Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
2784 | 1cl4 RC | 4498 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H VAL 49 H VAL 49 53.754 -4.284 6.316
2 HA VAL 49 HA VAL 49 52.863 -4.155 3.474
3 HB VAL 49 HB VAL 49 53.934 -6.759 3.905
4 1HG1 VAL 49 1HG1 VAL 49 53.695 -5.468 1.770
5 2HG1 VAL 49 2HG1 VAL 49 55.056 -4.466 2.273
6 3HG1 VAL 49 3HG1 VAL 49 55.291 -6.189 1.979
7 1HG2 VAL 49 1HG2 VAL 49 55.876 -4.528 4.595
8 2HG2 VAL 49 2HG2 VAL 49 55.329 -5.796 5.692
9 3HG2 VAL 49 3HG2 VAL 49 56.322 -6.208 4.295
10 HA PRO 50 HA PRO 50 49.948 -6.500 6.255
11 1HB PRO 50 1HB PRO 50 47.995 -4.549 6.464
12 2HB PRO 50 2HB PRO 50 49.287 -4.802 7.644
13 1HG PRO 50 1HG PRO 50 48.971 -2.581 5.732
14 2HG PRO 50 2HG PRO 50 49.999 -2.689 7.159
15 1HD PRO 50 1HD PRO 50 50.800 -3.000 4.409
16 2HD PRO 50 2HD PRO 50 51.803 -3.124 5.866
17 H GLY 51 H GLY 51 47.962 -7.497 5.427
18 1HA GLY 51 1HA GLY 51 47.271 -6.633 2.643
19 2HA GLY 51 2HA GLY 51 47.485 -8.330 3.054
20 H LEU 52 H LEU 52 45.487 -9.173 2.810
21 HA LEU 52 HA LEU 52 43.047 -8.193 2.829
22 1HB LEU 52 1HB LEU 52 43.609 -10.680 2.750
23 2HB LEU 52 2HB LEU 52 43.409 -10.657 4.507
24 HG LEU 52 HG LEU 52 41.321 -9.552 2.594
25 1HD1 LEU 52 1HD1 LEU 52 41.854 -12.104 2.421
26 2HD1 LEU 52 2HD1 LEU 52 41.093 -12.204 4.010
27 3HD1 LEU 52 3HD1 LEU 52 40.176 -11.604 2.629
28 1HD2 LEU 52 1HD2 LEU 52 41.642 -9.748 5.492
29 2HD2 LEU 52 2HD2 LEU 52 40.568 -8.727 4.542
30 3HD2 LEU 52 3HD2 LEU 52 40.118 -10.388 4.919
31 H CYS 53 H CYS 53 42.736 -6.535 3.895
32 HA CYS 53 HA CYS 53 43.024 -5.427 6.262
33 1HB CYS 53 1HB CYS 53 41.380 -4.636 4.644
34 2HB CYS 53 2HB CYS 53 40.307 -5.981 5.029
35 HA PRO 54 HA PRO 54 42.077 -8.503 9.340
36 1HB PRO 54 1HB PRO 54 42.689 -6.913 11.498
37 2HB PRO 54 2HB PRO 54 43.911 -7.717 10.496
38 1HG PRO 54 1HG PRO 54 43.141 -4.837 10.566
39 2HG PRO 54 2HG PRO 54 44.684 -5.578 10.100
40 1HD PRO 54 1HD PRO 54 42.704 -4.600 8.324
41 2HD PRO 54 2HD PRO 54 44.093 -5.618 7.887
42 H ARG 55 H ARG 55 40.190 -6.065 8.405
43 HA ARG 55 HA ARG 55 38.304 -6.341 10.700
44 1HB ARG 55 1HB ARG 55 39.374 -3.993 9.886
45 2HB ARG 55 2HB ARG 55 37.986 -4.072 8.800
46 1HG ARG 55 1HG ARG 55 37.024 -3.034 10.641
47 2HG ARG 55 2HG ARG 55 36.693 -4.726 11.014
48 1HD ARG 55 1HD ARG 55 39.001 -4.665 12.226
49 2HD ARG 55 2HD ARG 55 38.791 -2.914 12.189
50 HE ARG 55 HE ARG 55 36.675 -4.652 13.378
51 1HH1 ARG 55 1HH1 ARG 55 37.367 -1.486 13.135
52 2HH1 ARG 55 2HH1 ARG 55 37.532 -1.157 14.828
53 1HH2 ARG 55 1HH2 ARG 55 37.581 -4.501 15.744
54 2HH2 ARG 55 2HH2 ARG 55 37.652 -2.863 16.304
55 H CYS 56 H CYS 56 38.607 -6.025 7.149
56 HA CYS 56 HA CYS 56 35.920 -7.305 6.971
57 1HB CYS 56 1HB CYS 56 35.620 -6.302 4.809
58 2HB CYS 56 2HB CYS 56 36.189 -5.025 5.882
59 H LYS 57 H LYS 57 36.635 -7.837 4.079
60 HA LYS 57 HA LYS 57 38.751 -9.753 4.088
61 1HB LYS 57 1HB LYS 57 35.878 -10.621 4.215
62 2HB LYS 57 2HB LYS 57 37.039 -11.583 3.300
63 1HG LYS 57 1HG LYS 57 37.531 -10.816 6.182
64 2HG LYS 57 2HG LYS 57 36.633 -12.259 5.745
65 1HD LYS 57 1HD LYS 57 38.953 -12.270 4.132
66 2HD LYS 57 2HD LYS 57 39.484 -11.858 5.763
67 1HE LYS 57 1HE LYS 57 37.517 -14.089 5.425
68 2HE LYS 57 2HE LYS 57 39.214 -14.391 5.049
69 1HZ LYS 57 1HZ LYS 57 38.457 -13.064 7.570
70 2HZ LYS 57 2HZ LYS 57 38.390 -14.757 7.441
71 3HZ LYS 57 3HZ LYS 57 39.861 -13.948 7.205
72 H ARG 58 H ARG 58 37.449 -7.378 2.584
73 HA ARG 58 HA ARG 58 37.597 -8.697 -0.093
74 1HB ARG 58 1HB ARG 58 35.297 -7.622 0.940
75 2HB ARG 58 2HB ARG 58 35.972 -6.236 0.083
76 1HG ARG 58 1HG ARG 58 36.163 -7.559 -1.969
77 2HG ARG 58 2HG ARG 58 35.563 -8.987 -1.126
78 1HD ARG 58 1HD ARG 58 33.650 -8.127 -2.214
79 2HD ARG 58 2HD ARG 58 33.495 -7.538 -0.559
80 HE ARG 58 HE ARG 58 34.161 -5.329 -1.335
81 1HH1 ARG 58 1HH1 ARG 58 35.460 -7.068 -3.750
82 2HH1 ARG 58 2HH1 ARG 58 34.679 -6.255 -5.065
83 1HH2 ARG 58 1HH2 ARG 58 32.443 -4.556 -3.028
84 2HH2 ARG 58 2HH2 ARG 58 32.966 -4.833 -4.656
85 H GLY 59 H GLY 59 39.535 -7.191 1.694
86 1HA GLY 59 1HA GLY 59 40.589 -5.494 -0.467
87 2HA GLY 59 2HA GLY 59 40.117 -4.608 0.989
88 H LYS 60 H LYS 60 42.786 -4.645 0.220
89 HA LYS 60 HA LYS 60 43.982 -6.459 2.278
90 1HB LYS 60 1HB LYS 60 44.751 -5.851 -0.502
91 2HB LYS 60 2HB LYS 60 46.081 -5.705 0.653
92 1HG LYS 60 1HG LYS 60 46.206 -7.943 0.916
93 2HG LYS 60 2HG LYS 60 44.465 -8.075 1.169
94 1HD LYS 60 1HD LYS 60 44.344 -7.665 -1.428
95 2HD LYS 60 2HD LYS 60 46.019 -8.217 -1.398
96 1HE LYS 60 1HE LYS 60 45.434 -10.341 -0.568
97 2HE LYS 60 2HE LYS 60 43.858 -9.787 -0.003
98 1HZ LYS 60 1HZ LYS 60 43.449 -9.311 -2.486
99 2HZ LYS 60 2HZ LYS 60 44.735 -10.386 -2.751
100 3HZ LYS 60 3HZ LYS 60 43.344 -10.914 -1.930
101 H HIS 61 H HIS 61 42.978 -4.207 3.258
102 HA HIS 61 HA HIS 61 45.350 -2.392 3.545
103 1HB HIS 61 1HB HIS 61 43.584 -0.620 3.985
104 2HB HIS 61 2HB HIS 61 43.765 -1.131 2.296
105 HD1 HIS 61 HD1 HIS 61 41.735 -2.168 1.184
106 HD2 HIS 61 HD2 HIS 61 41.314 -2.002 5.332
107 HE1 HIS 61 HE1 HIS 61 39.393 -2.988 1.706
108 H TRP 62 H TRP 62 44.609 -0.777 5.446
109 HA TRP 62 HA TRP 62 44.327 -2.577 7.768
110 1HB TRP 62 1HB TRP 62 45.075 0.192 8.325
111 2HB TRP 62 2HB TRP 62 45.922 -1.303 8.689
112 HD1 TRP 62 HD1 TRP 62 46.811 1.628 7.115
113 HE1 TRP 62 HE1 TRP 62 48.352 1.336 5.066
114 HE3 TRP 62 HE3 TRP 62 46.061 -3.312 6.167
115 HZ2 TRP 62 HZ2 TRP 62 49.134 -0.741 3.239
116 HZ3 TRP 62 HZ3 TRP 62 47.148 -4.406 4.255
117 HH2 TRP 62 HH2 TRP 62 48.709 -3.150 2.805
118 H ALA 63 H ALA 63 43.097 -1.786 9.644
119 HA ALA 63 HA ALA 63 40.425 -1.247 9.153
120 1HB ALA 63 1HB ALA 63 42.193 -0.745 11.521
121 2HB ALA 63 2HB ALA 63 40.524 -0.176 11.555
122 3HB ALA 63 3HB ALA 63 40.867 -1.893 11.342
123 H ASN 64 H ASN 64 42.534 1.304 10.531
124 HA ASN 64 HA ASN 64 40.953 3.510 10.220
125 1HB ASN 64 1HB ASN 64 43.902 3.145 9.767
126 2HB ASN 64 2HB ASN 64 43.160 4.720 9.461
127 1HD2 ASN 64 1HD2 ASN 64 43.409 2.202 12.028
128 2HD2 ASN 64 2HD2 ASN 64 43.265 3.296 13.318
129 H GLU 65 H GLU 65 42.770 1.953 7.593
130 HA GLU 65 HA GLU 65 41.315 3.703 5.658
131 1HB GLU 65 1HB GLU 65 43.729 3.794 5.381
132 2HB GLU 65 2HB GLU 65 43.829 2.030 5.353
133 1HG GLU 65 1HG GLU 65 43.288 1.945 3.163
134 2HG GLU 65 2HG GLU 65 41.929 3.049 3.386
135 H CYS 66 H CYS 66 39.531 2.021 6.468
136 HA CYS 66 HA CYS 66 39.521 -0.171 4.442
137 1HB CYS 66 1HB CYS 66 40.004 -1.344 6.449
138 2HB CYS 66 2HB CYS 66 38.890 -0.359 7.390
139 H LYS 67 H LYS 67 37.581 -0.497 3.446
140 HA LYS 67 HA LYS 67 35.078 0.509 4.526
141 1HB LYS 67 1HB LYS 67 34.621 1.936 2.452
142 2HB LYS 67 2HB LYS 67 35.787 2.625 3.582
143 1HG LYS 67 1HG LYS 67 37.643 1.786 2.218
144 2HG LYS 67 2HG LYS 67 36.503 1.026 1.105
145 1HD LYS 67 1HD LYS 67 35.965 3.879 1.580
146 2HD LYS 67 2HD LYS 67 37.524 3.569 0.816
147 1HE LYS 67 1HE LYS 67 36.432 3.320 -1.138
148 2HE LYS 67 2HE LYS 67 35.716 1.849 -0.479
149 1HZ LYS 67 1HZ LYS 67 34.228 3.795 0.650
150 2HZ LYS 67 2HZ LYS 67 34.540 4.445 -0.889
151 3HZ LYS 67 3HZ LYS 67 33.794 2.925 -0.741
152 H SER 68 H SER 68 34.421 -1.461 4.380
153 HA SER 68 HA SER 68 34.653 -3.098 1.991
154 1HB SER 68 1HB SER 68 34.076 -3.291 4.789
155 2HB SER 68 2HB SER 68 32.847 -4.187 3.875
156 HG SER 68 HG SER 68 35.592 -4.420 3.258
157 H LYS 69 H LYS 69 33.224 -3.015 0.333
158 HA LYS 69 HA LYS 69 30.677 -1.569 0.653
159 1HB LYS 69 1HB LYS 69 32.400 -1.708 -1.427
160 2HB LYS 69 2HB LYS 69 31.298 -3.009 -1.876
161 1HG LYS 69 1HG LYS 69 30.469 -0.947 -2.846
162 2HG LYS 69 2HG LYS 69 29.384 -1.418 -1.537
163 1HD LYS 69 1HD LYS 69 31.113 0.083 -0.126
164 2HD LYS 69 2HD LYS 69 31.279 0.872 -1.695
165 1HE LYS 69 1HE LYS 69 28.524 0.259 -0.701
166 2HE LYS 69 2HE LYS 69 29.386 1.626 0.008
167 1HZ LYS 69 1HZ LYS 69 29.756 1.719 -2.754
168 2HZ LYS 69 2HZ LYS 69 28.097 1.474 -2.479
169 3HZ LYS 69 3HZ LYS 69 28.890 2.804 -1.779
170 H THR 70 H THR 70 29.862 -3.240 2.206
171 HA THR 70 HA THR 70 28.705 -5.556 0.714
172 HB THR 70 HB THR 70 29.973 -5.451 3.452
173 HG1 THR 70 HG1 THR 70 30.679 -7.572 2.401
174 1HG2 THR 70 1HG2 THR 70 27.860 -7.337 2.426
175 2HG2 THR 70 2HG2 THR 70 29.051 -7.864 3.611
176 3HG2 THR 70 3HG2 THR 70 27.957 -6.540 3.993
177 H ASP 71 H ASP 71 28.330 -3.316 3.463
178 HA ASP 71 HA ASP 71 25.408 -3.340 2.987
179 1HB ASP 71 1HB ASP 71 26.301 -5.043 4.864
180 2HB ASP 71 2HB ASP 71 26.229 -3.576 5.842
181 H ASN 72 H ASN 72 24.842 -1.918 5.455
182 HA ASN 72 HA ASN 72 26.279 0.640 4.864
183 1HB ASN 72 1HB ASN 72 24.235 1.813 5.518
184 2HB ASN 72 2HB ASN 72 23.863 0.641 4.248
185 1HD2 ASN 72 1HD2 ASN 72 21.754 1.445 5.883
186 2HD2 ASN 72 2HD2 ASN 72 21.323 0.188 6.939
187 H GLN 73 H GLN 73 27.472 -1.045 6.698
188 HA GLN 73 HA GLN 73 26.950 0.395 9.249
189 1HB GLN 73 1HB GLN 73 27.772 -1.922 10.244
190 2HB GLN 73 2HB GLN 73 26.069 -1.659 9.868
191 1HG GLN 73 1HG GLN 73 27.622 -2.601 7.565
192 2HG GLN 73 2HG GLN 73 27.643 -3.734 8.911
193 1HE2 GLN 73 1HE2 GLN 73 24.895 -1.558 8.424
194 2HE2 GLN 73 2HE2 GLN 73 23.797 -2.772 7.946
195 H GLY 74 H GLY 74 29.268 -2.190 8.971
196 1HA GLY 74 1HA GLY 74 31.487 -0.273 8.498
197 2HA GLY 74 2HA GLY 74 31.524 -1.261 9.967
198 H ASN 75 H ASN 75 31.143 -3.686 9.514
199 HA ASN 75 HA ASN 75 32.293 -4.503 6.904
200 1HB ASN 75 1HB ASN 75 33.421 -6.329 8.435
201 2HB ASN 75 2HB ASN 75 34.234 -4.808 8.092
202 1HD2 ASN 75 1HD2 ASN 75 31.475 -5.329 10.314
203 2HD2 ASN 75 2HD2 ASN 75 32.306 -4.838 11.719
204 HA PRO 76 HA PRO 76 28.682 -7.083 7.961
205 1HB PRO 76 1HB PRO 76 27.317 -6.470 5.668
206 2HB PRO 76 2HB PRO 76 27.256 -5.447 7.114
207 1HG PRO 76 1HG PRO 76 28.592 -4.903 4.537
208 2HG PRO 76 2HG PRO 76 28.177 -3.774 5.834
209 1HD PRO 76 1HD PRO 76 30.764 -5.013 5.276
210 2HD PRO 76 2HD PRO 76 30.379 -3.797 6.514
211 H ILE 77 H ILE 77 31.321 -7.408 6.406
212 HA ILE 77 HA ILE 77 31.002 -8.760 4.014
213 HB ILE 77 HB ILE 77 32.982 -9.862 5.989
214 1HG1 ILE 77 1HG1 ILE 77 33.110 -7.505 6.517
215 2HG1 ILE 77 2HG1 ILE 77 34.459 -7.870 5.439
216 1HG2 ILE 77 1HG2 ILE 77 32.613 -9.720 3.122
217 2HG2 ILE 77 2HG2 ILE 77 34.167 -9.020 3.576
218 3HG2 ILE 77 3HG2 ILE 77 33.773 -10.673 4.047
219 1HD1 ILE 77 1HD1 ILE 77 31.810 -6.858 4.395
220 2HD1 ILE 77 2HD1 ILE 77 33.102 -5.764 4.892
221 3HD1 ILE 77 3HD1 ILE 77 33.366 -6.896 3.565
222 HA PRO 78 HA PRO 78 28.577 -12.199 5.430
223 1HB PRO 78 1HB PRO 78 28.460 -13.508 3.005
224 2HB PRO 78 2HB PRO 78 27.422 -12.149 3.478
225 1HG PRO 78 1HG PRO 78 29.741 -12.174 1.606
226 2HG PRO 78 2HG PRO 78 28.346 -11.088 1.650
227 1HD PRO 78 1HD PRO 78 30.930 -10.459 2.596
228 2HD PRO 78 2HD PRO 78 29.444 -9.558 2.959
229 HA PRO 79 HA PRO 79 31.836 -15.568 4.406
230 1HB PRO 79 1HB PRO 79 34.354 -14.684 3.750
231 2HB PRO 79 2HB PRO 79 33.111 -15.081 2.546
232 1HG PRO 79 1HG PRO 79 34.073 -12.402 3.442
233 2HG PRO 79 2HG PRO 79 33.384 -12.884 1.883
234 1HD PRO 79 1HD PRO 79 32.005 -11.518 3.927
235 2HD PRO 79 2HD PRO 79 31.267 -12.341 2.543
236 H HIS 80 H HIS 80 32.810 -12.515 5.863
237 HA HIS 80 HA HIS 80 33.377 -13.816 8.401
238 1HB HIS 80 1HB HIS 80 35.507 -13.793 6.642
239 2HB HIS 80 2HB HIS 80 35.777 -12.329 7.589
240 HD1 HIS 80 HD1 HIS 80 35.309 -16.065 8.014
241 HD2 HIS 80 HD2 HIS 80 36.600 -12.778 10.231
242 HE1 HIS 80 HE1 HIS 80 36.276 -16.987 10.166
Start of MODEL 2
1 H VAL 49 H VAL 49 53.364 -4.887 7.927
2 HA VAL 49 HA VAL 49 52.865 -4.145 5.082
3 HB VAL 49 HB VAL 49 54.305 -6.685 5.852
4 1HG1 VAL 49 1HG1 VAL 49 53.509 -5.277 3.349
5 2HG1 VAL 49 2HG1 VAL 49 55.081 -6.077 3.347
6 3HG1 VAL 49 3HG1 VAL 49 53.619 -7.005 3.679
7 1HG2 VAL 49 1HG2 VAL 49 55.407 -3.945 5.189
8 2HG2 VAL 49 2HG2 VAL 49 55.780 -4.952 6.588
9 3HG2 VAL 49 3HG2 VAL 49 56.356 -5.419 4.987
