1HG GLU 19 -8.583 -0.593 -2.325
142 2HG GLU 19 2HG GLU 19 -7.822 0.795 -1.548
143 H ALA 20 H ALA 20 -3.913 -0.334 -2.017
144 HA ALA 20 HA ALA 20 -2.482 0.803 -4.269
145 1HB ALA 20 1HB ALA 20 -1.577 0.336 -1.429
146 2HB ALA 20 2HB ALA 20 -0.713 1.264 -2.656
147 3HB ALA 20 3HB ALA 20 -2.273 1.829 -2.059
148 H ILE 21 H ILE 21 -0.115 0.082 -4.504
149 HA ILE 21 HA ILE 21 -0.076 -2.859 -4.640
150 HB ILE 21 HB ILE 21 1.372 -2.723 -6.526
151 1HG1 ILE 21 1HG1 ILE 21 1.629 0.147 -5.715
152 2HG1 ILE 21 2HG1 ILE 21 2.888 -1.007 -6.139
153 1HG2 ILE 21 1HG2 ILE 21 -0.639 -0.552 -7.032
154 2HG2 ILE 21 2HG2 ILE 21 -0.059 -1.797 -8.137
155 3HG2 ILE 21 3HG2 ILE 21 -1.116 -2.233 -6.795
156 1HD1 ILE 21 1HD1 ILE 21 0.955 0.231 -8.083
157 2HD1 ILE 21 2HD1 ILE 21 2.616 0.760 -7.813
158 3HD1 ILE 21 3HD1 ILE 21 2.298 -0.845 -8.472
159 H LYS 22 H LYS 22 1.357 -0.154 -3.186
160 HA LYS 22 HA LYS 22 3.248 -1.812 -1.787
161 1HB LYS 22 1HB LYS 22 5.167 -0.218 -2.375
162 2HB LYS 22 2HB LYS 22 4.706 -1.410 -3.583
163 1HG LYS 22 1HG LYS 22 3.342 0.345 -4.701
164 2HG LYS 22 2HG LYS 22 4.000 1.515 -3.555
165 1HD LYS 22 1HD LYS 22 5.326 1.689 -5.505
166 2HD LYS 22 2HD LYS 22 6.295 0.790 -4.335
167 1HE LYS 22 1HE LYS 22 6.596 -0.623 -6.065
168 2HE LYS 22 2HE LYS 22 5.021 -1.241 -5.570
169 1HZ LYS 22 1HZ LYS 22 5.759 0.087 -7.979
170 2HZ LYS 22 2HZ LYS 22 4.461 0.867 -7.226
171 3HZ LYS 22 3HZ LYS 22 4.349 -0.775 -7.618
172 H CYS 23 H CYS 23 4.586 -0.389 -0.235
173 HA CYS 23 HA CYS 23 2.834 1.013 1.425
174 1HB CYS 23 1HB CYS 23 5.237 -0.024 1.833
175 2HB CYS 23 2HB CYS 23 5.755 1.628 1.518
176 H VAL 24 H VAL 24 2.984 3.289 2.096
177 HA VAL 24 HA VAL 24 3.425 5.034 -0.236
178 HB VAL 24 HB VAL 24 1.075 4.821 0.742
179 1HG1 VAL 24 1HG1 VAL 24 1.613 6.862 2.745
180 2HG1 VAL 24 2HG1 VAL 24 0.633 5.398 2.853
181 3HG1 VAL 24 3HG1 VAL 24 2.374 5.316 3.120
182 1HG2 VAL 24 1HG2 VAL 24 0.555 6.967 0.078
183 2HG2 VAL 24 2HG2 VAL 24 1.992 7.663 0.828
184 3HG2 VAL 24 2HG3 VAL 24 2.137 6.743 -0.671
185 H ALA 25 H ALA 25 5.332 4.157 1.944
186 HA ALA 25 HA ALA 25 6.305 6.846 2.572
187 1HB ALA 25 1HB ALA 25 5.863 6.668 4.738
188 2HB ALA 25 2HB ALA 25 5.204 5.050 4.499
189 3HB ALA 25 3HB ALA 25 6.924 5.262 4.819
190 H CYS 26 H CYS 26 6.988 3.362 2.643
191 HA CYS 26 HA CYS 26 9.825 3.971 2.150
192 1HB CYS 26 1HB CYS 26 10.394 1.891 3.126
193 2HB CYS 26 2HB CYS 26 9.163 2.579 4.181
194 H GLU 27 H GLU 27 6.998 2.817 0.704
195 HA GLU 27 HA GLU 27 6.573 2.090 -1.417
196 1HB GLU 27 1HB GLU 27 9.505 2.013 -2.042
197 2HB GLU 27 2HB GLU 27 8.154 2.367 -3.111
198 1HG GLU 27 1HG GLU 27 7.849 4.446 -1.569
199 2HG GLU 27 2HG GLU 27 9.532 4.136 -1.150
200 H THR 28 H THR 28 6.746 0.263 0.643
201 HA THR 28 HA THR 28 8.391 -1.972 -0.083
202 HB THR 28 HB THR 28 6.802 -1.244 2.164
203 HG1 THR 28 1HG THR 28 8.934 -2.066 2.241
204 1HG2 THR 28 1HG2 THR 28 6.210 -4.037 1.183
205 2HG2 THR 28 2HG2 THR 28 5.069 -2.694 1.105
206 3HG2 THR 28 3HG2 THR 28 5.632 -3.285 2.668
207 HA PRO 29 HA PRO 29 5.769 -3.881 -3.059
208 1HB PRO 29 1HB PRO 29 6.587 -6.455 -2.780
209 2HB PRO 29 2HB PRO 29 7.569 -5.215 -3.570
210 1HG PRO 29 1HG PRO 29 7.745 -6.275 -0.776
211 2HG PRO 29 2HG PRO 29 9.050 -5.916 -1.920
212 1HD PRO 29 1HD PRO 29 8.370 -4.234 0.089
213 2HD PRO 29 2HD PRO 29 8.994 -3.655 -1.469
214 H LYS 30 H LYS 30 3.649 -4.011 -2.640
215 HA LYS 30 HA LYS 30 2.425 -4.904 -0.327
216 1HB LYS 30 1HB LYS 30 1.163 -3.624 -1.900
217 2HB LYS 30 2HB LYS 30 1.419 -4.813 -3.170
218 1HG LYS 30 1HG LYS 30 0.153 -6.407 -1.538
219 2HG LYS 30 2HG LYS 30 -0.438 -4.896 -0.842
220 1HD LYS 30 1HD LYS 30 -0.832 -4.402 -3.465
221 2HD LYS 30 2HD LYS 30 -1.039 -6.156 -3.442
222 1HE LYS 30 1HE LYS 30 -2.865 -6.048 -2.016
223 2HE LYS 30 2HE LYS 30 -2.426 -4.450 -1.414
224 1HZ LYS 30 1HZ LYS 30 -3.573 -3.462 -3.027
225 2HZ LYS 30 2HZ LYS 30 -4.296 -4.965 -3.310
226 3HZ LYS 30 3HZ LYS 30 -2.963 -4.481 -4.232
227 HA PRO 31 HA PRO 31 2.811 -9.289 -0.378
228 1HB PRO 31 1HB PRO 31 0.698 -9.922 1.204
229 2HB PRO 31 2HB PRO 31 2.192 -9.218 1.834
230 1HG PRO 31 1HG PRO 31 -0.410 -7.883 1.198
231 2HG PRO 31 2HG PRO 31 0.652 -7.652 2.598
232 1HD PRO 31 1HD PRO 31 0.616 -5.941 0.500
233 2HD PRO 31 2HD PRO 31 2.086 -6.267 1.442
Start of MODEL 11
1 1H GLY 0 1H GLY 0 -15.521 -7.584 -9.464
2 1HA GLY 0 1HA GLY 0 -14.391 -6.067 -8.164
3 2HA GLY 0 2HA GLY 0 -15.404 -6.591 -6.826
4 H HIS 1 H HIS 1 -13.444 -6.221 -5.554
5 HA HIS 1 HA HIS 1 -11.787 -8.642 -5.513
6 1HB HIS 1 1HB HIS 1 -9.787 -7.271 -5.006
7 2HB HIS 1 2HB HIS 1 -10.431 -6.952 -6.614
8 HD1 HIS 1 HD1 HIS 1 -9.127 -5.213 -3.832
9 HD2 HIS 1 HD2 HIS 1 -12.303 -4.544 -6.425
10 HE1 HIS 1 HE1 HIS 1 -9.641 -2.759 -3.645
11 H MET 2 H MET 2 -11.474 -9.481 -3.530
12 HA MET 2 HA MET 2 -13.025 -8.758 -1.364
13 1HB MET 2 1HB MET 2 -11.827 -10.345 -0.101
14 2HB MET 2 2HB MET 2 -11.747 -10.931 -1.757
15 1HG MET 2 1HG MET 2 -9.564 -9.304 -0.493
16 2HG MET 2 2HG MET 2 -9.621 -11.064 -0.423
17 1HE MET 2 1HE MET 2 -6.830 -9.837 -3.079
18 2HE MET 2 2HE MET 2 -7.513 -8.655 -1.962
19 3HE MET 2 3HE MET 2 -7.082 -10.267 -1.388
20 H VAL 3 H VAL 3 -12.769 -7.491 0.425
21 HA VAL 3 HA VAL 3 -10.408 -5.727 0.443
22 HB VAL 3 HB VAL 3 -13.290 -5.186 1.005
23 1HG1 VAL 3 1HG1 VAL 3 -12.661 -3.108 2.189
24 2HG1 VAL 3 2HG1 VAL 3 -12.242 -4.567 3.090
25 3HG1 VAL 3 3HG1 VAL 3 -10.990 -3.669 2.230
26 1HG2 VAL 3 1HG2 VAL 3 -11.523 -4.523 -1.014
27 2HG2 VAL 3 2HG2 VAL 3 -13.092 -3.775 -0.714
28 3HG2 VAL 3 3HG2 VAL 3 -11.629 -3.050 -0.049
29 H ILE 4 H ILE 4 -9.059 -6.129 2.057
30 HA ILE 4 HA ILE 4 -10.090 -7.370 4.509
31 HB ILE 4 HB ILE 4 -7.172 -7.043 3.900
32 1HG1 ILE 4 1HG1 ILE 4 -7.491 -9.504 3.007
33 2HG1 ILE 4 2HG1 ILE 4 -9.118 -8.940 2.646
34 1HG2 ILE 4 1HG2 ILE 4 -8.142 -7.836 6.134
35 2HG2 ILE 4 2HG2 ILE 4 -8.553 -9.323 5.278
36 3HG2 ILE 4 3HG2 ILE 4 -6.869 -8.812 5.399
37 1HD1 ILE 4 1HD1 ILE 4 -6.811 -8.632 1.100
38 2HD1 ILE 4 2HD1 ILE 4 -8.407 -7.937 0.812
39 3HD1 ILE 4 3HD1 ILE 4 -7.201 -7.028 1.722
40 H GLY 5 H GLY 5 -8.870 -4.426 3.271
41 1HA GLY 5 1HA GLY 5 -9.164 -2.416 4.567
42 2HA GLY 5 2HA GLY 5 -8.782 -3.344 6.010
43 H THR 6 H THR 6 -7.566 -0.892 5.302
44 HA THR 6 HA THR 6 -5.207 -0.887 3.954
45 HB THR 6 HB THR 6 -4.336 0.714 5.696
46 HG1 THR 6 1HG THR 6 -5.233 0.384 7.596
47 1HG2 THR 6 1HG2 THR 6 -5.384 2.111 4.301
48 2HG2 THR 6 2HG2 THR 6 -6.760 2.051 5.403
49 3HG2 THR 6 3HG2 THR 6 -6.688 0.956 4.022
50 H TRP 7 H TRP 7 -3.277 -1.848 4.094
51 HA TRP 7 HA TRP 7 -2.830 -3.716 6.293
52 1HB TRP 7 1HB TRP 7 -0.834 -4.378 4.784
53 2HB TRP 7 2HB TRP 7 -2.460 -4.784 4.245
54 HD1 TRP 7 1HD TRP 7 -3.529 -3.034 2.352
55 HE1 TRP 7 1HE TRP 7 -2.327 -1.832 0.419
56 HE3 TRP 7 3HE TRP 7 1.281 -3.387 4.046
57 HZ2 TRP 7 2HZ TRP 7 0.313 -1.127 -0.293
58 HZ3 TRP 7 3HZ TRP 7 3.086 -2.424 2.679
59 HH2 TRP 7 2HH TRP 7 2.611 -1.318 0.555
60 H ASP 8 H ASP 8 -1.211 -3.548 7.756
61 HA ASP 8 HA ASP 8 0.225 -1.009 7.833
62 1HB ASP 8 1HB ASP 8 0.037 -3.197 9.914
63 2HB ASP 8 2HB ASP 8 0.763 -1.609 10.147
64 H CYS 9 H CYS 9 2.339 -0.800 7.445
65 HA CYS 9 HA CYS 9 3.828 -2.856 6.252
66 1HB CYS 9 1HB CYS 9 4.132 -0.271 6.157
67 2HB CYS 9 2HB CYS 9 5.138 -0.504 7.582
68 H ASP 10 H ASP 10 6.000 -3.600 7.045
69 HA ASP 10 HA ASP 10 6.004 -4.055 9.951
70 1HB ASP 10 1HB ASP 10 6.492 -6.364 9.697
71 2HB ASP 10 2HB ASP 10 5.135 -6.039 8.621
72 H THR 11 H THR 11 7.530 -2.437 7.770
73 HA THR 11 HA THR 11 10.207 -3.116 8.793
74 HB THR 11 HB THR 11 9.329 -2.746 5.983
75 HG1 THR 11 1HG THR 11 10.086 -4.760 6.779
76 1HG2 THR 11 1HG2 THR 11 10.668 -0.825 6.010
77 2HG2 THR 11 2HG2 THR 11 11.759 -2.092 5.447
78 3HG2 THR 11 3HG3 THR 11 11.833 -1.543 7.121
79 H CYS 12 H CYS 12 8.139 -0.610 7.376
80 HA CYS 12 HA CYS 12 9.839 1.428 8.653
81 1HB CYS 12 1HB CYS 12 9.361 2.897 6.946
82 2HB CYS 12 2HB CYS 12 9.289 1.372 6.070
83 H LEU 13 H LEU 13 6.951 -0.197 8.980
84 HA LEU 13 HA LEU 13 5.130 0.072 10.315
85 1HB LEU 13 1HB LEU 13 7.111 1.949 11.491
86 2HB LEU 13 2HB LEU 13 5.437 2.072 12.026
87 HG LEU 13 HG LEU 13 5.716 -0.512 12.433
88 1HD1 LEU 13 1HD1 LEU 13 7.969 -0.598 11.430
89 2HD1 LEU 13 2HD1 LEU 13 7.944 -1.138 13.108
90 3HD1 LEU 13 3HD1 LEU 13 8.553 0.468 12.709
91 1HD2 LEU 13 1HD2 LEU 13 6.123 -0.059 14.707
92 2HD2 LEU 13 2HD2 LEU 13 5.309 1.377 14.082
93 3HD2 LEU 13 3HD2 LEU 13 7.055 1.391 14.336
94 H VAL 14 H VAL 14 3.952 0.726 8.415
95 HA VAL 14 HA VAL 14 2.701 3.297 8.767
96 HB VAL 14 HB VAL 14 4.405 2.745 6.350
97 1HG1 VAL 14 1HG1 VAL 14 1.887 4.303 6.542
98 2HG1 VAL 14 2HG1 VAL 14 3.215 5.002 5.613
99 3HG1 VAL 14 3HG1 VAL 14 2.572 3.418 5.180
100 1HG2 VAL 14 1HG2 VAL 14 4.169 5.004 8.324
101 2HG2 VAL 14 2HG2 VAL 14 5.560 3.963 8.020
102 3HG2 VAL 14 3HG2 VAL 14 5.062 5.145 6.809
103 H GLN 15 H GLN 15 0.617 3.223 8.156
104 HA GLN 15 HA GLN 15 -0.390 0.744 7.054
105 1HB GLN 15 1HB GLN 15 -1.869 3.228 7.938
106 2HB GLN 15 2HB GLN 15 -2.607 1.686 7.527
107 1HG GLN 15 1HG GLN 15 -1.227 0.681 9.391
108 2HG GLN 15 2HG GLN 15 -0.856 2.334 9.875
109 1HE2 GLN 15 2HE2 GLN 15 -2.969 3.736 9.892
110 2HE2 GLN 15 1HE2 GLN 15 -4.274 3.040 10.784
111 H ASN 16 H ASN 16 -1.532 0.509 5.141
112 HA ASN 16 HA ASN 16 -1.708 2.806 3.345
113 1HB ASN 16 1HB ASN 16 -0.618 0.276 2.190
114 2HB ASN 16 2HB ASN 16 -0.393 1.940 1.657
115 1HD2 ASN 16 2HD2 ASN 16 0.316 -0.113 4.463
116 2HD2 ASN 16 1HD2 ASN 16 1.911 0.497 4.720
117 H LYS 17 H LYS 17 -3.272 2.610 1.728
118 HA LYS 17 HA LYS 17 -5.525 1.056 2.362
119 1HB LYS 17 1HB LYS 17 -6.561 2.040 0.515
120 2HB LYS 17 2HB LYS 17 -5.362 3.235 0.989
121 1HG LYS 17 1HG LYS 17 -3.925 2.630 -0.798
122 2HG LYS 17 2HG LYS 17 -4.885 1.198 -1.169
123 1HD LYS 17 1HD LYS 17 -5.700 2.596 -2.771
124 2HD LYS 17 2HD LYS 17 -6.793 3.025 -1.453
125 1HE LYS 17 1HE LYS 17 -5.230 4.879 -0.864
126 2HE LYS 17 2HE LYS 17 -4.304 4.494 -2.315
127 1HZ LYS 17 1HZ LYS 17 -5.855 5.398 -3.652
128 2HZ LYS 17 2HZ LYS 17 -6.261 6.281 -2.268
129 3HZ LYS 17 3HZ LYS 17 -7.157 4.910 -2.688
130 HA PRO 18 HA PRO 18 -4.684 -2.839 0.501
131 1HB PRO 18 1HB PRO 18 -7.223 -3.671 0.015
132 2HB PRO 18 2HB PRO 18 -6.523 -3.618 1.638
133 1HG PRO 18 1HG PRO 18 -8.345 -1.657 0.296
134 2HG PRO 18 2HG PRO 18 -8.392 -2.273 1.959
135 1HD PRO 18 1HD PRO 18 -7.360 0.151 1.332
136 2HD PRO 18 2HD PRO 18 -6.740 -0.833 2.673
137 H GLU 19 H GLU 19 -6.147 -0.264 -1.170
138 HA GLU 19 HA GLU 19 -6.433 -1.698 -3.678
139 1HB GLU 19 1HB GLU 19 -8.100 -0.104 -3.512
140 2HB GLU 19 2HB GLU 19 -7.050 1.065 -2.724
141 1HG GLU 19 1HG GLU 19 -7.663 1.766 -4.975
142 2HG GLU 19 2HG GLU 19 -5.926 1.513 -4.821
143 H ALA 20 H ALA 20 -3.925 -0.315 -1.998
144 HA ALA 20 HA ALA 20 -2.499 0.763 -4.278
145 1HB ALA 20 1HB ALA 20 -0.694 1.187 -2.653
146 2HB ALA 20 2HB ALA 20 -2.239 1.869 -2.144
147 3HB ALA 20 3HB ALA 20 -1.649 0.378 -1.411
148 H ILE 21 H ILE 21 -0.121 0.035 -4.485
149 HA ILE 21 HA ILE 21 -0.074 -2.911 -4.525
150 HB ILE 21 HB ILE 21 0.957 -2.931 -6.560
151 1HG1 ILE 21 1HG1 ILE 21 2.071 -0.221 -5.838
152 2HG1 ILE 21 2HG1 ILE 21 2.948 -1.734 -6.032
153 1HG2 ILE 21 1HG2 ILE 21 -0.600 -0.357 -6.524
154 2HG2 ILE 21 2HG2 ILE 21 0.023 -1.089 -8.001
155 3HG2 ILE 21 3HG2 ILE 21 -1.155 -1.957 -7.018
156 1HD1 ILE 21 1HD1 ILE 21 3.469 -0.686 -7.987
157 2HD1 ILE 21 2HD1 ILE 21 2.029 -1.575 -8.483
158 3HD1 ILE 21 3HD1 ILE 21 1.915 0.139 -8.089
159 H LYS 22 H LYS 22 1.331 -0.157 -3.191
160 HA LYS 22 HA LYS 22 3.377 -1.739 -1.903
161 1HB LYS 22 1HB LYS 22 5.206 -0.162 -2.519
162 2HB LYS 22 2HB LYS 22 4.602 -1.106 -3.875
163 1HG LYS 22 1HG LYS 22 3.179 0.860 -4.493
164 2HG LYS 22 2HG LYS 22 4.039 1.782 -3.257
165 1HD LYS 22 1HD LYS 22 4.964 2.096 -5.537
166 2HD LYS 22 2HD LYS 22 6.137 1.441 -4.392
167 1HE LYS 22 1HE LYS 22 6.102 -0.659 -5.361
168 2HE LYS 22 2HE LYS 22 4.513 -0.412 -6.084
169 1HZ LYS 22 1HZ LYS 22 6.957 1.035 -6.945
170 2HZ LYS 22 2HZ LYS 22 5.449 1.030 -7.709
171 3HZ LYS 22 3HZ LYS 22 6.389 -0.376 -7.688
172 H CYS 23 H CYS 23 4.790 -0.066 -0.516
173 HA CYS 23 HA CYS 23 2.909 1.181 1.244
174 1HB CYS 23 1HB CYS 23 5.245 0.029 1.725
175 2HB CYS 23 2HB CYS 23 5.845 1.668 1.488
176 H VAL 24 H VAL 24 2.934 3.405 1.906
177 HA VAL 24 HA VAL 24 3.598 5.207 -0.317
178 HB VAL 24 HB VAL 24 1.217 5.067 0.560
179 1HG1 VAL 24 1HG1 VAL 24 2.357 6.680 2.836
180 2HG1 VAL 24 2HG1 VAL 24 0.668 6.230 2.590
181 3HG1 VAL 24 3HG1 VAL 24 1.869 4.991 2.958
182 1HG2 VAL 24 1HG2 VAL 24 2.784 7.283 -0.274
183 2HG2 VAL 24 2HG2 VAL 24 1.060 7.001 -0.518
184 3HG2 VAL 24 2HG3 VAL 24 1.619 7.852 0.922
185 H ALA 25 H ALA 25 5.348 4.185 1.979
186 HA ALA 25 HA ALA 25 6.401 6.827 2.705
187 1HB ALA 25 1HB ALA 25 5.657 4.613 4.563
188 2HB ALA 25 2HB ALA 25 7.003 5.678 4.966
189 3HB ALA 25 3HB ALA 25 5.391 6.349 4.719
190 H CYS 26 H CYS 26 7.006 3.329 2.624
191 HA CYS 26 HA CYS 26 9.861 3.903 2.183
192 1HB CYS 26 1HB CYS 26 10.397 1.802 3.132
193 2HB CYS 26 2HB CYS 26 9.174 2.496 4.193
194 H GLU 27 H GLU 27 7.039 2.898 0.670
195 HA GLU 27 HA GLU 27 6.609 2.181 -1.450
196 1HB GLU 27 1HB GLU 27 9.568 2.114 -1.995
197 2HB GLU 27 2HB GLU 27 8.253 2.375 -3.131
198 1HG GLU 27 1HG GLU 27 8.938 4.512 -2.940
199 2HG GLU 27 2HG GLU 27 7.848 4.481 -1.555
200 H THR 28 H THR 28 6.967 0.347 0.711
201 HA THR 28 HA THR 28 8.485 -1.914 -0.125
202 HB THR 28 HB THR 28 6.742 -1.244 2.121
203 HG1 THR 28 1HG THR 28 8.291 -2.776 3.093
204 1HG2 THR 28 1HG2 THR 28 5.295 -2.972 1.444
205 2HG2 THR 28 2HG2 THR 28 6.362 -3.721 2.632
206 3HG2 THR 28 3HG2 THR 28 6.629 -3.995 0.911
207 HA PRO 29 HA PRO 29 5.736 -3.775 -3.013
208 1HB PRO 29 1HB PRO 29 6.516 -6.363 -2.766
209 2HB PRO 29 2HB PRO 29 7.494 -5.140 -3.584