10 HA PRO 50 HA PRO 50 49.604 -6.930 6.894
11 1HB PRO 50 1HB PRO 50 47.593 -5.025 6.986
12 2HB PRO 50 2HB PRO 50 48.651 -5.438 8.341
13 1HG PRO 50 1HG PRO 50 48.654 -2.976 6.705
14 2HG PRO 50 2HG PRO 50 49.388 -3.275 8.278
15 1HD PRO 50 1HD PRO 50 50.704 -3.210 5.725
16 2HD PRO 50 2HD PRO 50 51.413 -3.554 7.314
17 H GLY 51 H GLY 51 47.647 -7.690 5.673
18 1HA GLY 51 1HA GLY 51 47.628 -6.633 2.873
19 2HA GLY 51 2HA GLY 51 47.617 -8.362 3.207
20 H LEU 52 H LEU 52 45.679 -9.052 2.536
21 HA LEU 52 HA LEU 52 43.347 -8.449 1.851
22 1HB LEU 52 1HB LEU 52 43.558 -10.636 2.860
23 2HB LEU 52 2HB LEU 52 43.498 -9.924 4.480
24 HG LEU 52 HG LEU 52 41.294 -9.246 2.595
25 1HD1 LEU 52 1HD1 LEU 52 41.920 -11.894 2.809
26 2HD1 LEU 52 2HD1 LEU 52 40.842 -11.695 4.191
27 3HD1 LEU 52 3HD1 LEU 52 40.280 -11.291 2.568
28 1HD2 LEU 52 1HD2 LEU 52 41.873 -9.177 5.429
29 2HD2 LEU 52 2HD2 LEU 52 40.639 -8.310 4.514
30 3HD2 LEU 52 3HD2 LEU 52 40.322 -9.943 5.102
31 H CYS 53 H CYS 53 43.557 -8.136 5.291
32 HA CYS 53 HA CYS 53 43.201 -5.735 6.140
33 1HB CYS 53 1HB CYS 53 41.687 -5.142 4.314
34 2HB CYS 53 2HB CYS 53 40.518 -6.335 4.867
35 HA PRO 54 HA PRO 54 41.955 -8.326 9.526
36 1HB PRO 54 1HB PRO 54 42.630 -6.515 11.480
37 2HB PRO 54 2HB PRO 54 43.813 -7.530 10.637
38 1HG PRO 54 1HG PRO 54 43.269 -4.618 10.315
39 2HG PRO 54 2HG PRO 54 44.759 -5.525 9.994
40 1HD PRO 54 1HD PRO 54 42.889 -4.640 8.051
41 2HD PRO 54 2HD PRO 54 44.218 -5.788 7.785
42 H ARG 55 H ARG 55 40.286 -5.893 8.214
43 HA ARG 55 HA ARG 55 38.337 -5.715 10.474
44 1HB ARG 55 1HB ARG 55 39.596 -3.610 9.154
45 2HB ARG 55 2HB ARG 55 38.022 -3.708 8.363
46 1HG ARG 55 1HG ARG 55 37.770 -2.242 10.258
47 2HG ARG 55 2HG ARG 55 36.977 -3.764 10.670
48 1HD ARG 55 1HD ARG 55 39.828 -3.732 11.359
49 2HD ARG 55 2HD ARG 55 38.898 -2.500 12.211
50 HE ARG 55 HE ARG 55 37.470 -4.962 12.358
51 1HH1 ARG 55 1HH1 ARG 55 40.618 -3.874 13.170
52 2HH1 ARG 55 2HH1 ARG 55 40.618 -4.598 14.744
53 1HH2 ARG 55 1HH2 ARG 55 37.345 -5.721 14.519
54 2HH2 ARG 55 2HH2 ARG 55 38.766 -5.643 15.506
55 H CYS 56 H CYS 56 38.529 -5.538 6.891
56 HA CYS 56 HA CYS 56 35.892 -6.921 6.822
57 1HB CYS 56 1HB CYS 56 35.620 -6.091 4.578
58 2HB CYS 56 2HB CYS 56 36.163 -4.727 5.549
59 H LYS 57 H LYS 57 36.650 -7.660 3.972
60 HA LYS 57 HA LYS 57 38.850 -9.433 4.141
61 1HB LYS 57 1HB LYS 57 36.179 -10.431 4.821
62 2HB LYS 57 2HB LYS 57 36.975 -11.350 3.538
63 1HG LYS 57 1HG LYS 57 38.935 -11.698 4.943
64 2HG LYS 57 2HG LYS 57 38.243 -10.686 6.212
65 1HD LYS 57 1HD LYS 57 36.607 -12.269 6.763
66 2HD LYS 57 2HD LYS 57 36.720 -13.075 5.197
67 1HE LYS 57 1HE LYS 57 38.426 -14.403 5.878
68 2HE LYS 57 2HE LYS 57 39.245 -13.075 6.700
69 1HZ LYS 57 1HZ LYS 57 36.929 -13.583 8.128
70 2HZ LYS 57 2HZ LYS 57 37.613 -15.103 7.798
71 3HZ LYS 57 3HZ LYS 57 38.526 -13.921 8.600
72 H ARG 58 H ARG 58 37.591 -7.316 2.461
73 HA ARG 58 HA ARG 58 37.526 -8.866 -0.092
74 1HB ARG 58 1HB ARG 58 35.436 -7.366 1.032
75 2HB ARG 58 2HB ARG 58 36.120 -6.328 -0.223
76 1HG ARG 58 1HG ARG 58 35.300 -9.223 -0.630
77 2HG ARG 58 2HG ARG 58 34.326 -7.829 -1.096
78 1HD ARG 58 1HD ARG 58 36.822 -7.279 -2.195
79 2HD ARG 58 2HD ARG 58 36.628 -9.012 -2.449
80 HE ARG 58 HE ARG 58 35.407 -7.184 -4.088
81 1HH1 ARG 58 1HH1 ARG 58 34.681 -10.087 -2.542
82 2HH1 ARG 58 2HH1 ARG 58 33.001 -10.089 -2.964
83 1HH2 ARG 58 1HH2 ARG 58 33.065 -6.886 -4.296
84 2HH2 ARG 58 2HH2 ARG 58 32.085 -8.274 -3.959
85 H GLY 59 H GLY 59 39.773 -7.401 1.323
86 1HA GLY 59 1HA GLY 59 40.590 -5.880 -1.060
87 2HA GLY 59 2HA GLY 59 40.346 -4.887 0.377
88 H LYS 60 H LYS 60 42.384 -4.353 0.871
89 HA LYS 60 HA LYS 60 44.137 -6.352 2.086
90 1HB LYS 60 1HB LYS 60 44.503 -5.839 -0.653
91 2HB LYS 60 2HB LYS 60 45.701 -4.821 0.154
92 1HG LYS 60 1HG LYS 60 46.461 -6.807 1.452
93 2HG LYS 60 2HG LYS 60 45.327 -7.806 0.547
94 1HD LYS 60 1HD LYS 60 47.440 -6.108 -0.794
95 2HD LYS 60 2HD LYS 60 47.716 -7.790 -0.339
96 1HE LYS 60 1HE LYS 60 46.521 -8.556 -2.094
97 2HE LYS 60 2HE LYS 60 45.191 -7.445 -1.761
98 1HZ LYS 60 1HZ LYS 60 47.295 -5.904 -2.685
99 2HZ LYS 60 2HZ LYS 60 47.216 -7.248 -3.720
100 3HZ LYS 60 3HZ LYS 60 45.849 -6.269 -3.499
101 H HIS 61 H HIS 61 43.441 -4.780 3.812
102 HA HIS 61 HA HIS 61 45.411 -2.659 4.107
103 1HB HIS 61 1HB HIS 61 43.613 -0.866 4.201
104 2HB HIS 61 2HB HIS 61 44.123 -1.397 2.586
105 HD1 HIS 61 HD1 HIS 61 42.342 -2.480 1.103
106 HD2 HIS 61 HD2 HIS 61 41.114 -2.192 5.077
107 HE1 HIS 61 HE1 HIS 61 39.908 -3.221 1.168
108 H TRP 62 H TRP 62 44.385 -0.987 5.830
109 HA TRP 62 HA TRP 62 43.491 -2.744 8.049
110 1HB TRP 62 1HB TRP 62 44.568 -0.261 8.979
111 2HB TRP 62 2HB TRP 62 45.222 -1.882 9.145
112 HD1 TRP 62 HD1 TRP 62 46.290 1.263 7.930
113 HE1 TRP 62 HE1 TRP 62 48.098 1.076 6.102
114 HE3 TRP 62 HE3 TRP 62 45.741 -3.639 6.665
115 HZ2 TRP 62 HZ2 TRP 62 49.145 -0.899 4.312
116 HZ3 TRP 62 HZ3 TRP 62 47.104 -4.633 4.872
117 HH2 TRP 62 HH2 TRP 62 48.830 -3.289 3.712
118 H ALA 63 H ALA 63 42.305 -1.526 9.817
119 HA ALA 63 HA ALA 63 39.809 -0.637 8.976
120 1HB ALA 63 1HB ALA 63 41.376 -0.367 11.491
121 2HB ALA 63 2HB ALA 63 39.954 0.663 11.318
122 3HB ALA 63 3HB ALA 63 39.790 -1.090 11.224
123 H ASN 64 H ASN 64 42.209 1.637 10.383
124 HA ASN 64 HA ASN 64 41.030 4.036 9.772
125 1HB ASN 64 1HB ASN 64 43.223 3.907 10.857
126 2HB ASN 64 2HB ASN 64 43.958 3.364 9.344
127 1HD2 ASN 64 1HD2 ASN 64 44.928 5.032 8.194
128 2HD2 ASN 64 2HD2 ASN 64 44.452 6.660 8.238
129 H GLU 65 H GLU 65 42.764 1.957 7.488
130 HA GLU 65 HA GLU 65 41.703 3.669 5.274
131 1HB GLU 65 1HB GLU 65 44.204 3.575 5.435
132 2HB GLU 65 2HB GLU 65 44.115 1.822 5.220
133 1HG GLU 65 1HG GLU 65 43.931 2.061 2.991
134 2HG GLU 65 2HG GLU 65 42.545 3.134 3.185
135 H CYS 66 H CYS 66 39.834 2.017 6.108
136 HA CYS 66 HA CYS 66 39.991 -0.315 4.250
137 1HB CYS 66 1HB CYS 66 40.226 -1.278 6.419
138 2HB CYS 66 2HB CYS 66 38.992 -0.220 7.102
139 H LYS 67 H LYS 67 37.995 -1.005 3.372
140 HA LYS 67 HA LYS 67 35.577 0.592 3.859
141 1HB LYS 67 1HB LYS 67 37.078 1.660 1.961
142 2HB LYS 67 2HB LYS 67 36.464 0.317 0.996
143 1HG LYS 67 1HG LYS 67 34.161 0.994 1.444
144 2HG LYS 67 2HG LYS 67 34.721 2.282 2.510
145 1HD LYS 67 1HD LYS 67 35.906 3.332 0.606
146 2HD LYS 67 2HD LYS 67 35.305 2.061 -0.457
147 1HE LYS 67 1HE LYS 67 33.133 2.856 -0.412
148 2HE LYS 67 2HE LYS 67 33.320 3.580 1.184
149 1HZ LYS 67 1HZ LYS 67 35.112 4.946 -0.288
150 2HZ LYS 67 2HZ LYS 67 33.866 4.696 -1.414
151 3HZ LYS 67 3HZ LYS 67 33.535 5.478 0.054
152 H SER 68 H SER 68 33.692 -0.501 3.113
153 HA SER 68 HA SER 68 33.834 -2.982 1.647
154 1HB SER 68 1HB SER 68 34.601 -3.000 4.375
155 2HB SER 68 2HB SER 68 33.016 -3.792 4.281
156 HG SER 68 HG SER 68 35.477 -4.500 3.136
157 H LYS 69 H LYS 69 32.119 -1.159 1.022
158 HA LYS 69 HA LYS 69 29.750 -0.919 2.606
159 1HB LYS 69 1HB LYS 69 30.455 -0.373 -0.257
160 2HB LYS 69 2HB LYS 69 28.764 -0.312 0.246
161 1HG LYS 69 1HG LYS 69 29.248 1.356 1.921
162 2HG LYS 69 2HG LYS 69 30.985 1.192 1.653
163 1HD LYS 69 1HD LYS 69 30.945 2.467 -0.240
164 2HD LYS 69 2HD LYS 69 29.384 1.827 -0.757
165 1HE LYS 69 1HE LYS 69 28.344 3.183 1.135
166 2HE LYS 69 2HE LYS 69 29.909 3.978 1.304
167 1HZ LYS 69 1HZ LYS 69 28.390 3.843 -1.241
168 2HZ LYS 69 2HZ LYS 69 28.315 5.155 -0.166
169 3HZ LYS 69 3HZ LYS 69 29.781 4.764 -0.921
170 H THR 70 H THR 70 28.865 -2.882 3.228
171 HA THR 70 HA THR 70 27.920 -4.628 0.995
172 HB THR 70 HB THR 70 29.290 -5.331 3.541
173 HG1 THR 70 HG1 THR 70 28.710 -6.601 1.074
174 1HG2 THR 70 1HG2 THR 70 26.588 -6.455 2.877
175 2HG2 THR 70 2HG2 THR 70 27.826 -7.574 3.423
176 3HG2 THR 70 3HG2 THR 70 27.352 -6.218 4.441
177 H ASP 71 H ASP 71 27.190 -3.764 4.398
178 HA ASP 71 HA ASP 71 24.303 -3.731 3.598
179 1HB ASP 71 1HB ASP 71 25.667 -5.069 5.791
180 2HB ASP 71 2HB ASP 71 24.387 -4.006 6.379
181 H ASN 72 H ASN 72 25.598 -2.645 6.694
182 HA ASN 72 HA ASN 72 25.012 0.167 5.870
183 1HB ASN 72 1HB ASN 72 23.175 -0.077 7.210
184 2HB ASN 72 2HB ASN 72 23.859 -1.452 8.070
185 1HD2 ASN 72 1HD2 ASN 72 24.269 2.108 7.804
186 2HD2 ASN 72 2HD2 ASN 72 24.688 2.337 9.435
187 H GLN 73 H GLN 73 27.267 -1.991 7.145
188 HA GLN 73 HA GLN 73 28.770 0.240 8.425
189 1HB GLN 73 1HB GLN 73 28.947 -2.741 8.952
190 2HB GLN 73 2HB GLN 73 29.830 -1.478 9.799
191 1HG GLN 73 1HG GLN 73 26.817 -1.535 9.695
192 2HG GLN 73 2HG GLN 73 27.730 -2.337 10.972
193 1HE2 GLN 73 1HE2 GLN 73 27.907 -1.041 12.793
194 2HE2 GLN 73 2HE2 GLN 73 28.038 0.659 12.779
195 H GLY 74 H GLY 74 31.198 -1.351 8.542
196 1HA GLY 74 1HA GLY 74 31.849 -1.489 5.624
197 2HA GLY 74 2HA GLY 74 32.978 -0.850 6.825
198 H ASN 75 H ASN 75 31.441 -3.321 8.354
199 HA ASN 75 HA ASN 75 33.495 -5.289 7.435
200 1HB ASN 75 1HB ASN 75 32.362 -4.797 10.167
201 2HB ASN 75 2HB ASN 75 33.528 -6.070 9.781
202 1HD2 ASN 75 1HD2 ASN 75 33.428 -3.074 11.147
203 2HD2 ASN 75 2HD2 ASN 75 34.962 -2.485 10.690
204 HA PRO 76 HA PRO 76 29.373 -7.574 7.884
205 1HB PRO 76 1HB PRO 76 27.603 -6.643 6.070
206 2HB PRO 76 2HB PRO 76 27.714 -5.920 7.682
207 1HG PRO 76 1HG PRO 76 28.544 -4.765 5.097
208 2HG PRO 76 2HG PRO 76 28.268 -3.952 6.643
209 1HD PRO 76 1HD PRO 76 30.811 -4.787 5.468
210 2HD PRO 76 2HD PRO 76 30.515 -3.859 6.943
211 H ILE 77 H ILE 77 31.523 -8.428 6.642
212 HA ILE 77 HA ILE 77 30.791 -8.619 3.783
213 HB ILE 77 HB ILE 77 33.483 -9.535 4.605
214 1HG1 ILE 77 1HG1 ILE 77 33.034 -7.569 6.123
215 2HG1 ILE 77 2HG1 ILE 77 34.355 -7.309 4.985
216 1HG2 ILE 77 1HG2 ILE 77 32.556 -9.231 2.245
217 2HG2 ILE 77 2HG2 ILE 77 32.638 -7.494 2.540
218 3HG2 ILE 77 3HG2 ILE 77 34.111 -8.464 2.568
219 1HD1 ILE 77 1HD1 ILE 77 31.503 -6.420 4.465
220 2HD1 ILE 77 2HD1 ILE 77 32.723 -5.377 5.196
221 3HD1 ILE 77 3HD1 ILE 77 32.944 -5.975 3.551
222 HA PRO 78 HA PRO 78 30.226 -12.935 5.413
223 1HB PRO 78 1HB PRO 78 27.792 -13.351 4.214
224 2HB PRO 78 2HB PRO 78 27.977 -12.634 5.827
225 1HG PRO 78 1HG PRO 78 27.306 -11.297 3.238
226 2HG PRO 78 2HG PRO 78 26.858 -10.836 4.890
227 1HD PRO 78 1HD PRO 78 28.908 -9.644 3.368
228 2HD PRO 78 2HD PRO 78 28.698 -9.506 5.126
229 HA PRO 79 HA PRO 79 31.570 -14.577 1.501
230 1HB PRO 79 1HB PRO 79 31.649 -17.219 2.271
231 2HB PRO 79 2HB PRO 79 32.889 -16.030 2.717
232 1HG PRO 79 1HG PRO 79 30.729 -17.212 4.403
233 2HG PRO 79 2HG PRO 79 32.304 -16.563 4.888
234 1HD PRO 79 1HD PRO 79 29.818 -15.232 5.135
235 2HD PRO 79 2HD PRO 79 31.423 -14.485 5.292
236 H HIS 80 H HIS 80 28.639 -15.516 3.132
237 HA HIS 80 HA HIS 80 26.624 -16.414 2.336
238 1HB HIS 80 1HB HIS 80 27.524 -14.539 0.463
239 2HB HIS 80 2HB HIS 80 27.103 -15.956 -0.499
240 HD1 HIS 80 HD1 HIS 80 25.289 -13.549 -0.785
241 HD2 HIS 80 HD2 HIS 80 24.665 -16.487 2.107
242 HE1 HIS 80 HE1 HIS 80 22.841 -13.413 -0.140
Start of MODEL 3
1 H VAL 49 H VAL 49 53.854 -5.610 4.837
2 HA VAL 49 HA VAL 49 52.560 -4.347 7.148
3 HB VAL 49 HB VAL 49 50.901 -3.550 5.060
4 1HG1 VAL 49 1HG1 VAL 49 51.591 -2.417 7.259
5 2HG1 VAL 49 2HG1 VAL 49 52.962 -1.770 6.359
6 3HG1 VAL 49 3HG1 VAL 49 51.317 -1.358 5.875
7 1HG2 VAL 49 1HG2 VAL 49 53.058 -3.991 3.649
8 2HG2 VAL 49 2HG2 VAL 49 52.172 -2.487 3.403
9 3HG2 VAL 49 3HG2 VAL 49 53.637 -2.497 4.385
10 HA PRO 50 HA PRO 50 49.647 -7.564 6.615
11 1HB PRO 50 1HB PRO 50 47.272 -6.262 7.190
12 2HB PRO 50 2HB PRO 50 48.462 -6.787 8.381
13 1HG PRO 50 1HG PRO 50 47.869 -4.033 7.481
14 2HG PRO 50 2HG PRO 50 48.663 -4.584 8.954
15 1HD PRO 50 1HD PRO 50 49.924 -3.509 6.636
16 2HD PRO 50 2HD PRO 50 50.717 -4.226 8.056
17 H GLY 51 H GLY 51 47.439 -8.143 5.465
18 1HA GLY 51 1HA GLY 51 47.422 -6.742 2.817
19 2HA GLY 51 2HA GLY 51 47.352 -8.498 2.943
20 H LEU 52 H LEU 52 45.376 -9.198 2.455
21 HA LEU 52 HA LEU 52 43.048 -8.471 1.810
22 1HB LEU 52 1HB LEU 52 43.187 -10.680 2.783
23 2HB LEU 52 2HB LEU 52 43.236 -9.990 4.413
24 HG LEU 52 HG LEU 52 40.975 -9.198 2.637
25 1HD1 LEU 52 1HD1 LEU 52 41.513 -11.956 3.560
26 2HD1 LEU 52 2HD1 LEU 52 39.899 -11.346 3.928
27 3HD1 LEU 52 3HD1 LEU 52 40.465 -11.389 2.260
28 1HD2 LEU 52 1HD2 LEU 52 41.688 -9.194 5.455
29 2HD2 LEU 52 2HD2 LEU 52 40.495 -8.222 4.595
30 3HD2 LEU 52 3HD2 LEU 52 40.073 -9.832 5.176
31 H CYS 53 H CYS 53 43.381 -8.227 5.246
32 HA CYS 53 HA CYS 53 43.160 -5.812 6.121
33 1HB CYS 53 1HB CYS 53 41.578 -5.156 4.371
34 2HB CYS 53 2HB CYS 53 40.406 -6.329 4.957
35 HA PRO 54 HA PRO 54 41.960 -8.430 9.513
36 1HB PRO 54 1HB PRO 54 42.833 -6.715 11.473
37 2HB PRO 54 2HB PRO 54 43.913 -7.777 10.553
38 1HG PRO 54 1HG PRO 54 43.534 -4.831 10.321
39 2HG PRO 54 2HG PRO 54 44.948 -5.818 9.909
40 1HD PRO 54 1HD PRO 54 43.049 -4.773 8.077
41 2HD PRO 54 2HD PRO 54 44.290 -5.995 7.721
42 H ARG 55 H ARG 55 40.346 -5.931 8.316
43 HA ARG 55 HA ARG 55 38.547 -5.640 10.682
44 1HB ARG 55 1HB ARG 55 39.804 -3.564 9.627
45 2HB ARG 55 2HB ARG 55 38.543 -3.688 8.398
46 1HG ARG 55 1HG ARG 55 37.456 -2.313 9.897
47 2HG ARG 55 2HG ARG 55 36.984 -3.877 10.562
48 1HD ARG 55 1HD ARG 55 39.034 -3.749 12.047
49 2HD ARG 55 2HD ARG 55 39.234 -2.084 11.504
50 HE ARG 55 HE ARG 55 36.556 -2.516 12.480
51 1HH1 ARG 55 1HH1 ARG 55 38.757 -3.618 14.449
52 2HH1 ARG 55 2HH1 ARG 55 38.856 -2.274 15.538
53 1HH2 ARG 55 1HH2 ARG 55 37.148 -0.108 13.436
54 2HH2 ARG 55 2HH2 ARG 55 37.941 -0.286 14.965
55 H CYS 56 H CYS 56 38.564 -5.541 7.098
56 HA CYS 56 HA CYS 56 35.881 -6.828 7.181
57 1HB CYS 56 1HB CYS 56 35.486 -5.960 4.962
58 2HB CYS 56 2HB CYS 56 36.071 -4.621 5.941
59 H LYS 57 H LYS 57 36.454 -7.495 4.253
60 HA LYS 57 HA LYS 57 38.603 -9.331 4.247
61 1HB LYS 57 1HB LYS 57 36.954 -11.325 3.798
62 2HB LYS 57 2HB LYS 57 37.341 -10.884 5.464
63 1HG LYS 57 1HG LYS 57 35.261 -9.263 5.176
64 2HG LYS 57 2HG LYS 57 34.820 -10.410 3.911
65 1HD LYS 57 1HD LYS 57 33.795 -11.180 5.950
66 2HD LYS 57 2HD LYS 57 35.149 -12.259 5.614
67 1HE LYS 57 1HE LYS 57 36.159 -10.062 7.124
68 2HE LYS 57 2HE LYS 57 34.707 -10.643 7.938
69 1HZ LYS 57 1HZ LYS 57 35.710 -12.944 7.582
70 2HZ LYS 57 2HZ LYS 57 37.168 -12.133 7.276
71 3HZ LYS 57 3HZ LYS 57 36.403 -11.961 8.783
72 H ARG 58 H ARG 58 37.388 -7.126 2.715
73 HA ARG 58 HA ARG 58 37.085 -8.576 0.121
74 1HB ARG 58 1HB ARG 58 34.988 -7.412 1.191
75 2HB ARG 58 2HB ARG 58 35.768 -5.926 0.638
76 1HG ARG 58 1HG ARG 58 35.606 -6.525 -1.617
77 2HG ARG 58 2HG ARG 58 35.456 -8.244 -1.252
78 1HD ARG 58 1HD ARG 58 33.243 -7.497 -0.039
79 2HD ARG 58 2HD ARG 58 33.374 -6.087 -1.090
80 HE ARG 58 HE ARG 58 33.272 -8.885 -2.151
81 1HH1 ARG 58 1HH1 ARG 58 33.999 -6.649 -4.023
82 2HH1 ARG 58 2HH1 ARG 58 32.461 -6.244 -4.710
83 1HH2 ARG 58 1HH2 ARG 58 30.637 -7.878 -2.256
84 2HH2 ARG 58 2HH2 ARG 58 30.558 -6.936 -3.707
85 H GLY 59 H GLY 59 39.441 -7.172 1.541
86 1HA GLY 59 1HA GLY 59 40.226 -5.659 -0.875
87 2HA GLY 59 2HA GLY 59 40.121 -4.708 0.606
88 H LYS 60 H LYS 60 42.188 -4.298 1.024
89 HA LYS 60 HA LYS 60 43.942 -6.420 2.020
90 1HB LYS 60 1HB LYS 60 44.198 -5.377 -0.698
91 2HB LYS 60 2HB LYS 60 45.617 -4.969 0.266
92 1HG LYS 60 1HG LYS 60 45.033 -7.642 0.911
93 2HG LYS 60 2HG LYS 60 44.832 -7.534 -0.836
94 1HD LYS 60 1HD LYS 60 47.147 -6.039 -0.249
95 2HD LYS 60 2HD LYS 60 47.277 -7.512 0.712
96 1HE LYS 60 1HE LYS 60 46.389 -7.771 -2.131
97 2HE LYS 60 2HE LYS 60 48.095 -7.448 -1.824
98 1HZ LYS 60 1HZ LYS 60 47.552 -9.362 -0.022
99 2HZ LYS 60 2HZ LYS 60 46.550 -9.829 -1.312
100 3HZ LYS 60 3HZ LYS 60 48.218 -9.650 -1.558
101 H HIS 61 H HIS 61 43.326 -4.882 3.861
102 HA HIS 61 HA HIS 61 45.381 -2.890 4.281
103 1HB HIS 61 1HB HIS 61 43.790 -0.948 4.246
104 2HB HIS 61 2HB HIS 61 44.214 -1.585 2.642
105 HD1 HIS 61 HD1 HIS 61 42.242 -2.278 1.197
106 HD2 HIS 61 HD2 HIS 61 41.272 -2.271 5.250
107 HE1 HIS 61 HE1 HIS 61 39.786 -2.928 1.357
108 H TRP 62 H TRP 62 44.301 -1.125 5.960
109 HA TRP 62 HA TRP 62 42.994 -2.818 8.035
110 1HB TRP 62 1HB TRP 62 44.463 -0.781 9.291
111 2HB TRP 62 2HB TRP 62 44.863 -2.486 9.185
112 HD1 TRP 62 HD1 TRP 62 46.234 0.732 8.338
113 HE1 TRP 62 HE1 TRP 62 48.182 0.529 6.663
114 HE3 TRP 62 HE3 TRP 62 45.467 -4.022 6.736
115 HZ2 TRP 62 HZ2 TRP 62 49.255 -1.422 4.854
116 HZ3 TRP 62 HZ3 TRP 62 46.919 -5.016 5.020
117 HH2 TRP 62 HH2 TRP 62 48.838 -3.753 4.099
118 H ALA 63 H ALA 63 42.199 -1.328 9.909
119 HA ALA 63 HA ALA 63 39.904 0.020 9.308
120 1HB ALA 63 1HB ALA 63 41.941 0.498 11.468
121 2HB ALA 63 2HB ALA 63 40.532 1.553 11.346
122 3HB ALA 63 3HB ALA 63 40.318 -0.178 11.603
123 H ASN 64 H ASN 64 42.449 2.246 10.337
124 HA ASN 64 HA ASN 64 41.547 4.378 8.697
125 1HB ASN 64 1HB ASN 64 44.320 3.802 9.795
126 2HB ASN 64 2HB ASN 64 43.853 5.332 9.046
127 1HD2 ASN 64 1HD2 ASN 64 44.368 6.250 11.280
128 2HD2 ASN 64 2HD2 ASN 64 43.161 6.180 12.471
129 H GLU 65 H GLU 65 41.157 3.550 6.632
130 HA GLU 65 HA GLU 65 42.168 3.790 4.364
131 1HB GLU 65 1HB GLU 65 44.483 3.601 5.178
132 2HB GLU 65 2HB GLU 65 44.208 1.903 5.582
133 1HG GLU 65 1HG GLU 65 44.624 1.287 3.451
134 2HG GLU 65 2HG GLU 65 43.393 2.401 2.854
135 H CYS 66 H CYS 66 40.141 2.220 5.831
136 HA CYS 66 HA CYS 66 40.180 -0.238 4.129
137 1HB CYS 66 1HB CYS 66 40.474 -1.058 6.341
138 2HB CYS 66 2HB CYS 66 39.346 0.114 7.014
139 H LYS 67 H LYS 67 38.280 -0.749 3.106
140 HA LYS 67 HA LYS 67 35.864 0.877 3.681
141 1HB LYS 67 1HB LYS 67 37.339 1.699 1.624
142 2HB LYS 67 2HB LYS 67 36.582 0.325 0.815
143 1HG LYS 67 1HG LYS 67 35.071 2.060 0.368
144 2HG LYS 67 2HG LYS 67 34.360 1.298 1.791
145 1HD LYS 67 1HD LYS 67 36.071 3.081 2.956
146 2HD LYS 67 2HD LYS 67 35.598 3.965 1.505
147 1HE LYS 67 1HE LYS 67 33.466 2.598 3.104
148 2HE LYS 67 2HE LYS 67 34.131 4.114 3.709
149 1HZ LYS 67 1HZ LYS 67 33.424 4.032 0.887
150 2HZ LYS 67 2HZ LYS 67 32.131 4.011 1.989
151 3HZ LYS 67 3HZ LYS 67 33.252 5.288 2.014
152 H SER 68 H SER 68 33.919 -0.245 3.146
153 HA SER 68 HA SER 68 34.081 -2.886 1.938
154 1HB SER 68 1HB SER 68 34.641 -2.531 4.712
155 2HB SER 68 2HB SER 68 33.108 -3.412 4.559
156 HG SER 68 HG SER 68 34.520 -4.562 2.813
157 H LYS 69 H LYS 69 32.399 -0.330 1.906
158 HA LYS 69 HA LYS 69 29.869 -0.639 3.042
159 1HB LYS 69 1HB LYS 69 30.960 0.868 0.897
160 2HB LYS 69 2HB LYS 69 29.524 0.063 0.264
161 1HG LYS 69 1HG LYS 69 28.320 0.870 2.375
162 2HG LYS 69 2HG LYS 69 29.719 1.909 2.650
163 1HD LYS 69 1HD LYS 69 29.380 3.049 0.554
164 2HD LYS 69 2HD LYS 69 28.139 1.894 0.066
165 1HE LYS 69 1HE LYS 69 27.985 3.981 2.244
166 2HE LYS 69 2HE LYS 69 26.939 3.797 0.837
167 1HZ LYS 69 1HZ LYS 69 26.364 1.546 1.822
168 2HZ LYS 69 2HZ LYS 69 27.071 2.110 3.259
169 3HZ LYS 69 3HZ LYS 69 25.728 2.913 2.604
170 H THR 70 H THR 70 29.248 -2.785 3.245
171 HA THR 70 HA THR 70 28.752 -4.258 0.696
172 HB THR 70 HB THR 70 30.032 -5.002 3.246
173 HG1 THR 70 HG1 THR 70 29.930 -6.349 0.762
174 1HG2 THR 70 1HG2 THR 70 27.801 -6.683 2.120
175 2HG2 THR 70 2HG2 THR 70 29.187 -7.439 2.902
176 3HG2 THR 70 3HG2 THR 70 28.176 -6.315 3.799
177 H ASP 71 H ASP 71 27.514 -3.526 3.949
178 HA ASP 71 HA ASP 71 24.787 -3.636 2.940
179 1HB ASP 71 1HB ASP 71 25.866 -6.082 3.749
180 2HB ASP 71 2HB ASP 71 24.900 -5.553 5.126
181 H ASN 72 H ASN 72 26.454 -4.130 6.095
182 HA ASN 72 HA ASN 72 24.561 -2.189 7.270
183 1HB ASN 72 1HB ASN 72 24.988 -4.311 8.469
184 2HB ASN 72 2HB ASN 72 26.692 -3.872 8.614
185 1HD2 ASN 72 1HD2 ASN 72 24.037 -1.526 8.901
186 2HD2 ASN 72 2HD2 ASN 72 24.282 -1.189 10.543
187 H GLN 73 H GLN 73 27.984 -2.596 8.191
188 HA GLN 73 HA GLN 73 28.282 0.342 7.723
189 1HB GLN 73 1HB GLN 73 28.895 -1.365 10.051
190 2HB GLN 73 2HB GLN 73 30.164 -0.214 9.617
191 1HG GLN 73 1HG GLN 73 28.749 1.645 9.898
192 2HG GLN 73 2HG GLN 73 27.286 0.664 9.792
193 1HE2 GLN 73 1HE2 GLN 73 26.388 1.088 11.865
194 2HE2 GLN 73 2HE2 GLN 73 27.183 0.705 13.325
195 H GLY 74 H GLY 74 30.961 -1.653 8.775
196 1HA GLY 74 1HA GLY 74 32.105 -1.419 6.019
197 2HA GLY 74 2HA GLY 74 33.059 -1.054 7.457
198 H ASN 75 H ASN 75 31.209 -3.573 8.432
199 HA ASN 75 HA ASN 75 33.159 -5.574 7.366
200 1HB ASN 75 1HB ASN 75 32.036 -5.322 10.137
201 2HB ASN 75 2HB ASN 75 33.131 -6.605 9.607
202 1HD2 ASN 75 1HD2 ASN 75 33.043 -3.506 11.020
203 2HD2 ASN 75 2HD2 ASN 75 34.672 -3.074 10.765
204 HA PRO 76 HA PRO 76 28.762 -7.408 7.504
205 1HB PRO 76 1HB PRO 76 27.400 -6.311 5.418
206 2HB PRO 76 2HB PRO 76 27.378 -5.579 7.034
207 1HG PRO 76 1HG PRO 76 28.786 -4.643 4.587
208 2HG PRO 76 2HG PRO 76 28.273 -3.717 6.006
209 1HD PRO 76 1HD PRO 76 30.918 -4.700 5.431
210 2HD PRO 76 2HD PRO 76 30.353 -3.873 6.892
211 H ILE 77 H ILE 77 31.396 -7.363 5.857
212 HA ILE 77 HA ILE 77 30.975 -8.070 3.222
213 HB ILE 77 HB ILE 77 33.071 -9.554 4.767
214 1HG1 ILE 77 1HG1 ILE 77 33.214 -7.415 5.848
215 2HG1 ILE 77 2HG1 ILE 77 34.466 -7.425 4.607
216 1HG2 ILE 77 1HG2 ILE 77 32.811 -8.221 2.075
217 2HG2 ILE 77 2HG2 ILE 77 34.390 -8.649 2.734
218 3HG2 ILE 77 3HG2 ILE 77 33.189 -9.906 2.437
219 1HD1 ILE 77 1HD1 ILE 77 31.730 -6.326 3.981
220 2HD1 ILE 77 2HD1 ILE 77 32.915 -5.330 4.821
221 3HD1 ILE 77 3HD1 ILE 77 33.274 -5.957 3.215
222 HA PRO 78 HA PRO 78 28.930 -11.983 3.597
223 1HB PRO 78 1HB PRO 78 28.992 -12.625 0.928
224 2HB PRO 78 2HB PRO 78 27.870 -11.439 1.624
225 1HG PRO 78 1HG PRO 78 30.293 -10.973 -0.044
226 2HG PRO 78 2HG PRO 78 28.868 -9.943 0.176
227 1HD PRO 78 1HD PRO 78 31.409 -9.605 1.418
228 2HD PRO 78 2HD PRO 78 29.913 -8.732 1.811
229 HA PRO 79 HA PRO 79 32.576 -14.611 3.619
230 1HB PRO 79 1HB PRO 79 31.375 -16.687 4.961
231 2HB PRO 79 2HB PRO 79 31.991 -15.227 5.762
232 1HG PRO 79 1HG PRO 79 29.169 -16.009 5.195
233 2HG PRO 79 2HG PRO 79 29.809 -14.964 6.474
234 1HD PRO 79 1HD PRO 79 28.554 -14.088 4.091
235 2HD PRO 79 2HD PRO 79 29.489 -13.076 5.214
236 H HIS 80 H HIS 80 32.858 -15.336 1.494
237 HA HIS 80 HA HIS 80 31.185 -17.671 0.678
238 1HB HIS 80 1HB HIS 80 31.841 -15.183 -0.881
239 2HB HIS 80 2HB HIS 80 31.593 -16.710 -1.728
240 HD1 HIS 80 HD1 HIS 80 29.766 -13.882 -0.455
241 HD2 HIS 80 HD2 HIS 80 28.951 -17.949 -0.869
242 HE1 HIS 80 HE1 HIS 80 27.249 -14.125 -0.321
Start of MODEL 4
1 H VAL 49 H VAL 49 51.003 -2.985 3.637
2 HA VAL 49 HA VAL 49 53.348 -4.619 3.299
3 HB VAL 49 HB VAL 49 53.083 -4.547 6.116
4 1HG1 VAL 49 1HG1 VAL 49 55.041 -5.098 4.480
5 2HG1 VAL 49 2HG1 VAL 49 55.372 -3.369 4.576
6 3HG1 VAL 49 3HG1 VAL 49 55.408 -4.355 6.036
7 1HG2 VAL 49 1HG2 VAL 49 53.589 -1.845 4.821
8 2HG2 VAL 49 2HG2 VAL 49 52.209 -2.246 5.840
9 3HG2 VAL 49 3HG2 VAL 49 53.832 -2.212 6.526
10 HA PRO 50 HA PRO 50 50.111 -7.136 5.726
11 1HB PRO 50 1HB PRO 50 47.933 -5.689 6.655
12 2HB PRO 50 2HB PRO 50 49.371 -6.081 7.615
13 1HG PRO 50 1HG PRO 50 48.619 -3.472 6.373
14 2HG PRO 50 2HG PRO 50 49.620 -3.793 7.788
15 1HD PRO 50 1HD PRO 50 50.584 -3.109 5.248
16 2HD PRO 50 2HD PRO 50 51.531 -3.843 6.542
17 H GLY 51 H GLY 51 47.626 -7.729 5.165
18 1HA GLY 51 1HA GLY 51 47.097 -6.612 2.439
19 2HA GLY 51 2HA GLY 51 47.145 -8.351 2.698
20 H LEU 52 H LEU 52 45.135 -8.934 2.261
21 HA LEU 52 HA LEU 52 42.750 -8.446 2.015
22 1HB LEU 52 1HB LEU 52 43.209 -10.599 3.068
23 2HB LEU 52 2HB LEU 52 43.260 -9.816 4.655
24 HG LEU 52 HG LEU 52 40.874 -9.369 2.913
25 1HD1 LEU 52 1HD1 LEU 52 41.730 -11.962 3.926
26 2HD1 LEU 52 2HD1 LEU 52 40.175 -11.482 4.602
27 3HD1 LEU 52 3HD1 LEU 52 40.386 -11.575 2.854
28 1HD2 LEU 52 1HD2 LEU 52 41.660 -9.080 5.716
29 2HD2 LEU 52 2HD2 LEU 52 40.468 -8.178 4.777
30 3HD2 LEU 52 3HD2 LEU 52 40.046 -9.738 5.485
31 H CYS 53 H CYS 53 43.372 -8.114 5.386
32 HA CYS 53 HA CYS 53 43.135 -5.707 6.284