210 1HG PRO 29 1HG PRO 29 7.739 -6.209 -0.799
211 2HG PRO 29 2HG PRO 29 9.015 -5.870 -1.984
212 1HD PRO 29 1HD PRO 29 8.429 -4.182 0.051
213 2HD PRO 29 2HD PRO 29 9.012 -3.611 -1.526
214 H LYS 30 H LYS 30 3.629 -3.836 -2.497
215 HA LYS 30 HA LYS 30 2.460 -4.713 -0.162
216 1HB LYS 30 1HB LYS 30 1.169 -3.426 -1.702
217 2HB LYS 30 2HB LYS 30 1.376 -4.620 -2.976
218 1HG LYS 30 1HG LYS 30 0.137 -6.194 -1.298
219 2HG LYS 30 2HG LYS 30 -0.423 -4.671 -0.603
220 1HD LYS 30 1HD LYS 30 -0.951 -4.124 -3.136
221 2HD LYS 30 2HD LYS 30 -1.008 -5.884 -3.257
222 1HE LYS 30 1HE LYS 30 -3.209 -5.309 -2.780
223 2HE LYS 30 2HE LYS 30 -2.559 -5.757 -1.204
224 1HZ LYS 30 1HZ LYS 30 -3.367 -3.139 -2.206
225 2HZ LYS 30 2HZ LYS 30 -2.031 -3.180 -1.170
226 3HZ LYS 30 3HZ LYS 30 -3.519 -3.798 -0.655
227 HA PRO 31 HA PRO 31 2.776 -9.104 -0.190
228 1HB PRO 31 1HB PRO 31 0.698 -9.694 1.454
229 2HB PRO 31 2HB PRO 31 2.219 -9.008 2.036
230 1HG PRO 31 1HG PRO 31 -0.379 -7.637 1.463
231 2HG PRO 31 2HG PRO 31 0.725 -7.414 2.832
232 1HD PRO 31 1HD PRO 31 0.657 -5.717 0.723
233 2HD PRO 31 2HD PRO 31 2.147 -6.058 1.626
Start of MODEL 12
1 1H GLY 0 1H GLY 0 -17.152 -4.029 8.209
2 1HA GLY 0 1HA GLY 0 -19.673 -2.642 8.389
3 2HA GLY 0 2HA GLY 0 -18.087 -1.978 8.753
4 H HIS 1 H HIS 1 -20.253 -0.736 7.280
5 HA HIS 1 HA HIS 1 -20.270 -0.702 4.608
6 1HB HIS 1 1HB HIS 1 -19.988 1.746 6.362
7 2HB HIS 1 2HB HIS 1 -20.521 1.771 4.684
8 HD1 HIS 1 HD1 HIS 1 -22.469 2.921 6.574
9 HD2 HIS 1 HD2 HIS 1 -22.331 -1.161 5.813
10 HE1 HIS 1 HE1 HIS 1 -24.740 2.042 7.201
11 H MET 2 H MET 2 -17.884 1.266 6.394
12 HA MET 2 HA MET 2 -16.304 1.886 4.169
13 1HB MET 2 1HB MET 2 -14.816 2.852 5.656
14 2HB MET 2 2HB MET 2 -16.308 2.864 6.587
15 1HG MET 2 1HG MET 2 -13.968 1.007 6.862
16 2HG MET 2 2HG MET 2 -14.603 2.147 8.045
17 1HE MET 2 1HE MET 2 -16.971 0.448 10.056
18 2HE MET 2 2HE MET 2 -15.246 0.122 10.231
19 3HE MET 2 3HE MET 2 -15.796 1.724 9.734
20 H VAL 3 H VAL 3 -13.904 1.225 4.060
21 HA VAL 3 HA VAL 3 -13.776 -1.715 4.182
22 HB VAL 3 HB VAL 3 -12.151 -1.619 2.365
23 1HG1 VAL 3 1HG1 VAL 3 -14.296 0.091 1.271
24 2HG1 VAL 3 2HG1 VAL 3 -13.723 -1.492 0.742
25 3HG1 VAL 3 3HG1 VAL 3 -14.811 -1.363 2.124
26 1HG2 VAL 3 1HG2 VAL 3 -12.127 0.758 1.192
27 2HG2 VAL 3 2HG2 VAL 3 -12.374 1.304 2.851
28 3HG2 VAL 3 3HG2 VAL 3 -10.962 0.328 2.445
29 H ILE 4 H ILE 4 -12.795 -2.137 6.093
30 HA ILE 4 HA ILE 4 -10.408 -0.632 6.848
31 HB ILE 4 HB ILE 4 -10.598 -2.283 8.887
32 1HG1 ILE 4 1HG1 ILE 4 -13.483 -2.195 8.014
33 2HG1 ILE 4 2HG1 ILE 4 -12.438 -3.567 7.655
34 1HG2 ILE 4 1HG2 ILE 4 -12.332 0.105 8.327
35 2HG2 ILE 4 2HG2 ILE 4 -12.285 -0.677 9.905
36 3HG2 ILE 4 3HG2 ILE 4 -10.819 0.032 9.230
37 1HD1 ILE 4 1HD1 ILE 4 -12.198 -2.973 10.417
38 2HD1 ILE 4 2HD1 ILE 4 -13.911 -3.037 10.005
39 3HD1 ILE 4 3HD1 ILE 4 -12.866 -4.412 9.647
40 H GLY 5 H GLY 5 -9.756 -1.950 4.660
41 1HA GLY 5 1HA GLY 5 -8.564 -4.515 5.453
42 2HA GLY 5 2HA GLY 5 -8.762 -3.941 3.803
43 H THR 6 H THR 6 -7.714 -1.265 5.122
44 HA THR 6 HA THR 6 -5.294 -1.038 4.004
45 HB THR 6 HB THR 6 -4.608 0.484 5.888
46 HG1 THR 6 1HG THR 6 -5.617 -0.435 7.645
47 1HG2 THR 6 1HG2 THR 6 -6.980 0.687 4.196
48 2HG2 THR 6 2HG2 THR 6 -5.687 1.854 4.477
49 3HG2 THR 6 3HG2 THR 6 -7.036 1.742 5.607
50 H TRP 7 H TRP 7 -3.268 -1.791 4.228
51 HA TRP 7 HA TRP 7 -2.792 -3.738 6.375
52 1HB TRP 7 1HB TRP 7 -0.816 -4.379 4.841
53 2HB TRP 7 2HB TRP 7 -2.442 -4.815 4.325
54 HD1 TRP 7 1HD TRP 7 -3.573 -2.959 2.507
55 HE1 TRP 7 1HE TRP 7 -2.408 -1.807 0.522
56 HE3 TRP 7 3HE TRP 7 1.290 -3.552 3.964
57 HZ2 TRP 7 2HZ TRP 7 0.225 -1.227 -0.316
58 HZ3 TRP 7 3HZ TRP 7 3.073 -2.671 2.515
59 HH2 TRP 7 2HH TRP 7 2.549 -1.534 0.419
60 H ASP 8 H ASP 8 -1.081 -3.561 7.755
61 HA ASP 8 HA ASP 8 0.302 -0.979 7.751
62 1HB ASP 8 1HB ASP 8 0.506 -2.942 10.001
63 2HB ASP 8 2HB ASP 8 0.540 -1.181 10.048
64 H CYS 9 H CYS 9 2.456 -0.779 7.500
65 HA CYS 9 HA CYS 9 3.942 -2.843 6.313
66 1HB CYS 9 1HB CYS 9 4.272 -0.231 6.327
67 2HB CYS 9 2HB CYS 9 5.312 -0.576 7.705
68 H ASP 10 H ASP 10 6.168 -3.497 7.195
69 HA ASP 10 HA ASP 10 5.997 -4.102 10.068
70 1HB ASP 10 1HB ASP 10 5.399 -6.020 8.377
71 2HB ASP 10 2HB ASP 10 7.146 -6.116 8.174
72 H THR 11 H THR 11 7.632 -2.447 7.879
73 HA THR 11 HA THR 11 10.237 -2.955 9.165
74 HB THR 11 HB THR 11 9.617 -2.411 6.277
75 HG1 THR 11 1HG THR 11 11.283 -4.113 6.142
76 1HG2 THR 11 1HG2 THR 11 12.045 -1.980 5.941
77 2HG2 THR 11 2HG2 THR 11 12.230 -1.877 7.693
78 3HG2 THR 11 3HG3 THR 11 11.225 -0.705 6.841
79 H CYS 12 H CYS 12 8.583 -0.484 7.186
80 HA CYS 12 HA CYS 12 10.000 1.623 8.592
81 1HB CYS 12 1HB CYS 12 9.384 3.024 6.875
82 2HB CYS 12 2HB CYS 12 9.338 1.476 6.037
83 H LEU 13 H LEU 13 6.985 0.009 8.758
84 HA LEU 13 HA LEU 13 5.259 0.190 10.236
85 1HB LEU 13 1HB LEU 13 6.524 2.602 11.474
86 2HB LEU 13 2HB LEU 13 5.510 1.370 12.224
87 HG LEU 13 HG LEU 13 8.396 1.076 11.398
88 1HD1 LEU 13 1HD1 LEU 13 7.115 1.967 13.799
89 2HD1 LEU 13 2HD1 LEU 13 8.835 1.840 13.431
90 3HD1 LEU 13 3HD1 LEU 13 7.973 0.457 14.103
91 1HD2 LEU 13 1HD2 LEU 13 6.999 -1.004 12.977
92 2HD2 LEU 13 2HD2 LEU 13 8.308 -1.155 11.804
93 3HD2 LEU 13 3HD2 LEU 13 6.648 -0.933 11.251
94 H VAL 14 H VAL 14 4.181 0.874 8.217
95 HA VAL 14 HA VAL 14 2.864 3.429 8.633
96 HB VAL 14 HB VAL 14 4.326 2.803 6.065
97 1HG1 VAL 14 1HG1 VAL 14 3.397 5.220 5.579
98 2HG1 VAL 14 2HG1 VAL 14 2.433 3.784 5.228
99 3HG1 VAL 14 3HG1 VAL 14 2.132 4.712 6.697
100 1HG2 VAL 14 1HG2 VAL 14 5.641 3.764 7.976
101 2HG2 VAL 14 2HG2 VAL 14 5.630 4.746 6.511
102 3HG2 VAL 14 3HG2 VAL 14 4.611 5.191 7.879
103 H GLN 15 H GLN 15 0.758 3.321 8.130
104 HA GLN 15 HA GLN 15 -0.288 0.827 7.111
105 1HB GLN 15 1HB GLN 15 -1.633 3.342 8.104
106 2HB GLN 15 2HB GLN 15 -2.509 1.924 7.546
107 1HG GLN 15 1HG GLN 15 -2.381 1.942 9.955
108 2HG GLN 15 2HG GLN 15 -1.460 0.587 9.303
109 1HE2 GLN 15 2HE2 GLN 15 -1.375 3.442 11.166
110 2HE2 GLN 15 1HE2 GLN 15 0.308 3.414 11.554
111 H ASN 16 H ASN 16 -1.614 0.594 5.282
112 HA ASN 16 HA ASN 16 -1.811 2.827 3.424
113 1HB ASN 16 1HB ASN 16 -0.762 0.277 2.280
114 2HB ASN 16 2HB ASN 16 -0.552 1.932 1.712
115 1HD2 ASN 16 2HD2 ASN 16 0.278 -0.132 4.473
116 2HD2 ASN 16 1HD2 ASN 16 1.872 0.500 4.683
117 H LYS 17 H LYS 17 -3.231 2.357 1.593
118 HA LYS 17 HA LYS 17 -5.506 0.817 2.434
119 1HB LYS 17 1HB LYS 17 -6.657 1.793 0.634
120 2HB LYS 17 2HB LYS 17 -5.535 3.039 1.163
121 1HG LYS 17 1HG LYS 17 -4.099 2.661 -0.675
122 2HG LYS 17 2HG LYS 17 -4.930 1.165 -1.106
123 1HD LYS 17 1HD LYS 17 -5.599 2.906 -2.633
124 2HD LYS 17 2HD LYS 17 -6.966 2.491 -1.598
125 1HE LYS 17 1HE LYS 17 -6.587 4.439 -0.235
126 2HE LYS 17 2HE LYS 17 -5.104 4.812 -1.112
127 1HZ LYS 17 1HZ LYS 17 -7.890 5.183 -1.927
128 2HZ LYS 17 2HZ LYS 17 -6.760 4.821 -3.131
129 3HZ LYS 17 3HZ LYS 17 -6.553 6.192 -2.163
130 HA PRO 18 HA PRO 18 -4.666 -2.973 0.376
131 1HB PRO 18 1HB PRO 18 -7.195 -3.810 -0.149
132 2HB PRO 18 2HB PRO 18 -6.497 -3.820 1.475
133 1HG PRO 18 1HG PRO 18 -8.339 -1.824 0.217
134 2HG PRO 18 2HG PRO 18 -8.381 -2.510 1.851
135 1HD PRO 18 1HD PRO 18 -7.376 -0.051 1.331
136 2HD PRO 18 2HD PRO 18 -6.746 -1.085 2.630
137 H GLU 19 H GLU 19 -6.128 -0.336 -1.186
138 HA GLU 19 HA GLU 19 -6.414 -1.661 -3.753
139 1HB GLU 19 1HB GLU 19 -6.598 1.306 -3.391
140 2HB GLU 19 2HB GLU 19 -7.474 0.265 -4.505
141 1HG GLU 19 1HG GLU 19 -7.904 0.447 -1.532
142 2HG GLU 19 2HG GLU 19 -8.943 1.125 -2.782
143 H ALA 20 H ALA 20 -3.912 -0.341 -2.011
144 HA ALA 20 HA ALA 20 -2.485 0.823 -4.251
145 1HB ALA 20 1HB ALA 20 -1.560 0.325 -1.424
146 2HB ALA 20 2HB ALA 20 -0.726 1.293 -2.640
147 3HB ALA 20 3HB ALA 20 -2.291 1.816 -2.017
148 H ILE 21 H ILE 21 -0.124 0.117 -4.517
149 HA ILE 21 HA ILE 21 -0.071 -2.822 -4.684
150 HB ILE 21 HB ILE 21 0.053 -1.929 -6.876
151 1HG1 ILE 21 1HG1 ILE 21 2.264 -2.647 -7.635
152 2HG1 ILE 21 2HG1 ILE 21 2.889 -2.510 -5.994
153 1HG2 ILE 21 1HG2 ILE 21 1.486 0.210 -5.572
154 2HG2 ILE 21 2HG2 ILE 21 2.326 -0.333 -7.024
155 3HG2 ILE 21 3HG2 ILE 21 0.648 0.199 -7.124
156 1HD1 ILE 21 1HD1 ILE 21 0.918 -4.499 -7.067
157 2HD1 ILE 21 2HD1 ILE 21 2.511 -4.797 -6.372
158 3HD1 ILE 21 3HD1 ILE 21 1.187 -4.254 -5.342
159 H LYS 22 H LYS 22 1.380 -0.114 -3.222
160 HA LYS 22 HA LYS 22 3.242 -1.787 -1.805
161 1HB LYS 22 1HB LYS 22 5.171 -0.177 -2.407
162 2HB LYS 22 2HB LYS 22 4.741 -1.436 -3.557
163 1HG LYS 22 1HG LYS 22 4.927 0.361 -4.950
164 2HG LYS 22 2HG LYS 22 3.207 0.437 -4.561
165 1HD LYS 22 1HD LYS 22 3.639 2.120 -2.866
166 2HD LYS 22 2HD LYS 22 5.376 2.004 -3.162
167 1HE LYS 22 1HE LYS 22 4.660 3.917 -4.335
168 2HE LYS 22 2HE LYS 22 4.865 2.662 -5.557
169 1HZ LYS 22 1HZ LYS 22 2.459 4.007 -4.677
170 2HZ LYS 22 2HZ LYS 22 2.298 2.337 -4.889
171 3HZ LYS 22 3HZ LYS 22 2.823 3.305 -6.172
172 H CYS 23 H CYS 23 4.533 -0.441 -0.202
173 HA CYS 23 HA CYS 23 2.820 1.020 1.420
174 1HB CYS 23 1HB CYS 23 5.212 -0.039 1.837
175 2HB CYS 23 2HB CYS 23 5.746 1.608 1.515
176 H VAL 24 H VAL 24 2.978 3.297 2.073
177 HA VAL 24 HA VAL 24 3.454 5.026 -0.264
178 HB VAL 24 HB VAL 24 1.093 4.792 0.787
179 1HG1 VAL 24 1HG1 VAL 24 2.212 5.284 3.107
180 2HG1 VAL 24 2HG1 VAL 24 1.995 6.967 2.617
181 3HG1 VAL 24 3HG1 VAL 24 0.599 5.895 2.740
182 1HG2 VAL 24 1HG2 VAL 24 2.431 7.412 0.157
183 2HG2 VAL 24 2HG2 VAL 24 1.477 6.391 -0.918
184 3HG2 VAL 24 2HG3 VAL 24 0.691 7.259 0.401
185 H ALA 25 H ALA 25 5.334 4.150 1.938
186 HA ALA 25 HA ALA 25 6.306 6.838 2.574
187 1HB ALA 25 1HB ALA 25 5.626 6.603 4.691
188 2HB ALA 25 2HB ALA 25 5.348 4.871 4.506
189 3HB ALA 25 3HB ALA 25 6.970 5.472 4.852
190 H CYS 26 H CYS 26 6.985 3.354 2.638
191 HA CYS 26 HA CYS 26 9.827 3.962 2.172
192 1HB CYS 26 1HB CYS 26 10.384 1.874 3.143
193 2HB CYS 26 2HB CYS 26 9.152 2.566 4.192
194 H GLU 27 H GLU 27 7.009 2.812 0.700
195 HA GLU 27 HA GLU 27 6.598 2.082 -1.421
196 1HB GLU 27 1HB GLU 27 9.544 2.065 -2.009
197 2HB GLU 27 2HB GLU 27 8.203 2.346 -3.110
198 1HG GLU 27 1HG GLU 27 7.967 4.531 -2.498
199 2HG GLU 27 2HG GLU 27 8.623 4.265 -0.883
200 H THR 28 H THR 28 6.703 0.235 0.579
201 HA THR 28 HA THR 28 8.395 -1.981 -0.146
202 HB THR 28 HB THR 28 6.818 -1.274 2.118
203 HG1 THR 28 1HG THR 28 8.018 -3.555 2.565
204 1HG2 THR 28 1HG2 THR 28 6.228 -4.056 1.103
205 2HG2 THR 28 2HG2 THR 28 5.078 -2.718 1.087
206 3HG2 THR 28 3HG2 THR 28 5.682 -3.343 2.620
207 HA PRO 29 HA PRO 29 5.760 -3.900 -3.102
208 1HB PRO 29 1HB PRO 29 6.567 -6.476 -2.817
209 2HB PRO 29 2HB PRO 29 7.554 -5.244 -3.611
210 1HG PRO 29 1HG PRO 29 7.727 -6.295 -0.814
211 2HG PRO 29 2HG PRO 29 9.034 -5.945 -1.961
212 1HD PRO 29 1HD PRO 29 8.363 -4.254 0.045
213 2HD PRO 29 2HD PRO 29 8.987 -3.684 -1.517
214 H LYS 30 H LYS 30 3.640 -4.025 -2.686
215 HA LYS 30 HA LYS 30 2.418 -4.908 -0.364
216 1HB LYS 30 1HB LYS 30 1.157 -3.615 -1.925
217 2HB LYS 30 2HB LYS 30 1.405 -4.797 -3.204
218 1HG LYS 30 1HG LYS 30 0.137 -6.390 -1.557
219 2HG LYS 30 2HG LYS 30 -0.460 -4.871 -0.886
220 1HD LYS 30 1HD LYS 30 -0.840 -4.403 -3.509
221 2HD LYS 30 2HD LYS 30 -1.030 -6.159 -3.482
222 1HE LYS 30 1HE LYS 30 -2.884 -6.067 -2.109
223 2HE LYS 30 2HE LYS 30 -2.448 -4.490 -1.451
224 1HZ LYS 30 1HZ LYS 30 -3.566 -3.446 -3.050
225 2HZ LYS 30 2HZ LYS 30 -4.295 -4.935 -3.384
226 3HZ LYS 30 3HZ LYS 30 -2.949 -4.435 -4.277
227 HA PRO 31 HA PRO 31 2.771 -9.296 -0.431
228 1HB PRO 31 1HB PRO 31 0.658 -9.920 1.155
229 2HB PRO 31 2HB PRO 31 2.159 -9.229 1.782
230 1HG PRO 31 1HG PRO 31 -0.436 -7.872 1.158
231 2HG PRO 31 2HG PRO 31 0.633 -7.654 2.556
232 1HD PRO 31 1HD PRO 31 0.603 -5.936 0.464
233 2HD PRO 31 2HD PRO 31 2.072 -6.276 1.401
Start of MODEL 13
1 1H GLY 0 1H GLY 0 -14.080 11.459 3.962
2 1HA GLY 0 1HA GLY 0 -12.174 11.569 1.819
3 2HA GLY 0 2HA GLY 0 -11.861 11.043 3.466
4 H HIS 1 H HIS 1 -13.198 8.876 3.926
5 HA HIS 1 HA HIS 1 -13.173 7.065 1.664
6 1HB HIS 1 1HB HIS 1 -11.594 5.487 2.724
7 2HB HIS 1 2HB HIS 1 -10.826 7.019 2.320
8 HD1 HIS 1 HD1 HIS 1 -10.914 4.651 4.935
9 HD2 HIS 1 HD2 HIS 1 -10.919 8.803 4.803
10 HE1 HIS 1 HE1 HIS 1 -10.150 5.397 7.212
11 H MET 2 H MET 2 -14.670 5.513 1.894
12 HA MET 2 HA MET 2 -15.746 5.027 4.593
13 1HB MET 2 1HB MET 2 -17.164 6.400 2.868
14 2HB MET 2 2HB MET 2 -17.482 4.822 2.162
15 1HG MET 2 1HG MET 2 -19.274 5.230 3.609
16 2HG MET 2 2HG MET 2 -18.233 4.094 4.463
17 1HE MET 2 1HE MET 2 -20.173 7.423 4.803
18 2HE MET 2 2HE MET 2 -18.956 8.507 5.476
19 3HE MET 2 3HE MET 2 -18.765 7.872 3.841
20 H VAL 3 H VAL 3 -14.302 3.204 4.681
21 HA VAL 3 HA VAL 3 -15.526 0.775 3.942
22 HB VAL 3 HB VAL 3 -14.762 1.184 1.709
23 1HG1 VAL 3 1HG1 VAL 3 -12.513 1.722 1.117
24 2HG1 VAL 3 2HG1 VAL 3 -13.025 2.861 2.365
25 3HG1 VAL 3 3HG1 VAL 3 -11.966 1.512 2.780
26 1HG2 VAL 3 1HG2 VAL 3 -14.549 -1.107 2.478
27 2HG2 VAL 3 2HG2 VAL 3 -13.235 -0.718 1.367
28 3HG2 VAL 3 3HG2 VAL 3 -12.934 -0.771 3.104
29 H ILE 4 H ILE 4 -14.391 -1.080 4.734
30 HA ILE 4 HA ILE 4 -12.367 -0.376 6.748
31 HB ILE 4 HB ILE 4 -14.378 -2.610 6.626
32 1HG1 ILE 4 1HG1 ILE 4 -13.785 -0.725 8.901
33 2HG1 ILE 4 2HG1 ILE 4 -14.872 -0.276 7.591
34 1HG2 ILE 4 1HG2 ILE 4 -12.797 -3.930 7.518
35 2HG2 ILE 4 2HG2 ILE 4 -11.754 -2.570 7.929
36 3HG2 ILE 4 3HG2 ILE 4 -13.094 -3.005 8.990
37 1HD1 ILE 4 1HD1 ILE 4 -16.118 -2.441 8.152
38 2HD1 ILE 4 2HD1 ILE 4 -15.204 -2.408 9.660
39 3HD1 ILE 4 3HD1 ILE 4 -16.281 -1.073 9.252
40 H GLY 5 H GLY 5 -10.463 -0.566 5.634
41 1HA GLY 5 1HA GLY 5 -9.392 -3.162 5.286
42 2HA GLY 5 2HA GLY 5 -9.818 -2.486 3.720
43 H THR 6 H THR 6 -7.259 -3.030 5.503
44 HA THR 6 HA THR 6 -5.583 -1.211 4.194
45 HB THR 6 HB THR 6 -4.895 -0.069 6.512
46 HG1 THR 6 1HG THR 6 -6.556 -0.927 7.752
47 1HG2 THR 6 1HG2 THR 6 -5.350 1.732 5.282