33 1HB CYS 53 1HB CYS 53 41.452 -5.089 4.630
34 2HB CYS 53 2HB CYS 53 40.337 -6.289 5.273
35 HA PRO 54 HA PRO 54 42.239 -8.289 9.784
36 1HB PRO 54 1HB PRO 54 43.038 -6.452 11.666
37 2HB PRO 54 2HB PRO 54 44.166 -7.454 10.736
38 1HG PRO 54 1HG PRO 54 43.537 -4.554 10.431
39 2HG PRO 54 2HG PRO 54 45.019 -5.433 10.008
40 1HD PRO 54 1HD PRO 54 43.005 -4.606 8.199
41 2HD PRO 54 2HD PRO 54 44.313 -5.757 7.852
42 H ARG 55 H ARG 55 40.424 -5.865 8.632
43 HA ARG 55 HA ARG 55 38.666 -5.756 11.043
44 1HB ARG 55 1HB ARG 55 39.687 -3.647 9.353
45 2HB ARG 55 2HB ARG 55 37.928 -3.700 9.240
46 1HG ARG 55 1HG ARG 55 38.010 -3.904 11.842
47 2HG ARG 55 2HG ARG 55 39.647 -3.271 11.672
48 1HD ARG 55 1HD ARG 55 38.842 -1.189 11.410
49 2HD ARG 55 2HD ARG 55 37.885 -1.715 10.026
50 HE ARG 55 HE ARG 55 36.010 -2.079 11.510
51 1HH1 ARG 55 1HH1 ARG 55 38.138 -2.652 13.805
52 2HH1 ARG 55 2HH1 ARG 55 37.669 -1.410 14.918
53 1HH2 ARG 55 1HH2 ARG 55 35.713 0.287 12.613
54 2HH2 ARG 55 2HH2 ARG 55 36.298 0.253 14.243
55 H CYS 56 H CYS 56 38.588 -5.603 7.450
56 HA CYS 56 HA CYS 56 35.954 -6.987 7.607
57 1HB CYS 56 1HB CYS 56 35.430 -6.093 5.429
58 2HB CYS 56 2HB CYS 56 36.036 -4.752 6.393
59 H LYS 57 H LYS 57 36.392 -7.597 4.670
60 HA LYS 57 HA LYS 57 38.580 -9.389 4.499
61 1HB LYS 57 1HB LYS 57 35.884 -10.396 5.256
62 2HB LYS 57 2HB LYS 57 36.784 -11.334 4.060
63 1HG LYS 57 1HG LYS 57 38.767 -11.060 5.774
64 2HG LYS 57 2HG LYS 57 37.465 -10.772 6.929
65 1HD LYS 57 1HD LYS 57 37.163 -13.104 5.096
66 2HD LYS 57 2HD LYS 57 38.357 -13.244 6.386
67 1HE LYS 57 1HE LYS 57 35.669 -12.160 7.102
68 2HE LYS 57 2HE LYS 57 35.794 -13.889 6.783
69 1HZ LYS 57 1HZ LYS 57 37.549 -12.409 8.664
70 2HZ LYS 57 2HZ LYS 57 36.167 -13.283 9.132
71 3HZ LYS 57 3HZ LYS 57 37.490 -14.088 8.431
72 H ARG 58 H ARG 58 37.118 -7.172 3.081
73 HA ARG 58 HA ARG 58 36.707 -8.606 0.489
74 1HB ARG 58 1HB ARG 58 34.820 -7.137 1.896
75 2HB ARG 58 2HB ARG 58 35.439 -5.975 0.718
76 1HG ARG 58 1HG ARG 58 34.530 -8.774 -0.008
77 2HG ARG 58 2HG ARG 58 33.488 -7.354 -0.109
78 1HD ARG 58 1HD ARG 58 34.885 -6.330 -1.759
79 2HD ARG 58 2HD ARG 58 36.173 -7.505 -1.493
80 HE ARG 58 HE ARG 58 34.011 -9.051 -2.288
81 1HH1 ARG 58 1HH1 ARG 58 36.222 -6.762 -3.529
82 2HH1 ARG 58 2HH1 ARG 58 35.707 -6.937 -5.174
83 1HH2 ARG 58 1HH2 ARG 58 33.106 -9.098 -4.408
84 2HH2 ARG 58 2HH2 ARG 58 33.943 -8.261 -5.672
85 H GLY 59 H GLY 59 39.053 -7.054 1.890
86 1HA GLY 59 1HA GLY 59 39.819 -5.656 -0.607
87 2HA GLY 59 2HA GLY 59 39.691 -4.638 0.830
88 H LYS 60 H LYS 60 41.962 -4.247 0.768
89 HA LYS 60 HA LYS 60 43.567 -6.337 2.087
90 1HB LYS 60 1HB LYS 60 44.757 -4.765 -0.183
91 2HB LYS 60 2HB LYS 60 45.241 -6.313 0.483
92 1HG LYS 60 1HG LYS 60 43.303 -7.414 -0.501
93 2HG LYS 60 2HG LYS 60 42.702 -5.864 -1.090
94 1HD LYS 60 1HD LYS 60 45.068 -5.725 -2.246
95 2HD LYS 60 2HD LYS 60 45.039 -7.479 -2.057
96 1HE LYS 60 1HE LYS 60 42.898 -5.821 -3.427
97 2HE LYS 60 2HE LYS 60 44.109 -6.808 -4.245
98 1HZ LYS 60 1HZ LYS 60 42.440 -8.069 -2.194
99 2HZ LYS 60 2HZ LYS 60 41.741 -7.743 -3.707
100 3HZ LYS 60 3HZ LYS 60 43.113 -8.735 -3.604
101 H HIS 61 H HIS 61 43.185 -4.769 3.900
102 HA HIS 61 HA HIS 61 45.267 -2.735 3.985
103 1HB HIS 61 1HB HIS 61 43.584 -0.867 4.322
104 2HB HIS 61 2HB HIS 61 43.858 -1.392 2.645
105 HD1 HIS 61 HD1 HIS 61 41.837 -2.279 1.377
106 HD2 HIS 61 HD2 HIS 61 41.177 -2.203 5.498
107 HE1 HIS 61 HE1 HIS 61 39.425 -3.005 1.738
108 H TRP 62 H TRP 62 44.620 -1.074 5.813
109 HA TRP 62 HA TRP 62 43.988 -2.794 8.133
110 1HB TRP 62 1HB TRP 62 45.130 -0.215 8.783
111 2HB TRP 62 2HB TRP 62 45.759 -1.831 9.065
112 HD1 TRP 62 HD1 TRP 62 46.961 1.079 7.607
113 HE1 TRP 62 HE1 TRP 62 48.562 0.689 5.625
114 HE3 TRP 62 HE3 TRP 62 45.789 -3.752 6.487
115 HZ2 TRP 62 HZ2 TRP 62 49.236 -1.416 3.773
116 HZ3 TRP 62 HZ3 TRP 62 46.854 -4.890 4.580
117 HH2 TRP 62 HH2 TRP 62 48.581 -3.733 3.230
118 H ALA 63 H ALA 63 43.039 -1.578 10.055
119 HA ALA 63 HA ALA 63 40.431 -0.661 9.461
120 1HB ALA 63 1HB ALA 63 41.088 -1.561 11.659
121 2HB ALA 63 2HB ALA 63 42.085 -0.135 11.946
122 3HB ALA 63 3HB ALA 63 40.333 0.024 11.828
123 H ASN 64 H ASN 64 43.069 1.366 10.823
124 HA ASN 64 HA ASN 64 41.941 3.865 10.627
125 1HB ASN 64 1HB ASN 64 44.741 2.918 10.071
126 2HB ASN 64 2HB ASN 64 44.327 4.618 9.823
127 1HD2 ASN 64 1HD2 ASN 64 44.051 2.037 12.332
128 2HD2 ASN 64 2HD2 ASN 64 44.210 3.098 13.648
129 H GLU 65 H GLU 65 42.945 1.819 7.983
130 HA GLU 65 HA GLU 65 41.757 3.792 6.086
131 1HB GLU 65 1HB GLU 65 44.235 3.866 5.909
132 2HB GLU 65 2HB GLU 65 44.253 2.124 5.604
133 1HG GLU 65 1HG GLU 65 42.685 2.595 3.640
134 2HG GLU 65 2HG GLU 65 43.066 4.301 3.867
135 H CYS 66 H CYS 66 40.049 2.000 6.915
136 HA CYS 66 HA CYS 66 40.146 -0.208 4.905
137 1HB CYS 66 1HB CYS 66 40.400 -1.337 6.956
138 2HB CYS 66 2HB CYS 66 39.316 -0.237 7.801
139 H LYS 67 H LYS 67 38.091 -0.931 4.135
140 HA LYS 67 HA LYS 67 35.658 0.562 4.699
141 1HB LYS 67 1HB LYS 67 37.336 1.677 2.766
142 2HB LYS 67 2HB LYS 67 36.184 0.730 1.823
143 1HG LYS 67 1HG LYS 67 34.880 2.592 2.031
144 2HG LYS 67 2HG LYS 67 34.504 1.901 3.611
145 1HD LYS 67 1HD LYS 67 35.158 4.250 3.866
146 2HD LYS 67 2HD LYS 67 36.374 3.204 4.600
147 1HE LYS 67 1HE LYS 67 37.224 3.417 1.965
148 2HE LYS 67 2HE LYS 67 36.629 5.035 2.335
149 1HZ LYS 67 1HZ LYS 67 37.955 4.612 4.535
150 2HZ LYS 67 2HZ LYS 67 38.832 3.540 3.552
151 3HZ LYS 67 3HZ LYS 67 38.738 5.183 3.140
152 H SER 68 H SER 68 33.822 -0.417 3.438
153 HA SER 68 HA SER 68 34.343 -2.815 1.905
154 1HB SER 68 1HB SER 68 34.583 -2.992 4.699
155 2HB SER 68 2HB SER 68 33.032 -3.753 4.312
156 HG SER 68 HG SER 68 34.179 -4.999 2.733
157 H LYS 69 H LYS 69 32.712 -1.284 0.795
158 HA LYS 69 HA LYS 69 30.039 -1.032 1.817
159 1HB LYS 69 1HB LYS 69 30.820 -1.199 -1.111
160 2HB LYS 69 2HB LYS 69 29.427 -0.367 -0.418
161 1HG LYS 69 1HG LYS 69 31.409 0.857 0.955
162 2HG LYS 69 2HG LYS 69 32.273 0.480 -0.536
163 1HD LYS 69 1HD LYS 69 31.120 2.029 -1.718
164 2HD LYS 69 2HD LYS 69 29.580 1.534 -1.018
165 1HE LYS 69 1HE LYS 69 29.912 3.762 -0.255
166 2HE LYS 69 2HE LYS 69 30.346 2.741 1.117
167 1HZ LYS 69 1HZ LYS 69 32.691 2.870 0.216
168 2HZ LYS 69 2HZ LYS 69 32.144 4.141 -0.770
169 3HZ LYS 69 3HZ LYS 69 32.074 4.282 0.923
170 H THR 70 H THR 70 29.500 -3.132 2.642
171 HA THR 70 HA THR 70 29.069 -5.199 0.525
172 HB THR 70 HB THR 70 30.243 -5.329 3.238
173 HG1 THR 70 HG1 THR 70 31.527 -5.941 1.628
174 1HG2 THR 70 1HG2 THR 70 28.352 -7.502 2.283
175 2HG2 THR 70 2HG2 THR 70 29.471 -7.649 3.636
176 3HG2 THR 70 3HG2 THR 70 28.137 -6.500 3.717
177 H ASP 71 H ASP 71 27.751 -3.772 3.523
178 HA ASP 71 HA ASP 71 25.060 -4.550 2.514
179 1HB ASP 71 1HB ASP 71 25.971 -6.176 4.287
180 2HB ASP 71 2HB ASP 71 25.757 -4.854 5.434
181 H ASN 72 H ASN 72 26.127 -3.036 5.586
182 HA ASN 72 HA ASN 72 24.805 -0.530 4.650
183 1HB ASN 72 1HB ASN 72 23.356 -2.071 6.164
184 2HB ASN 72 2HB ASN 72 24.417 -1.522 7.465
185 1HD2 ASN 72 1HD2 ASN 72 24.051 0.572 8.312
186 2HD2 ASN 72 2HD2 ASN 72 22.905 1.656 7.687
187 H GLN 73 H GLN 73 27.274 -2.045 6.648
188 HA GLN 73 HA GLN 73 28.240 0.690 7.335
189 1HB GLN 73 1HB GLN 73 28.388 -1.922 8.848
190 2HB GLN 73 2HB GLN 73 29.398 -0.537 9.249
191 1HG GLN 73 1HG GLN 73 26.379 -0.443 9.099
192 2HG GLN 73 2HG GLN 73 27.294 -0.619 10.596
193 1HE2 GLN 73 1HE2 GLN 73 26.178 1.668 8.223
194 2HE2 GLN 73 2HE2 GLN 73 26.929 3.044 8.896
195 H GLY 74 H GLY 74 30.626 -1.395 8.272
196 1HA GLY 74 1HA GLY 74 31.879 -1.412 5.562
197 2HA GLY 74 2HA GLY 74 32.770 -0.826 6.971
198 H ASN 75 H ASN 75 30.990 -3.216 8.263
199 HA ASN 75 HA ASN 75 32.976 -5.320 7.513
200 1HB ASN 75 1HB ASN 75 31.919 -4.473 10.177
201 2HB ASN 75 2HB ASN 75 32.711 -6.032 9.952
202 1HD2 ASN 75 1HD2 ASN 75 33.256 -2.531 9.392
203 2HD2 ASN 75 2HD2 ASN 75 34.944 -2.592 9.618
204 HA PRO 76 HA PRO 76 28.577 -7.115 7.813
205 1HB PRO 76 1HB PRO 76 27.405 -6.459 5.432
206 2HB PRO 76 2HB PRO 76 27.243 -5.436 6.873
207 1HG PRO 76 1HG PRO 76 28.849 -4.957 4.421
208 2HG PRO 76 2HG PRO 76 28.241 -3.792 5.605
209 1HD PRO 76 1HD PRO 76 30.915 -4.849 5.425
210 2HD PRO 76 2HD PRO 76 30.247 -3.775 6.666
211 H ILE 77 H ILE 77 31.325 -7.363 6.338
212 HA ILE 77 HA ILE 77 31.036 -8.643 3.915
213 HB ILE 77 HB ILE 77 33.107 -9.768 5.736
214 1HG1 ILE 77 1HG1 ILE 77 33.117 -7.485 6.537
215 2HG1 ILE 77 2HG1 ILE 77 34.465 -7.655 5.411
216 1HG2 ILE 77 1HG2 ILE 77 33.118 -8.584 2.945
217 2HG2 ILE 77 2HG2 ILE 77 34.502 -9.345 3.730
218 3HG2 ILE 77 3HG2 ILE 77 33.070 -10.302 3.344
219 1HD1 ILE 77 1HD1 ILE 77 31.814 -6.740 4.353
220 2HD1 ILE 77 2HD1 ILE 77 32.816 -5.591 5.239
221 3HD1 ILE 77 3HD1 ILE 77 33.437 -6.362 3.780
222 HA PRO 78 HA PRO 78 28.982 -12.370 5.284
223 1HB PRO 78 1HB PRO 78 28.662 -13.433 2.769
224 2HB PRO 78 2HB PRO 78 27.621 -12.158 3.433
225 1HG PRO 78 1HG PRO 78 29.762 -11.947 1.371
226 2HG PRO 78 2HG PRO 78 28.344 -10.917 1.625
227 1HD PRO 78 1HD PRO 78 31.010 -10.320 2.403
228 2HD PRO 78 2HD PRO 78 29.547 -9.441 2.899
229 HA PRO 79 HA PRO 79 32.492 -15.108 5.230
230 1HB PRO 79 1HB PRO 79 31.271 -17.203 6.526
231 2HB PRO 79 2HB PRO 79 31.854 -15.745 7.354
232 1HG PRO 79 1HG PRO 79 29.055 -16.551 6.714
233 2HG PRO 79 2HG PRO 79 29.652 -15.496 8.005
234 1HD PRO 79 1HD PRO 79 28.454 -14.646 5.579
235 2HD PRO 79 2HD PRO 79 29.324 -13.617 6.736
236 H HIS 80 H HIS 80 33.121 -17.122 4.186
237 HA HIS 80 HA HIS 80 33.033 -18.695 2.448
238 1HB HIS 80 1HB HIS 80 30.566 -18.934 3.955
239 2HB HIS 80 2HB HIS 80 30.293 -19.312 2.253
240 HD1 HIS 80 HD1 HIS 80 30.810 -21.669 1.640
241 HD2 HIS 80 HD2 HIS 80 33.044 -20.422 4.933
242 HE1 HIS 80 HE1 HIS 80 32.182 -23.668 2.375
Start of MODEL 5
1 H VAL 49 H VAL 49 52.756 -4.449 8.224
2 HA VAL 49 HA VAL 49 52.721 -4.484 5.239
3 HB VAL 49 HB VAL 49 53.821 -6.674 7.008
4 1HG1 VAL 49 1HG1 VAL 49 53.066 -6.770 4.409
5 2HG1 VAL 49 2HG1 VAL 49 54.724 -6.201 4.224
6 3HG1 VAL 49 3HG1 VAL 49 54.402 -7.719 5.061
7 1HG2 VAL 49 1HG2 VAL 49 55.001 -4.108 6.100
8 2HG2 VAL 49 2HG2 VAL 49 55.449 -5.132 7.464
9 3HG2 VAL 49 3HG2 VAL 49 56.001 -5.537 5.840
10 HA PRO 50 HA PRO 50 49.180 -7.092 7.068
11 1HB PRO 50 1HB PRO 50 47.140 -5.221 7.146
12 2HB PRO 50 2HB PRO 50 48.114 -5.704 8.542
13 1HG PRO 50 1HG PRO 50 48.236 -3.168 6.995
14 2HG PRO 50 2HG PRO 50 48.750 -3.502 8.647
15 1HD PRO 50 1HD PRO 50 50.443 -3.270 6.392
16 2HD PRO 50 2HD PRO 50 50.878 -3.878 8.003
17 H GLY 51 H GLY 51 47.363 -7.820 5.664
18 1HA GLY 51 1HA GLY 51 47.534 -6.608 2.928
19 2HA GLY 51 2HA GLY 51 47.432 -8.347 3.190
20 H LEU 52 H LEU 52 45.485 -9.095 2.657
21 HA LEU 52 HA LEU 52 43.214 -8.275 1.792
22 1HB LEU 52 1HB LEU 52 43.180 -10.502 2.596
23 2HB LEU 52 2HB LEU 52 43.401 -9.981 4.267
24 HG LEU 52 HG LEU 52 41.013 -10.692 3.402
25 1HD1 LEU 52 1HD1 LEU 52 41.902 -9.371 5.565
26 2HD1 LEU 52 2HD1 LEU 52 40.779 -8.190 4.890
27 3HD1 LEU 52 3HD1 LEU 52 40.218 -9.813 5.294
28 1HD2 LEU 52 1HD2 LEU 52 41.451 -8.469 1.754
29 2HD2 LEU 52 2HD2 LEU 52 39.945 -9.328 1.988
30 3HD2 LEU 52 3HD2 LEU 52 40.316 -7.926 2.985
31 H CYS 53 H CYS 53 43.298 -8.175 5.250
32 HA CYS 53 HA CYS 53 43.042 -5.720 6.128
33 1HB CYS 53 1HB CYS 53 41.489 -5.108 4.363
34 2HB CYS 53 2HB CYS 53 40.350 -6.340 4.882
35 HA PRO 54 HA PRO 54 41.922 -8.344 9.538
36 1HB PRO 54 1HB PRO 54 42.588 -6.526 11.492
37 2HB PRO 54 2HB PRO 54 43.771 -7.533 10.639
38 1HG PRO 54 1HG PRO 54 43.189 -4.626 10.303
39 2HG PRO 54 2HG PRO 54 44.694 -5.514 9.998
40 1HD PRO 54 1HD PRO 54 42.851 -4.664 8.031
41 2HD PRO 54 2HD PRO 54 44.158 -5.844 7.792
42 H ARG 55 H ARG 55 40.160 -5.966 8.255
43 HA ARG 55 HA ARG 55 38.241 -5.859 10.538
44 1HB ARG 55 1HB ARG 55 39.298 -3.761 8.793