48 2HG2 THR 6 2HG2 THR 6 -7.079 1.484 5.518
49 3HG2 THR 6 3HG2 THR 6 -6.255 0.717 4.161
50 H TRP 7 H TRP 7 -3.392 -1.594 4.607
51 HA TRP 7 HA TRP 7 -2.839 -3.768 6.520
52 1HB TRP 7 1HB TRP 7 -1.035 -4.475 4.872
53 2HB TRP 7 2HB TRP 7 -2.698 -4.771 4.374
54 HD1 TRP 7 1HD TRP 7 -3.731 -2.818 2.628
55 HE1 TRP 7 1HE TRP 7 -2.524 -1.646 0.680
56 HE3 TRP 7 3HE TRP 7 1.109 -3.686 4.028
57 HZ2 TRP 7 2HZ TRP 7 0.127 -1.155 -0.154
58 HZ3 TRP 7 3HZ TRP 7 2.921 -2.832 2.600
59 HH2 TRP 7 2HH TRP 7 2.438 -1.593 0.552
60 H ASP 8 H ASP 8 -1.096 -3.542 7.822
61 HA ASP 8 HA ASP 8 0.307 -0.980 7.704
62 1HB ASP 8 1HB ASP 8 0.536 -3.008 9.917
63 2HB ASP 8 2HB ASP 8 0.826 -1.272 9.987
64 H CYS 9 H CYS 9 2.546 -0.800 7.685
65 HA CYS 9 HA CYS 9 3.929 -2.826 6.241
66 1HB CYS 9 1HB CYS 9 4.298 -0.246 6.263
67 2HB CYS 9 2HB CYS 9 5.318 -0.573 7.660
68 H ASP 10 H ASP 10 6.211 -3.480 7.027
69 HA ASP 10 HA ASP 10 6.115 -4.222 9.872
70 1HB ASP 10 1HB ASP 10 7.191 -6.097 7.780
71 2HB ASP 10 2HB ASP 10 6.708 -6.454 9.436
72 H THR 11 H THR 11 7.722 -2.567 7.572
73 HA THR 11 HA THR 11 10.347 -3.045 8.830
74 HB THR 11 HB THR 11 9.615 -2.476 5.988
75 HG1 THR 11 1HG THR 11 11.444 -3.996 5.780
76 1HG2 THR 11 1HG2 THR 11 11.963 -1.791 5.553
77 2HG2 THR 11 2HG2 THR 11 12.220 -1.688 7.295
78 3HG2 THR 11 3HG3 THR 11 11.063 -0.615 6.509
79 H CYS 12 H CYS 12 8.448 -0.536 7.150
80 HA CYS 12 HA CYS 12 9.905 1.521 8.637
81 1HB CYS 12 1HB CYS 12 9.354 3.009 6.972
82 2HB CYS 12 2HB CYS 12 9.356 1.509 6.050
83 H LEU 13 H LEU 13 7.039 -0.229 8.800
84 HA LEU 13 HA LEU 13 5.196 -0.099 10.125
85 1HB LEU 13 1HB LEU 13 6.408 2.218 11.578
86 2HB LEU 13 2HB LEU 13 5.381 0.927 12.201
87 HG LEU 13 HG LEU 13 8.164 0.354 11.244
88 1HD1 LEU 13 1HD1 LEU 13 7.861 0.677 14.125
89 2HD1 LEU 13 2HD1 LEU 13 7.685 2.185 13.227
90 3HD1 LEU 13 3HD1 LEU 13 9.150 1.219 13.050
91 1HD2 LEU 13 1HD2 LEU 13 7.218 -1.669 11.639
92 2HD2 LEU 13 2HD2 LEU 13 6.046 -1.023 12.788
93 3HD2 LEU 13 3HD2 LEU 13 7.716 -1.297 13.290
94 H VAL 14 H VAL 14 3.987 0.657 8.307
95 HA VAL 14 HA VAL 14 2.747 3.214 8.802
96 HB VAL 14 HB VAL 14 4.268 2.729 6.242
97 1HG1 VAL 14 1HG1 VAL 14 3.290 4.820 5.425
98 2HG1 VAL 14 2HG1 VAL 14 2.052 3.595 5.713
99 3HG1 VAL 14 3HG1 VAL 14 2.280 4.910 6.868
100 1HG2 VAL 14 1HG2 VAL 14 5.298 4.911 6.813
101 2HG2 VAL 14 2HG2 VAL 14 4.423 4.888 8.344
102 3HG2 VAL 14 3HG2 VAL 14 5.633 3.653 8.001
103 H GLN 15 H GLN 15 0.654 3.231 8.167
104 HA GLN 15 HA GLN 15 -0.431 0.774 7.096
105 1HB GLN 15 1HB GLN 15 -1.808 3.322 7.960
106 2HB GLN 15 2HB GLN 15 -2.621 1.824 7.528
107 1HG GLN 15 1HG GLN 15 -1.615 0.690 9.405
108 2HG GLN 15 2HG GLN 15 -0.682 2.131 9.808
109 1HE2 GLN 15 2HE2 GLN 15 -2.175 1.072 11.744
110 2HE2 GLN 15 1HE2 GLN 15 -3.569 2.042 12.061
111 H ASN 16 H ASN 16 -1.597 0.552 5.189
112 HA ASN 16 HA ASN 16 -1.695 2.819 3.354
113 1HB ASN 16 1HB ASN 16 -0.681 0.246 2.233
114 2HB ASN 16 2HB ASN 16 -0.395 1.896 1.687
115 1HD2 ASN 16 2HD2 ASN 16 0.242 -0.189 4.485
116 2HD2 ASN 16 1HD2 ASN 16 1.851 0.380 4.756
117 H LYS 17 H LYS 17 -3.212 2.589 1.665
118 HA LYS 17 HA LYS 17 -5.522 1.108 2.343
119 1HB LYS 17 1HB LYS 17 -6.538 2.101 0.484
120 2HB LYS 17 2HB LYS 17 -5.333 3.282 0.978
121 1HG LYS 17 1HG LYS 17 -3.891 2.694 -0.801
122 2HG LYS 17 2HG LYS 17 -4.835 1.252 -1.181
123 1HD LYS 17 1HD LYS 17 -5.323 2.965 -2.805
124 2HD LYS 17 2HD LYS 17 -6.742 2.719 -1.784
125 1HE LYS 17 1HE LYS 17 -4.722 4.847 -1.160
126 2HE LYS 17 2HE LYS 17 -6.014 5.130 -2.325
127 1HZ LYS 17 1HZ LYS 17 -7.149 4.001 -0.037
128 2HZ LYS 17 2HZ LYS 17 -7.370 5.561 -0.650
129 3HZ LYS 17 3HZ LYS 17 -6.139 5.259 0.471
130 HA PRO 18 HA PRO 18 -4.765 -2.803 0.480
131 1HB PRO 18 1HB PRO 18 -7.319 -3.574 -0.024
132 2HB PRO 18 2HB PRO 18 -6.629 -3.539 1.603
133 1HG PRO 18 1HG PRO 18 -8.396 -1.536 0.251
134 2HG PRO 18 2HG PRO 18 -8.469 -2.152 1.913
135 1HD PRO 18 1HD PRO 18 -7.377 0.248 1.294
136 2HD PRO 18 2HD PRO 18 -6.789 -0.751 2.639
137 H GLU 19 H GLU 19 -6.147 -0.191 -1.200
138 HA GLU 19 HA GLU 19 -6.457 -1.614 -3.711
139 1HB GLU 19 1HB GLU 19 -6.549 1.368 -3.492
140 2HB GLU 19 2HB GLU 19 -7.469 0.299 -4.543
141 1HG GLU 19 1HG GLU 19 -8.524 -0.527 -2.309
142 2HG GLU 19 2HG GLU 19 -7.942 1.017 -1.691
143 H ALA 20 H ALA 20 -3.922 -0.301 -2.013
144 HA ALA 20 HA ALA 20 -2.452 0.711 -4.301
145 1HB ALA 20 1HB ALA 20 -2.212 1.866 -2.184
146 2HB ALA 20 2HB ALA 20 -1.632 0.386 -1.417
147 3HB ALA 20 3HB ALA 20 -0.668 1.165 -2.671
148 H ILE 21 H ILE 21 -0.096 -0.065 -4.477
149 HA ILE 21 HA ILE 21 -0.099 -3.013 -4.425
150 HB ILE 21 HB ILE 21 1.105 -1.077 -6.383
151 1HG1 ILE 21 1HG1 ILE 21 0.019 -2.907 -7.918
152 2HG1 ILE 21 2HG1 ILE 21 -0.876 -3.326 -6.461
153 1HG2 ILE 21 1HG2 ILE 21 1.926 -3.903 -5.814
154 2HG2 ILE 21 2HG2 ILE 21 2.121 -3.196 -7.416
155 3HG2 ILE 21 3HG2 ILE 21 2.938 -2.476 -6.029
156 1HD1 ILE 21 1HD1 ILE 21 -0.988 -0.845 -8.105
157 2HD1 ILE 21 2HD1 ILE 21 -2.300 -1.855 -7.496
158 3HD1 ILE 21 3HD1 ILE 21 -1.426 -0.788 -6.398
159 H LYS 22 H LYS 22 1.400 -0.210 -3.238
160 HA LYS 22 HA LYS 22 3.384 -1.806 -1.852
161 1HB LYS 22 1HB LYS 22 5.195 -0.125 -2.492
162 2HB LYS 22 2HB LYS 22 4.728 -1.295 -3.720
163 1HG LYS 22 1HG LYS 22 4.778 0.616 -4.962
164 2HG LYS 22 2HG LYS 22 3.086 0.611 -4.461
165 1HD LYS 22 1HD LYS 22 3.580 2.163 -2.667
166 2HD LYS 22 2HD LYS 22 5.300 2.108 -3.059
167 1HE LYS 22 1HE LYS 22 4.509 4.092 -4.039
168 2HE LYS 22 2HE LYS 22 4.638 2.942 -5.369
169 1HZ LYS 22 1HZ LYS 22 2.555 4.261 -5.355
170 2HZ LYS 22 2HZ LYS 22 2.116 3.502 -3.909
171 3HZ LYS 22 3HZ LYS 22 2.297 2.589 -5.322
172 H CYS 23 H CYS 23 4.717 -0.288 -0.360
173 HA CYS 23 HA CYS 23 2.893 1.050 1.329
174 1HB CYS 23 1HB CYS 23 5.267 -0.036 1.782
175 2HB CYS 23 2HB CYS 23 5.819 1.614 1.512
176 H VAL 24 H VAL 24 2.895 3.290 1.958
177 HA VAL 24 HA VAL 24 3.481 5.065 -0.311
178 HB VAL 24 HB VAL 24 1.121 4.950 0.468
179 1HG1 VAL 24 1HG1 VAL 24 2.334 6.034 2.998
180 2HG1 VAL 24 2HG1 VAL 24 0.621 6.203 2.609
181 3HG1 VAL 24 3HG1 VAL 24 1.330 4.599 2.797
182 1HG2 VAL 24 1HG2 VAL 24 2.625 7.161 -0.242
183 2HG2 VAL 24 2HG2 VAL 24 0.865 7.048 -0.245
184 3HG2 VAL 24 2HG3 VAL 24 1.703 7.706 1.159
185 H ALA 25 H ALA 25 5.246 4.123 2.030
186 HA ALA 25 HA ALA 25 6.237 6.808 2.698
187 1HB ALA 25 1HB ALA 25 6.910 5.695 4.956
188 2HB ALA 25 2HB ALA 25 5.270 6.303 4.728
189 3HB ALA 25 3HB ALA 25 5.600 4.577 4.578
190 H CYS 26 H CYS 26 6.963 3.332 2.626
191 HA CYS 26 HA CYS 26 9.790 4.002 2.150
192 1HB CYS 26 1HB CYS 26 10.400 1.906 3.079
193 2HB CYS 26 2HB CYS 26 9.185 2.572 4.163
194 H GLU 27 H GLU 27 6.982 2.865 0.682
195 HA GLU 27 HA GLU 27 6.557 2.152 -1.442
196 1HB GLU 27 1HB GLU 27 9.511 2.194 -2.018
197 2HB GLU 27 2HB GLU 27 8.175 2.406 -3.142
198 1HG GLU 27 1HG GLU 27 8.778 4.568 -2.958
199 2HG GLU 27 2HG GLU 27 7.707 4.495 -1.560
200 H THR 28 H THR 28 6.923 0.317 0.672
201 HA THR 28 HA THR 28 8.532 -1.888 -0.189
202 HB THR 28 HB THR 28 6.860 -1.264 2.115
203 HG1 THR 28 1HG THR 28 8.748 -3.316 2.141
204 1HG2 THR 28 1HG2 THR 28 6.780 -4.051 0.966
205 2HG2 THR 28 2HG2 THR 28 5.416 -3.016 1.385
206 3HG2 THR 28 3HG2 THR 28 6.436 -3.686 2.656
207 HA PRO 29 HA PRO 29 5.756 -3.832 -2.996
208 1HB PRO 29 1HB PRO 29 6.613 -6.398 -2.769
209 2HB PRO 29 2HB PRO 29 7.534 -5.147 -3.615
210 1HG PRO 29 1HG PRO 29 7.887 -6.207 -0.837
211 2HG PRO 29 2HG PRO 29 9.119 -5.835 -2.057
212 1HD PRO 29 1HD PRO 29 8.544 -4.160 -0.009
213 2HD PRO 29 2HD PRO 29 9.067 -3.575 -1.602
214 H LYS 30 H LYS 30 3.675 -3.874 -2.342
215 HA LYS 30 HA LYS 30 2.577 -4.770 -0.012
216 1HB LYS 30 1HB LYS 30 1.219 -3.591 -1.591
217 2HB LYS 30 2HB LYS 30 1.435 -4.845 -2.805
218 1HG LYS 30 1HG LYS 30 0.280 -6.372 -1.046
219 2HG LYS 30 2HG LYS 30 -0.288 -4.842 -0.370
220 1HD LYS 30 1HD LYS 30 -0.736 -4.607 -3.103
221 2HD LYS 30 2HD LYS 30 -1.184 -6.272 -2.723
222 1HE LYS 30 1HE LYS 30 -2.749 -5.559 -1.080
223 2HE LYS 30 2HE LYS 30 -2.159 -3.899 -1.148
224 1HZ LYS 30 1HZ LYS 30 -3.594 -3.467 -2.757
225 2HZ LYS 30 2HZ LYS 30 -4.218 -5.034 -2.630
226 3HZ LYS 30 3HZ LYS 30 -2.965 -4.709 -3.720
227 HA PRO 31 HA PRO 31 3.086 -9.142 0.107
228 1HB PRO 31 1HB PRO 31 1.078 -9.756 1.827
229 2HB PRO 31 2HB PRO 31 2.584 -8.987 2.344
230 1HG PRO 31 1HG PRO 31 -0.085 -7.747 1.791
231 2HG PRO 31 2HG PRO 31 1.044 -7.428 3.121
232 1HD PRO 31 1HD PRO 31 0.850 -5.814 0.955
233 2HD PRO 31 2HD PRO 31 2.375 -6.060 1.830
Start of MODEL 14
1 1H GLY 0 1H GLY 0 -23.541 -0.494 -2.342
2 1HA GLY 0 1HA GLY 0 -23.799 -3.315 -2.570
3 2HA GLY 0 2HA GLY 0 -22.591 -2.718 -3.698
4 H HIS 1 H HIS 1 -20.685 -3.293 -2.860
5 HA HIS 1 HA HIS 1 -20.027 -2.294 -0.186
6 1HB HIS 1 1HB HIS 1 -19.788 -5.127 -1.148
7 2HB HIS 1 2HB HIS 1 -18.664 -4.505 0.057
8 HD1 HIS 1 HD1 HIS 1 -19.422 -4.620 2.420
9 HD2 HIS 1 HD2 HIS 1 -22.587 -4.927 -0.253
10 HE1 HIS 1 HE1 HIS 1 -21.446 -5.117 3.828
11 H MET 2 H MET 2 -18.129 -1.267 -0.123
12 HA MET 2 HA MET 2 -16.347 -1.545 -2.449
13 1HB MET 2 1HB MET 2 -16.582 0.769 -0.517
14 2HB MET 2 2HB MET 2 -15.552 0.710 -1.942
15 1HG MET 2 1HG MET 2 -18.554 0.533 -2.013
16 2HG MET 2 2HG MET 2 -17.635 2.020 -2.237
17 1HE MET 2 1HE MET 2 -19.353 1.983 -4.158
18 2HE MET 2 2HE MET 2 -18.893 1.454 -5.777
19 3HE MET 2 3HE MET 2 -19.736 0.346 -4.694
20 H VAL 3 H VAL 3 -14.404 -2.413 -2.152
21 HA VAL 3 HA VAL 3 -13.476 -3.734 -0.012
22 HB VAL 3 HB VAL 3 -11.095 -2.957 -0.800
23 1HG1 VAL 3 1HG1 VAL 3 -11.535 -4.402 -2.951
24 2HG1 VAL 3 2HG1 VAL 3 -11.621 -5.123 -1.343
25 3HG1 VAL 3 3HG1 VAL 3 -13.102 -4.668 -2.187
26 1HG2 VAL 3 1HG2 VAL 3 -12.301 -2.350 -3.397
27 2HG2 VAL 3 2HG2 VAL 3 -12.574 -1.111 -2.171
28 3HG2 VAL 3 3HG2 VAL 3 -10.929 -1.601 -2.579
29 H ILE 4 H ILE 4 -13.722 -2.955 2.021
30 HA ILE 4 HA ILE 4 -12.405 -0.402 2.670
31 HB ILE 4 HB ILE 4 -14.737 -0.299 3.216
32 1HG1 ILE 4 1HG1 ILE 4 -13.297 -0.853 5.812
33 2HG1 ILE 4 2HG1 ILE 4 -13.011 0.594 4.850
34 1HG2 ILE 4 1HG2 ILE 4 -15.841 -2.185 3.619
35 2HG2 ILE 4 2HG2 ILE 4 -14.343 -3.056 3.943
36 3HG2 ILE 4 3HG2 ILE 4 -15.149 -2.175 5.240
37 1HD1 ILE 4 1HD1 ILE 4 -14.702 1.567 5.881
38 2HD1 ILE 4 2HD1 ILE 4 -15.797 0.371 5.187
39 3HD1 ILE 4 3HD1 ILE 4 -15.055 0.080 6.760
40 H GLY 5 H GLY 5 -10.348 -0.994 3.172
41 1HA GLY 5 1HA GLY 5 -9.951 -2.348 5.682
42 2HA GLY 5 2HA GLY 5 -9.379 -3.275 4.303
43 H THR 6 H THR 6 -7.290 -3.057 5.412
44 HA THR 6 HA THR 6 -5.626 -1.199 4.166
45 HB THR 6 HB THR 6 -4.995 -0.073 6.518
46 HG1 THR 6 1HG THR 6 -6.872 0.389 7.674
47 1HG2 THR 6 1HG2 THR 6 -6.331 0.720 4.136
48 2HG2 THR 6 2HG2 THR 6 -5.394 1.714 5.251
49 3HG2 THR 6 3HG2 THR 6 -7.127 1.508 5.497
50 H TRP 7 H TRP 7 -3.451 -1.602 4.557
51 HA TRP 7 HA TRP 7 -2.884 -3.743 6.502
52 1HB TRP 7 1HB TRP 7 -1.099 -4.489 4.867
53 2HB TRP 7 2HB TRP 7 -2.762 -4.758 4.352
54 HD1 TRP 7 1HD TRP 7 -3.737 -2.889 2.529
55 HE1 TRP 7 1HE TRP 7 -2.489 -1.713 0.609
56 HE3 TRP 7 3HE TRP 7 1.067 -3.617 4.119
57 HZ2 TRP 7 2HZ TRP 7 0.179 -1.166 -0.132
58 HZ3 TRP 7 3HZ TRP 7 2.909 -2.737 2.746
59 HH2 TRP 7 2HH TRP 7 2.473 -1.538 0.664
60 H ASP 8 H ASP 8 -1.055 -3.560 7.725
61 HA ASP 8 HA ASP 8 0.312 -0.971 7.592
62 1HB ASP 8 1HB ASP 8 0.549 -2.987 9.820
63 2HB ASP 8 2HB ASP 8 0.875 -1.257 9.873
64 H CYS 9 H CYS 9 2.583 -0.813 7.683
65 HA CYS 9 HA CYS 9 3.950 -2.816 6.176
66 1HB CYS 9 1HB CYS 9 4.335 -0.235 6.263
67 2HB CYS 9 2HB CYS 9 5.362 -0.612 7.643
68 H ASP 10 H ASP 10 6.240 -3.474 6.972
69 HA ASP 10 HA ASP 10 6.115 -4.283 9.798
70 1HB ASP 10 1HB ASP 10 5.519 -6.092 7.999
71 2HB ASP 10 2HB ASP 10 7.261 -6.139 7.742
72 H THR 11 H THR 11 7.750 -2.599 7.530
73 HA THR 11 HA THR 11 10.360 -3.104 8.807
74 HB THR 11 HB THR 11 9.687 -2.379 5.971
75 HG1 THR 11 1HG THR 11 11.343 -4.321 7.235
76 1HG2 THR 11 1HG2 THR 11 11.328 -0.822 6.101
77 2HG2 THR 11 2HG2 THR 11 12.378 -2.232 5.967
78 3HG2 THR 11 3HG3 THR 11 12.035 -1.534 7.550
79 H CYS 12 H CYS 12 8.539 -0.551 7.102
80 HA CYS 12 HA CYS 12 9.985 1.478 8.621
81 1HB CYS 12 1HB CYS 12 9.404 2.986 6.985
82 2HB CYS 12 2HB CYS 12 9.389 1.497 6.046
83 H LEU 13 H LEU 13 7.020 -0.196 8.667
84 HA LEU 13 HA LEU 13 5.236 -0.106 10.079
85 1HB LEU 13 1HB LEU 13 6.462 2.203 11.530
86 2HB LEU 13 2HB LEU 13 5.441 0.911 12.157
87 HG LEU 13 HG LEU 13 8.317 0.594 11.296
88 1HD1 LEU 13 1HD1 LEU 13 8.339 0.088 13.918
89 2HD1 LEU 13 2HD1 LEU 13 7.040 1.280 13.873
90 3HD1 LEU 13 3HD1 LEU 13 8.637 1.692 13.248
91 1HD2 LEU 13 1HD2 LEU 13 7.937 -1.589 11.332
92 2HD2 LEU 13 2HD2 LEU 13 6.234 -1.299 11.690
93 3HD2 LEU 13 3HD2 LEU 13 7.396 -1.469 13.007
94 H VAL 14 H VAL 14 4.091 0.687 8.195
95 HA VAL 14 HA VAL 14 2.836 3.243 8.737
96 HB VAL 14 HB VAL 14 4.298 2.732 6.146
97 1HG1 VAL 14 1HG1 VAL 14 2.788 3.975 5.097
98 2HG1 VAL 14 2HG1 VAL 14 1.874 4.170 6.594
99 3HG1 VAL 14 3HG1 VAL 14 3.154 5.313 6.185
100 1HG2 VAL 14 1HG2 VAL 14 5.637 3.625 8.025
101 2HG2 VAL 14 2HG2 VAL 14 5.512 4.751 6.674
102 3HG2 VAL 14 3HG2 VAL 14 4.536 4.999 8.122
103 H GLN 15 H GLN 15 0.739 3.294 8.102
104 HA GLN 15 HA GLN 15 -0.396 0.834 7.100
105 1HB GLN 15 1HB GLN 15 -1.542 3.407 8.147
106 2HB GLN 15 2HB GLN 15 -2.567 2.222 7.351
107 1HG GLN 15 1HG GLN 15 -2.303 0.663 9.030
108 2HG GLN 15 2HG GLN 15 -0.797 1.382 9.599
109 1HE2 GLN 15 2HE2 GLN 15 -1.498 1.492 11.717
110 2HE2 GLN 15 1HE2 GLN 15 -2.696 2.621 12.243
111 H ASN 16 H ASN 16 -1.687 0.633 5.237
112 HA ASN 16 HA ASN 16 -1.700 2.825 3.322
113 1HB ASN 16 1HB ASN 16 -0.742 0.191 2.286
114 2HB ASN 16 2HB ASN 16 -0.448 1.813 1.665
115 1HD2 ASN 16 2HD2 ASN 16 0.234 -0.202 4.500
116 2HD2 ASN 16 1HD2 ASN 16 1.843 0.380 4.739
117 H LYS 17 H LYS 17 -3.187 2.522 1.586
118 HA LYS 17 HA LYS 17 -5.533 1.101 2.345