45 2HB ARG 55 2HB ARG 55 37.535 -3.809 8.789
46 1HG ARG 55 1HG ARG 55 37.714 -2.580 10.693
47 2HG ARG 55 2HG ARG 55 38.078 -4.129 11.455
48 1HD ARG 55 1HD ARG 55 40.520 -3.702 10.875
49 2HD ARG 55 2HD ARG 55 40.042 -2.059 10.448
50 HE ARG 55 HE ARG 55 39.218 -1.867 12.848
51 1HH1 ARG 55 1HH1 ARG 55 42.301 -2.504 12.179
52 2HH1 ARG 55 2HH1 ARG 55 42.684 -3.396 13.614
53 1HH2 ARG 55 1HH2 ARG 55 39.376 -3.760 14.589
54 2HH2 ARG 55 2HH2 ARG 55 41.028 -4.107 14.978
55 H CYS 56 H CYS 56 38.583 -5.972 6.986
56 HA CYS 56 HA CYS 56 35.922 -7.327 6.917
57 1HB CYS 56 1HB CYS 56 35.508 -6.386 4.731
58 2HB CYS 56 2HB CYS 56 36.009 -5.056 5.772
59 H LYS 57 H LYS 57 36.631 -7.862 3.989
60 HA LYS 57 HA LYS 57 38.894 -9.568 4.009
61 1HB LYS 57 1HB LYS 57 37.448 -11.638 3.449
62 2HB LYS 57 2HB LYS 57 37.562 -11.169 5.148
63 1HG LYS 57 1HG LYS 57 35.432 -9.653 4.212
64 2HG LYS 57 2HG LYS 57 35.231 -11.194 3.380
65 1HD LYS 57 1HD LYS 57 34.185 -11.792 5.323
66 2HD LYS 57 2HD LYS 57 35.836 -12.084 5.868
67 1HE LYS 57 1HE LYS 57 35.501 -9.356 6.274
68 2HE LYS 57 2HE LYS 57 33.938 -10.034 6.727
69 1HZ LYS 57 1HZ LYS 57 35.608 -11.773 7.866
70 2HZ LYS 57 2HZ LYS 57 36.528 -10.353 7.984
71 3HZ LYS 57 3HZ LYS 57 34.971 -10.416 8.664
72 H ARG 58 H ARG 58 37.563 -7.365 2.499
73 HA ARG 58 HA ARG 58 37.634 -8.672 -0.180
74 1HB ARG 58 1HB ARG 58 35.304 -7.779 0.901
75 2HB ARG 58 2HB ARG 58 35.881 -6.302 0.125
76 1HG ARG 58 1HG ARG 58 36.270 -7.704 -1.969
77 2HG ARG 58 2HG ARG 58 35.367 -8.990 -1.168
78 1HD ARG 58 1HD ARG 58 34.105 -6.301 -1.154
79 2HD ARG 58 2HD ARG 58 34.183 -7.118 -2.716
80 HE ARG 58 HE ARG 58 33.033 -8.531 -0.351
81 1HH1 ARG 58 1HH1 ARG 58 33.166 -9.577 -3.246
82 2HH1 ARG 58 2HH1 ARG 58 31.529 -9.321 -3.751
83 1HH2 ARG 58 1HH2 ARG 58 30.773 -7.190 -1.122
84 2HH2 ARG 58 2HH2 ARG 58 30.173 -7.970 -2.547
85 H GLY 59 H GLY 59 39.934 -7.764 0.334
86 1HA GLY 59 1HA GLY 59 40.638 -5.709 -1.354
87 2HA GLY 59 2HA GLY 59 40.220 -4.866 0.138
88 H LYS 60 H LYS 60 42.239 -4.247 0.772
89 HA LYS 60 HA LYS 60 43.968 -6.231 2.046
90 1HB LYS 60 1HB LYS 60 44.518 -5.449 -0.664
91 2HB LYS 60 2HB LYS 60 45.733 -4.706 0.383
92 1HG LYS 60 1HG LYS 60 46.480 -6.780 1.196
93 2HG LYS 60 2HG LYS 60 44.995 -7.606 0.724
94 1HD LYS 60 1HD LYS 60 46.392 -6.365 -1.538
95 2HD LYS 60 2HD LYS 60 47.345 -7.610 -0.730
96 1HE LYS 60 1HE LYS 60 44.462 -8.046 -1.526
97 2HE LYS 60 2HE LYS 60 45.806 -8.421 -2.604
98 1HZ LYS 60 1HZ LYS 60 46.663 -9.643 -0.457
99 2HZ LYS 60 2HZ LYS 60 45.003 -9.713 -0.107
100 3HZ LYS 60 3HZ LYS 60 45.602 -10.400 -1.540
101 H HIS 61 H HIS 61 43.334 -4.789 3.870
102 HA HIS 61 HA HIS 61 45.168 -2.599 4.267
103 1HB HIS 61 1HB HIS 61 43.379 -0.825 4.265
104 2HB HIS 61 2HB HIS 61 43.932 -1.363 2.664
105 HD1 HIS 61 HD1 HIS 61 42.182 -2.426 1.139
106 HD2 HIS 61 HD2 HIS 61 40.892 -2.219 5.096
107 HE1 HIS 61 HE1 HIS 61 39.786 -3.279 1.162
108 H TRP 62 H TRP 62 44.103 -0.972 5.945
109 HA TRP 62 HA TRP 62 42.930 -2.696 8.068
110 1HB TRP 62 1HB TRP 62 44.197 -0.411 9.180
111 2HB TRP 62 2HB TRP 62 44.715 -2.087 9.241
112 HD1 TRP 62 HD1 TRP 62 45.983 1.084 8.216
113 HE1 TRP 62 HE1 TRP 62 47.882 0.878 6.483
114 HE3 TRP 62 HE3 TRP 62 45.310 -3.750 6.775
115 HZ2 TRP 62 HZ2 TRP 62 48.955 -1.096 4.691
116 HZ3 TRP 62 HZ3 TRP 62 46.725 -4.747 5.026
117 HH2 TRP 62 HH2 TRP 62 48.568 -3.441 3.997
118 H ALA 63 H ALA 63 41.886 -1.286 9.856
119 HA ALA 63 HA ALA 63 39.510 -0.148 8.956
120 1HB ALA 63 1HB ALA 63 40.903 -0.354 11.464
121 2HB ALA 63 2HB ALA 63 40.175 1.246 11.328
122 3HB ALA 63 3HB ALA 63 39.171 -0.196 11.174
123 H ASN 64 H ASN 64 42.118 1.893 10.349
124 HA ASN 64 HA ASN 64 41.217 4.384 9.623
125 1HB ASN 64 1HB ASN 64 43.864 3.197 10.021
126 2HB ASN 64 2HB ASN 64 43.895 4.567 8.905
127 1HD2 ASN 64 1HD2 ASN 64 43.381 6.679 9.751
128 2HD2 ASN 64 2HD2 ASN 64 43.178 6.968 11.412
129 H GLU 65 H GLU 65 42.434 1.916 7.476
130 HA GLU 65 HA GLU 65 41.691 3.651 5.163
131 1HB GLU 65 1HB GLU 65 44.163 3.539 5.349
132 2HB GLU 65 2HB GLU 65 44.078 1.774 5.321
133 1HG GLU 65 1HG GLU 65 43.838 1.729 3.075
134 2HG GLU 65 2HG GLU 65 42.601 2.987 3.110
135 H CYS 66 H CYS 66 39.754 2.086 6.017
136 HA CYS 66 HA CYS 66 39.862 -0.295 4.223
137 1HB CYS 66 1HB CYS 66 40.098 -1.222 6.423
138 2HB CYS 66 2HB CYS 66 38.851 -0.159 7.073
139 H LYS 67 H LYS 67 37.895 -0.885 3.286
140 HA LYS 67 HA LYS 67 35.467 0.641 3.860
141 1HB LYS 67 1HB LYS 67 37.213 1.534 1.802
142 2HB LYS 67 2HB LYS 67 35.850 0.750 1.004
143 1HG LYS 67 1HG LYS 67 34.299 2.116 2.411
144 2HG LYS 67 2HG LYS 67 35.699 2.970 3.062
145 1HD LYS 67 1HD LYS 67 36.213 3.221 0.421
146 2HD LYS 67 2HD LYS 67 34.451 3.158 0.374
147 1HE LYS 67 1HE LYS 67 35.362 4.862 2.538
148 2HE LYS 67 2HE LYS 67 36.029 5.395 0.995
149 1HZ LYS 67 1HZ LYS 67 33.578 4.961 0.219
150 2HZ LYS 67 2HZ LYS 67 33.237 5.238 1.861
151 3HZ LYS 67 3HZ LYS 67 34.021 6.431 0.945
152 H SER 68 H SER 68 33.639 -0.463 3.166
153 HA SER 68 HA SER 68 33.851 -2.738 1.379
154 1HB SER 68 1HB SER 68 34.660 -3.048 4.054
155 2HB SER 68 2HB SER 68 33.079 -3.847 3.951
156 HG SER 68 HG SER 68 35.296 -4.888 3.228
157 H LYS 69 H LYS 69 32.116 -0.693 1.161
158 HA LYS 69 HA LYS 69 29.693 -0.707 2.562
159 1HB LYS 69 1HB LYS 69 28.655 -0.049 0.316
160 2HB LYS 69 2HB LYS 69 30.000 0.952 0.865
161 1HG LYS 69 1HG LYS 69 31.350 -0.966 -0.514
162 2HG LYS 69 2HG LYS 69 29.846 -0.910 -1.435
163 1HD LYS 69 1HD LYS 69 30.233 1.718 -1.210
164 2HD LYS 69 2HD LYS 69 31.916 1.210 -1.054
165 1HE LYS 69 1HE LYS 69 31.879 1.250 -3.334
166 2HE LYS 69 2HE LYS 69 31.120 -0.332 -3.153
167 1HZ LYS 69 1HZ LYS 69 29.522 2.153 -3.145
168 2HZ LYS 69 2HZ LYS 69 29.946 1.382 -4.600
169 3HZ LYS 69 3HZ LYS 69 29.008 0.562 -3.448
170 H THR 70 H THR 70 29.160 -2.832 3.191
171 HA THR 70 HA THR 70 28.258 -4.613 0.967
172 HB THR 70 HB THR 70 29.926 -5.092 3.347
173 HG1 THR 70 HG1 THR 70 29.356 -6.636 1.043
174 1HG2 THR 70 1HG2 THR 70 27.823 -6.127 4.163
175 2HG2 THR 70 2HG2 THR 70 27.739 -7.089 2.687
176 3HG2 THR 70 3HG2 THR 70 29.062 -7.332 3.823
177 H ASP 71 H ASP 71 27.601 -3.462 4.268
178 HA ASP 71 HA ASP 71 24.736 -3.569 3.737
179 1HB ASP 71 1HB ASP 71 25.863 -5.934 4.650
180 2HB ASP 71 2HB ASP 71 25.229 -5.186 6.116
181 H ASN 72 H ASN 72 26.765 -3.812 6.691
182 HA ASN 72 HA ASN 72 25.202 -1.606 7.856
183 1HB ASN 72 1HB ASN 72 26.084 -3.806 9.026
184 2HB ASN 72 2HB ASN 72 27.547 -2.843 9.250
185 1HD2 ASN 72 1HD2 ASN 72 27.545 -1.637 11.146
186 2HD2 ASN 72 2HD2 ASN 72 26.158 -1.080 11.950
187 H GLN 73 H GLN 73 28.745 -2.141 8.049
188 HA GLN 73 HA GLN 73 29.051 0.706 7.199
189 1HB GLN 73 1HB GLN 73 29.971 -0.690 9.635
190 2HB GLN 73 2HB GLN 73 31.187 0.316 8.843
191 1HG GLN 73 1HG GLN 73 29.544 2.204 8.823
192 2HG GLN 73 2HG GLN 73 28.427 1.193 9.738
193 1HE2 GLN 73 1HE2 GLN 73 29.023 0.628 11.971
194 2HE2 GLN 73 2HE2 GLN 73 30.214 1.521 12.805
195 H GLY 74 H GLY 74 31.743 -1.330 8.140
196 1HA GLY 74 1HA GLY 74 32.464 -1.581 5.247
197 2HA GLY 74 2HA GLY 74 33.650 -1.088 6.458
198 H ASN 75 H ASN 75 31.826 -3.270 8.081
199 HA ASN 75 HA ASN 75 33.486 -5.547 7.081
200 1HB ASN 75 1HB ASN 75 32.736 -4.891 9.914
201 2HB ASN 75 2HB ASN 75 33.755 -6.245 9.408
202 1HD2 ASN 75 1HD2 ASN 75 33.997 -3.203 10.703
203 2HD2 ASN 75 2HD2 ASN 75 35.518 -2.744 10.084
204 HA PRO 76 HA PRO 76 29.056 -7.020 8.075
205 1HB PRO 76 1HB PRO 76 27.494 -6.165 6.005
206 2HB PRO 76 2HB PRO 76 27.687 -5.217 7.494
207 1HG PRO 76 1HG PRO 76 28.829 -4.708 4.796
208 2HG PRO 76 2HG PRO 76 28.518 -3.566 6.111
209 1HD PRO 76 1HD PRO 76 31.041 -4.729 5.394
210 2HD PRO 76 2HD PRO 76 30.675 -3.711 6.795
211 H ILE 77 H ILE 77 31.424 -7.271 6.008
212 HA ILE 77 HA ILE 77 30.694 -8.359 3.634
213 HB ILE 77 HB ILE 77 32.813 -9.801 5.202
214 1HG1 ILE 77 1HG1 ILE 77 33.232 -7.559 5.924
215 2HG1 ILE 77 2HG1 ILE 77 34.330 -7.826 4.567
216 1HG2 ILE 77 1HG2 ILE 77 32.120 -9.257 2.411
217 2HG2 ILE 77 2HG2 ILE 77 33.808 -8.894 2.774
218 3HG2 ILE 77 3HG2 ILE 77 33.166 -10.507 3.083
219 1HD1 ILE 77 1HD1 ILE 77 31.759 -6.827 3.636
220 2HD1 ILE 77 2HD1 ILE 77 32.459 -5.747 4.839
221 3HD1 ILE 77 3HD1 ILE 77 33.368 -6.158 3.389
222 HA PRO 78 HA PRO 78 28.158 -11.759 4.953
223 1HB PRO 78 1HB PRO 78 27.514 -12.636 2.418
224 2HB PRO 78 2HB PRO 78 26.720 -11.293 3.263
225 1HG PRO 78 1HG PRO 78 28.687 -11.199 1.027
226 2HG PRO 78 2HG PRO 78 27.447 -10.023 1.482
227 1HD PRO 78 1HD PRO 78 30.208 -9.789 2.037
228 2HD PRO 78 2HD PRO 78 28.911 -8.828 2.774
229 HA PRO 79 HA PRO 79 30.826 -15.167 2.870
230 1HB PRO 79 1HB PRO 79 33.292 -14.390 1.934
231 2HB PRO 79 2HB PRO 79 31.842 -14.483 0.915
232 1HG PRO 79 1HG PRO 79 33.207 -12.073 2.030
233 2HG PRO 79 2HG PRO 79 32.242 -12.235 0.552
234 1HD PRO 79 1HD PRO 79 31.340 -11.115 2.971
235 2HD PRO 79 2HD PRO 79 30.315 -11.652 1.631
236 H HIS 80 H HIS 80 33.364 -15.917 3.431
237 HA HIS 80 HA HIS 80 33.999 -14.746 6.104
238 1HB HIS 80 1HB HIS 80 33.643 -17.650 5.354
239 2HB HIS 80 2HB HIS 80 34.570 -17.164 6.772
240 HD1 HIS 80 HD1 HIS 80 32.627 -14.655 7.375
241 HD2 HIS 80 HD2 HIS 80 31.474 -18.636 6.926
242 HE1 HIS 80 HE1 HIS 80 30.412 -14.900 8.578
Start of MODEL 6
1 H VAL 49 H VAL 49 53.378 -3.475 6.359
2 HA VAL 49 HA VAL 49 52.694 -3.867 3.479
3 HB VAL 49 HB VAL 49 54.384 -5.695 5.201
4 1HG1 VAL 49 1HG1 VAL 49 53.248 -5.793 2.462
5 2HG1 VAL 49 2HG1 VAL 49 54.935 -6.290 2.615
6 3HG1 VAL 49 3HG1 VAL 49 53.684 -7.112 3.547
7 1HG2 VAL 49 1HG2 VAL 49 55.363 -3.396 4.626
8 2HG2 VAL 49 2HG2 VAL 49 56.297 -4.791 4.088
9 3HG2 VAL 49 3HG2 VAL 49 55.298 -3.903 2.938
10 HA PRO 50 HA PRO 50 49.816 -6.382 6.329
11 1HB PRO 50 1HB PRO 50 47.711 -4.604 6.611
12 2HB PRO 50 2HB PRO 50 48.986 -4.852 7.811
13 1HG PRO 50 1HG PRO 50 48.607 -2.544 5.978
14 2HG PRO 50 2HG PRO 50 49.480 -2.634 7.504
15 1HD PRO 50 1HD PRO 50 50.630 -2.636 4.917
16 2HD PRO 50 2HD PRO 50 51.442 -2.990 6.458
17 H GLY 51 H GLY 51 47.444 -7.028 5.561
18 1HA GLY 51 1HA GLY 51 47.116 -6.311 2.680
19 2HA GLY 51 2HA GLY 51 47.277 -8.006 3.120
20 H LEU 52 H LEU 52 45.336 -8.768 2.555
21 HA LEU 52 HA LEU 52 42.937 -8.414 2.105
22 1HB LEU 52 1HB LEU 52 43.407 -10.528 3.205
23 2HB LEU 52 2HB LEU 52 43.369 -9.732 4.786
24 HG LEU 52 HG LEU 52 41.022 -9.370 2.972
25 1HD1 LEU 52 1HD1 LEU 52 41.702 -11.878 3.108
26 2HD1 LEU 52 2HD1 LEU 52 41.181 -11.770 4.789
27 3HD1 LEU 52 3HD1 LEU 52 40.035 -11.448 3.488
28 1HD2 LEU 52 1HD2 LEU 52 41.719 -9.093 5.794
29 2HD2 LEU 52 2HD2 LEU 52 40.493 -8.254 4.848
30 3HD2 LEU 52 3HD2 LEU 52 40.154 -9.845 5.524
31 H CYS 53 H CYS 53 43.315 -7.973 5.508
32 HA CYS 53 HA CYS 53 42.802 -5.548 6.305
33 1HB CYS 53 1HB CYS 53 41.153 -5.161 4.557
34 2HB CYS 53 2HB CYS 53 40.143 -6.466 5.180
35 HA PRO 54 HA PRO 54 41.995 -8.181 9.805
36 1HB PRO 54 1HB PRO 54 42.586 -6.274 11.694
37 2HB PRO 54 2HB PRO 54 43.812 -7.207 10.820
38 1HG PRO 54 1HG PRO 54 43.004 -4.360 10.450
39 2HG PRO 54 2HG PRO 54 44.557 -5.143 10.101
40 1HD PRO 54 1HD PRO 54 42.574 -4.474 8.196
41 2HD PRO 54 2HD PRO 54 43.964 -5.546 7.924
42 H ARG 55 H ARG 55 40.012 -5.944 8.559
43 HA ARG 55 HA ARG 55 38.173 -5.971 10.917
44 1HB ARG 55 1HB ARG 55 39.140 -3.708 9.815
45 2HB ARG 55 2HB ARG 55 37.765 -3.972 8.741
46 1HG ARG 55 1HG ARG 55 36.619 -2.860 10.375
47 2HG ARG 55 2HG ARG 55 36.591 -4.448 11.142
48 1HD ARG 55 1HD ARG 55 38.216 -3.888 12.684
49 2HD ARG 55 2HD ARG 55 38.987 -2.726 11.605
50 HE ARG 55 HE ARG 55 36.661 -2.190 13.349
51 1HH1 ARG 55 1HH1 ARG 55 36.310 -0.969 10.593
52 2HH1 ARG 55 2HH1 ARG 55 37.009 0.599 10.820
53 1HH2 ARG 55 1HH2 ARG 55 38.634 -0.262 13.764
54 2HH2 ARG 55 2HH2 ARG 55 38.327 1.000 12.618
55 H CYS 56 H CYS 56 38.096 -5.663 7.336
56 HA CYS 56 HA CYS 56 35.619 -7.300 7.359