119 1HB LYS 17 1HB LYS 17 -6.563 2.087 0.483
120 2HB LYS 17 2HB LYS 17 -5.358 3.269 0.978
121 1HG LYS 17 1HG LYS 17 -3.884 2.595 -0.790
122 2HG LYS 17 2HG LYS 17 -4.955 1.261 -1.228
123 1HD LYS 17 1HD LYS 17 -6.710 2.884 -1.805
124 2HD LYS 17 2HD LYS 17 -5.607 4.204 -1.405
125 1HE LYS 17 1HE LYS 17 -4.663 2.174 -3.350
126 2HE LYS 17 2HE LYS 17 -5.916 3.289 -3.890
127 1HZ LYS 17 1HZ LYS 17 -3.820 4.235 -4.415
128 2HZ LYS 17 2HZ LYS 17 -3.226 3.982 -2.851
129 3HZ LYS 17 3HZ LYS 17 -4.446 5.122 -3.117
130 HA PRO 18 HA PRO 18 -4.873 -2.817 0.470
131 1HB PRO 18 1HB PRO 18 -7.437 -3.523 -0.080
132 2HB PRO 18 2HB PRO 18 -6.776 -3.507 1.559
133 1HG PRO 18 1HG PRO 18 -8.466 -1.457 0.177
134 2HG PRO 18 2HG PRO 18 -8.585 -2.071 1.837
135 1HD PRO 18 1HD PRO 18 -7.420 0.299 1.241
136 2HD PRO 18 2HD PRO 18 -6.882 -0.715 2.595
137 H GLU 19 H GLU 19 -6.201 -0.179 -1.232
138 HA GLU 19 HA GLU 19 -6.471 -1.596 -3.750
139 1HB GLU 19 1HB GLU 19 -8.084 0.052 -3.630
140 2HB GLU 19 2HB GLU 19 -7.023 1.180 -2.798
141 1HG GLU 19 1HG GLU 19 -5.793 1.554 -4.877
142 2HG GLU 19 2HG GLU 19 -6.868 0.431 -5.710
143 H ALA 20 H ALA 20 -3.957 -0.317 -2.002
144 HA ALA 20 HA ALA 20 -2.437 0.693 -4.262
145 1HB ALA 20 1HB ALA 20 -2.233 1.839 -2.133
146 2HB ALA 20 2HB ALA 20 -1.668 0.355 -1.366
147 3HB ALA 20 3HB ALA 20 -0.683 1.139 -2.602
148 H ILE 21 H ILE 21 -0.096 -0.103 -4.420
149 HA ILE 21 HA ILE 21 -0.122 -3.049 -4.373
150 HB ILE 21 HB ILE 21 1.426 -1.214 -6.207
151 1HG1 ILE 21 1HG1 ILE 21 -0.089 -2.518 -7.905
152 2HG1 ILE 21 2HG1 ILE 21 -1.117 -2.775 -6.500
153 1HG2 ILE 21 1HG2 ILE 21 2.017 -3.301 -7.394
154 2HG2 ILE 21 2HG2 ILE 21 2.681 -3.222 -5.764
155 3HG2 ILE 21 3HG2 ILE 21 1.265 -4.222 -6.092
156 1HD1 ILE 21 1HD1 ILE 21 -1.308 -0.374 -6.187
157 2HD1 ILE 21 2HD1 ILE 21 -0.247 -0.101 -7.571
158 3HD1 ILE 21 3HD1 ILE 21 -1.828 -0.848 -7.805
159 H LYS 22 H LYS 22 1.501 -0.212 -3.304
160 HA LYS 22 HA LYS 22 3.392 -1.858 -1.815
161 1HB LYS 22 1HB LYS 22 5.258 -0.277 -2.419
162 2HB LYS 22 2HB LYS 22 4.722 -1.331 -3.721
163 1HG LYS 22 1HG LYS 22 3.345 0.536 -4.596
164 2HG LYS 22 2HG LYS 22 4.045 1.579 -3.356
165 1HD LYS 22 1HD LYS 22 5.330 1.976 -5.285
166 2HD LYS 22 2HD LYS 22 6.314 0.896 -4.294
167 1HE LYS 22 1HE LYS 22 6.368 0.174 -6.603
168 2HE LYS 22 2HE LYS 22 5.507 -1.014 -5.624
169 1HZ LYS 22 1HZ LYS 22 3.658 -0.713 -6.795
170 2HZ LYS 22 2HZ LYS 22 4.597 0.128 -7.922
171 3HZ LYS 22 3HZ LYS 22 3.764 0.973 -6.716
172 H CYS 23 H CYS 23 4.769 -0.274 -0.364
173 HA CYS 23 HA CYS 23 2.927 1.039 1.339
174 1HB CYS 23 1HB CYS 23 5.288 -0.034 1.818
175 2HB CYS 23 2HB CYS 23 5.861 1.598 1.492
176 H VAL 24 H VAL 24 2.937 3.285 1.969
177 HA VAL 24 HA VAL 24 3.503 5.053 -0.312
178 HB VAL 24 HB VAL 24 1.129 4.845 0.590
179 1HG1 VAL 24 1HG1 VAL 24 2.136 5.054 3.015
180 2HG1 VAL 24 2HG1 VAL 24 1.914 6.778 2.713
181 3HG1 VAL 24 3HG1 VAL 24 0.533 5.682 2.634
182 1HG2 VAL 24 1HG2 VAL 24 2.222 6.779 -0.762
183 2HG2 VAL 24 2HG2 VAL 24 0.637 7.021 -0.027
184 3HG2 VAL 24 2HG3 VAL 24 2.078 7.676 0.750
185 H ALA 25 H ALA 25 5.253 4.135 2.056
186 HA ALA 25 HA ALA 25 6.215 6.833 2.721
187 1HB ALA 25 1HB ALA 25 5.097 6.147 4.696
188 2HB ALA 25 2HB ALA 25 5.822 4.540 4.630
189 3HB ALA 25 3HB ALA 25 6.824 5.946 4.995
190 H CYS 26 H CYS 26 6.989 3.366 2.660
191 HA CYS 26 HA CYS 26 9.808 4.072 2.194
192 1HB CYS 26 1HB CYS 26 10.440 1.981 3.119
193 2HB CYS 26 2HB CYS 26 9.207 2.626 4.198
194 H GLU 27 H GLU 27 7.020 2.889 0.714
195 HA GLU 27 HA GLU 27 6.605 2.149 -1.401
196 1HB GLU 27 1HB GLU 27 9.547 2.333 -2.007
197 2HB GLU 27 2HB GLU 27 8.191 2.494 -3.114
198 1HG GLU 27 1HG GLU 27 9.295 4.467 -1.174
199 2HG GLU 27 2HG GLU 27 8.890 4.670 -2.878
200 H THR 28 H THR 28 6.813 0.264 0.535
201 HA THR 28 HA THR 28 8.575 -1.859 -0.374
202 HB THR 28 HB THR 28 7.074 -1.294 2.059
203 HG1 THR 28 1HG THR 28 9.161 -3.172 1.599
204 1HG2 THR 28 1HG2 THR 28 7.072 -4.123 1.002
205 2HG2 THR 28 2HG2 THR 28 5.654 -3.117 1.298
206 3HG2 THR 28 3HG2 THR 28 6.655 -3.651 2.648
207 HA PRO 29 HA PRO 29 5.639 -3.865 -2.966
208 1HB PRO 29 1HB PRO 29 6.581 -6.407 -2.825
209 2HB PRO 29 2HB PRO 29 7.397 -5.129 -3.732
210 1HG PRO 29 1HG PRO 29 7.998 -6.191 -0.999
211 2HG PRO 29 2HG PRO 29 9.118 -5.780 -2.309
212 1HD PRO 29 1HD PRO 29 8.662 -4.131 -0.211
213 2HD PRO 29 2HD PRO 29 9.041 -3.525 -1.836
214 H LYS 30 H LYS 30 3.600 -4.109 -2.291
215 HA LYS 30 HA LYS 30 2.782 -5.106 0.186
216 1HB LYS 30 1HB LYS 30 1.286 -3.736 -1.083
217 2HB LYS 30 2HB LYS 30 1.314 -4.856 -2.439
218 1HG LYS 30 1HG LYS 30 0.369 -6.516 -0.600
219 2HG LYS 30 2HG LYS 30 -0.183 -4.998 0.113
220 1HD LYS 30 1HD LYS 30 -0.661 -5.261 -2.776
221 2HD LYS 30 2HD LYS 30 -1.549 -6.405 -1.766
222 1HE LYS 30 1HE LYS 30 -2.342 -4.484 -0.399
223 2HE LYS 30 2HE LYS 30 -1.559 -3.397 -1.545
224 1HZ LYS 30 1HZ LYS 30 -3.563 -3.438 -2.524
225 2HZ LYS 30 2HZ LYS 30 -4.021 -4.900 -1.809
226 3HZ LYS 30 3HZ LYS 30 -3.033 -4.904 -3.182
227 HA PRO 31 HA PRO 31 3.159 -9.474 -0.219
228 1HB PRO 31 1HB PRO 31 1.346 -10.233 1.652
229 2HB PRO 31 2HB PRO 31 2.925 -9.554 2.065
230 1HG PRO 31 1HG PRO 31 0.252 -8.210 1.968
231 2HG PRO 31 2HG PRO 31 1.537 -8.059 3.181
232 1HD PRO 31 1HD PRO 31 1.145 -6.216 1.236
233 2HD PRO 31 2HD PRO 31 2.752 -6.585 1.893
Start of MODEL 15
1 1H GLY 0 1H GLY 0 -18.636 10.906 6.369
2 1HA GLY 0 1HA GLY 0 -19.528 8.894 7.924
3 2HA GLY 0 2HA GLY 0 -20.316 9.309 6.409
4 H HIS 1 H HIS 1 -17.992 8.491 4.805
5 HA HIS 1 HA HIS 1 -18.201 5.572 5.153
6 1HB HIS 1 1HB HIS 1 -18.562 5.244 2.894
7 2HB HIS 1 2HB HIS 1 -19.425 6.758 3.151
8 HD1 HIS 1 HD1 HIS 1 -17.082 5.267 0.926
9 HD2 HIS 1 HD2 HIS 1 -17.590 9.074 2.511
10 HE1 HIS 1 HE1 HIS 1 -15.803 6.806 -0.597
11 H MET 2 H MET 2 -16.379 4.333 4.715
12 HA MET 2 HA MET 2 -13.943 5.603 3.810
13 1HB MET 2 1HB MET 2 -13.699 6.209 6.077
14 2HB MET 2 2HB MET 2 -14.314 4.662 6.644
15 1HG MET 2 1HG MET 2 -12.296 3.560 5.813
16 2HG MET 2 2HG MET 2 -11.680 5.116 5.263
17 1HE MET 2 1HE MET 2 -11.961 2.614 8.116
18 2HE MET 2 2HE MET 2 -11.932 3.595 9.581
19 3HE MET 2 3HE MET 2 -13.352 3.614 8.535
20 H VAL 3 H VAL 3 -12.157 4.032 3.585
21 HA VAL 3 HA VAL 3 -13.227 1.435 2.783
22 HB VAL 3 HB VAL 3 -11.943 2.504 1.078
23 1HG1 VAL 3 1HG1 VAL 3 -9.328 2.680 1.906
24 2HG1 VAL 3 2HG1 VAL 3 -10.454 4.030 1.750
25 3HG1 VAL 3 3HG1 VAL 3 -10.228 3.246 3.314
26 1HG2 VAL 3 1HG2 VAL 3 -11.622 0.021 1.543
27 2HG2 VAL 3 2HG2 VAL 3 -10.405 0.808 0.539
28 3HG2 VAL 3 3HG2 VAL 3 -10.062 0.466 2.235
29 H ILE 4 H ILE 4 -12.519 -0.505 3.580
30 HA ILE 4 HA ILE 4 -10.719 -0.374 5.911
31 HB ILE 4 HB ILE 4 -13.227 -1.004 6.232
32 1HG1 ILE 4 1HG1 ILE 4 -10.895 -2.554 7.357
33 2HG1 ILE 4 2HG1 ILE 4 -11.688 -1.145 8.053
34 1HG2 ILE 4 1HG2 ILE 4 -13.856 -3.230 5.831
35 2HG2 ILE 4 2HG2 ILE 4 -13.064 -2.704 4.347
36 3HG2 ILE 4 3HG2 ILE 4 -12.197 -3.725 5.493
37 1HD1 ILE 4 1HD1 ILE 4 -12.241 -3.268 9.186
38 2HD1 ILE 4 2HD1 ILE 4 -13.652 -2.429 8.541
39 3HD1 ILE 4 3HD1 ILE 4 -12.996 -3.830 7.695
40 H GLY 5 H GLY 5 -9.328 -2.175 6.277
41 1HA GLY 5 1HA GLY 5 -8.594 -4.401 5.487
42 2HA GLY 5 2HA GLY 5 -8.853 -3.802 3.855
43 H THR 6 H THR 6 -7.672 -1.187 5.255
44 HA THR 6 HA THR 6 -5.279 -1.042 3.994
45 HB THR 6 HB THR 6 -4.521 0.542 5.777
46 HG1 THR 6 1HG THR 6 -5.654 -0.622 7.503
47 1HG2 THR 6 1HG2 THR 6 -5.671 1.930 4.458
48 2HG2 THR 6 2HG2 THR 6 -7.025 1.742 5.572
49 3HG2 THR 6 3HG2 THR 6 -6.906 0.712 4.146
50 H TRP 7 H TRP 7 -3.243 -1.789 4.232
51 HA TRP 7 HA TRP 7 -2.786 -3.722 6.395
52 1HB TRP 7 1HB TRP 7 -0.797 -4.364 4.866
53 2HB TRP 7 2HB TRP 7 -2.422 -4.820 4.364
54 HD1 TRP 7 1HD TRP 7 -3.581 -3.003 2.528
55 HE1 TRP 7 1HE TRP 7 -2.439 -1.861 0.524
56 HE3 TRP 7 3HE TRP 7 1.296 -3.520 3.970
57 HZ2 TRP 7 2HZ TRP 7 0.183 -1.260 -0.333
58 HZ3 TRP 7 3HZ TRP 7 3.061 -2.634 2.502
59 HH2 TRP 7 2HH TRP 7 2.513 -1.528 0.395
60 H ASP 8 H ASP 8 -1.068 -3.560 7.771
61 HA ASP 8 HA ASP 8 0.317 -0.979 7.780
62 1HB ASP 8 1HB ASP 8 0.376 -3.026 9.990
63 2HB ASP 8 2HB ASP 8 0.694 -1.297 10.094
64 H CYS 9 H CYS 9 2.459 -0.780 7.485
65 HA CYS 9 HA CYS 9 3.946 -2.832 6.291
66 1HB CYS 9 1HB CYS 9 4.283 -0.228 6.314
67 2HB CYS 9 2HB CYS 9 5.307 -0.570 7.705
68 H ASP 10 H ASP 10 6.183 -3.481 7.164
69 HA ASP 10 HA ASP 10 6.018 -4.121 10.030
70 1HB ASP 10 1HB ASP 10 7.042 -6.084 7.982
71 2HB ASP 10 2HB ASP 10 6.641 -6.383 9.672
72 H THR 11 H THR 11 7.628 -2.390 7.922
73 HA THR 11 HA THR 11 10.238 -2.919 9.183
74 HB THR 11 HB THR 11 9.670 -2.290 6.291
75 HG1 THR 11 1HG THR 11 9.944 -4.404 6.349
76 1HG2 THR 11 1HG2 THR 11 11.426 -0.764 7.080
77 2HG2 THR 11 2HG2 THR 11 12.071 -1.973 5.970
78 3HG2 THR 11 3HG3 THR 11 12.335 -2.140 7.706
79 H CYS 12 H CYS 12 8.580 -0.462 7.191
80 HA CYS 12 HA CYS 12 9.987 1.654 8.596
81 1HB CYS 12 1HB CYS 12 9.382 3.046 6.867
82 2HB CYS 12 2HB CYS 12 9.342 1.494 6.036
83 H LEU 13 H LEU 13 7.013 0.004 8.804
84 HA LEU 13 HA LEU 13 5.262 0.196 10.248
85 1HB LEU 13 1HB LEU 13 6.524 2.608 11.492
86 2HB LEU 13 2HB LEU 13 5.501 1.381 12.237
87 HG LEU 13 HG LEU 13 8.424 1.232 11.564
88 1HD1 LEU 13 1HD1 LEU 13 7.485 0.181 14.099
89 2HD1 LEU 13 2HD1 LEU 13 7.040 1.871 13.867
90 3HD1 LEU 13 3HD1 LEU 13 8.732 1.383 13.762
91 1HD2 LEU 13 1HD2 LEU 13 6.451 -0.987 11.877
92 2HD2 LEU 13 2HD2 LEU 13 8.097 -1.189 12.476
93 3HD2 LEU 13 3HD2 LEU 13 7.816 -0.843 10.769
94 H VAL 14 H VAL 14 4.183 0.877 8.233
95 HA VAL 14 HA VAL 14 2.862 3.430 8.644
96 HB VAL 14 HB VAL 14 4.344 2.814 6.085
97 1HG1 VAL 14 1HG1 VAL 14 2.360 4.992 6.718
98 2HG1 VAL 14 2HG1 VAL 14 3.423 4.997 5.311
99 3HG1 VAL 14 3HG1 VAL 14 2.211 3.730 5.496
100 1HG2 VAL 14 1HG2 VAL 14 4.601 5.192 7.916
101 2HG2 VAL 14 2HG2 VAL 14 5.650 3.777 7.994
102 3HG2 VAL 14 3HG2 VAL 14 5.624 4.776 6.541
103 H GLN 15 H GLN 15 0.758 3.301 8.152
104 HA GLN 15 HA GLN 15 -0.272 0.814 7.111
105 1HB GLN 15 1HB GLN 15 -1.453 3.253 8.368
106 2HB GLN 15 2HB GLN 15 -2.499 2.198 7.427
107 1HG GLN 15 1HG GLN 15 -1.422 0.330 8.922
108 2HG GLN 15 2HG GLN 15 -1.109 1.687 10.003
109 1HE2 GLN 15 2HE2 GLN 15 -2.630 2.091 11.427
110 2HE2 GLN 15 1HE2 GLN 15 -4.304 1.688 11.278
111 H ASN 16 H ASN 16 -1.602 0.587 5.279
112 HA ASN 16 HA ASN 16 -1.789 2.826 3.427
113 1HB ASN 16 1HB ASN 16 -0.751 0.275 2.277
114 2HB ASN 16 2HB ASN 16 -0.531 1.929 1.716
115 1HD2 ASN 16 2HD2 ASN 16 0.283 -0.148 4.470
116 2HD2 ASN 16 1HD2 ASN 16 1.880 0.473 4.687
117 H LYS 17 H LYS 17 -3.205 2.361 1.588
118 HA LYS 17 HA LYS 17 -5.490 0.835 2.426
119 1HB LYS 17 1HB LYS 17 -6.627 1.803 0.605
120 2HB LYS 17 2HB LYS 17 -5.519 3.052 1.160
121 1HG LYS 17 1HG LYS 17 -4.040 2.668 -0.655
122 2HG LYS 17 2HG LYS 17 -4.898 1.198 -1.125
123 1HD LYS 17 1HD LYS 17 -5.711 2.733 -2.650
124 2HD LYS 17 2HD LYS 17 -6.938 2.799 -1.383
125 1HE LYS 17 1HE LYS 17 -4.598 4.660 -1.313
126 2HE LYS 17 2HE LYS 17 -5.970 5.006 -2.363
127 1HZ LYS 17 1HZ LYS 17 -6.951 5.894 -0.603
128 2HZ LYS 17 2HZ LYS 17 -5.733 5.358 0.441
129 3HZ LYS 17 3HZ LYS 17 -7.046 4.353 0.088
130 HA PRO 18 HA PRO 18 -4.663 -2.963 0.376
131 1HB PRO 18 1HB PRO 18 -7.194 -3.790 -0.150
132 2HB PRO 18 2HB PRO 18 -6.499 -3.800 1.474
133 1HG PRO 18 1HG PRO 18 -8.331 -1.799 0.212
134 2HG PRO 18 2HG PRO 18 -8.377 -2.482 1.847
135 1HD PRO 18 1HD PRO 18 -7.361 -0.028 1.324
136 2HD PRO 18 2HD PRO 18 -6.737 -1.063 2.625
137 H GLU 19 H GLU 19 -6.131 -0.327 -1.191
138 HA GLU 19 HA GLU 19 -6.410 -1.656 -3.756
139 1HB GLU 19 1HB GLU 19 -8.078 -0.077 -3.547
140 2HB GLU 19 2HB GLU 19 -7.048 1.052 -2.679
141 1HG GLU 19 1HG GLU 19 -7.605 1.900 -4.877
142 2HG GLU 19 2HG GLU 19 -5.874 1.587 -4.747
143 H ALA 20 H ALA 20 -3.908 -0.338 -2.014
144 HA ALA 20 HA ALA 20 -2.479 0.820 -4.258
145 1HB ALA 20 1HB ALA 20 -0.637 1.051 -2.524
146 2HB ALA 20 2HB ALA 20 -2.122 1.956 -2.228
147 3HB ALA 20 3HB ALA 20 -1.813 0.458 -1.350
148 H ILE 21 H ILE 21 -0.135 0.113 -4.549
149 HA ILE 21 HA ILE 21 -0.078 -2.824 -4.704
150 HB ILE 21 HB ILE 21 1.539 -0.850 -6.318
151 1HG1 ILE 21 1HG1 ILE 21 0.039 -1.554 -8.193
152 2HG1 ILE 21 2HG1 ILE 21 -0.957 -2.408 -7.020
153 1HG2 ILE 21 1HG2 ILE 21 1.672 -3.716 -5.952
154 2HG2 ILE 21 2HG2 ILE 21 1.414 -3.285 -7.641
155 3HG2 ILE 21 3HG2 ILE 21 2.798 -2.630 -6.767
156 1HD1 ILE 21 1HD1 ILE 21 -1.565 0.009 -7.820
157 2HD1 ILE 21 2HD1 ILE 21 -1.813 -0.483 -6.143
158 3HD1 ILE 21 3HD1 ILE 21 -0.400 0.477 -6.582
159 H LYS 22 H LYS 22 1.418 -0.096 -3.280
160 HA LYS 22 HA LYS 22 3.244 -1.794 -1.826
161 1HB LYS 22 1HB LYS 22 5.180 -0.185 -2.407
162 2HB LYS 22 2HB LYS 22 4.756 -1.438 -3.566
163 1HG LYS 22 1HG LYS 22 3.395 0.252 -4.790
164 2HG LYS 22 2HG LYS 22 4.028 1.480 -3.690
165 1HD LYS 22 1HD LYS 22 5.377 1.555 -5.640
166 2HD LYS 22 2HD LYS 22 6.339 0.752 -4.397
167 1HE LYS 22 1HE LYS 22 6.518 -0.380 -6.564
168 2HE LYS 22 2HE LYS 22 5.786 -1.417 -5.341
169 1HZ LYS 22 1HZ LYS 22 4.631 -1.537 -7.476
170 2HZ LYS 22 2HZ LYS 22 4.284 0.117 -7.393
171 3HZ LYS 22 3HZ LYS 22 3.619 -0.944 -6.256
172 H CYS 23 H CYS 23 4.515 -0.468 -0.199
173 HA CYS 23 HA CYS 23 2.807 0.976 1.426
174 1HB CYS 23 1HB CYS 23 5.214 -0.048 1.829
175 2HB CYS 23 2HB CYS 23 5.726 1.604 1.500
176 H VAL 24 H VAL 24 2.994 3.261 2.111
177 HA VAL 24 HA VAL 24 3.398 5.004 -0.232
178 HB VAL 24 HB VAL 24 1.060 4.861 0.603
179 1HG1 VAL 24 1HG1 VAL 24 2.127 6.261 3.050
180 2HG1 VAL 24 2HG1 VAL 24 0.449 5.828 2.721
181 3HG1 VAL 24 3HG1 VAL 24 1.650 4.565 2.994
182 1HG2 VAL 24 1HG2 VAL 24 2.333 6.981 -0.369
183 2HG2 VAL 24 2HG2 VAL 24 0.642 7.049 0.128
184 3HG2 VAL 24 2HG3 VAL 24 1.903 7.640 1.210
185 H ALA 25 H ALA 25 5.311 4.135 1.952
186 HA ALA 25 HA ALA 25 6.275 6.830 2.575
187 1HB ALA 25 1HB ALA 25 6.972 5.514 4.854
188 2HB ALA 25 2HB ALA 25 5.575 6.579 4.691
189 3HB ALA 25 3HB ALA 25 5.378 4.834 4.523
190 H CYS 26 H CYS 26 6.973 3.349 2.647
191 HA CYS 26 HA CYS 26 9.807 3.969 2.154
192 1HB CYS 26 1HB CYS 26 10.382 1.885 3.122
193 2HB CYS 26 2HB CYS 26 9.153 2.572 4.180
194 H GLU 27 H GLU 27 6.983 2.799 0.708
195 HA GLU 27 HA GLU 27 6.560 2.073 -1.413
196 1HB GLU 27 1HB GLU 27 9.510 2.071 -1.999
197 2HB GLU 27 2HB GLU 27 8.171 2.309 -3.113
198 1HG GLU 27 1HG GLU 27 9.502 4.229 -1.308
199 2HG GLU 27 2HG GLU 27 8.858 4.454 -2.933
200 H THR 28 H THR 28 6.699 0.233 0.606
201 HA THR 28 HA THR 28 8.381 -1.984 -0.118
202 HB THR 28 HB THR 28 6.810 -1.273 2.140
203 HG1 THR 28 1HG THR 28 7.995 -3.146 2.988
204 1HG2 THR 28 1HG2 THR 28 5.615 -3.301 2.636
205 2HG2 THR 28 2HG2 THR 28 6.176 -4.051 1.142
206 3HG2 THR 28 3HG2 THR 28 5.053 -2.693 1.080
207 HA PRO 29 HA PRO 29 5.769 -3.906 -3.092
208 1HB PRO 29 1HB PRO 29 6.588 -6.478 -2.810
209 2HB PRO 29 2HB PRO 29 7.570 -5.238 -3.598
210 1HG PRO 29 1HG PRO 29 7.739 -6.296 -0.803
211 2HG PRO 29 2HG PRO 29 9.048 -5.936 -1.943
212 1HD PRO 29 1HD PRO 29 8.361 -4.253 0.063
213 2HD PRO 29 2HD PRO 29 8.988 -3.676 -1.494
214 H LYS 30 H LYS 30 3.646 -4.046 -2.688
215 HA LYS 30 HA LYS 30 2.411 -4.924 -0.378
216 1HB LYS 30 1HB LYS 30 1.162 -3.669 -1.986
217 2HB LYS 30 2HB LYS 30 1.422 -4.886 -3.229
218 1HG LYS 30 1HG LYS 30 0.148 -6.446 -1.578
219 2HG LYS 30 2HG LYS 30 -0.438 -4.925 -0.898
220 1HD LYS 30 1HD LYS 30 -0.829 -4.468 -3.532
221 2HD LYS 30 2HD LYS 30 -1.056 -6.218 -3.475
222 1HE LYS 30 1HE LYS 30 -2.893 -6.066 -2.088
223 2HE LYS 30 2HE LYS 30 -2.412 -4.495 -1.450
224 1HZ LYS 30 1HZ LYS 30 -3.547 -3.447 -3.031
225 2HZ LYS 30 2HZ LYS 30 -4.282 -4.931 -3.378
226 3HZ LYS 30 3HZ LYS 30 -2.931 -4.428 -4.265
227 HA PRO 31 HA PRO 31 2.832 -9.308 -0.376
228 1HB PRO 31 1HB PRO 31 0.718 -9.937 1.207
229 2HB PRO 31 2HB PRO 31 2.206 -9.215 1.832
230 1HG PRO 31 1HG PRO 31 -0.403 -7.905 1.174
231 2HG PRO 31 2HG PRO 31 0.653 -7.651 2.575
232 1HD PRO 31 1HD PRO 31 0.611 -5.965 0.457
233 2HD PRO 31 2HD PRO 31 2.080 -6.270 1.406
Start of MODEL 16
1 1H GLY 0 1H GLY 0 -18.864 -4.717 -3.298
2 1HA GLY 0 1HA GLY 0 -18.998 -4.693 -6.203
3 2HA GLY 0 2HA GLY 0 -19.349 -3.159 -5.419
4 H HIS 1 H HIS 1 -17.571 -3.021 -3.398
5 HA HIS 1 HA HIS 1 -14.934 -3.795 -4.032
6 1HB HIS 1 1HB HIS 1 -14.270 -1.246 -4.442
7 2HB HIS 1 2HB HIS 1 -14.677 -2.329 -5.771
8 HD1 HIS 1 HD1 HIS 1 -15.843 -0.855 -7.395
9 HD2 HIS 1 HD2 HIS 1 -17.222 -0.303 -3.514
10 HE1 HIS 1 HE1 HIS 1 -17.789 0.727 -7.591
11 H MET 2 H MET 2 -14.288 -4.068 -1.998
12 HA MET 2 HA MET 2 -15.119 -2.203 0.074
13 1HB MET 2 1HB MET 2 -14.293 -3.797 1.644
14 2HB MET 2 2HB MET 2 -15.155 -4.697 0.404
15 1HG MET 2 1HG MET 2 -13.010 -5.238 -0.666
16 2HG MET 2 2HG MET 2 -12.171 -4.383 0.626
17 1HE MET 2 1HE MET 2 -12.378 -7.228 -0.775
18 2HE MET 2 2HE MET 2 -12.033 -8.417 0.482
19 3HE MET 2 3HE MET 2 -13.682 -8.213 -0.111
20 H VAL 3 H VAL 3 -13.870 -0.653 0.917
21 HA VAL 3 HA VAL 3 -11.064 -0.524 0.037
22 HB VAL 3 HB VAL 3 -13.023 1.639 0.771
23 1HG1 VAL 3 1HG1 VAL 3 -10.946 3.137 0.271
24 2HG1 VAL 3 2HG1 VAL 3 -11.182 2.466 1.886
25 3HG1 VAL 3 3HG1 VAL 3 -10.038 1.711 0.775
26 1HG2 VAL 3 1HG2 VAL 3 -13.233 1.785 -1.435
27 2HG2 VAL 3 2HG2 VAL 3 -11.529 2.226 -1.545
28 3HG2 VAL 3 3HG2 VAL 3 -12.011 0.534 -1.666
29 H ILE 4 H ILE 4 -12.984 -1.164 2.699
30 HA ILE 4 HA ILE 4 -11.201 -0.046 4.691
31 HB ILE 4 HB ILE 4 -13.586 -0.107 5.177
32 1HG1 ILE 4 1HG1 ILE 4 -13.465 -0.974 7.404
33 2HG1 ILE 4 2HG1 ILE 4 -12.203 -2.117 6.958
34 1HG2 ILE 4 1HG2 ILE 4 -13.852 -2.942 5.679
35 2HG2 ILE 4 2HG2 ILE 4 -14.896 -1.856 4.764
36 3HG2 ILE 4 3HG2 ILE 4 -13.508 -2.610 3.981
37 1HD1 ILE 4 1HD1 ILE 4 -10.617 -0.347 6.692
38 2HD1 ILE 4 2HD1 ILE 4 -11.870 0.871 6.930
39 3HD1 ILE 4 3HD1 ILE 4 -11.396 -0.180 8.264
40 H GLY 5 H GLY 5 -9.247 -1.132 4.168
41 1HA GLY 5 1HA GLY 5 -8.858 -3.550 5.615
42 2HA GLY 5 2HA GLY 5 -8.864 -3.859 3.885
43 H THR 6 H THR 6 -7.638 -0.969 5.495
44 HA THR 6 HA THR 6 -5.274 -0.844 4.037
45 HB THR 6 HB THR 6 -4.442 0.686 5.820
46 HG1 THR 6 1HG THR 6 -5.877 1.114 7.566
47 1HG2 THR 6 1HG2 THR 6 -6.848 0.968 4.242
48 2HG2 THR 6 2HG2 THR 6 -5.576 2.147 4.570
49 3HG2 THR 6 3HG2 THR 6 -6.920 1.962 5.697
50 H TRP 7 H TRP 7 -3.240 -1.623 4.299
51 HA TRP 7 HA TRP 7 -2.875 -3.632 6.412
52 1HB TRP 7 1HB TRP 7 -0.922 -4.343 4.875
53 2HB TRP 7 2HB TRP 7 -2.567 -4.706 4.356
54 HD1 TRP 7 1HD TRP 7 -3.618 -2.847 2.522
55 HE1 TRP 7 1HE TRP 7 -2.408 -1.705 0.558
56 HE3 TRP 7 3HE TRP 7 1.215 -3.519 4.048
57 HZ2 TRP 7 2HZ TRP 7 0.246 -1.162 -0.239
58 HZ3 TRP 7 3HZ TRP 7 3.030 -2.659 2.627
59 HH2 TRP 7 2HH TRP 7 2.554 -1.507 0.528
60 H ASP 8 H ASP 8 -1.218 -3.506 7.840
61 HA ASP 8 HA ASP 8 0.266 -0.995 7.900
62 1HB ASP 8 1HB ASP 8 0.386 -3.122 10.022
63 2HB ASP 8 2HB ASP 8 0.632 -1.385 10.185
64 H CYS 9 H CYS 9 2.394 -0.819 7.531
65 HA CYS 9 HA CYS 9 3.818 -2.882 6.263
66 1HB CYS 9 1HB CYS 9 4.167 -0.280 6.264
67 2HB CYS 9 2HB CYS 9 5.238 -0.619 7.619
68 H ASP 10 H ASP 10 6.154 -3.416 7.098
69 HA ASP 10 HA ASP 10 6.101 -4.046 9.960
70 1HB ASP 10 1HB ASP 10 6.375 -6.006 7.697
71 2HB ASP 10 2HB ASP 10 7.096 -6.340 9.269
72 H THR 11 H THR 11 7.630 -2.446 7.690
73 HA THR 11 HA THR 11 10.299 -3.040 8.787
74 HB THR 11 HB THR 11 9.483 -3.193 6.057
75 HG1 THR 11 1HG THR 11 11.950 -3.447 7.448
76 1HG2 THR 11 1HG2 THR 11 11.100 -1.706 5.003
77 2HG2 THR 11 2HG2 THR 11 11.571 -1.074 6.580
78 3HG2 THR 11 3HG3 THR 11 9.947 -0.778 5.960
79 H CYS 12 H CYS 12 8.101 -0.628 7.463
80 HA CYS 12 HA CYS 12 9.804 1.481 8.620
81 1HB CYS 12 1HB CYS 12 9.260 2.907 6.898
82 2HB CYS 12 2HB CYS 12 9.201 1.366 6.047
83 H LEU 13 H LEU 13 6.988 -0.222 9.061
84 HA LEU 13 HA LEU 13 5.164 0.034 10.393
85 1HB LEU 13 1HB LEU 13 7.131 1.945 11.550
86 2HB LEU 13 2HB LEU 13 5.467 1.997 12.128
87 HG LEU 13 HG LEU 13 5.873 -0.595 12.459
88 1HD1 LEU 13 1HD1 LEU 13 8.528 0.487 11.933
89 2HD1 LEU 13 2HD1 LEU 13 7.964 -1.184 11.944
90 3HD1 LEU 13 3HD1 LEU 13 8.416 -0.397 13.455
91 1HD2 LEU 13 1HD2 LEU 13 5.274 1.025 14.201
92 2HD2 LEU 13 2HD2 LEU 13 6.968 1.500 14.333
93 3HD2 LEU 13 3HD2 LEU 13 6.474 -0.136 14.768
94 H VAL 14 H VAL 14 4.142 0.757 8.337
95 HA VAL 14 HA VAL 14 2.814 3.302 8.782
96 HB VAL 14 HB VAL 14 4.410 2.739 6.286
97 1HG1 VAL 14 1HG1 VAL 14 3.376 5.067 5.664
98 2HG1 VAL 14 2HG1 VAL 14 2.497 3.575 5.323
99 3HG1 VAL 14 3HG1 VAL 14 2.080 4.543 6.737
100 1HG2 VAL 14 1HG2 VAL 14 5.587 3.791 8.191
101 2HG2 VAL 14 2HG2 VAL 14 5.493 4.840 6.777
102 3HG2 VAL 14 3HG2 VAL 14 4.420 5.111 8.149
103 H GLN 15 H GLN 15 0.723 3.232 8.191
104 HA GLN 15 HA GLN 15 -0.292 0.756 7.083
105 1HB GLN 15 1HB GLN 15 -1.495 3.148 8.407
106 2HB GLN 15 2HB GLN 15 -2.524 2.122 7.417
107 1HG GLN 15 1HG GLN 15 -1.732 0.178 8.799
108 2HG GLN 15 2HG GLN 15 -0.980 1.355 9.875
109 1HE2 GLN 15 2HE2 GLN 15 -2.148 1.775 11.594
110 2HE2 GLN 15 1HE2 GLN 15 -3.873 1.801 11.681
111 H ASN 16 H ASN 16 -1.526 0.565 5.203
112 HA ASN 16 HA ASN 16 -1.693 2.880 3.432
113 1HB ASN 16 1HB ASN 16 -0.686 0.345 2.220
114 2HB ASN 16 2HB ASN 16 -0.430 2.011 1.709
115 1HD2 ASN 16 2HD2 ASN 16 0.239 -0.003 4.557
116 2HD2 ASN 16 1HD2 ASN 16 1.873 0.525 4.753
117 H LYS 17 H LYS 17 -3.141 2.555 1.623
118 HA LYS 17 HA LYS 17 -5.473 1.101 2.364
119 1HB LYS 17 1HB LYS 17 -6.501 2.064 0.481
120 2HB LYS 17 2HB LYS 17 -5.344 3.273 1.020
121 1HG LYS 17 1HG LYS 17 -3.841 2.749 -0.737
122 2HG LYS 17 2HG LYS 17 -4.752 1.300 -1.169
123 1HD LYS 17 1HD LYS 17 -5.346 2.907 -2.782
124 2HD LYS 17 2HD LYS 17 -6.702 2.865 -1.653
125 1HE LYS 17 1HE LYS 17 -6.293 5.147 -2.040
126 2HE LYS 17 2HE LYS 17 -5.573 4.810 -0.467
127 1HZ LYS 17 1HZ LYS 17 -4.308 5.586 -2.947
128 2HZ LYS 17 2HZ LYS 17 -3.518 4.340 -2.120
129 3HZ LYS 17 3HZ LYS 17 -3.798 5.820 -1.351
130 HA PRO 18 HA PRO 18 -4.709 -2.804 0.493
131 1HB PRO 18 1HB PRO 18 -7.262 -3.588 0.006
132 2HB PRO 18 2HB PRO 18 -6.561 -3.551 1.628
133 1HG PRO 18 1HG PRO 18 -8.348 -1.556 0.289
134 2HG PRO 18 2HG PRO 18 -8.407 -2.173 1.951
135 1HD PRO 18 1HD PRO 18 -7.332 0.233 1.327
136 2HD PRO 18 2HD PRO 18 -6.729 -0.764 2.667
137 H GLU 19 H GLU 19 -6.121 -0.199 -1.175
138 HA GLU 19 HA GLU 19 -6.442 -1.621 -3.685
139 1HB GLU 19 1HB GLU 19 -8.058 -0.001 -3.608
140 2HB GLU 19 2HB GLU 19 -7.056 1.107 -2.681
141 1HG GLU 19 1HG GLU 19 -5.806 1.698 -4.655
142 2HG GLU 19 2HG GLU 19 -6.687 0.504 -5.606
143 H ALA 20 H ALA 20 -3.899 -0.302 -2.005
144 HA ALA 20 HA ALA 20 -2.447 0.694 -4.318
145 1HB ALA 20 1HB ALA 20 -1.618 0.442 -1.430
146 2HB ALA 20 2HB ALA 20 -0.666 1.205 -2.704
147 3HB ALA 20 3HB ALA 20 -2.216 1.897 -2.226
148 H ILE 21 H ILE 21 -0.165 -0.081 -4.638
149 HA ILE 21 HA ILE 21 -0.133 -3.018 -4.522
150 HB ILE 21 HB ILE 21 0.145 -1.499 -6.716
151 1HG1 ILE 21 1HG1 ILE 21 0.346 -4.148 -6.116
152 2HG1 ILE 21 2HG1 ILE 21 0.531 -3.483 -7.736
153 1HG2 ILE 21 1HG2 ILE 21 2.966 -1.936 -5.746
154 2HG2 ILE 21 2HG2 ILE 21 2.499 -1.332 -7.335
155 3HG2 ILE 21 3HG2 ILE 21 2.152 -0.379 -5.893
156 1HD1 ILE 21 1HD1 ILE 21 2.296 -5.100 -7.051
157 2HD1 ILE 21 2HD1 ILE 21 2.902 -3.522 -7.557
158 3HD1 ILE 21 3HD1 ILE 21 2.822 -3.929 -5.843
159 H LYS 22 H LYS 22 1.525 -0.163 -3.495
160 HA LYS 22 HA LYS 22 3.393 -1.819 -1.973
161 1HB LYS 22 1HB LYS 22 5.235 -0.170 -2.549
162 2HB LYS 22 2HB LYS 22 4.761 -1.282 -3.827
163 1HG LYS 22 1HG LYS 22 4.886 0.688 -4.982
164 2HG LYS 22 2HG LYS 22 3.179 0.673 -4.537
165 1HD LYS 22 1HD LYS 22 3.632 2.136 -2.651
166 2HD LYS 22 2HD LYS 22 5.359 2.101 -3.014
167 1HE LYS 22 1HE LYS 22 4.230 4.153 -3.818
168 2HE LYS 22 2HE LYS 22 4.992 3.227 -5.110
169 1HZ LYS 22 1HZ LYS 22 2.254 2.494 -4.647
170 2HZ LYS 22 2HZ LYS 22 3.039 2.876 -6.094
171 3HZ LYS 22 3HZ LYS 22 2.433 4.111 -5.110
172 H CYS 23 H CYS 23 4.707 -0.310 -0.443
173 HA CYS 23 HA CYS 23 2.840 1.023 1.215
174 1HB CYS 23 1HB CYS 23 5.135 -0.122 1.778
175 2HB CYS 23 2HB CYS 23 5.789 1.483 1.463
176 H VAL 24 H VAL 24 2.751 3.236 1.805
177 HA VAL 24 HA VAL 24 3.488 5.032 -0.395
178 HB VAL 24 HB VAL 24 1.087 4.899 0.322
179 1HG1 VAL 24 1HG1 VAL 24 2.160 6.234 2.805
180 2HG1 VAL 24 2HG1 VAL 24 0.453 6.096 2.384
181 3HG1 VAL 24 3HG1 VAL 24 1.402 4.645 2.709
182 1HG2 VAL 24 1HG2 VAL 24 0.802 6.999 -0.406
183 2HG2 VAL 24 2HG2 VAL 24 1.751 7.687 0.911
184 3HG2 VAL 24 2HG3 VAL 24 2.563 7.043 -0.516
185 H ALA 25 H ALA 25 5.115 4.052 2.043
186 HA ALA 25 HA ALA 25 6.070 6.728 2.807
187 1HB ALA 25 1HB ALA 25 5.029 6.099 4.776
188 2HB ALA 25 2HB ALA 25 5.458 4.398 4.580
189 3HB ALA 25 3HB ALA 25 6.692 5.572 5.040
190 H CYS 26 H CYS 26 6.873 3.267 2.669
191 HA CYS 26 HA CYS 26 9.694 4.007 2.277
192 1HB CYS 26 1HB CYS 26 10.314 1.871 3.129
193 2HB CYS 26 2HB CYS 26 9.090 2.507 4.224
194 H GLU 27 H GLU 27 6.943 2.803 0.720
195 HA GLU 27 HA GLU 27 6.580 2.140 -1.431
196 1HB GLU 27 1HB GLU 27 9.536 2.385 -1.952
197 2HB GLU 27 2HB GLU 27 8.213 2.526 -3.101
198 1HG GLU 27 1HG GLU 27 8.660 4.720 -2.860
199 2HG GLU 27 2HG GLU 27 7.563 4.542 -1.491
200 H THR 28 H THR 28 6.766 0.202 0.456
201 HA THR 28 HA THR 28 8.554 -1.882 -0.506
202 HB THR 28 HB THR 28 7.035 -1.402 1.947
203 HG1 THR 28 1HG THR 28 9.364 -2.830 1.175
204 1HG2 THR 28 1HG2 THR 28 7.003 -4.121 0.660
205 2HG2 THR 28 2HG2 THR 28 5.664 -3.227 1.381
206 3HG2 THR 28 3HG2 THR 28 6.919 -3.917 2.410
207 HA PRO 29 HA PRO 29 5.599 -3.828 -3.126
208 1HB PRO 29 1HB PRO 29 6.585 -6.358 -3.095
209 2HB PRO 29 2HB PRO 29 7.362 -5.034 -3.971
210 1HG PRO 29 1HG PRO 29 8.032 -6.184 -1.289
211 2HG PRO 29 2HG PRO 29 9.120 -5.706 -2.604
212 1HD PRO 29 1HD PRO 29 8.679 -4.142 -0.439
213 2HD PRO 29 2HD PRO 29 9.017 -3.471 -2.047
214 H LYS 30 H LYS 30 3.579 -4.116 -2.408
215 HA LYS 30 HA LYS 30 2.824 -5.217 0.040
216 1HB LYS 30 1HB LYS 30 1.282 -3.832 -1.156
217 2HB LYS 30 2HB LYS 30 1.302 -4.907 -2.548
218 1HG LYS 30 1HG LYS 30 0.420 -6.640 -0.745
219 2HG LYS 30 2HG LYS 30 -0.143 -5.156 0.025
220 1HD LYS 30 1HD LYS 30 -0.670 -5.350 -2.864
221 2HD LYS 30 2HD LYS 30 -1.531 -6.521 -1.860
222 1HE LYS 30 1HE LYS 30 -2.392 -4.695 -0.478
223 2HE LYS 30 2HE LYS 30 -1.527 -3.527 -1.476
224 1HZ LYS 30 1HZ LYS 30 -3.486 -3.440 -2.546
225 2HZ LYS 30 2HZ LYS 30 -3.986 -4.968 -2.019
226 3HZ LYS 30 3HZ LYS 30 -2.923 -4.831 -3.328
227 HA PRO 31 HA PRO 31 3.267 -9.563 -0.521
228 1HB PRO 31 1HB PRO 31 1.501 -10.416 1.356
229 2HB PRO 31 2HB PRO 31 3.076 -9.724 1.764
230 1HG PRO 31 1HG PRO 31 0.379 -8.424 1.760
231 2HG PRO 31 2HG PRO 31 1.683 -8.291 2.955
232 1HD PRO 31 1HD PRO 31 1.224 -6.391 1.082
233 2HD PRO 31 2HD PRO 31 2.850 -6.753 1.695
Start of MODEL 17
1 1H GLY 0 1H GLY 0 -19.427 -3.246 7.129
2 1HA GLY 0 1HA GLY 0 -21.417 -1.948 6.769
3 2HA GLY 0 2HA GLY 0 -21.314 -2.213 8.503
4 H HIS 1 H HIS 1 -18.828 -0.359 8.327
5 HA HIS 1 HA HIS 1 -20.305 2.182 8.161
6 1HB HIS 1 1HB HIS 1 -19.846 1.285 10.538
7 2HB HIS 1 2HB HIS 1 -18.165 1.702 10.222
8 HD1 HIS 1 HD1 HIS 1 -17.517 4.018 10.809
9 HD2 HIS 1 HD2 HIS 1 -21.616 3.651 10.237
10 HE1 HIS 1 HE1 HIS 1 -18.483 6.264 11.402
11 H MET 2 H MET 2 -17.175 0.553 8.051
12 HA MET 2 HA MET 2 -16.269 2.121 5.877
13 1HB MET 2 1HB MET 2 -14.427 3.308 6.982
14 2HB MET 2 2HB MET 2 -15.990 3.840 7.589
15 1HG MET 2 1HG MET 2 -15.667 2.287 9.522
16 2HG MET 2 2HG MET 2 -14.027 2.012 8.942
17 1HE MET 2 1HE MET 2 -12.021 4.472 9.178
18 2HE MET 2 2HE MET 2 -12.156 4.188 10.913
19 3HE MET 2 3HE MET 2 -12.330 2.844 9.783
20 H VAL 3 H VAL 3 -15.142 0.679 4.765
21 HA VAL 3 HA VAL 3 -14.213 -1.755 5.712
22 HB VAL 3 HB VAL 3 -14.547 -1.219 3.315
23 1HG1 VAL 3 1HG1 VAL 3 -13.225 1.009 3.629