57 1HB CYS 56 1HB CYS 56 35.145 -6.427 5.162
58 2HB CYS 56 2HB CYS 56 35.697 -5.054 6.120
59 H LYS 57 H LYS 57 36.316 -7.964 4.471
60 HA LYS 57 HA LYS 57 38.656 -9.573 4.545
61 1HB LYS 57 1HB LYS 57 36.051 -10.765 5.247
62 2HB LYS 57 2HB LYS 57 36.941 -11.632 3.992
63 1HG LYS 57 1HG LYS 57 38.948 -11.178 5.751
64 2HG LYS 57 2HG LYS 57 37.587 -11.283 6.867
65 1HD LYS 57 1HD LYS 57 36.946 -13.418 5.528
66 2HD LYS 57 2HD LYS 57 38.609 -13.363 4.942
67 1HE LYS 57 1HE LYS 57 38.951 -14.629 6.835
68 2HE LYS 57 2HE LYS 57 39.105 -13.025 7.553
69 1HZ LYS 57 1HZ LYS 57 36.642 -13.150 7.957
70 2HZ LYS 57 2HZ LYS 57 36.733 -14.798 7.555
71 3HZ LYS 57 3HZ LYS 57 37.593 -14.204 8.890
72 H ARG 58 H ARG 58 37.104 -7.551 2.912
73 HA ARG 58 HA ARG 58 37.070 -9.128 0.372
74 1HB ARG 58 1HB ARG 58 34.883 -7.967 1.462
75 2HB ARG 58 2HB ARG 58 35.514 -6.605 0.527
76 1HG ARG 58 1HG ARG 58 35.693 -8.981 -1.074
77 2HG ARG 58 2HG ARG 58 34.052 -8.853 -0.435
78 1HD ARG 58 1HD ARG 58 33.851 -6.578 -1.291
79 2HD ARG 58 2HD ARG 58 35.530 -6.604 -1.834
80 HE ARG 58 HE ARG 58 33.291 -7.726 -3.264
81 1HH1 ARG 58 1HH1 ARG 58 36.668 -7.891 -2.619
82 2HH1 ARG 58 2HH1 ARG 58 37.010 -8.940 -3.954
83 1HH2 ARG 58 1HH2 ARG 58 33.696 -9.225 -4.929
84 2HH2 ARG 58 2HH2 ARG 58 35.330 -9.694 -5.260
85 H GLY 59 H GLY 59 39.235 -7.441 1.764
86 1HA GLY 59 1HA GLY 59 39.900 -5.937 -0.700
87 2HA GLY 59 2HA GLY 59 39.725 -4.970 0.765
88 H LYS 60 H LYS 60 41.827 -4.388 1.004
89 HA LYS 60 HA LYS 60 43.655 -6.323 2.187
90 1HB LYS 60 1HB LYS 60 43.847 -5.712 -0.631
91 2HB LYS 60 2HB LYS 60 45.242 -5.038 0.214
92 1HG LYS 60 1HG LYS 60 45.961 -7.129 0.974
93 2HG LYS 60 2HG LYS 60 44.355 -7.844 0.820
94 1HD LYS 60 1HD LYS 60 45.940 -6.900 -1.577
95 2HD LYS 60 2HD LYS 60 46.063 -8.546 -0.949
96 1HE LYS 60 1HE LYS 60 43.529 -8.682 -1.141
97 2HE LYS 60 2HE LYS 60 43.598 -7.168 -2.043
98 1HZ LYS 60 1HZ LYS 60 45.123 -9.608 -2.773
99 2HZ LYS 60 2HZ LYS 60 43.626 -9.188 -3.453
100 3HZ LYS 60 3HZ LYS 60 44.975 -8.181 -3.684
101 H HIS 61 H HIS 61 43.133 -4.705 3.883
102 HA HIS 61 HA HIS 61 45.063 -2.506 3.844
103 1HB HIS 61 1HB HIS 61 43.164 -0.823 4.213
104 2HB HIS 61 2HB HIS 61 43.506 -1.321 2.546
105 HD1 HIS 61 HD1 HIS 61 41.563 -2.350 1.272
106 HD2 HIS 61 HD2 HIS 61 40.961 -2.471 5.398
107 HE1 HIS 61 HE1 HIS 61 39.254 -3.357 1.636
108 H TRP 62 H TRP 62 44.198 -0.843 5.677
109 HA TRP 62 HA TRP 62 43.916 -2.582 8.058
110 1HB TRP 62 1HB TRP 62 44.768 0.141 8.600
111 2HB TRP 62 2HB TRP 62 45.600 -1.379 8.892
112 HD1 TRP 62 HD1 TRP 62 46.360 1.614 7.257
113 HE1 TRP 62 HE1 TRP 62 47.861 1.323 5.180
114 HE3 TRP 62 HE3 TRP 62 45.778 -3.381 6.461
115 HZ2 TRP 62 HZ2 TRP 62 48.678 -0.775 3.388
116 HZ3 TRP 62 HZ3 TRP 62 46.856 -4.481 4.548
117 HH2 TRP 62 HH2 TRP 62 48.333 -3.207 3.024
118 H ALA 63 H ALA 63 42.790 -1.606 9.947
119 HA ALA 63 HA ALA 63 40.112 -1.035 9.489
120 1HB ALA 63 1HB ALA 63 41.937 -0.863 11.752
121 2HB ALA 63 2HB ALA 63 40.673 0.365 11.834
122 3HB ALA 63 3HB ALA 63 40.240 -1.341 11.717
123 H ASN 64 H ASN 64 42.145 1.566 10.842
124 HA ASN 64 HA ASN 64 40.636 3.763 10.330
125 1HB ASN 64 1HB ASN 64 43.567 3.292 10.221
126 2HB ASN 64 2HB ASN 64 42.993 4.801 9.502
127 1HD2 ASN 64 1HD2 ASN 64 42.784 2.875 12.531
128 2HD2 ASN 64 2HD2 ASN 64 42.535 4.213 13.545
129 H GLU 65 H GLU 65 42.692 2.224 7.854
130 HA GLU 65 HA GLU 65 41.176 3.766 5.791
131 1HB GLU 65 1HB GLU 65 43.841 3.732 6.059
132 2HB GLU 65 2HB GLU 65 43.663 2.253 5.108
133 1HG GLU 65 1HG GLU 65 42.230 4.753 4.251
134 2HG GLU 65 2HG GLU 65 43.941 4.555 3.872
135 H CYS 66 H CYS 66 39.582 1.864 6.539
136 HA CYS 66 HA CYS 66 40.130 -0.438 4.724
137 1HB CYS 66 1HB CYS 66 40.094 -1.529 6.760
138 2HB CYS 66 2HB CYS 66 39.041 -0.331 7.499
139 H LYS 67 H LYS 67 38.325 -1.341 3.640
140 HA LYS 67 HA LYS 67 35.765 0.106 3.690
141 1HB LYS 67 1HB LYS 67 36.948 -0.264 0.971
142 2HB LYS 67 2HB LYS 67 35.830 0.973 1.545
143 1HG LYS 67 1HG LYS 67 37.741 1.942 2.892
144 2HG LYS 67 2HG LYS 67 38.812 0.821 2.049
145 1HD LYS 67 1HD LYS 67 37.927 1.773 -0.128
146 2HD LYS 67 2HD LYS 67 37.131 3.024 0.829
147 1HE LYS 67 1HE LYS 67 39.202 3.994 0.210
148 2HE LYS 67 2HE LYS 67 39.452 3.449 1.869
149 1HZ LYS 67 1HZ LYS 67 40.122 1.765 -0.471
150 2HZ LYS 67 2HZ LYS 67 41.234 2.848 0.212
151 3HZ LYS 67 3HZ LYS 67 40.619 1.567 1.142
152 H SER 68 H SER 68 34.162 -1.075 2.348
153 HA SER 68 HA SER 68 34.887 -3.790 1.538
154 1HB SER 68 1HB SER 68 34.085 -3.176 4.212
155 2HB SER 68 2HB SER 68 32.824 -4.166 3.468
156 HG SER 68 HG SER 68 35.478 -4.890 3.012
157 H LYS 69 H LYS 69 32.482 -1.250 1.937
158 HA LYS 69 HA LYS 69 30.376 -0.961 0.922
159 1HB LYS 69 1HB LYS 69 32.408 -1.229 -0.975
160 2HB LYS 69 2HB LYS 69 31.124 -2.283 -1.566
161 1HG LYS 69 1HG LYS 69 30.721 0.601 -0.725
162 2HG LYS 69 2HG LYS 69 30.899 0.061 -2.395
163 1HD LYS 69 1HD LYS 69 28.921 -1.567 -1.095
164 2HD LYS 69 2HD LYS 69 28.521 0.133 -0.845
165 1HE LYS 69 1HE LYS 69 27.612 -0.943 -2.987
166 2HE LYS 69 2HE LYS 69 28.487 0.575 -3.185
167 1HZ LYS 69 1HZ LYS 69 30.132 -1.802 -3.256
168 2HZ LYS 69 2HZ LYS 69 29.029 -1.672 -4.538
169 3HZ LYS 69 3HZ LYS 69 30.156 -0.431 -4.259
170 H THR 70 H THR 70 29.679 -2.821 2.450
171 HA THR 70 HA THR 70 28.557 -4.988 0.738
172 HB THR 70 HB THR 70 30.061 -5.207 3.332
173 HG1 THR 70 HG1 THR 70 29.918 -6.998 1.163
174 1HG2 THR 70 1HG2 THR 70 27.615 -6.693 2.578
175 2HG2 THR 70 2HG2 THR 70 28.977 -7.689 3.092
176 3HG2 THR 70 3HG2 THR 70 28.340 -6.444 4.162
177 H ASP 71 H ASP 71 28.262 -3.032 3.690
178 HA ASP 71 HA ASP 71 25.335 -3.096 3.349
179 1HB ASP 71 1HB ASP 71 26.247 -5.039 4.917
180 2HB ASP 71 2HB ASP 71 26.278 -3.738 6.109
181 H ASN 72 H ASN 72 25.176 -2.148 6.272
182 HA ASN 72 HA ASN 72 25.855 0.662 5.634
183 1HB ASN 72 1HB ASN 72 24.239 1.295 7.201
184 2HB ASN 72 2HB ASN 72 23.569 -0.210 6.568
185 1HD2 ASN 72 1HD2 ASN 72 24.310 -2.255 7.909
186 2HD2 ASN 72 2HD2 ASN 72 24.359 -2.062 9.594
187 H GLN 73 H GLN 73 27.649 -1.694 6.803
188 HA GLN 73 HA GLN 73 28.834 0.004 8.968
189 1HB GLN 73 1HB GLN 73 27.903 -2.581 9.248
190 2HB GLN 73 2HB GLN 73 29.622 -2.832 8.935
191 1HG GLN 73 1HG GLN 73 29.663 -2.536 11.234
192 2HG GLN 73 2HG GLN 73 29.890 -0.870 10.698
193 1HE2 GLN 73 1HE2 GLN 73 28.865 -0.191 12.788
194 2HE2 GLN 73 2HE2 GLN 73 27.166 -0.243 12.941
195 H GLY 74 H GLY 74 31.190 -1.798 9.016
196 1HA GLY 74 1HA GLY 74 32.417 -0.951 6.422
197 2HA GLY 74 2HA GLY 74 33.292 -0.899 7.957
198 H ASN 75 H ASN 75 31.502 -3.581 8.302
199 HA ASN 75 HA ASN 75 33.193 -5.367 6.651
200 1HB ASN 75 1HB ASN 75 33.014 -6.198 9.422
201 2HB ASN 75 2HB ASN 75 34.402 -6.257 8.342
202 1HD2 ASN 75 1HD2 ASN 75 32.559 -4.102 10.512
203 2HD2 ASN 75 2HD2 ASN 75 33.826 -2.982 10.752
204 HA PRO 76 HA PRO 76 28.982 -7.118 7.786
205 1HB PRO 76 1HB PRO 76 27.462 -6.156 5.727
206 2HB PRO 76 2HB PRO 76 27.663 -5.263 7.246
207 1HG PRO 76 1HG PRO 76 28.812 -4.659 4.577
208 2HG PRO 76 2HG PRO 76 28.584 -3.586 5.966
209 1HD PRO 76 1HD PRO 76 31.037 -4.909 5.148
210 2HD PRO 76 2HD PRO 76 30.781 -3.850 6.543
211 H ILE 77 H ILE 77 31.398 -7.501 5.902
212 HA ILE 77 HA ILE 77 30.715 -8.489 3.431
213 HB ILE 77 HB ILE 77 32.774 -10.002 4.998
214 1HG1 ILE 77 1HG1 ILE 77 33.184 -7.764 5.810
215 2HG1 ILE 77 2HG1 ILE 77 34.353 -8.060 4.521
216 1HG2 ILE 77 1HG2 ILE 77 32.243 -9.142 2.202
217 2HG2 ILE 77 2HG2 ILE 77 33.934 -9.198 2.703
218 3HG2 ILE 77 3HG2 ILE 77 32.934 -10.648 2.805
219 1HD1 ILE 77 1HD1 ILE 77 31.703 -6.767 3.900
220 2HD1 ILE 77 2HD1 ILE 77 33.040 -5.808 4.527
221 3HD1 ILE 77 3HD1 ILE 77 33.219 -6.675 3.003
222 HA PRO 78 HA PRO 78 29.830 -12.776 5.353
223 1HB PRO 78 1HB PRO 78 29.564 -12.903 8.085
224 2HB PRO 78 2HB PRO 78 31.099 -13.156 7.232
225 1HG PRO 78 1HG PRO 78 30.206 -10.806 8.828
226 2HG PRO 78 2HG PRO 78 31.848 -11.365 8.476
227 1HD PRO 78 1HD PRO 78 30.500 -9.215 7.210
228 2HD PRO 78 2HD PRO 78 32.027 -9.951 6.683
229 HA PRO 79 HA PRO 79 25.569 -11.336 5.647
230 1HB PRO 79 1HB PRO 79 24.517 -13.488 4.296
231 2HB PRO 79 2HB PRO 79 25.250 -12.087 3.491
232 1HG PRO 79 1HG PRO 79 26.358 -14.832 3.861
233 2HG PRO 79 2HG PRO 79 26.706 -13.643 2.594
234 1HD PRO 79 1HD PRO 79 28.348 -14.212 4.826
235 2HD PRO 79 2HD PRO 79 28.503 -12.808 3.747
236 H HIS 80 H HIS 80 26.798 -14.534 6.493
237 HA HIS 80 HA HIS 80 24.470 -14.954 8.304
238 1HB HIS 80 1HB HIS 80 25.132 -17.269 8.394
239 2HB HIS 80 2HB HIS 80 25.192 -16.780 6.701
240 HD1 HIS 80 HD1 HIS 80 27.417 -16.962 5.524
241 HD2 HIS 80 HD2 HIS 80 27.791 -17.337 9.660
242 HE1 HIS 80 HE1 HIS 80 29.820 -17.625 5.969
Start of MODEL 7
1 H VAL 49 H VAL 49 53.479 -3.999 6.430
2 HA VAL 49 HA VAL 49 52.745 -3.675 3.595
3 HB VAL 49 HB VAL 49 54.069 -6.267 4.013
4 1HG1 VAL 49 1HG1 VAL 49 53.193 -5.292 1.854
5 2HG1 VAL 49 2HG1 VAL 49 54.498 -4.108 1.932
6 3HG1 VAL 49 3HG1 VAL 49 54.874 -5.825 1.784
7 1HG2 VAL 49 1HG2 VAL 49 55.591 -4.823 5.342
8 2HG2 VAL 49 2HG2 VAL 49 56.360 -5.373 3.853
9 3HG2 VAL 49 3HG2 VAL 49 55.735 -3.727 3.966
10 HA PRO 50 HA PRO 50 49.909 -6.365 6.109
11 1HB PRO 50 1HB PRO 50 47.885 -4.511 6.414
12 2HB PRO 50 2HB PRO 50 49.171 -4.783 7.593
13 1HG PRO 50 1HG PRO 50 48.800 -2.463 5.803
14 2HG PRO 50 2HG PRO 50 49.792 -2.609 7.252
15 1HD PRO 50 1HD PRO 50 50.676 -2.721 4.517
16 2HD PRO 50 2HD PRO 50 51.648 -2.909 5.988
17 H GLY 51 H GLY 51 47.550 -6.945 5.322
18 1HA GLY 51 1HA GLY 51 47.195 -6.110 2.481
19 2HA GLY 51 2HA GLY 51 47.339 -7.825 2.844
20 H LEU 52 H LEU 52 45.360 -8.419 2.167
21 HA LEU 52 HA LEU 52 42.961 -7.967 1.841
22 1HB LEU 52 1HB LEU 52 43.484 -10.207 2.659
23 2HB LEU 52 2HB LEU 52 43.454 -9.613 4.327
24 HG LEU 52 HG LEU 52 41.083 -9.043 2.611
25 1HD1 LEU 52 1HD1 LEU 52 42.046 -11.734 3.251
26 2HD1 LEU 52 2HD1 LEU 52 40.420 -11.425 3.857
27 3HD1 LEU 52 3HD1 LEU 52 40.771 -11.236 2.139
28 1HD2 LEU 52 1HD2 LEU 52 41.813 -9.088 5.418
29 2HD2 LEU 52 2HD2 LEU 52 40.466 -8.283 4.613
30 3HD2 LEU 52 3HD2 LEU 52 40.320 -9.967 5.108
31 H CYS 53 H CYS 53 43.437 -7.989 5.257
32 HA CYS 53 HA CYS 53 42.925 -5.568 6.249
33 1HB CYS 53 1HB CYS 53 41.024 -5.268 4.754
34 2HB CYS 53 2HB CYS 53 40.233 -6.687 5.420
35 HA PRO 54 HA PRO 54 42.772 -8.260 9.756
36 1HB PRO 54 1HB PRO 54 43.044 -6.284 11.644
37 2HB PRO 54 2HB PRO 54 44.394 -6.903 10.677
38 1HG PRO 54 1HG PRO 54 42.953 -4.307 10.438
39 2HG PRO 54 2HG PRO 54 44.606 -4.723 9.951
40 1HD PRO 54 1HD PRO 54 42.356 -4.503 8.232
41 2HD PRO 54 2HD PRO 54 43.943 -5.182 7.809
42 H ARG 55 H ARG 55 40.276 -6.578 8.629
43 HA ARG 55 HA ARG 55 38.609 -7.130 11.031
44 1HB ARG 55 1HB ARG 55 39.020 -4.691 10.913
45 2HB ARG 55 2HB ARG 55 38.381 -4.671 9.269
46 1HG ARG 55 1HG ARG 55 36.235 -4.759 9.981
47 2HG ARG 55 2HG ARG 55 36.597 -5.989 11.192
48 1HD ARG 55 1HD ARG 55 37.742 -4.074 12.507
49 2HD ARG 55 2HD ARG 55 36.858 -2.992 11.430
50 HE ARG 55 HE ARG 55 35.106 -4.973 12.618
51 1HH1 ARG 55 1HH1 ARG 55 34.674 -1.955 12.131
52 2HH1 ARG 55 2HH1 ARG 55 34.501 -1.396 13.762
53 1HH2 ARG 55 1HH2 ARG 55 35.803 -4.284 15.169
54 2HH2 ARG 55 2HH2 ARG 55 35.141 -2.715 15.482
55 H CYS 56 H CYS 56 38.176 -6.018 7.630
56 HA CYS 56 HA CYS 56 35.897 -7.872 7.415
57 1HB CYS 56 1HB CYS 56 35.314 -6.711 5.400
58 2HB CYS 56 2HB CYS 56 35.861 -5.459 6.510
59 H LYS 57 H LYS 57 36.401 -8.149 4.532
60 HA LYS 57 HA LYS 57 38.826 -9.545 4.126
61 1HB LYS 57 1HB LYS 57 37.766 -11.782 3.689
62 2HB LYS 57 2HB LYS 57 37.763 -11.316 5.393
63 1HG LYS 57 1HG LYS 57 35.517 -11.460 5.432
64 2HG LYS 57 2HG LYS 57 35.413 -10.235 4.167
65 1HD LYS 57 1HD LYS 57 34.802 -11.792 2.662
66 2HD LYS 57 2HD LYS 57 36.255 -12.732 3.005
67 1HE LYS 57 1HE LYS 57 35.127 -13.755 4.953