24 2HG1 VAL 3 2HG1 VAL 3 -11.825 0.007 3.238
25 3HG1 VAL 3 3HG1 VAL 3 -13.157 0.151 2.090
26 1HG2 VAL 3 1HG2 VAL 3 -12.140 -2.552 4.399
27 2HG2 VAL 3 2HG2 VAL 3 -13.443 -3.198 3.401
28 3HG2 VAL 3 3HG2 VAL 3 -12.158 -2.244 2.661
29 H ILE 4 H ILE 4 -12.316 -2.501 6.531
30 HA ILE 4 HA ILE 4 -10.189 -0.520 7.013
31 HB ILE 4 HB ILE 4 -9.702 -1.892 9.116
32 1HG1 ILE 4 1HG1 ILE 4 -12.598 -2.687 8.791
33 2HG1 ILE 4 2HG1 ILE 4 -11.256 -3.759 8.410
34 1HG2 ILE 4 1HG2 ILE 4 -12.292 -0.356 9.107
35 2HG2 ILE 4 2HG2 ILE 4 -11.162 -0.550 10.446
36 3HG2 ILE 4 3HG2 ILE 4 -10.699 0.398 9.033
37 1HD1 ILE 4 1HD1 ILE 4 -12.131 -2.714 11.069
38 2HD1 ILE 4 2HD1 ILE 4 -11.880 -4.381 10.552
39 3HD1 ILE 4 3HD1 ILE 4 -10.495 -3.322 10.820
40 H GLY 5 H GLY 5 -9.935 -1.911 4.770
41 1HA GLY 5 1HA GLY 5 -8.545 -4.409 5.190
42 2HA GLY 5 2HA GLY 5 -8.788 -3.593 3.653
43 H THR 6 H THR 6 -7.679 -1.100 5.112
44 HA THR 6 HA THR 6 -5.239 -0.877 4.013
45 HB THR 6 HB THR 6 -4.567 0.587 5.961
46 HG1 THR 6 1HG THR 6 -6.400 0.974 7.439
47 1HG2 THR 6 1HG2 THR 6 -6.858 1.987 5.629
48 2HG2 THR 6 2HG2 THR 6 -6.957 0.881 4.259
49 3HG2 THR 6 3HG2 THR 6 -5.556 1.936 4.441
50 H TRP 7 H TRP 7 -3.291 -1.788 4.174
51 HA TRP 7 HA TRP 7 -2.851 -3.723 6.332
52 1HB TRP 7 1HB TRP 7 -0.890 -4.404 4.796
53 2HB TRP 7 2HB TRP 7 -2.527 -4.795 4.275
54 HD1 TRP 7 1HD TRP 7 -3.607 -2.961 2.434
55 HE1 TRP 7 1HE TRP 7 -2.413 -1.802 0.471
56 HE3 TRP 7 3HE TRP 7 1.234 -3.538 3.973
57 HZ2 TRP 7 2HZ TRP 7 0.231 -1.211 -0.322
58 HZ3 TRP 7 3HZ TRP 7 3.037 -2.648 2.555
59 HH2 TRP 7 2HH TRP 7 2.543 -1.509 0.452
60 H ASP 8 H ASP 8 -1.176 -3.572 7.744
61 HA ASP 8 HA ASP 8 0.215 -1.016 7.839
62 1HB ASP 8 1HB ASP 8 0.638 -3.133 9.899
63 2HB ASP 8 2HB ASP 8 0.526 -1.386 10.092
64 H CYS 9 H CYS 9 2.437 -0.770 7.835
65 HA CYS 9 HA CYS 9 3.894 -2.754 6.351
66 1HB CYS 9 1HB CYS 9 4.130 -0.229 6.112
67 2HB CYS 9 2HB CYS 9 5.032 -0.265 7.622
68 H ASP 10 H ASP 10 5.994 -3.592 7.028
69 HA ASP 10 HA ASP 10 6.182 -3.964 9.945
70 1HB ASP 10 1HB ASP 10 5.353 -5.954 8.435
71 2HB ASP 10 2HB ASP 10 7.068 -6.118 8.064
72 H THR 11 H THR 11 7.571 -2.297 7.728
73 HA THR 11 HA THR 11 10.310 -2.941 8.602
74 HB THR 11 HB THR 11 9.323 -2.307 5.840
75 HG1 THR 11 1HG THR 11 9.783 -4.492 6.523
76 1HG2 THR 11 1HG2 THR 11 10.959 -0.637 6.014
77 2HG2 THR 11 2HG2 THR 11 11.816 -1.999 5.291
78 3HG2 THR 11 3HG3 THR 11 12.011 -1.645 7.007
79 H CYS 12 H CYS 12 8.181 -0.420 7.281
80 HA CYS 12 HA CYS 12 9.846 1.593 8.642
81 1HB CYS 12 1HB CYS 12 9.424 3.101 6.956
82 2HB CYS 12 2HB CYS 12 9.378 1.599 6.040
83 H LEU 13 H LEU 13 7.064 -0.099 9.001
84 HA LEU 13 HA LEU 13 5.176 0.142 10.247
85 1HB LEU 13 1HB LEU 13 6.337 2.553 11.568
86 2HB LEU 13 2HB LEU 13 5.382 1.245 12.263
87 HG LEU 13 HG LEU 13 8.281 1.073 11.440
88 1HD1 LEU 13 1HD1 LEU 13 8.316 2.313 13.388
89 2HD1 LEU 13 2HD1 LEU 13 8.446 0.663 13.995
90 3HD1 LEU 13 3HD1 LEU 13 6.897 1.504 14.054
91 1HD2 LEU 13 1HD2 LEU 13 6.290 -0.937 12.373
92 2HD2 LEU 13 2HD2 LEU 13 7.968 -1.091 12.894
93 3HD2 LEU 13 3HD2 LEU 13 7.574 -1.092 11.174
94 H VAL 14 H VAL 14 3.707 0.744 8.700
95 HA VAL 14 HA VAL 14 2.512 3.289 8.946
96 HB VAL 14 HB VAL 14 4.608 3.099 6.967
97 1HG1 VAL 14 1HG1 VAL 14 1.852 3.785 5.955
98 2HG1 VAL 14 2HG1 VAL 14 3.357 4.096 5.088
99 3HG1 VAL 14 3HG1 VAL 14 2.861 2.438 5.431
100 1HG2 VAL 14 1HG2 VAL 14 2.879 5.496 7.336
101 2HG2 VAL 14 2HG2 VAL 14 3.859 4.938 8.693
102 3HG2 VAL 14 3HG2 VAL 14 4.632 5.384 7.172
103 H GLN 15 H GLN 15 0.441 3.204 8.264
104 HA GLN 15 HA GLN 15 -0.479 0.712 7.100
105 1HB GLN 15 1HB GLN 15 -2.018 3.122 8.081
106 2HB GLN 15 2HB GLN 15 -2.737 1.606 7.557
107 1HG GLN 15 1HG GLN 15 -1.709 0.429 9.382
108 2HG GLN 15 2HG GLN 15 -0.825 1.876 9.864
109 1HE2 GLN 15 2HE2 GLN 15 -2.885 0.131 11.198
110 2HE2 GLN 15 1HE2 GLN 15 -4.079 1.240 11.772
111 H ASN 16 H ASN 16 -1.583 0.499 5.164
112 HA ASN 16 HA ASN 16 -1.811 2.847 3.439
113 1HB ASN 16 1HB ASN 16 -0.660 0.380 2.214
114 2HB ASN 16 2HB ASN 16 -0.460 2.065 1.741
115 1HD2 ASN 16 2HD2 ASN 16 0.195 0.046 4.590
116 2HD2 ASN 16 1HD2 ASN 16 1.801 0.630 4.841
117 H LYS 17 H LYS 17 -3.334 2.643 1.770
118 HA LYS 17 HA LYS 17 -5.576 1.055 2.347
119 1HB LYS 17 1HB LYS 17 -6.586 2.028 0.477
120 2HB LYS 17 2HB LYS 17 -5.422 3.242 0.993
121 1HG LYS 17 1HG LYS 17 -3.936 2.701 -0.763
122 2HG LYS 17 2HG LYS 17 -4.827 1.230 -1.159
123 1HD LYS 17 1HD LYS 17 -5.375 2.881 -2.799
124 2HD LYS 17 2HD LYS 17 -6.783 2.672 -1.755
125 1HE LYS 17 1HE LYS 17 -4.746 4.814 -1.236
126 2HE LYS 17 2HE LYS 17 -6.071 5.062 -2.373
127 1HZ LYS 17 1HZ LYS 17 -7.018 3.990 0.081
128 2HZ LYS 17 2HZ LYS 17 -7.466 5.418 -0.706
129 3HZ LYS 17 3HZ LYS 17 -6.147 5.414 0.353
130 HA PRO 18 HA PRO 18 -4.622 -2.822 0.499
131 1HB PRO 18 1HB PRO 18 -7.141 -3.713 0.013
132 2HB PRO 18 2HB PRO 18 -6.443 -3.645 1.635
133 1HG PRO 18 1HG PRO 18 -8.311 -1.728 0.295
134 2HG PRO 18 2HG PRO 18 -8.344 -2.345 1.958
135 1HD PRO 18 1HD PRO 18 -7.371 0.102 1.332
136 2HD PRO 18 2HD PRO 18 -6.727 -0.866 2.672
137 H GLU 19 H GLU 19 -6.118 -0.273 -1.173
138 HA GLU 19 HA GLU 19 -6.395 -1.710 -3.680
139 1HB GLU 19 1HB GLU 19 -6.594 1.267 -3.467
140 2HB GLU 19 2HB GLU 19 -7.486 0.163 -4.504
141 1HG GLU 19 1HG GLU 19 -7.880 0.611 -1.558
142 2HG GLU 19 2HG GLU 19 -8.977 1.050 -2.866
143 H ALA 20 H ALA 20 -3.902 -0.286 -2.001
144 HA ALA 20 HA ALA 20 -2.487 0.810 -4.275
145 1HB ALA 20 1HB ALA 20 -1.367 0.315 -1.528
146 2HB ALA 20 2HB ALA 20 -0.808 1.462 -2.745
147 3HB ALA 20 3HB ALA 20 -2.347 1.727 -1.926
148 H ILE 21 H ILE 21 -0.105 0.097 -4.499
149 HA ILE 21 HA ILE 21 -0.067 -2.845 -4.640
150 HB ILE 21 HB ILE 21 0.104 -2.123 -6.844
151 1HG1 ILE 21 1HG1 ILE 21 2.438 -2.530 -7.528
152 2HG1 ILE 21 2HG1 ILE 21 2.961 -2.306 -5.861
153 1HG2 ILE 21 1HG2 ILE 21 1.993 -0.268 -7.278
154 2HG2 ILE 21 2HG2 ILE 21 0.301 0.123 -6.973
155 3HG2 ILE 21 3HG2 ILE 21 1.476 0.204 -5.660
156 1HD1 ILE 21 1HD1 ILE 21 1.310 -4.237 -5.356
157 2HD1 ILE 21 2HD1 ILE 21 1.452 -4.567 -7.083
158 3HD1 ILE 21 3HD1 ILE 21 2.888 -4.594 -6.059
159 H LYS 22 H LYS 22 1.395 -0.119 -3.223
160 HA LYS 22 HA LYS 22 3.269 -1.786 -1.799
161 1HB LYS 22 1HB LYS 22 5.179 -0.156 -2.396
162 2HB LYS 22 2HB LYS 22 4.755 -1.404 -3.559
163 1HG LYS 22 1HG LYS 22 4.913 0.403 -4.937
164 2HG LYS 22 2HG LYS 22 3.198 0.475 -4.527
165 1HD LYS 22 1HD LYS 22 3.605 2.169 -2.874
166 2HD LYS 22 2HD LYS 22 5.352 2.005 -3.072
167 1HE LYS 22 1HE LYS 22 3.528 2.812 -5.325
168 2HE LYS 22 2HE LYS 22 4.252 3.983 -4.223
169 1HZ LYS 22 1HZ LYS 22 5.619 3.799 -6.152
170 2HZ LYS 22 2HZ LYS 22 5.687 2.114 -6.027
171 3HZ LYS 22 3HZ LYS 22 6.448 3.080 -4.865
172 H CYS 23 H CYS 23 4.566 -0.410 -0.209
173 HA CYS 23 HA CYS 23 2.818 1.033 1.412
174 1HB CYS 23 1HB CYS 23 5.166 -0.059 1.892
175 2HB CYS 23 2HB CYS 23 5.761 1.561 1.539
176 H VAL 24 H VAL 24 3.020 3.309 2.095
177 HA VAL 24 HA VAL 24 3.530 5.044 -0.231
178 HB VAL 24 HB VAL 24 1.178 4.986 0.518
179 1HG1 VAL 24 1HG1 VAL 24 0.483 5.401 2.637
180 2HG1 VAL 24 2HG1 VAL 24 2.089 4.779 3.020
181 3HG1 VAL 24 3HG1 VAL 24 1.805 6.519 2.971
182 1HG2 VAL 24 1HG2 VAL 24 1.949 7.711 1.303
183 2HG2 VAL 24 2HG2 VAL 24 2.646 7.146 -0.214
184 3HG2 VAL 24 2HG3 VAL 24 0.897 7.159 0.001
185 H ALA 25 H ALA 25 5.330 4.114 2.061
186 HA ALA 25 HA ALA 25 6.342 6.793 2.712
187 1HB ALA 25 1HB ALA 25 6.635 6.336 4.983
188 2HB ALA 25 2HB ALA 25 5.028 5.705 4.623
189 3HB ALA 25 3HB ALA 25 6.397 4.602 4.760
190 H CYS 26 H CYS 26 6.994 3.313 2.585
191 HA CYS 26 HA CYS 26 9.843 3.928 2.154
192 1HB CYS 26 1HB CYS 26 10.394 1.783 3.037
193 2HB CYS 26 2HB CYS 26 9.236 2.503 4.150
194 H GLU 27 H GLU 27 7.005 2.755 0.708
195 HA GLU 27 HA GLU 27 6.580 2.101 -1.439
196 1HB GLU 27 1HB GLU 27 9.529 2.084 -2.023
197 2HB GLU 27 2HB GLU 27 8.193 2.357 -3.134
198 1HG GLU 27 1HG GLU 27 7.955 4.541 -2.539
199 2HG GLU 27 2HG GLU 27 8.559 4.278 -0.904
200 H THR 28 H THR 28 6.833 0.239 0.625
201 HA THR 28 HA THR 28 8.444 -1.982 -0.197
202 HB THR 28 HB THR 28 6.835 -1.312 2.088
203 HG1 THR 28 1HG THR 28 8.709 -2.042 2.747
204 1HG2 THR 28 1HG2 THR 28 6.418 -4.097 0.991
205 2HG2 THR 28 2HG2 THR 28 5.180 -2.850 1.145
206 3HG2 THR 28 3HG2 THR 28 5.927 -3.534 2.589
207 HA PRO 29 HA PRO 29 5.742 -3.859 -3.119
208 1HB PRO 29 1HB PRO 29 6.537 -6.443 -2.874
209 2HB PRO 29 2HB PRO 29 7.516 -5.209 -3.675
210 1HG PRO 29 1HG PRO 29 7.735 -6.290 -0.892
211 2HG PRO 29 2HG PRO 29 9.022 -5.937 -2.058
212 1HD PRO 29 1HD PRO 29 8.400 -4.261 -0.025
213 2HD PRO 29 2HD PRO 29 8.999 -3.680 -1.592
214 H LYS 30 H LYS 30 3.629 -3.991 -2.681
215 HA LYS 30 HA LYS 30 2.425 -4.854 -0.352
216 1HB LYS 30 1HB LYS 30 1.160 -3.598 -1.948
217 2HB LYS 30 2HB LYS 30 1.387 -4.827 -3.186
218 1HG LYS 30 1HG LYS 30 0.138 -6.355 -1.463
219 2HG LYS 30 2HG LYS 30 -0.448 -4.809 -0.843
220 1HD LYS 30 1HD LYS 30 -0.860 -4.440 -3.476
221 2HD LYS 30 2HD LYS 30 -1.052 -6.192 -3.382
222 1HE LYS 30 1HE LYS 30 -2.898 -6.050 -2.014
223 2HE LYS 30 2HE LYS 30 -2.440 -4.469 -1.382
224 1HZ LYS 30 1HZ LYS 30 -3.566 -3.437 -2.984
225 2HZ LYS 30 2HZ LYS 30 -4.310 -4.924 -3.292
226 3HZ LYS 30 3HZ LYS 30 -2.967 -4.446 -4.202
227 HA PRO 31 HA PRO 31 2.821 -9.240 -0.335
228 1HB PRO 31 1HB PRO 31 0.729 -9.850 1.285
229 2HB PRO 31 2HB PRO 31 2.231 -9.134 1.882
230 1HG PRO 31 1HG PRO 31 -0.382 -7.811 1.261
231 2HG PRO 31 2HG PRO 31 0.700 -7.558 2.642
232 1HD PRO 31 1HD PRO 31 0.634 -5.880 0.517
233 2HD PRO 31 2HD PRO 31 2.116 -6.189 1.444
Start of MODEL 18
1 1H GLY 0 1H GLY 0 -11.988 8.396 9.719
2 1HA GLY 0 1HA GLY 0 -11.141 7.151 7.407
3 2HA GLY 0 2HA GLY 0 -11.739 6.295 8.821
4 H HIS 1 H HIS 1 -12.194 5.032 6.573
5 HA HIS 1 HA HIS 1 -14.917 5.729 5.713
6 1HB HIS 1 1HB HIS 1 -12.770 4.043 4.427
7 2HB HIS 1 2HB HIS 1 -14.434 4.065 3.852
8 HD1 HIS 1 HD1 HIS 1 -11.293 5.613 3.237
9 HD2 HIS 1 HD2 HIS 1 -15.236 6.921 3.247
10 HE1 HIS 1 HE1 HIS 1 -11.299 7.738 1.892
11 H MET 2 H MET 2 -16.030 3.502 4.908
12 HA MET 2 HA MET 2 -16.527 2.064 7.344
13 1HB MET 2 1HB MET 2 -18.336 2.645 5.764
14 2HB MET 2 2HB MET 2 -17.613 1.583 4.563
15 1HG MET 2 1HG MET 2 -19.572 0.661 5.855
16 2HG MET 2 2HG MET 2 -18.124 -0.343 5.796
17 1HE MET 2 1HE MET 2 -16.961 -1.210 8.504
18 2HE MET 2 2HE MET 2 -18.585 -1.603 9.069
19 3HE MET 2 3HE MET 2 -18.183 -1.758 7.357
20 H VAL 3 H VAL 3 -14.037 1.832 5.343
21 HA VAL 3 HA VAL 3 -13.825 -1.089 5.667
22 HB VAL 3 HB VAL 3 -14.143 -0.397 3.275
23 1HG1 VAL 3 1HG1 VAL 3 -12.571 0.860 2.117
24 2HG1 VAL 3 2HG1 VAL 3 -12.690 1.708 3.660
25 3HG1 VAL 3 3HG1 VAL 3 -11.330 0.628 3.349
26 1HG2 VAL 3 1HG2 VAL 3 -11.409 -1.528 3.418
27 2HG2 VAL 3 2HG2 VAL 3 -12.682 -2.387 4.284
28 3HG2 VAL 3 3HG2 VAL 3 -12.832 -2.105 2.550
29 H ILE 4 H ILE 4 -12.068 -1.783 6.716
30 HA ILE 4 HA ILE 4 -9.838 0.107 7.093
31 HB ILE 4 HB ILE 4 -9.470 -1.009 9.315
32 1HG1 ILE 4 1HG1 ILE 4 -12.301 -1.997 8.939
33 2HG1 ILE 4 2HG1 ILE 4 -10.881 -3.019 8.742
34 1HG2 ILE 4 1HG2 ILE 4 -12.167 0.297 9.227
35 2HG2 ILE 4 2HG2 ILE 4 -10.902 0.445 10.445
36 3HG2 ILE 4 3HG2 ILE 4 -10.697 1.200 8.864
37 1HD1 ILE 4 1HD1 ILE 4 -11.585 -3.464 10.901
38 2HD1 ILE 4 2HD1 ILE 4 -10.292 -2.287 11.134
39 3HD1 ILE 4 3HD1 ILE 4 -11.978 -1.777 11.228
40 H GLY 5 H GLY 5 -10.051 -1.876 5.030
41 1HA GLY 5 1HA GLY 5 -8.600 -4.223 5.730
42 2HA GLY 5 2HA GLY 5 -8.890 -3.632 4.101
43 H THR 6 H THR 6 -7.612 -1.018 5.320
44 HA THR 6 HA THR 6 -5.251 -0.970 4.027
45 HB THR 6 HB THR 6 -4.397 0.630 5.752
46 HG1 THR 6 1HG THR 6 -6.360 -0.592 7.211
47 1HG2 THR 6 1HG2 THR 6 -6.823 0.831 4.186
48 2HG2 THR 6 2HG2 THR 6 -5.552 2.025 4.445
49 3HG2 THR 6 3HG2 THR 6 -6.880 1.887 5.597
50 H TRP 7 H TRP 7 -3.243 -1.794 4.204
51 HA TRP 7 HA TRP 7 -2.781 -3.730 6.353
52 1HB TRP 7 1HB TRP 7 -0.784 -4.341 4.821
53 2HB TRP 7 2HB TRP 7 -2.408 -4.775 4.295
54 HD1 TRP 7 1HD TRP 7 -3.535 -2.993 2.448
55 HE1 TRP 7 1HE TRP 7 -2.374 -1.769 0.504
56 HE3 TRP 7 3HE TRP 7 1.310 -3.360 4.037
57 HZ2 TRP 7 2HZ TRP 7 0.248 -1.056 -0.256
58 HZ3 TRP 7 3HZ TRP 7 3.085 -2.382 2.642
59 HH2 TRP 7 2HH TRP 7 2.564 -1.254 0.540
60 H ASP 8 H ASP 8 -1.148 -3.552 7.802
61 HA ASP 8 HA ASP 8 0.269 -0.997 7.866
62 1HB ASP 8 1HB ASP 8 0.315 -3.099 10.025
63 2HB ASP 8 2HB ASP 8 0.616 -1.370 10.175
64 H CYS 9 H CYS 9 2.372 -0.800 7.442
65 HA CYS 9 HA CYS 9 3.872 -2.860 6.296
66 1HB CYS 9 1HB CYS 9 4.183 -0.264 6.230
67 2HB CYS 9 2HB CYS 9 5.203 -0.533 7.640
68 H ASP 10 H ASP 10 6.101 -3.510 7.138
69 HA ASP 10 HA ASP 10 6.038 -4.016 10.031
70 1HB ASP 10 1HB ASP 10 5.239 -5.992 8.580
71 2HB ASP 10 2HB ASP 10 6.924 -6.136 8.086
72 H THR 11 H THR 11 7.597 -2.433 7.797
73 HA THR 11 HA THR 11 10.255 -3.046 8.909
74 HB THR 11 HB THR 11 9.510 -2.451 6.054
75 HG1 THR 11 1HG THR 11 10.226 -4.623 7.415
76 1HG2 THR 11 1HG2 THR 11 11.305 -0.902 6.640
77 2HG2 THR 11 2HG2 THR 11 11.902 -2.170 5.569
78 3HG2 THR 11 3HG3 THR 11 12.254 -2.234 7.296
79 H CYS 12 H CYS 12 8.204 -0.581 7.393
80 HA CYS 12 HA CYS 12 9.862 1.497 8.654
81 1HB CYS 12 1HB CYS 12 9.354 2.929 6.927
82 2HB CYS 12 2HB CYS 12 9.287 1.389 6.074
83 H LEU 13 H LEU 13 6.978 -0.155 8.993
84 HA LEU 13 HA LEU 13 5.164 0.107 10.337
85 1HB LEU 13 1HB LEU 13 7.138 1.998 11.500
86 2HB LEU 13 2HB LEU 13 5.464 2.116 12.041
87 HG LEU 13 HG LEU 13 5.642 -0.369 12.592
88 1HD1 LEU 13 1HD1 LEU 13 7.500 -1.292 11.711
89 2HD1 LEU 13 2HD1 LEU 13 8.235 -0.717 13.207
90 3HD1 LEU 13 3HD1 LEU 13 8.396 0.228 11.727
91 1HD2 LEU 13 1HD2 LEU 13 5.772 1.654 14.171
92 2HD2 LEU 13 2HD2 LEU 13 7.506 1.327 14.218
93 3HD2 LEU 13 3HD2 LEU 13 6.360 0.099 14.759
94 H VAL 14 H VAL 14 4.022 0.761 8.393
95 HA VAL 14 HA VAL 14 2.750 3.328 8.753
96 HB VAL 14 HB VAL 14 4.337 2.738 6.256