68 2HE LYS 57 2HE LYS 57 33.670 -12.832 4.588
69 1HZ LYS 57 1HZ LYS 57 33.715 -13.904 2.351
70 2HZ LYS 57 2HZ LYS 57 34.947 -14.925 2.923
71 3HZ LYS 57 3HZ LYS 57 33.406 -14.965 3.638
72 H ARG 58 H ARG 58 37.017 -7.478 2.997
73 HA ARG 58 HA ARG 58 36.651 -8.679 0.287
74 1HB ARG 58 1HB ARG 58 34.610 -7.785 1.717
75 2HB ARG 58 2HB ARG 58 35.194 -6.209 1.182
76 1HG ARG 58 1HG ARG 58 35.114 -7.037 -1.181
77 2HG ARG 58 2HG ARG 58 34.390 -8.534 -0.592
78 1HD ARG 58 1HD ARG 58 32.760 -6.743 0.612
79 2HD ARG 58 2HD ARG 58 33.201 -5.821 -0.824
80 HE ARG 58 HE ARG 58 31.454 -8.125 -0.771
81 1HH1 ARG 58 1HH1 ARG 58 33.062 -5.832 -2.669
82 2HH1 ARG 58 2HH1 ARG 58 32.880 -6.696 -4.157
83 1HH2 ARG 58 1HH2 ARG 58 31.575 -9.538 -2.666
84 2HH2 ARG 58 2HH2 ARG 58 32.038 -8.789 -4.157
85 H GLY 59 H GLY 59 38.946 -7.185 1.749
86 1HA GLY 59 1HA GLY 59 39.604 -5.504 -0.573
87 2HA GLY 59 2HA GLY 59 39.371 -4.604 0.927
88 H LYS 60 H LYS 60 41.691 -4.105 0.529
89 HA LYS 60 HA LYS 60 43.436 -6.032 1.947
90 1HB LYS 60 1HB LYS 60 45.014 -4.660 0.020
91 2HB LYS 60 2HB LYS 60 44.678 -6.383 0.116
92 1HG LYS 60 1HG LYS 60 43.946 -5.795 -2.044
93 2HG LYS 60 2HG LYS 60 42.466 -5.847 -1.088
94 1HD LYS 60 1HD LYS 60 42.889 -3.320 -0.677
95 2HD LYS 60 2HD LYS 60 44.000 -3.431 -2.043
96 1HE LYS 60 1HE LYS 60 42.033 -4.564 -3.292
97 2HE LYS 60 2HE LYS 60 41.021 -3.908 -2.004
98 1HZ LYS 60 1HZ LYS 60 42.629 -1.828 -2.765
99 2HZ LYS 60 2HZ LYS 60 42.204 -2.576 -4.227
100 3HZ LYS 60 3HZ LYS 60 40.991 -2.037 -3.167
101 H HIS 61 H HIS 61 43.361 -4.677 3.804
102 HA HIS 61 HA HIS 61 45.111 -2.376 3.773
103 1HB HIS 61 1HB HIS 61 43.228 -0.761 4.365
104 2HB HIS 61 2HB HIS 61 43.409 -1.169 2.646
105 HD1 HIS 61 HD1 HIS 61 41.296 -2.010 1.541
106 HD2 HIS 61 HD2 HIS 61 41.256 -2.682 5.658
107 HE1 HIS 61 HE1 HIS 61 39.084 -3.147 2.066
108 H TRP 62 H TRP 62 44.337 -0.874 5.768
109 HA TRP 62 HA TRP 62 44.196 -2.777 8.033
110 1HB TRP 62 1HB TRP 62 44.962 -0.058 8.716
111 2HB TRP 62 2HB TRP 62 45.856 -1.558 8.900
112 HD1 TRP 62 HD1 TRP 62 46.504 1.540 7.455
113 HE1 TRP 62 HE1 TRP 62 47.960 1.425 5.326
114 HE3 TRP 62 HE3 TRP 62 45.976 -3.382 6.320
115 HZ2 TRP 62 HZ2 TRP 62 48.762 -0.527 3.368
116 HZ3 TRP 62 HZ3 TRP 62 47.017 -4.331 4.311
117 HH2 TRP 62 HH2 TRP 62 48.439 -2.934 2.847
118 H ALA 63 H ALA 63 43.175 -1.807 10.060
119 HA ALA 63 HA ALA 63 40.443 -1.328 9.704
120 1HB ALA 63 1HB ALA 63 42.275 -0.511 11.973
121 2HB ALA 63 2HB ALA 63 40.519 -0.373 12.049
122 3HB ALA 63 3HB ALA 63 41.272 -1.957 11.875
123 H ASN 64 H ASN 64 42.671 1.231 10.857
124 HA ASN 64 HA ASN 64 41.069 3.444 10.516
125 1HB ASN 64 1HB ASN 64 43.980 3.290 9.671
126 2HB ASN 64 2HB ASN 64 43.097 4.761 10.094
127 1HD2 ASN 64 1HD2 ASN 64 41.610 3.329 12.306
128 2HD2 ASN 64 2HD2 ASN 64 42.740 3.158 13.561
129 H GLU 65 H GLU 65 42.847 1.754 7.946
130 HA GLU 65 HA GLU 65 41.363 3.419 5.956
131 1HB GLU 65 1HB GLU 65 43.806 3.566 5.736
132 2HB GLU 65 2HB GLU 65 43.914 1.805 5.642
133 1HG GLU 65 1HG GLU 65 43.389 1.809 3.450
134 2HG GLU 65 2HG GLU 65 41.995 2.856 3.723
135 H CYS 66 H CYS 66 39.748 1.558 6.960
136 HA CYS 66 HA CYS 66 39.846 -0.651 4.953
137 1HB CYS 66 1HB CYS 66 40.195 -1.839 6.922
138 2HB CYS 66 2HB CYS 66 39.254 -0.713 7.892
139 H LYS 67 H LYS 67 38.114 -0.824 3.688
140 HA LYS 67 HA LYS 67 35.482 0.129 4.603
141 1HB LYS 67 1HB LYS 67 37.039 1.334 2.320
142 2HB LYS 67 2HB LYS 67 35.282 1.235 2.211
143 1HG LYS 67 1HG LYS 67 35.211 2.347 4.512
144 2HG LYS 67 2HG LYS 67 36.930 2.678 4.298
145 1HD LYS 67 1HD LYS 67 36.389 4.507 3.106
146 2HD LYS 67 2HD LYS 67 35.661 3.459 1.890
147 1HE LYS 67 1HE LYS 67 34.012 5.094 2.678
148 2HE LYS 67 2HE LYS 67 33.538 3.470 3.177
149 1HZ LYS 67 1HZ LYS 67 35.055 5.355 4.895
150 2HZ LYS 67 2HZ LYS 67 33.368 5.166 4.954
151 3HZ LYS 67 3HZ LYS 67 34.385 3.865 5.353
152 H SER 68 H SER 68 33.883 -1.105 3.788
153 HA SER 68 HA SER 68 34.547 -2.972 1.575
154 1HB SER 68 1HB SER 68 34.527 -3.545 4.367
155 2HB SER 68 2HB SER 68 33.173 -4.414 3.627
156 HG SER 68 HG SER 68 35.102 -5.624 3.508
157 H LYS 69 H LYS 69 32.962 -2.329 0.175
158 HA LYS 69 HA LYS 69 30.328 -1.488 1.042
159 1HB LYS 69 1HB LYS 69 31.153 -2.343 -1.743
160 2HB LYS 69 2HB LYS 69 29.837 -1.252 -1.298
161 1HG LYS 69 1HG LYS 69 31.288 0.490 -0.743
162 2HG LYS 69 2HG LYS 69 32.646 -0.597 -0.459
163 1HD LYS 69 1HD LYS 69 33.253 0.269 -2.519
164 2HD LYS 69 2HD LYS 69 32.318 -1.132 -3.040
165 1HE LYS 69 1HE LYS 69 30.411 0.180 -3.534
166 2HE LYS 69 2HE LYS 69 31.013 1.554 -2.607
167 1HZ LYS 69 1HZ LYS 69 32.973 1.188 -4.403
168 2HZ LYS 69 2HZ LYS 69 31.613 0.750 -5.316
169 3HZ LYS 69 3HZ LYS 69 31.690 2.286 -4.594
170 H THR 70 H THR 70 29.670 -3.356 2.303
171 HA THR 70 HA THR 70 28.853 -5.677 0.604
172 HB THR 70 HB THR 70 30.198 -5.530 3.227
173 HG1 THR 70 HG1 THR 70 30.365 -7.885 2.408
174 1HG2 THR 70 1HG2 THR 70 27.899 -7.473 2.855
175 2HG2 THR 70 2HG2 THR 70 29.083 -7.512 4.157
176 3HG2 THR 70 3HG2 THR 70 27.956 -6.165 4.036
177 H ASP 71 H ASP 71 27.975 -3.624 3.379
178 HA ASP 71 HA ASP 71 25.132 -4.000 2.591
179 1HB ASP 71 1HB ASP 71 26.256 -4.434 5.365
180 2HB ASP 71 2HB ASP 71 24.543 -4.157 5.058
181 H ASN 72 H ASN 72 25.700 -2.485 5.637
182 HA ASN 72 HA ASN 72 25.903 0.196 4.380
183 1HB ASN 72 1HB ASN 72 24.029 0.857 6.102
184 2HB ASN 72 2HB ASN 72 23.579 0.137 4.558
185 1HD2 ASN 72 1HD2 ASN 72 24.807 -1.310 7.611
186 2HD2 ASN 72 2HD2 ASN 72 23.542 -2.431 7.765
187 H GLN 73 H GLN 73 27.900 -1.164 5.815
188 HA GLN 73 HA GLN 73 28.142 0.632 8.170
189 1HB GLN 73 1HB GLN 73 27.293 -1.816 8.705
190 2HB GLN 73 2HB GLN 73 28.990 -2.236 8.463
191 1HG GLN 73 1HG GLN 73 29.542 -1.396 10.478
192 2HG GLN 73 2HG GLN 73 28.772 0.145 10.094
193 1HE2 GLN 73 1HE2 GLN 73 26.077 -0.716 9.778
194 2HE2 GLN 73 2HE2 GLN 73 25.506 -1.284 11.282
195 H GLY 74 H GLY 74 30.576 -1.292 8.751
196 1HA GLY 74 1HA GLY 74 32.331 -0.118 6.630
197 2HA GLY 74 2HA GLY 74 32.843 -0.299 8.314
198 H ASN 75 H ASN 75 31.535 -2.887 8.633
199 HA ASN 75 HA ASN 75 32.925 -4.641 6.709
200 1HB ASN 75 1HB ASN 75 33.556 -5.938 8.897
201 2HB ASN 75 2HB ASN 75 34.641 -4.723 8.236
202 1HD2 ASN 75 1HD2 ASN 75 31.571 -4.160 9.979
203 2HD2 ASN 75 2HD2 ASN 75 32.273 -3.309 11.281
204 HA PRO 76 HA PRO 76 28.828 -6.213 8.192
205 1HB PRO 76 1HB PRO 76 27.514 -5.805 5.825
206 2HB PRO 76 2HB PRO 76 27.647 -4.546 7.069
207 1HG PRO 76 1HG PRO 76 29.000 -4.703 4.438
208 2HG PRO 76 2HG PRO 76 28.759 -3.296 5.485
209 1HD PRO 76 1HD PRO 76 31.150 -4.928 5.206
210 2HD PRO 76 2HD PRO 76 30.922 -3.499 6.236
211 H ILE 77 H ILE 77 31.332 -7.187 6.617
212 HA ILE 77 HA ILE 77 30.598 -8.823 4.506
213 HB ILE 77 HB ILE 77 32.634 -9.892 6.418
214 1HG1 ILE 77 1HG1 ILE 77 33.131 -7.560 6.628
215 2HG1 ILE 77 2HG1 ILE 77 34.252 -8.189 5.421
216 1HG2 ILE 77 1HG2 ILE 77 31.927 -10.163 3.662
217 2HG2 ILE 77 2HG2 ILE 77 33.545 -9.468 3.745
218 3HG2 ILE 77 3HG2 ILE 77 33.201 -11.000 4.549
219 1HD1 ILE 77 1HD1 ILE 77 31.644 -7.112 4.434
220 2HD1 ILE 77 2HD1 ILE 77 32.833 -5.950 5.013
221 3HD1 ILE 77 3HD1 ILE 77 33.240 -7.044 3.692
222 HA PRO 78 HA PRO 78 28.044 -11.706 6.820
223 1HB PRO 78 1HB PRO 78 27.015 -12.946 4.593
224 2HB PRO 78 2HB PRO 78 26.418 -11.394 5.212
225 1HG PRO 78 1HG PRO 78 28.114 -11.933 2.820
226 2HG PRO 78 2HG PRO 78 27.006 -10.587 3.129
227 1HD PRO 78 1HD PRO 78 29.828 -10.501 3.351
228 2HD PRO 78 2HD PRO 78 28.689 -9.281 3.957
229 HA PRO 79 HA PRO 79 30.332 -15.482 6.624
230 1HB PRO 79 1HB PRO 79 28.365 -17.339 7.102
231 2HB PRO 79 2HB PRO 79 29.016 -16.263 8.355
232 1HG PRO 79 1HG PRO 79 26.391 -16.131 6.943
233 2HG PRO 79 2HG PRO 79 26.833 -15.532 8.551
234 1HD PRO 79 1HD PRO 79 26.566 -13.960 6.212
235 2HD PRO 79 2HD PRO 79 27.320 -13.445 7.737
236 H HIS 80 H HIS 80 27.218 -16.521 5.263
237 HA HIS 80 HA HIS 80 28.689 -17.486 2.847
238 1HB HIS 80 1HB HIS 80 26.562 -18.965 2.633
239 2HB HIS 80 2HB HIS 80 27.746 -19.390 3.870
240 HD1 HIS 80 HD1 HIS 80 24.306 -17.970 3.423
241 HD2 HIS 80 HD2 HIS 80 26.907 -18.874 6.552
242 HE1 HIS 80 HE1 HIS 80 22.945 -17.815 5.554
Start of MODEL 8
1 H VAL 49 H VAL 49 53.681 -4.694 6.999
2 HA VAL 49 HA VAL 49 52.983 -4.897 4.105
3 HB VAL 49 HB VAL 49 54.173 -7.289 5.425
4 1HG1 VAL 49 1HG1 VAL 49 53.735 -6.154 2.746
5 2HG1 VAL 49 2HG1 VAL 49 55.324 -6.886 2.954
6 3HG1 VAL 49 3HG1 VAL 49 53.870 -7.841 3.245
7 1HG2 VAL 49 1HG2 VAL 49 55.644 -4.732 4.830
8 2HG2 VAL 49 2HG2 VAL 49 55.860 -5.851 6.177
9 3HG2 VAL 49 3HG2 VAL 49 56.452 -6.279 4.571
10 HA PRO 50 HA PRO 50 49.791 -6.937 6.897
11 1HB PRO 50 1HB PRO 50 47.898 -4.908 6.896
12 2HB PRO 50 2HB PRO 50 49.087 -5.175 8.179
13 1HG PRO 50 1HG PRO 50 49.028 -3.016 6.162
14 2HG PRO 50 2HG PRO 50 49.898 -3.099 7.687
15 1HD PRO 50 1HD PRO 50 50.984 -3.504 5.071
16 2HD PRO 50 2HD PRO 50 51.792 -3.695 6.637
17 H GLY 51 H GLY 51 47.472 -7.511 6.057
18 1HA GLY 51 1HA GLY 51 47.329 -7.022 3.108
19 2HA GLY 51 2HA GLY 51 47.207 -8.659 3.742
20 H LEU 52 H LEU 52 45.180 -9.149 3.125
21 HA LEU 52 HA LEU 52 42.890 -8.414 2.536
22 1HB LEU 52 1HB LEU 52 42.998 -10.537 3.705
23 2HB LEU 52 2HB LEU 52 43.109 -9.717 5.262
24 HG LEU 52 HG LEU 52 40.777 -10.624 4.427
25 1HD1 LEU 52 1HD1 LEU 52 41.464 -8.989 6.368
26 2HD1 LEU 52 2HD1 LEU 52 40.585 -7.837 5.368
27 3HD1 LEU 52 3HD1 LEU 52 39.777 -9.288 5.955
28 1HD2 LEU 52 1HD2 LEU 52 41.268 -9.077 2.295
29 2HD2 LEU 52 2HD2 LEU 52 39.651 -9.449 2.857
30 3HD2 LEU 52 3HD2 LEU 52 40.401 -7.920 3.306
31 H CYS 53 H CYS 53 43.049 -7.996 5.922
32 HA CYS 53 HA CYS 53 42.972 -5.408 6.545
33 1HB CYS 53 1HB CYS 53 41.402 -4.873 4.815
34 2HB CYS 53 2HB CYS 53 40.257 -6.082 5.373
35 HA PRO 54 HA PRO 54 41.855 -7.457 10.298
36 1HB PRO 54 1HB PRO 54 42.378 -5.324 11.949
37 2HB PRO 54 2HB PRO 54 43.636 -6.367 11.266
38 1HG PRO 54 1HG PRO 54 42.886 -3.586 10.504
39 2HG PRO 54 2HG PRO 54 44.438 -4.424 10.313
40 1HD PRO 54 1HD PRO 54 42.515 -3.980 8.274
41 2HD PRO 54 2HD PRO 54 43.922 -5.059 8.175
42 H ARG 55 H ARG 55 39.866 -5.664 8.636
43 HA ARG 55 HA ARG 55 37.936 -5.341 10.874
44 1HB ARG 55 1HB ARG 55 38.979 -3.126 10.011
45 2HB ARG 55 2HB ARG 55 38.016 -3.405 8.559
46 1HG ARG 55 1HG ARG 55 36.230 -3.881 10.644
47 2HG ARG 55 2HG ARG 55 37.161 -2.489 11.197
48 1HD ARG 55 1HD ARG 55 36.231 -2.474 8.363
49 2HD ARG 55 2HD ARG 55 35.017 -2.213 9.614
50 HE ARG 55 HE ARG 55 37.251 -0.399 8.965
51 1HH1 ARG 55 1HH1 ARG 55 37.094 -0.665 11.943
52 2HH1 ARG 55 2HH1 ARG 55 35.951 0.568 12.361
53 1HH2 ARG 55 1HH2 ARG 55 34.734 0.908 9.131
54 2HH2 ARG 55 2HH2 ARG 55 34.615 1.459 10.769
55 H CYS 56 H CYS 56 38.255 -5.351 7.297
56 HA CYS 56 HA CYS 56 35.679 -6.844 7.226
57 1HB CYS 56 1HB CYS 56 35.307 -5.969 5.011
58 2HB CYS 56 2HB CYS 56 35.803 -4.607 6.012
59 H LYS 57 H LYS 57 36.426 -7.473 4.362
60 HA LYS 57 HA LYS 57 38.678 -9.166 4.405
61 1HB LYS 57 1HB LYS 57 37.246 -11.256 3.909
62 2HB LYS 57 2HB LYS 57 37.359 -10.741 5.593
63 1HG LYS 57 1HG LYS 57 35.220 -9.275 4.810
64 2HG LYS 57 2HG LYS 57 35.039 -10.667 3.742
65 1HD LYS 57 1HD LYS 57 34.044 -11.687 5.501
66 2HD LYS 57 2HD LYS 57 35.670 -11.840 6.167
67 1HE LYS 57 1HE LYS 57 35.241 -9.397 7.037
68 2HE LYS 57 2HE LYS 57 33.543 -9.820 6.815
69 1HZ LYS 57 1HZ LYS 57 34.902 -11.939 8.087
70 2HZ LYS 57 2HZ LYS 57 35.189 -10.501 8.939
71 3HZ LYS 57 3HZ LYS 57 33.594 -11.017 8.658
72 H ARG 58 H ARG 58 37.265 -6.999 2.847
73 HA ARG 58 HA ARG 58 37.207 -8.385 0.201
74 1HB ARG 58 1HB ARG 58 35.079 -7.074 1.372
75 2HB ARG 58 2HB ARG 58 35.793 -5.807 0.376
76 1HG ARG 58 1HG ARG 58 35.126 -8.580 -0.645
77 2HG ARG 58 2HG ARG 58 34.067 -7.182 -0.830
78 1HD ARG 58 1HD ARG 58 35.380 -6.232 -2.436
79 2HD ARG 58 2HD ARG 58 36.876 -6.760 -1.665