97 1HG1 VAL 14 1HG1 VAL 14 3.227 5.205 5.873
98 2HG1 VAL 14 2HG1 VAL 14 2.646 3.705 5.149
99 3HG1 VAL 14 3HG1 VAL 14 1.905 4.317 6.627
100 1HG2 VAL 14 1HG2 VAL 14 4.404 5.000 8.247
101 2HG2 VAL 14 2HG2 VAL 14 5.642 3.769 8.000
102 3HG2 VAL 14 3HG2 VAL 14 5.321 4.962 6.742
103 H GLN 15 H GLN 15 0.659 3.244 8.169
104 HA GLN 15 HA GLN 15 -0.350 0.756 7.084
105 1HB GLN 15 1HB GLN 15 -1.616 3.196 8.292
106 2HB GLN 15 2HB GLN 15 -2.593 2.015 7.430
107 1HG GLN 15 1HG GLN 15 -2.283 0.391 9.015
108 2HG GLN 15 2HG GLN 15 -0.756 1.072 9.570
109 1HE2 GLN 15 2HE2 GLN 15 -4.158 2.062 9.311
110 2HE2 GLN 15 1HE2 GLN 15 -4.254 2.750 10.893
111 H ASN 16 H ASN 16 -1.556 0.533 5.196
112 HA ASN 16 HA ASN 16 -1.758 2.829 3.406
113 1HB ASN 16 1HB ASN 16 -0.680 0.311 2.219
114 2HB ASN 16 2HB ASN 16 -0.462 1.980 1.699
115 1HD2 ASN 16 2HD2 ASN 16 0.265 -0.063 4.510
116 2HD2 ASN 16 1HD2 ASN 16 1.872 0.528 4.736
117 H LYS 17 H LYS 17 -3.239 2.519 1.660
118 HA LYS 17 HA LYS 17 -5.511 0.975 2.373
119 1HB LYS 17 1HB LYS 17 -6.572 1.927 0.499
120 2HB LYS 17 2HB LYS 17 -5.455 3.165 1.058
121 1HG LYS 17 1HG LYS 17 -3.977 2.798 -0.718
122 2HG LYS 17 2HG LYS 17 -4.711 1.245 -1.121
123 1HD LYS 17 1HD LYS 17 -5.619 2.565 -2.760
124 2HD LYS 17 2HD LYS 17 -6.851 2.731 -1.505
125 1HE LYS 17 1HE LYS 17 -6.378 4.908 -2.373
126 2HE LYS 17 2HE LYS 17 -5.694 4.809 -0.751
127 1HZ LYS 17 1HZ LYS 17 -4.291 5.807 -2.646
128 2HZ LYS 17 2HZ LYS 17 -4.024 4.199 -3.100
129 3HZ LYS 17 3HZ LYS 17 -3.553 4.735 -1.565
130 HA PRO 18 HA PRO 18 -4.644 -2.885 0.453
131 1HB PRO 18 1HB PRO 18 -7.176 -3.737 -0.029
132 2HB PRO 18 2HB PRO 18 -6.467 -3.698 1.590
133 1HG PRO 18 1HG PRO 18 -8.318 -1.741 0.285
134 2HG PRO 18 2HG PRO 18 -8.350 -2.378 1.939
135 1HD PRO 18 1HD PRO 18 -7.349 0.065 1.338
136 2HD PRO 18 2HD PRO 18 -6.709 -0.929 2.663
137 H GLU 19 H GLU 19 -6.152 -0.305 -1.176
138 HA GLU 19 HA GLU 19 -6.440 -1.707 -3.700
139 1HB GLU 19 1HB GLU 19 -8.105 -0.139 -3.590
140 2HB GLU 19 2HB GLU 19 -7.128 0.992 -2.664
141 1HG GLU 19 1HG GLU 19 -5.934 1.662 -4.632
142 2HG GLU 19 2HG GLU 19 -6.737 0.420 -5.590
143 H ALA 20 H ALA 20 -3.930 -0.326 -2.018
144 HA ALA 20 HA ALA 20 -2.526 0.794 -4.291
145 1HB ALA 20 1HB ALA 20 -1.689 0.376 -1.426
146 2HB ALA 20 2HB ALA 20 -0.694 1.158 -2.655
147 3HB ALA 20 3HB ALA 20 -2.228 1.882 -2.171
148 H ILE 21 H ILE 21 -0.100 0.079 -4.431
149 HA ILE 21 HA ILE 21 -0.063 -2.865 -4.580
150 HB ILE 21 HB ILE 21 1.070 -2.820 -6.580
151 1HG1 ILE 21 1HG1 ILE 21 1.927 -0.001 -5.900
152 2HG1 ILE 21 2HG1 ILE 21 2.939 -1.441 -5.911
153 1HG2 ILE 21 1HG2 ILE 21 -1.128 -1.969 -7.005
154 2HG2 ILE 21 2HG2 ILE 21 -0.627 -0.331 -6.588
155 3HG2 ILE 21 3HG2 ILE 21 0.007 -1.104 -8.041
156 1HD1 ILE 21 1HD1 ILE 21 3.499 -0.394 -7.888
157 2HD1 ILE 21 2HD1 ILE 21 2.297 -1.578 -8.408
158 3HD1 ILE 21 3HD1 ILE 21 1.841 0.114 -8.208
159 H LYS 22 H LYS 22 1.384 -0.105 -3.235
160 HA LYS 22 HA LYS 22 3.367 -1.729 -1.899
161 1HB LYS 22 1HB LYS 22 5.225 -0.138 -2.505
162 2HB LYS 22 2HB LYS 22 4.675 -1.178 -3.813
163 1HG LYS 22 1HG LYS 22 3.219 0.753 -4.556
164 2HG LYS 22 2HG LYS 22 4.126 1.746 -3.413
165 1HD LYS 22 1HD LYS 22 6.220 1.039 -4.569
166 2HD LYS 22 2HD LYS 22 5.222 0.225 -5.776
167 1HE LYS 22 1HE LYS 22 5.751 2.326 -6.702
168 2HE LYS 22 2HE LYS 22 4.086 2.464 -6.136
169 1HZ LYS 22 1HZ LYS 22 5.640 3.227 -4.006
170 2HZ LYS 22 2HZ LYS 22 4.745 4.244 -5.018
171 3HZ LYS 22 3HZ LYS 22 6.378 3.948 -5.347
172 H CYS 23 H CYS 23 4.756 -0.174 -0.436
173 HA CYS 23 HA CYS 23 2.908 1.163 1.264
174 1HB CYS 23 1HB CYS 23 5.222 -0.025 1.766
175 2HB CYS 23 2HB CYS 23 5.848 1.604 1.530
176 H VAL 24 H VAL 24 2.856 3.375 1.846
177 HA VAL 24 HA VAL 24 3.626 5.157 -0.355
178 HB VAL 24 HB VAL 24 1.229 5.079 0.378
179 1HG1 VAL 24 1HG1 VAL 24 1.890 6.772 2.721
180 2HG1 VAL 24 2HG1 VAL 24 0.530 5.677 2.459
181 3HG1 VAL 24 3HG1 VAL 24 2.115 5.031 2.885
182 1HG2 VAL 24 1HG2 VAL 24 1.174 7.080 -0.581
183 2HG2 VAL 24 2HG2 VAL 24 1.643 7.826 0.946
184 3HG2 VAL 24 2HG3 VAL 24 2.880 7.319 -0.204
185 H ALA 25 H ALA 25 5.336 4.153 1.952
186 HA ALA 25 HA ALA 25 6.349 6.797 2.724
187 1HB ALA 25 1HB ALA 25 5.976 4.478 4.615
188 2HB ALA 25 2HB ALA 25 6.802 5.988 5.001
189 3HB ALA 25 3HB ALA 25 5.078 5.996 4.627
190 H CYS 26 H CYS 26 7.001 3.305 2.634
191 HA CYS 26 HA CYS 26 9.853 3.918 2.231
192 1HB CYS 26 1HB CYS 26 10.393 1.795 3.149
193 2HB CYS 26 2HB CYS 26 9.177 2.487 4.216
194 H GLU 27 H GLU 27 7.052 2.816 0.701
195 HA GLU 27 HA GLU 27 6.670 2.156 -1.451
196 1HB GLU 27 1HB GLU 27 9.595 1.989 -2.051
197 2HB GLU 27 2HB GLU 27 8.271 2.499 -3.089
198 1HG GLU 27 1HG GLU 27 8.128 4.463 -1.322
199 2HG GLU 27 2HG GLU 27 9.824 4.043 -1.095
200 H THR 28 H THR 28 6.953 0.306 0.689
201 HA THR 28 HA THR 28 8.486 -1.954 -0.159
202 HB THR 28 HB THR 28 6.763 -1.291 2.111
203 HG1 THR 28 1HG THR 28 9.217 -1.991 1.706
204 1HG2 THR 28 1HG2 THR 28 6.704 -4.061 0.930
205 2HG2 THR 28 2HG2 THR 28 5.342 -3.047 1.410
206 3HG2 THR 28 3HG2 THR 28 6.394 -3.750 2.637
207 HA PRO 29 HA PRO 29 5.672 -3.760 -3.024
208 1HB PRO 29 1HB PRO 29 6.488 -6.344 -2.860
209 2HB PRO 29 2HB PRO 29 7.428 -5.091 -3.679
210 1HG PRO 29 1HG PRO 29 7.769 -6.219 -0.927
211 2HG PRO 29 2HG PRO 29 9.004 -5.839 -2.142
212 1HD PRO 29 1HD PRO 29 8.461 -4.203 -0.054
213 2HD PRO 29 2HD PRO 29 8.990 -3.591 -1.633
214 H LYS 30 H LYS 30 3.579 -3.929 -2.518
215 HA LYS 30 HA LYS 30 2.724 -5.375 -0.155
216 1HB LYS 30 1HB LYS 30 1.596 -3.309 -0.551
217 2HB LYS 30 2HB LYS 30 1.253 -3.742 -2.220
218 1HG LYS 30 1HG LYS 30 -0.074 -5.709 -1.139
219 2HG LYS 30 2HG LYS 30 -0.062 -4.671 0.288
220 1HD LYS 30 1HD LYS 30 -1.336 -3.032 -0.732
221 2HD LYS 30 2HD LYS 30 -0.876 -3.542 -2.358
222 1HE LYS 30 1HE LYS 30 -2.152 -5.760 -1.420
223 2HE LYS 30 2HE LYS 30 -3.057 -4.470 -0.629
224 1HZ LYS 30 1HZ LYS 30 -3.468 -3.465 -2.767
225 2HZ LYS 30 2HZ LYS 30 -3.992 -5.073 -2.791
226 3HZ LYS 30 3HZ LYS 30 -2.541 -4.645 -3.549
227 HA PRO 31 HA PRO 31 1.829 -9.169 -2.203
228 1HB PRO 31 1HB PRO 31 -0.025 -10.156 -0.482
229 2HB PRO 31 2HB PRO 31 1.700 -10.097 -0.105
230 1HG PRO 31 1HG PRO 31 -0.487 -8.231 0.731
231 2HG PRO 31 2HG PRO 31 0.852 -8.889 1.691
232 1HD PRO 31 1HD PRO 31 0.893 -6.387 0.657
233 2HD PRO 31 2HD PRO 31 2.364 -7.359 0.864
Start of MODEL 19
1 1H GLY 0 1H GLY 0 -22.361 -3.745 -4.156
2 1HA GLY 0 1HA GLY 0 -21.670 -1.401 -4.114
3 2HA GLY 0 2HA GLY 0 -21.400 -1.585 -2.387
4 H HIS 1 H HIS 1 -19.443 -2.230 -1.672
5 HA HIS 1 HA HIS 1 -17.548 -3.414 -3.551
6 1HB HIS 1 1HB HIS 1 -17.233 -0.743 -2.224
7 2HB HIS 1 2HB HIS 1 -15.811 -1.725 -2.568
8 HD1 HIS 1 HD1 HIS 1 -17.749 0.867 -4.012
9 HD2 HIS 1 HD2 HIS 1 -15.876 -2.530 -5.501
10 HE1 HIS 1 HE1 HIS 1 -17.491 1.270 -6.481
11 H MET 2 H MET 2 -15.657 -4.326 -2.500
12 HA MET 2 HA MET 2 -16.036 -4.807 0.379
13 1HB MET 2 1HB MET 2 -15.101 -6.902 -1.583
14 2HB MET 2 2HB MET 2 -15.495 -7.129 0.117
15 1HG MET 2 1HG MET 2 -17.817 -6.754 -0.303
16 2HG MET 2 2HG MET 2 -17.489 -6.290 -1.971
17 1HE MET 2 1HE MET 2 -18.186 -8.880 0.553
18 2HE MET 2 2HE MET 2 -17.949 -10.446 -0.222
19 3HE MET 2 3HE MET 2 -16.560 -9.543 0.383
20 H VAL 3 H VAL 3 -14.342 -2.857 -0.700
21 HA VAL 3 HA VAL 3 -11.698 -3.998 -0.071
22 HB VAL 3 HB VAL 3 -10.747 -2.162 -1.528
23 1HG1 VAL 3 1HG1 VAL 3 -11.897 -4.692 -2.247
24 2HG1 VAL 3 2HG1 VAL 3 -11.975 -3.578 -3.615
25 3HG1 VAL 3 3HG1 VAL 3 -10.426 -3.922 -2.844
26 1HG2 VAL 3 1HG2 VAL 3 -12.045 -0.764 -2.707
27 2HG2 VAL 3 2HG2 VAL 3 -13.188 -2.035 -3.138
28 3HG2 VAL 3 3HG2 VAL 3 -13.314 -1.228 -1.575
29 H ILE 4 H ILE 4 -13.249 -3.065 1.957
30 HA ILE 4 HA ILE 4 -12.241 -0.360 2.522
31 HB ILE 4 HB ILE 4 -14.542 -1.903 3.711
32 1HG1 ILE 4 1HG1 ILE 4 -15.650 0.366 2.993
33 2HG1 ILE 4 2HG1 ILE 4 -14.243 0.499 1.943
34 1HG2 ILE 4 1HG2 ILE 4 -14.647 0.621 4.797
35 2HG2 ILE 4 2HG2 ILE 4 -14.116 -0.841 5.627
36 3HG2 ILE 4 3HG2 ILE 4 -12.930 0.224 4.873
37 1HD1 ILE 4 1HD1 ILE 4 -15.094 -2.044 1.442
38 2HD1 ILE 4 2HD1 ILE 4 -16.609 -1.181 1.706
39 3HD1 ILE 4 3HD1 ILE 4 -15.480 -0.622 0.473
40 H GLY 5 H GLY 5 -10.131 -1.516 2.901
41 1HA GLY 5 1HA GLY 5 -9.949 -2.161 5.757
42 2HA GLY 5 2HA GLY 5 -9.293 -3.313 4.604
43 H THR 6 H THR 6 -7.215 -3.048 5.520
44 HA THR 6 HA THR 6 -5.556 -1.226 4.200
45 HB THR 6 HB THR 6 -4.859 -0.078 6.517
46 HG1 THR 6 1HG THR 6 -6.662 -1.097 7.608
47 1HG2 THR 6 1HG2 THR 6 -5.296 1.708 5.261
48 2HG2 THR 6 2HG2 THR 6 -7.026 1.490 5.530
49 3HG2 THR 6 3HG2 THR 6 -6.239 0.699 4.165
50 H TRP 7 H TRP 7 -3.365 -1.611 4.586
51 HA TRP 7 HA TRP 7 -2.793 -3.783 6.495
52 1HB TRP 7 1HB TRP 7 -0.981 -4.460 4.844
53 2HB TRP 7 2HB TRP 7 -2.641 -4.766 4.342
54 HD1 TRP 7 1HD TRP 7 -3.689 -2.825 2.601
55 HE1 TRP 7 1HE TRP 7 -2.491 -1.619 0.667
56 HE3 TRP 7 3HE TRP 7 1.157 -3.622 4.023
57 HZ2 TRP 7 2HZ TRP 7 0.156 -1.079 -0.147
58 HZ3 TRP 7 3HZ TRP 7 2.962 -2.728 2.611
59 HH2 TRP 7 2HH TRP 7 2.470 -1.484 0.569
60 H ASP 8 H ASP 8 -1.084 -3.530 7.826
61 HA ASP 8 HA ASP 8 0.324 -0.970 7.703
62 1HB ASP 8 1HB ASP 8 0.426 -3.002 9.933
63 2HB ASP 8 2HB ASP 8 0.873 -1.301 10.004
64 H CYS 9 H CYS 9 2.532 -0.781 7.584
65 HA CYS 9 HA CYS 9 3.938 -2.834 6.234
66 1HB CYS 9 1HB CYS 9 4.302 -0.246 6.235
67 2HB CYS 9 2HB CYS 9 5.332 -0.572 7.626
68 H ASP 10 H ASP 10 6.191 -3.513 7.034
69 HA ASP 10 HA ASP 10 6.087 -4.192 9.897
70 1HB ASP 10 1HB ASP 10 5.410 -6.110 8.392
71 2HB ASP 10 2HB ASP 10 7.051 -6.086 7.751
72 H THR 11 H THR 11 7.698 -2.548 7.619
73 HA THR 11 HA THR 11 10.321 -3.038 8.876
74 HB THR 11 HB THR 11 9.643 -2.369 6.023
75 HG1 THR 11 1HG THR 11 11.637 -4.163 6.848
76 1HG2 THR 11 1HG2 THR 11 12.332 -2.038 7.362
77 2HG2 THR 11 2HG2 THR 11 11.323 -0.740 6.725
78 3HG2 THR 11 3HG3 THR 11 12.026 -1.928 5.629
79 H CYS 12 H CYS 12 8.398 -0.552 7.195
80 HA CYS 12 HA CYS 12 9.873 1.521 8.650
81 1HB CYS 12 1HB CYS 12 9.344 2.991 6.961
82 2HB CYS 12 2HB CYS 12 9.346 1.479 6.057
83 H LEU 13 H LEU 13 7.042 -0.242 8.875
84 HA LEU 13 HA LEU 13 5.174 -0.079 10.160
85 1HB LEU 13 1HB LEU 13 7.090 1.760 11.496
86 2HB LEU 13 2HB LEU 13 5.403 1.808 12.003
87 HG LEU 13 HG LEU 13 5.755 -0.798 12.234
88 1HD1 LEU 13 1HD1 LEU 13 8.441 -0.160 13.189
89 2HD1 LEU 13 2HD1 LEU 13 8.275 -0.113 11.434
90 3HD1 LEU 13 3HD1 LEU 13 7.847 -1.576 12.322
91 1HD2 LEU 13 1HD2 LEU 13 6.147 -0.481 14.562
92 2HD2 LEU 13 2HD2 LEU 13 5.175 0.879 14.002
93 3HD2 LEU 13 3HD2 LEU 13 6.904 1.087 14.283
94 H VAL 14 H VAL 14 4.017 0.671 8.287
95 HA VAL 14 HA VAL 14 2.771 3.238 8.755
96 HB VAL 14 HB VAL 14 4.273 2.700 6.192
97 1HG1 VAL 14 1HG1 VAL 14 3.331 5.128 5.761
98 2HG1 VAL 14 2HG1 VAL 14 2.402 3.691 5.330
99 3HG1 VAL 14 3HG1 VAL 14 2.041 4.562 6.821
100 1HG2 VAL 14 1HG2 VAL 14 4.501 4.928 8.213
101 2HG2 VAL 14 2HG2 VAL 14 5.635 3.591 8.019
102 3HG2 VAL 14 3HG2 VAL 14 5.440 4.777 6.729
103 H GLN 15 H GLN 15 0.678 3.243 8.138
104 HA GLN 15 HA GLN 15 -0.410 0.781 7.077
105 1HB GLN 15 1HB GLN 15 -1.508 3.225 8.373
106 2HB GLN 15 2HB GLN 15 -2.584 2.308 7.327
107 1HG GLN 15 1HG GLN 15 -2.080 0.285 8.665
108 2HG GLN 15 2HG GLN 15 -1.131 1.292 9.757
109 1HE2 GLN 15 2HE2 GLN 15 -2.282 3.100 10.783
110 2HE2 GLN 15 1HE2 GLN 15 -3.939 2.877 11.218
111 H ASN 16 H ASN 16 -1.570 0.551 5.173
112 HA ASN 16 HA ASN 16 -1.686 2.820 3.338
113 1HB ASN 16 1HB ASN 16 -0.670 0.247 2.215
114 2HB ASN 16 2HB ASN 16 -0.393 1.898 1.666
115 1HD2 ASN 16 2HD2 ASN 16 0.264 -0.178 4.467
116 2HD2 ASN 16 1HD2 ASN 16 1.874 0.396 4.728
117 H LYS 17 H LYS 17 -3.213 2.588 1.661
118 HA LYS 17 HA LYS 17 -5.514 1.097 2.348
119 1HB LYS 17 1HB LYS 17 -6.544 2.092 0.497
120 2HB LYS 17 2HB LYS 17 -5.337 3.274 0.983
121 1HG LYS 17 1HG LYS 17 -3.898 2.670 -0.801
122 2HG LYS 17 2HG LYS 17 -4.871 1.248 -1.188
123 1HD LYS 17 1HD LYS 17 -6.684 2.615 -1.949
124 2HD LYS 17 2HD LYS 17 -5.890 4.080 -1.366
125 1HE LYS 17 1HE LYS 17 -4.607 2.310 -3.421
126 2HE LYS 17 2HE LYS 17 -5.771 3.552 -3.877
127 1HZ LYS 17 1HZ LYS 17 -3.097 3.918 -3.542
128 2HZ LYS 17 2HZ LYS 17 -3.744 4.530 -2.104
129 3HZ LYS 17 3HZ LYS 17 -4.262 5.144 -3.593
130 HA PRO 18 HA PRO 18 -4.757 -2.808 0.474
131 1HB PRO 18 1HB PRO 18 -7.311 -3.585 -0.020
132 2HB PRO 18 2HB PRO 18 -6.615 -3.551 1.605
133 1HG PRO 18 1HG PRO 18 -8.392 -1.550 0.263
134 2HG PRO 18 2HG PRO 18 -8.456 -2.168 1.924
135 1HD PRO 18 1HD PRO 18 -7.374 0.235 1.305
136 2HD PRO 18 2HD PRO 18 -6.777 -0.764 2.646
137 H GLU 19 H GLU 19 -6.137 -0.194 -1.196
138 HA GLU 19 HA GLU 19 -6.462 -1.614 -3.708
139 1HB GLU 19 1HB GLU 19 -6.543 1.363 -3.538
140 2HB GLU 19 2HB GLU 19 -7.516 0.271 -4.511
141 1HG GLU 19 1HG GLU 19 -8.706 -0.430 -2.461
142 2HG GLU 19 2HG GLU 19 -7.786 0.772 -1.557
143 H ALA 20 H ALA 20 -3.920 -0.308 -2.017
144 HA ALA 20 HA ALA 20 -2.458 0.705 -4.312
145 1HB ALA 20 1HB ALA 20 -2.201 1.873 -2.213
146 2HB ALA 20 2HB ALA 20 -1.647 0.395 -1.425
147 3HB ALA 20 3HB ALA 20 -0.662 1.147 -2.680
148 H ILE 21 H ILE 21 -0.104 -0.071 -4.498
149 HA ILE 21 HA ILE 21 -0.109 -3.017 -4.451
150 HB ILE 21 HB ILE 21 0.010 -2.465 -6.705
151 1HG1 ILE 21 1HG1 ILE 21 2.306 -2.962 -7.421
152 2HG1 ILE 21 2HG1 ILE 21 2.899 -2.578 -5.809
153 1HG2 ILE 21 1HG2 ILE 21 1.806 -0.671 -7.412
154 2HG2 ILE 21 2HG2 ILE 21 0.191 -0.193 -6.889
155 3HG2 ILE 21 3HG2 ILE 21 1.546 -0.099 -5.764
156 1HD1 ILE 21 1HD1 ILE 21 2.775 -4.800 -5.535
157 2HD1 ILE 21 2HD1 ILE 21 1.073 -4.465 -5.216
158 3HD1 ILE 21 3HD1 ILE 21 1.580 -4.998 -6.818
159 H LYS 22 H LYS 22 1.387 -0.225 -3.236
160 HA LYS 22 HA LYS 22 3.373 -1.840 -1.866
161 1HB LYS 22 1HB LYS 22 5.206 -0.238 -2.457
162 2HB LYS 22 2HB LYS 22 4.645 -1.225 -3.801
163 1HG LYS 22 1HG LYS 22 3.226 0.693 -4.525
164 2HG LYS 22 2HG LYS 22 3.998 1.665 -3.269
165 1HD LYS 22 1HD LYS 22 5.216 2.149 -5.210
166 2HD LYS 22 2HD LYS 22 6.213 0.971 -4.351
167 1HE LYS 22 1HE LYS 22 6.265 0.070 -6.449
168 2HE LYS 22 2HE LYS 22 4.834 -0.739 -5.813
169 1HZ LYS 22 1HZ LYS 22 4.643 1.806 -7.306
170 2HZ LYS 22 2HZ LYS 22 3.425 0.672 -6.999
171 3HZ LYS 22 3HZ LYS 22 4.658 0.312 -8.100
172 H CYS 23 H CYS 23 4.778 -0.162 -0.469
173 HA CYS 23 HA CYS 23 2.895 1.063 1.293
174 1HB CYS 23 1HB CYS 23 5.266 -0.024 1.750
175 2HB CYS 23 2HB CYS 23 5.822 1.627 1.496
176 H VAL 24 H VAL 24 2.961 3.303 1.994
177 HA VAL 24 HA VAL 24 3.535 5.112 -0.256
178 HB VAL 24 HB VAL 24 1.151 4.873 0.686
179 1HG1 VAL 24 1HG1 VAL 24 2.160 5.151 3.081
180 2HG1 VAL 24 2HG1 VAL 24 2.013 6.873 2.726
181 3HG1 VAL 24 3HG1 VAL 24 0.583 5.840 2.695
182 1HG2 VAL 24 1HG2 VAL 24 2.579 7.035 -0.416
183 2HG2 VAL 24 2HG2 VAL 24 0.841 6.743 -0.474
184 3HG2 VAL 24 2HG3 VAL 24 1.529 7.706 0.833
185 H ALA 25 H ALA 25 5.305 4.141 2.044
186 HA ALA 25 HA ALA 25 6.280 6.811 2.776
187 1HB ALA 25 1HB ALA 25 5.499 4.617 4.618
188 2HB ALA 25 2HB ALA 25 6.918 5.580 5.031
189 3HB ALA 25 3HB ALA 25 5.353 6.364 4.810
190 H CYS 26 H CYS 26 6.944 3.353 2.502
191 HA CYS 26 HA CYS 26 9.795 4.001 2.129
192 1HB CYS 26 1HB CYS 26 10.396 1.911 3.070
193 2HB CYS 26 2HB CYS 26 9.170 2.577 4.144
194 H GLU 27 H GLU 27 6.987 2.869 0.655
195 HA GLU 27 HA GLU 27 6.569 2.159 -1.472
196 1HB GLU 27 1HB GLU 27 9.521 2.153 -2.040
197 2HB GLU 27 2HB GLU 27 8.191 2.402 -3.162
198 1HG GLU 27 1HG GLU 27 7.946 4.592 -2.611
199 2HG GLU 27 2HG GLU 27 8.511 4.355 -0.957
200 H THR 28 H THR 28 6.939 0.335 0.673
201 HA THR 28 HA THR 28 8.513 -1.894 -0.181
202 HB THR 28 HB THR 28 6.829 -1.246 2.113
203 HG1 THR 28 1HG THR 28 8.782 -3.268 2.068
204 1HG2 THR 28 1HG2 THR 28 6.423 -3.671 2.670
205 2HG2 THR 28 2HG2 THR 28 6.772 -4.040 0.981
206 3HG2 THR 28 3HG2 THR 28 5.400 -3.011 1.394
207 HA PRO 29 HA PRO 29 5.717 -3.818 -2.983
208 1HB PRO 29 1HB PRO 29 6.558 -6.389 -2.754
209 2HB PRO 29 2HB PRO 29 7.485 -5.147 -3.604
210 1HG PRO 29 1HG PRO 29 7.836 -6.204 -0.826
211 2HG PRO 29 2HG PRO 29 9.068 -5.842 -2.049
212 1HD PRO 29 1HD PRO 29 8.508 -4.160 -0.002
213 2HD PRO 29 2HD PRO 29 9.033 -3.582 -1.597
214 H LYS 30 H LYS 30 3.641 -3.818 -2.298
215 HA LYS 30 HA LYS 30 2.527 -4.688 0.018
216 1HB LYS 30 1HB LYS 30 1.174 -3.555 -1.599
217 2HB LYS 30 2HB LYS 30 1.406 -4.838 -2.780
218 1HG LYS 30 1HG LYS 30 0.247 -6.325 -0.983
219 2HG LYS 30 2HG LYS 30 -0.340 -4.779 -0.363
220 1HD LYS 30 1HD LYS 30 -0.774 -4.609 -3.092
221 2HD LYS 30 2HD LYS 30 -1.175 -6.284 -2.704
222 1HE LYS 30 1HE LYS 30 -2.811 -5.631 -1.135
223 2HE LYS 30 2HE LYS 30 -2.232 -3.966 -1.108
224 1HZ LYS 30 1HZ LYS 30 -3.603 -3.466 -2.755
225 2HZ LYS 30 2HZ LYS 30 -4.243 -5.029 -2.691
226 3HZ LYS 30 3HZ LYS 30 -2.960 -4.684 -3.738
227 HA PRO 31 HA PRO 31 3.053 -9.053 0.253
228 1HB PRO 31 1HB PRO 31 1.032 -9.632 1.970
229 2HB PRO 31 2HB PRO 31 2.529 -8.843 2.480
230 1HG PRO 31 1HG PRO 31 -0.140 -7.630 1.872
231 2HG PRO 31 2HG PRO 31 0.975 -7.272 3.205
232 1HD PRO 31 1HD PRO 31 0.794 -5.715 0.997
233 2HD PRO 31 2HD PRO 31 2.313 -5.931 1.890
Start of MODEL 20
1 1H GLY 0 1H GLY 0 -23.286 6.727 4.428
2 1HA GLY 0 1HA GLY 0 -24.404 4.215 4.862
3 2HA GLY 0 2HA GLY 0 -23.268 4.039 3.533
4 H HIS 1 H HIS 1 -21.147 3.832 3.973
5 HA HIS 1 HA HIS 1 -19.902 4.850 6.312
6 1HB HIS 1 1HB HIS 1 -21.294 2.726 7.024
7 2HB HIS 1 2HB HIS 1 -19.930 1.859 6.326
8 HD1 HIS 1 HD1 HIS 1 -20.865 4.071 9.195
9 HD2 HIS 1 HD2 HIS 1 -17.555 1.987 7.794
10 HE1 HIS 1 HE1 HIS 1 -19.205 4.097 11.083
11 H MET 2 H MET 2 -17.642 4.561 6.302
12 HA MET 2 HA MET 2 -16.573 3.966 3.678
13 1HB MET 2 1HB MET 2 -15.915 5.936 5.222
14 2HB MET 2 2HB MET 2 -14.937 4.751 6.075
15 1HG MET 2 1HG MET 2 -13.682 4.288 4.061
16 2HG MET 2 2HG MET 2 -14.706 5.390 3.144
17 1HE MET 2 1HE MET 2 -11.187 7.083 3.328
18 2HE MET 2 2HE MET 2 -11.111 5.475 4.048
19 3HE MET 2 3HE MET 2 -12.068 5.745 2.591
20 H VAL 3 H VAL 3 -14.629 2.628 3.421
21 HA VAL 3 HA VAL 3 -14.890 0.166 4.975
22 HB VAL 3 HB VAL 3 -14.802 0.341 2.363
23 1HG1 VAL 3 1HG1 VAL 3 -12.711 0.349 1.344
24 2HG1 VAL 3 2HG1 VAL 3 -12.561 1.599 2.582
25 3HG1 VAL 3 3HG1 VAL 3 -11.866 0.000 2.852
26 1HG2 VAL 3 1HG2 VAL 3 -12.994 -1.779 3.391
27 2HG2 VAL 3 2HG2 VAL 3 -14.625 -1.693 4.060
28 3HG2 VAL 3 3HG2 VAL 3 -14.394 -1.903 2.324
29 H ILE 4 H ILE 4 -13.124 -0.871 5.943
30 HA ILE 4 HA ILE 4 -10.655 0.695 6.201
31 HB ILE 4 HB ILE 4 -12.092 -0.560 8.543
32 1HG1 ILE 4 1HG1 ILE 4 -13.159 1.525 7.600
33 2HG1 ILE 4 2HG1 ILE 4 -12.635 1.651 9.276
34 1HG2 ILE 4 1HG2 ILE 4 -10.374 0.479 9.901
35 2HG2 ILE 4 2HG2 ILE 4 -9.640 -0.586 8.705
36 3HG2 ILE 4 3HG2 ILE 4 -9.617 1.160 8.462
37 1HD1 ILE 4 1HD1 ILE 4 -12.153 3.562 7.559
38 2HD1 ILE 4 2HD1 ILE 4 -10.960 3.123 8.782
39 3HD1 ILE 4 3HD1 ILE 4 -10.783 2.538 7.127
40 H GLY 5 H GLY 5 -9.345 -0.679 5.101
41 1HA GLY 5 1HA GLY 5 -8.940 -3.324 6.315
42 2HA GLY 5 2HA GLY 5 -9.203 -3.221 4.580
43 H THR 6 H THR 6 -7.599 -0.482 5.509
44 HA THR 6 HA THR 6 -5.340 -0.777 4.072
45 HB THR 6 HB THR 6 -4.208 0.822 5.568
46 HG1 THR 6 1HG THR 6 -5.406 1.503 7.457
47 1HG2 THR 6 1HG2 THR 6 -5.424 2.363 4.515
48 2HG2 THR 6 2HG2 THR 6 -6.700 2.175 5.718
49 3HG2 THR 6 3HG2 THR 6 -6.711 1.185 4.259
50 H TRP 7 H TRP 7 -3.229 -1.505 4.374
51 HA TRP 7 HA TRP 7 -2.942 -3.540 6.477
52 1HB TRP 7 1HB TRP 7 -1.028 -4.329 4.923
53 2HB TRP 7 2HB TRP 7 -2.690 -4.635 4.428
54 HD1 TRP 7 1HD TRP 7 -3.699 -2.776 2.583
55 HE1 TRP 7 1HE TRP 7 -2.474 -1.677 0.604
56 HE3 TRP 7 3HE TRP 7 1.126 -3.548 4.085
57 HZ2 TRP 7 2HZ TRP 7 0.185 -1.203 -0.214
58 HZ3 TRP 7 3HZ TRP 7 2.952 -2.742 2.646
59 HH2 TRP 7 2HH TRP 7 2.490 -1.594 0.542
60 H ASP 8 H ASP 8 -1.125 -3.606 7.771
61 HA ASP 8 HA ASP 8 0.341 -1.094 7.960
62 1HB ASP 8 1HB ASP 8 0.529 -3.450 9.836
63 2HB ASP 8 2HB ASP 8 0.964 -1.774 10.157
64 H CYS 9 H CYS 9 2.573 -0.924 7.888
65 HA CYS 9 HA CYS 9 3.894 -2.838 6.204
66 1HB CYS 9 1HB CYS 9 4.213 -0.295 6.195
67 2HB CYS 9 2HB CYS 9 5.217 -0.529 7.622
68 H ASP 10 H ASP 10 6.094 -3.667 6.760
69 HA ASP 10 HA ASP 10 6.192 -4.499 9.586
70 1HB ASP 10 1HB ASP 10 5.637 -6.377 8.133
71 2HB ASP 10 2HB ASP 10 7.046 -6.044 7.129
72 H THR 11 H THR 11 7.658 -2.587 7.364
73 HA THR 11 HA THR 11 10.318 -2.951 8.581
74 HB THR 11 HB THR 11 9.505 -2.365 5.787
75 HG1 THR 11 1HG THR 11 11.277 -3.701 5.400
76 1HG2 THR 11 1HG2 THR 11 11.742 -0.972 7.208
77 2HG2 THR 11 2HG2 THR 11 10.606 -0.337 6.018
78 3HG2 THR 11 3HG3 THR 11 11.911 -1.406 5.508
79 H CYS 12 H CYS 12 8.381 -0.428 6.960
80 HA CYS 12 HA CYS 12 9.623 1.580 8.684
81 1HB CYS 12 1HB CYS 12 9.118 3.151 7.082
82 2HB CYS 12 2HB CYS 12 9.247 1.718 6.069
83 H LEU 13 H LEU 13 7.188 -0.436 9.075
84 HA LEU 13 HA LEU 13 5.120 -0.414 10.072
85 1HB LEU 13 1HB LEU 13 6.651 1.595 11.715
86 2HB LEU 13 2HB LEU 13 5.120 0.872 12.204
87 HG LEU 13 HG LEU 13 7.568 -0.039 12.937
88 1HD1 LEU 13 1HD1 LEU 13 4.836 -0.943 13.015
89 2HD1 LEU 13 2HD1 LEU 13 6.115 -1.126 14.215
90 3HD1 LEU 13 3HD1 LEU 13 5.946 -2.309 12.918
91 1HD2 LEU 13 1HD2 LEU 13 6.700 -1.646 10.538
92 2HD2 LEU 13 2HD2 LEU 13 7.893 -2.179 11.722
93 3HD2 LEU 13 3HD2 LEU 13 8.209 -0.753 10.734
94 H VAL 14 H VAL 14 3.799 0.433 8.455
95 HA VAL 14 HA VAL 14 2.567 2.945 9.102
96 HB VAL 14 HB VAL 14 4.676 3.139 7.340
97 1HG1 VAL 14 1HG1 VAL 14 2.166 3.269 5.685
98 2HG1 VAL 14 2HG1 VAL 14 3.835 3.448 5.142
99 3HG1 VAL 14 3HG1 VAL 14 3.249 1.879 5.693
100 1HG2 VAL 14 1HG2 VAL 14 2.505 4.783 8.317
101 2HG2 VAL 14 2HG2 VAL 14 4.184 5.214 7.990
102 3HG2 VAL 14 3HG2 VAL 14 2.995 5.252 6.689
103 H GLN 15 H GLN 15 0.493 3.077 8.344
104 HA GLN 15 HA GLN 15 -0.570 0.665 7.125
105 1HB GLN 15 1HB GLN 15 -1.743 3.028 8.533
106 2HB GLN 15 2HB GLN 15 -2.773 2.061 7.485
107 1HG GLN 15 1HG GLN 15 -2.198 0.062 8.788
108 2HG GLN 15 2HG GLN 15 -1.213 1.060 9.856
109 1HE2 GLN 15 2HE2 GLN 15 -2.609 3.169 10.460
110 2HE2 GLN 15 1HE2 GLN 15 -4.134 2.779 11.169
111 H ASN 16 H ASN 16 -1.613 0.550 5.167
112 HA ASN 16 HA ASN 16 -1.758 2.970 3.528
113 1HB ASN 16 1HB ASN 16 -0.714 0.497 2.220
114 2HB ASN 16 2HB ASN 16 -0.437 2.187 1.808
115 1HD2 ASN 16 2HD2 ASN 16 0.090 0.104 4.637
116 2HD2 ASN 16 1HD2 ASN 16 1.732 0.580 4.891
117 H LYS 17 H LYS 17 -3.144 2.750 1.658
118 HA LYS 17 HA LYS 17 -5.536 1.370 2.227
119 1HB LYS 17 1HB LYS 17 -6.384 2.290 0.230
120 2HB LYS 17 2HB LYS 17 -5.231 3.479 0.823
121 1HG LYS 17 1HG LYS 17 -3.660 2.951 -0.817
122 2HG LYS 17 2HG LYS 17 -4.434 1.409 -1.192
123 1HD LYS 17 1HD LYS 17 -5.023 2.802 -2.979
124 2HD LYS 17 2HD LYS 17 -6.445 2.812 -1.933
125 1HE LYS 17 1HE LYS 17 -5.662 5.054 -2.858
126 2HE LYS 17 2HE LYS 17 -5.971 4.962 -1.124
127 1HZ LYS 17 1HZ LYS 17 -3.255 4.475 -2.139
128 2HZ LYS 17 2HZ LYS 17 -3.745 5.064 -0.632
129 3HZ LYS 17 3HZ LYS 17 -3.813 6.066 -1.992
130 HA PRO 18 HA PRO 18 -4.745 -2.642 0.594
131 1HB PRO 18 1HB PRO 18 -7.303 -3.423 0.128
132 2HB PRO 18 2HB PRO 18 -6.612 -3.316 1.751
133 1HG PRO 18 1HG PRO 18 -8.369 -1.369 0.309
134 2HG PRO 18 2HG PRO 18 -8.445 -1.905 1.997
135 1HD PRO 18 1HD PRO 18 -7.341 0.457 1.267
136 2HD PRO 18 2HD PRO 18 -6.756 -0.481 2.656
137 H GLU 19 H GLU 19 -6.127 -0.107 -1.204
138 HA GLU 19 HA GLU 19 -6.436 -1.645 -3.647
139 1HB GLU 19 1HB GLU 19 -6.516 1.331 -3.656
140 2HB GLU 19 2HB GLU 19 -7.519 0.178 -4.527
141 1HG GLU 19 1HG GLU 19 -8.396 -0.384 -2.116
142 2HG GLU 19 2HG GLU 19 -7.807 1.240 -1.767
143 H ALA 20 H ALA 20 -3.903 -0.251 -2.012
144 HA ALA 20 HA ALA 20 -2.434 0.669 -4.336
145 1HB ALA 20 1HB ALA 20 -1.657 0.456 -1.433
146 2HB ALA 20 2HB ALA 20 -0.624 1.118 -2.700
147 3HB ALA 20 3HB ALA 20 -2.147 1.911 -2.299
148 H ILE 21 H ILE 21 -0.137 -0.133 -4.602
149 HA ILE 21 HA ILE 21 -0.155 -3.072 -4.485
150 HB ILE 21 HB ILE 21 1.409 -1.233 -6.301
151 1HG1 ILE 21 1HG1 ILE 21 -0.860 -3.139 -6.914
152 2HG1 ILE 21 2HG1 ILE 21 -1.017 -1.390 -6.797
153 1HG2 ILE 21 1HG2 ILE 21 2.830 -2.987 -6.303
154 2HG2 ILE 21 2HG2 ILE 21 1.609 -4.116 -5.717
155 3HG2 ILE 21 3HG2 ILE 21 1.647 -3.665 -7.422
156 1HD1 ILE 21 1HD1 ILE 21 0.112 -3.056 -8.948
157 2HD1 ILE 21 2HD1 ILE 21 -0.785 -1.540 -9.031
158 3HD1 ILE 21 3HD1 ILE 21 0.930 -1.529 -8.619
159 H LYS 22 H LYS 22 1.530 -0.236 -3.458
160 HA LYS 22 HA LYS 22 3.372 -1.908 -1.924
161 1HB LYS 22 1HB LYS 22 5.262 -0.369 -2.502
162 2HB LYS 22 2HB LYS 22 4.704 -1.366 -3.839
163 1HG LYS 22 1HG LYS 22 3.315 0.612 -4.569
164 2HG LYS 22 2HG LYS 22 4.209 1.561 -3.380
165 1HD LYS 22 1HD LYS 22 6.238 1.282 -4.515
166 2HD LYS 22 2HD LYS 22 5.627 -0.083 -5.454
167 1HE LYS 22 1HE LYS 22 4.478 2.681 -5.721
168 2HE LYS 22 2HE LYS 22 5.881 2.160 -6.653
169 1HZ LYS 22 1HZ LYS 22 3.091 1.402 -6.921
170 2HZ LYS 22 2HZ LYS 22 4.207 0.145 -7.109
171 3HZ LYS 22 3HZ LYS 22 4.303 1.514 -8.098
172 H CYS 23 H CYS 23 4.775 -0.282 -0.495
173 HA CYS 23 HA CYS 23 2.888 1.053 1.178
174 1HB CYS 23 1HB CYS 23 5.197 -0.128 1.729
175 2HB CYS 23 2HB CYS 23 5.825 1.498 1.483
176 H VAL 24 H VAL 24 2.784 3.264 1.702
177 HA VAL 24 HA VAL 24 3.651 5.023 -0.483
178 HB VAL 24 HB VAL 24 1.225 4.957 0.039
179 1HG1 VAL 24 1HG1 VAL 24 0.810 4.706 2.245
180 2HG1 VAL 24 2HG1 VAL 24 2.252 5.601 2.730
181 3HG1 VAL 24 3HG1 VAL 24 0.802 6.470 2.221
182 1HG2 VAL 24 1HG2 VAL 24 1.028 7.096 -0.601
183 2HG2 VAL 24 2HG2 VAL 24 1.869 7.699 0.828
184 3HG2 VAL 24 2HG3 VAL 24 2.792 7.117 -0.558
185 H ALA 25 H ALA 25 5.112 4.062 2.076
186 HA ALA 25 HA ALA 25 6.024 6.745 2.878
187 1HB ALA 25 1HB ALA 25 6.034 6.233 5.109
188 2HB ALA 25 2HB ALA 25 4.636 5.296 4.580
189 3HB ALA 25 3HB ALA 25 6.190 4.500 4.824
190 H CYS 26 H CYS 26 6.840 3.335 2.459
191 HA CYS 26 HA CYS 26 9.676 4.114 2.250
192 1HB CYS 26 1HB CYS 26 10.323 1.992 3.122
193 2HB CYS 26 2HB CYS 26 9.078 2.619 4.198
194 H GLU 27 H GLU 27 6.974 2.784 0.679
195 HA GLU 27 HA GLU 27 6.675 2.153 -1.497
196 1HB GLU 27 1HB GLU 27 9.623 2.251 -2.022
197 2HB GLU 27 2HB GLU 27 8.289 2.601 -3.113
198 1HG GLU 27 1HG GLU 27 7.854 4.577 -1.452
199 2HG GLU 27 2HG GLU 27 9.550 4.327 -1.045
200 H THR 28 H THR 28 6.808 0.245 0.451
201 HA THR 28 HA THR 28 8.565 -1.885 -0.469
202 HB THR 28 HB THR 28 7.045 -1.340 1.976
203 HG1 THR 28 1HG THR 28 9.059 -3.244 1.911
204 1HG2 THR 28 1HG2 THR 28 7.014 -4.078 0.736
205 2HG2 THR 28 2HG2 THR 28 5.682 -3.180 1.464
206 3HG2 THR 28 3HG2 THR 28 6.953 -3.854 2.484
207 HA PRO 29 HA PRO 29 5.561 -3.822 -3.042
208 1HB PRO 29 1HB PRO 29 6.522 -6.359 -2.996
209 2HB PRO 29 2HB PRO 29 7.303 -5.053 -3.894
210 1HG PRO 29 1HG PRO 29 7.992 -6.179 -1.208
211 2HG PRO 29 2HG PRO 29 9.070 -5.726 -2.540
212 1HD PRO 29 1HD PRO 29 8.668 -4.134 -0.388
213 2HD PRO 29 2HD PRO 29 8.995 -3.485 -2.008
214 H LYS 30 H LYS 30 3.542 -4.126 -2.340
215 HA LYS 30 HA LYS 30 2.791 -5.161 0.140
216 1HB LYS 30 1HB LYS 30 1.246 -3.812 -1.096
217 2HB LYS 30 2HB LYS 30 1.266 -4.929 -2.455
218 1HG LYS 30 1HG LYS 30 0.386 -6.613 -0.617
219 2HG LYS 30 2HG LYS 30 -0.162 -5.113 0.137
220 1HD LYS 30 1HD LYS 30 -0.716 -5.413 -2.751
221 2HD LYS 30 2HD LYS 30 -1.610 -6.480 -1.667
222 1HE LYS 30 1HE LYS 30 -2.340 -4.512 -0.377
223 2HE LYS 30 2HE LYS 30 -1.489 -3.469 -1.516
224 1HZ LYS 30 1HZ LYS 30 -3.518 -3.414 -2.469
225 2HZ LYS 30 2HZ LYS 30 -4.000 -4.905 -1.832
226 3HZ LYS 30 3HZ LYS 30 -2.996 -4.852 -3.192
227 HA PRO 31 HA PRO 31 3.254 -9.517 -0.306
228 1HB PRO 31 1HB PRO 31 1.493 -10.328 1.596
229 2HB PRO 31 2HB PRO 31 3.066 -9.618 1.982
230 1HG PRO 31 1HG PRO 31 0.363 -8.330 1.949
231 2HG PRO 31 2HG PRO 31 1.669 -8.161 3.137
232 1HD PRO 31 1HD PRO 31 1.200 -6.312 1.214
233 2HD PRO 31 2HD PRO 31 2.828 -6.652 1.835