80 HE ARG 58 HE ARG 58 36.728 -8.826 -2.867
81 1HH1 ARG 58 1HH1 ARG 58 33.668 -8.991 -2.556
82 2HH1 ARG 58 2HH1 ARG 58 33.176 -8.902 -4.214
83 1HH2 ARG 58 1HH2 ARG 58 36.247 -7.755 -5.342
84 2HH2 ARG 58 2HH2 ARG 58 34.634 -8.200 -5.790
85 H GLY 59 H GLY 59 39.606 -7.767 0.685
86 1HA GLY 59 1HA GLY 59 40.773 -6.103 -1.046
87 2HA GLY 59 2HA GLY 59 40.203 -4.921 0.134
88 H LYS 60 H LYS 60 42.831 -4.870 0.055
89 HA LYS 60 HA LYS 60 43.733 -6.504 2.392
90 1HB LYS 60 1HB LYS 60 45.952 -5.667 0.762
91 2HB LYS 60 2HB LYS 60 45.442 -7.299 1.178
92 1HG LYS 60 1HG LYS 60 45.360 -7.285 -1.172
93 2HG LYS 60 2HG LYS 60 43.683 -7.029 -0.691
94 1HD LYS 60 1HD LYS 60 44.660 -4.456 -0.741
95 2HD LYS 60 2HD LYS 60 45.533 -5.207 -2.078
96 1HE LYS 60 1HE LYS 60 42.526 -5.326 -1.701
97 2HE LYS 60 2HE LYS 60 43.358 -4.231 -2.803
98 1HZ LYS 60 1HZ LYS 60 44.368 -6.259 -3.823
99 2HZ LYS 60 2HZ LYS 60 43.294 -7.193 -2.894
100 3HZ LYS 60 3HZ LYS 60 42.696 -6.104 -4.053
101 H HIS 61 H HIS 61 43.725 -4.934 4.022
102 HA HIS 61 HA HIS 61 45.597 -2.761 3.868
103 1HB HIS 61 1HB HIS 61 43.809 -0.962 3.946
104 2HB HIS 61 2HB HIS 61 44.168 -1.652 2.353
105 HD1 HIS 61 HD1 HIS 61 42.298 -2.951 1.182
106 HD2 HIS 61 HD2 HIS 61 41.374 -2.093 5.157
107 HE1 HIS 61 HE1 HIS 61 39.900 -3.703 1.539
108 H TRP 62 H TRP 62 44.762 -0.926 5.475
109 HA TRP 62 HA TRP 62 44.026 -2.394 7.950
110 1HB TRP 62 1HB TRP 62 45.308 0.121 8.472
111 2HB TRP 62 2HB TRP 62 45.894 -1.505 8.783
112 HD1 TRP 62 HD1 TRP 62 47.009 1.399 7.094
113 HE1 TRP 62 HE1 TRP 62 48.622 0.879 5.147
114 HE3 TRP 62 HE3 TRP 62 46.081 -3.566 6.515
115 HZ2 TRP 62 HZ2 TRP 62 49.389 -1.379 3.528
116 HZ3 TRP 62 HZ3 TRP 62 47.194 -4.858 4.749
117 HH2 TRP 62 HH2 TRP 62 48.878 -3.796 3.275
118 H ALA 63 H ALA 63 43.027 -0.907 9.650
119 HA ALA 63 HA ALA 63 40.533 0.039 8.866
120 1HB ALA 63 1HB ALA 63 42.225 0.292 11.234
121 2HB ALA 63 2HB ALA 63 41.176 1.690 11.004
122 3HB ALA 63 3HB ALA 63 40.478 0.076 11.122
123 H ASN 64 H ASN 64 43.208 2.263 9.742
124 HA ASN 64 HA ASN 64 42.179 4.664 8.908
125 1HB ASN 64 1HB ASN 64 44.800 3.619 9.313
126 2HB ASN 64 2HB ASN 64 44.823 4.541 7.805
127 1HD2 ASN 64 1HD2 ASN 64 45.520 5.018 10.940
128 2HD2 ASN 64 2HD2 ASN 64 44.992 6.617 11.148
129 H GLU 65 H GLU 65 43.250 2.048 6.818
130 HA GLU 65 HA GLU 65 42.167 3.589 4.496
131 1HB GLU 65 1HB GLU 65 44.552 3.512 4.177
132 2HB GLU 65 2HB GLU 65 44.614 1.803 4.624
133 1HG GLU 65 1HG GLU 65 43.750 1.097 2.596
134 2HG GLU 65 2HG GLU 65 42.861 2.599 2.332
135 H CYS 66 H CYS 66 40.244 2.246 5.503
136 HA CYS 66 HA CYS 66 40.196 -0.366 4.056
137 1HB CYS 66 1HB CYS 66 40.401 -1.044 6.320
138 2HB CYS 66 2HB CYS 66 39.326 0.233 6.885
139 H LYS 67 H LYS 67 38.106 -1.050 3.378
140 HA LYS 67 HA LYS 67 35.778 0.659 3.689
141 1HB LYS 67 1HB LYS 67 37.350 0.636 1.107
142 2HB LYS 67 2HB LYS 67 35.605 0.894 1.094
143 1HG LYS 67 1HG LYS 67 36.075 2.694 2.906
144 2HG LYS 67 2HG LYS 67 37.746 2.601 2.351
145 1HD LYS 67 1HD LYS 67 35.315 3.285 0.674
146 2HD LYS 67 2HD LYS 67 36.634 4.370 1.117
147 1HE LYS 67 1HE LYS 67 37.602 3.757 -0.833
148 2HE LYS 67 2HE LYS 67 37.943 2.214 -0.047
149 1HZ LYS 67 1HZ LYS 67 35.589 1.598 -0.772
150 2HZ LYS 67 2HZ LYS 67 35.700 2.916 -1.834
151 3HZ LYS 67 3HZ LYS 67 36.801 1.627 -1.962
152 H SER 68 H SER 68 33.890 -0.405 2.928
153 HA SER 68 HA SER 68 34.187 -3.024 1.648
154 1HB SER 68 1HB SER 68 34.230 -2.667 4.496
155 2HB SER 68 2HB SER 68 32.775 -3.578 4.053
156 HG SER 68 HG SER 68 35.483 -4.152 3.402
157 H LYS 69 H LYS 69 32.784 -1.050 0.534
158 HA LYS 69 HA LYS 69 30.143 -0.533 1.361
159 1HB LYS 69 1HB LYS 69 29.665 -0.349 -1.155
160 2HB LYS 69 2HB LYS 69 30.959 0.675 -0.529
161 1HG LYS 69 1HG LYS 69 32.038 -1.898 -1.243
162 2HG LYS 69 2HG LYS 69 31.135 -1.241 -2.608
163 1HD LYS 69 1HD LYS 69 33.108 0.442 -1.060
164 2HD LYS 69 2HD LYS 69 33.612 -0.563 -2.420
165 1HE LYS 69 1HE LYS 69 31.969 0.580 -3.871
166 2HE LYS 69 2HE LYS 69 31.486 1.598 -2.514
167 1HZ LYS 69 1HZ LYS 69 33.751 2.431 -2.381
168 2HZ LYS 69 2HZ LYS 69 34.208 1.459 -3.697
169 3HZ LYS 69 3HZ LYS 69 33.095 2.718 -3.921
170 H THR 70 H THR 70 29.287 -2.450 2.303
171 HA THR 70 HA THR 70 28.324 -4.427 0.295
172 HB THR 70 HB THR 70 29.749 -4.981 2.907
173 HG1 THR 70 HG1 THR 70 30.556 -4.949 0.513
174 1HG2 THR 70 1HG2 THR 70 27.561 -6.490 1.615
175 2HG2 THR 70 2HG2 THR 70 28.986 -7.443 2.027
176 3HG2 THR 70 3HG2 THR 70 28.142 -6.538 3.276
177 H ASP 71 H ASP 71 28.025 -3.118 3.589
178 HA ASP 71 HA ASP 71 25.084 -3.186 3.282
179 1HB ASP 71 1HB ASP 71 26.100 -5.319 4.499
180 2HB ASP 71 2HB ASP 71 26.167 -4.219 5.876
181 H ASN 72 H ASN 72 24.863 -2.656 6.242
182 HA ASN 72 HA ASN 72 26.104 0.068 6.264
183 1HB ASN 72 1HB ASN 72 23.560 -0.055 5.830
184 2HB ASN 72 2HB ASN 72 23.430 -0.549 7.522
185 1HD2 ASN 72 1HD2 ASN 72 23.141 1.175 8.931
186 2HD2 ASN 72 2HD2 ASN 72 23.683 2.761 8.662
187 H GLN 73 H GLN 73 27.159 -2.350 7.482
188 HA GLN 73 HA GLN 73 26.848 -1.656 10.364
189 1HB GLN 73 1HB GLN 73 27.528 -4.310 9.060
190 2HB GLN 73 2HB GLN 73 27.447 -4.015 10.793
191 1HG GLN 73 1HG GLN 73 25.190 -3.915 8.792
192 2HG GLN 73 2HG GLN 73 25.334 -4.956 10.207
193 1HE2 GLN 73 1HE2 GLN 73 23.380 -2.640 9.327
194 2HE2 GLN 73 2HE2 GLN 73 23.268 -1.695 10.742
195 H GLY 74 H GLY 74 29.287 -3.912 9.920
196 1HA GLY 74 1HA GLY 74 31.347 -1.755 9.697
197 2HA GLY 74 2HA GLY 74 31.524 -3.139 10.787
198 H ASN 75 H ASN 75 30.919 -5.290 9.392
199 HA ASN 75 HA ASN 75 32.258 -5.170 6.759
200 1HB ASN 75 1HB ASN 75 33.376 -7.377 7.610
201 2HB ASN 75 2HB ASN 75 34.145 -5.825 7.914
202 1HD2 ASN 75 1HD2 ASN 75 31.252 -7.093 9.583
203 2HD2 ASN 75 2HD2 ASN 75 31.972 -7.175 11.124
204 HA PRO 76 HA PRO 76 28.699 -8.044 6.744
205 1HB PRO 76 1HB PRO 76 27.310 -6.687 4.817
206 2HB PRO 76 2HB PRO 76 27.217 -6.253 6.531
207 1HG PRO 76 1HG PRO 76 28.531 -4.774 4.333
208 2HG PRO 76 2HG PRO 76 28.075 -4.202 5.946
209 1HD PRO 76 1HD PRO 76 30.712 -5.074 5.019
210 2HD PRO 76 2HD PRO 76 30.282 -4.392 6.603
211 H ILE 77 H ILE 77 31.353 -7.731 5.264
212 HA ILE 77 HA ILE 77 31.137 -8.060 2.531
213 HB ILE 77 HB ILE 77 33.116 -9.761 4.012
214 1HG1 ILE 77 1HG1 ILE 77 33.156 -7.759 5.358
215 2HG1 ILE 77 2HG1 ILE 77 34.514 -7.641 4.238
216 1HG2 ILE 77 1HG2 ILE 77 33.012 -9.561 1.497
217 2HG2 ILE 77 2HG2 ILE 77 33.421 -7.855 1.680
218 3HG2 ILE 77 3HG2 ILE 77 34.560 -9.097 2.204
219 1HD1 ILE 77 1HD1 ILE 77 31.818 -6.431 3.609
220 2HD1 ILE 77 2HD1 ILE 77 33.054 -5.548 4.503
221 3HD1 ILE 77 3HD1 ILE 77 33.373 -6.083 2.855
222 HA PRO 78 HA PRO 78 30.486 -12.756 3.144
223 1HB PRO 78 1HB PRO 78 29.832 -13.623 5.670
224 2HB PRO 78 2HB PRO 78 31.495 -13.537 5.056
225 1HG PRO 78 1HG PRO 78 30.119 -11.753 7.008
226 2HG PRO 78 2HG PRO 78 31.847 -12.095 6.824
227 1HD PRO 78 1HD PRO 78 30.499 -9.773 5.920
228 2HD PRO 78 2HD PRO 78 32.150 -10.261 5.487
229 HA PRO 79 HA PRO 79 26.082 -11.980 3.004
230 1HB PRO 79 1HB PRO 79 25.489 -14.131 1.400
231 2HB PRO 79 2HB PRO 79 26.175 -12.613 0.788
232 1HG PRO 79 1HG PRO 79 27.506 -15.253 1.173
233 2HG PRO 79 2HG PRO 79 27.913 -13.944 0.051
234 1HD PRO 79 1HD PRO 79 29.231 -14.521 2.495
235 2HD PRO 79 2HD PRO 79 29.430 -13.052 1.517
236 H HIS 80 H HIS 80 24.075 -13.621 3.203
237 HA HIS 80 HA HIS 80 24.339 -16.072 4.608
238 1HB HIS 80 1HB HIS 80 23.511 -15.071 6.886
239 2HB HIS 80 2HB HIS 80 25.235 -15.054 6.516
240 HD1 HIS 80 HD1 HIS 80 22.747 -12.679 4.958
241 HD2 HIS 80 HD2 HIS 80 25.810 -12.605 7.783
242 HE1 HIS 80 HE1 HIS 80 23.165 -10.240 5.499
Start of MODEL 9
1 H VAL 49 H VAL 49 53.340 -5.463 2.761
2 HA VAL 49 HA VAL 49 53.165 -4.403 5.550
3 HB VAL 49 HB VAL 49 50.978 -3.412 4.092
4 1HG1 VAL 49 1HG1 VAL 49 53.632 -2.126 4.797
5 2HG1 VAL 49 2HG1 VAL 49 52.176 -1.238 4.350
6 3HG1 VAL 49 3HG1 VAL 49 52.204 -2.201 5.826
7 1HG2 VAL 49 1HG2 VAL 49 52.115 -4.060 1.991
8 2HG2 VAL 49 2HG2 VAL 49 52.010 -2.307 2.146
9 3HG2 VAL 49 3HG2 VAL 49 53.533 -3.132 2.478
10 HA PRO 50 HA PRO 50 49.924 -7.231 6.341
11 1HB PRO 50 1HB PRO 50 47.793 -5.640 7.162
12 2HB PRO 50 2HB PRO 50 49.167 -6.115 8.175
13 1HG PRO 50 1HG PRO 50 48.630 -3.468 6.890
14 2HG PRO 50 2HG PRO 50 49.558 -3.849 8.343
15 1HD PRO 50 1HD PRO 50 50.662 -3.241 5.853
16 2HD PRO 50 2HD PRO 50 51.518 -4.054 7.179
17 H GLY 51 H GLY 51 47.560 -7.882 5.624
18 1HA GLY 51 1HA GLY 51 47.117 -6.717 2.900
19 2HA GLY 51 2HA GLY 51 47.151 -8.457 3.151
20 H LEU 52 H LEU 52 45.162 -9.010 2.600
21 HA LEU 52 HA LEU 52 42.806 -8.587 2.246
22 1HB LEU 52 1HB LEU 52 43.212 -10.681 3.440
23 2HB LEU 52 2HB LEU 52 43.148 -9.816 4.982
24 HG LEU 52 HG LEU 52 40.887 -9.505 3.046
25 1HD1 LEU 52 1HD1 LEU 52 41.221 -11.816 4.979
26 2HD1 LEU 52 2HD1 LEU 52 39.755 -11.450 4.071
27 3HD1 LEU 52 3HD1 LEU 52 41.219 -11.943 3.221
28 1HD2 LEU 52 1HD2 LEU 52 41.452 -9.048 5.892
29 2HD2 LEU 52 2HD2 LEU 52 40.396 -8.161 4.791
30 3HD2 LEU 52 3HD2 LEU 52 39.843 -9.663 5.534
31 H CYS 53 H CYS 53 43.161 -8.091 5.639
32 HA CYS 53 HA CYS 53 42.880 -5.607 6.358
33 1HB CYS 53 1HB CYS 53 41.337 -5.097 4.552
34 2HB CYS 53 2HB CYS 53 40.178 -6.274 5.160
35 HA PRO 54 HA PRO 54 41.698 -7.951 9.943
36 1HB PRO 54 1HB PRO 54 42.305 -5.976 11.753
37 2HB PRO 54 2HB PRO 54 43.522 -7.018 10.995
38 1HG PRO 54 1HG PRO 54 42.888 -4.158 10.438
39 2HG PRO 54 2HG PRO 54 44.410 -5.038 10.206
40 1HD PRO 54 1HD PRO 54 42.550 -4.371 8.176
41 2HD PRO 54 2HD PRO 54 43.899 -5.517 8.023
42 H ARG 55 H ARG 55 39.953 -5.657 8.479
43 HA ARG 55 HA ARG 55 37.982 -5.438 10.711
44 1HB ARG 55 1HB ARG 55 39.180 -3.377 9.159
45 2HB ARG 55 2HB ARG 55 37.498 -3.497 8.642
46 1HG ARG 55 1HG ARG 55 37.017 -2.249 10.469
47 2HG ARG 55 2HG ARG 55 37.309 -3.724 11.393
48 1HD ARG 55 1HD ARG 55 39.766 -3.063 11.441
49 2HD ARG 55 2HD ARG 55 39.269 -1.495 10.805
50 HE ARG 55 HE ARG 55 37.793 -1.348 12.896
51 1HH1 ARG 55 1HH1 ARG 55 41.050 -2.032 12.821
52 2HH1 ARG 55 2HH1 ARG 55 41.168 -2.577 14.462
53 1HH2 ARG 55 1HH2 ARG 55 37.739 -2.608 14.975
54 2HH2 ARG 55 2HH2 ARG 55 39.293 -2.903 15.681
55 H CYS 56 H CYS 56 38.118 -5.241 7.126
56 HA CYS 56 HA CYS 56 35.554 -6.734 7.080
57 1HB CYS 56 1HB CYS 56 35.226 -5.897 4.852
58 2HB CYS 56 2HB CYS 56 35.768 -4.530 5.822
59 H LYS 57 H LYS 57 36.314 -7.443 4.214
60 HA LYS 57 HA LYS 57 38.512 -9.224 4.380
61 1HB LYS 57 1HB LYS 57 35.701 -10.275 4.606
62 2HB LYS 57 2HB LYS 57 36.993 -11.268 3.923
63 1HG LYS 57 1HG LYS 57 38.291 -10.568 6.104
64 2HG LYS 57 2HG LYS 57 36.672 -10.249 6.728
65 1HD LYS 57 1HD LYS 57 36.924 -12.810 5.295
66 2HD LYS 57 2HD LYS 57 37.887 -12.711 6.769
67 1HE LYS 57 1HE LYS 57 35.887 -12.018 8.036
68 2HE LYS 57 2HE LYS 57 34.919 -12.113 6.563
69 1HZ LYS 57 1HZ LYS 57 36.168 -14.520 6.661
70 2HZ LYS 57 2HZ LYS 57 35.823 -14.214 8.296
71 3HZ LYS 57 3HZ LYS 57 34.572 -14.220 7.146
72 H ARG 58 H ARG 58 37.199 -7.081 2.696
73 HA ARG 58 HA ARG 58 37.113 -8.640 0.147
74 1HB ARG 58 1HB ARG 58 35.019 -7.264 1.132
75 2HB ARG 58 2HB ARG 58 35.847 -5.949 0.294
76 1HG ARG 58 1HG ARG 58 34.297 -6.963 -1.265
77 2HG ARG 58 2HG ARG 58 35.932 -7.410 -1.756
78 1HD ARG 58 1HD ARG 58 35.429 -9.591 -1.541
79 2HD ARG 58 2HD ARG 58 34.979 -9.339 0.146
80 HE ARG 58 HE ARG 58 32.687 -9.130 -0.534
81 1HH1 ARG 58 1HH1 ARG 58 33.910 -7.831 -3.210
82 2HH1 ARG 58 2HH1 ARG 58 33.132 -8.864 -4.362
83 1HH2 ARG 58 1HH2 ARG 58 32.094 -11.170 -1.996
84 2HH2 ARG 58 2HH2 ARG 58 32.106 -10.751 -3.675
85 H GLY 59 H GLY 59 39.354 -7.133 1.701
86 1HA GLY 59 1HA GLY 59 40.349 -5.784 -0.748
87 2HA GLY 59 2HA GLY 59 40.173 -4.762 0.680
88 H LYS 60 H LYS 60 42.312 -4.413 1.043
89 HA LYS 60 HA LYS 60 43.823 -6.468 2.410
90 1HB LYS 60 1HB LYS 60 45.629 -5.341 0.486
91 2HB LYS 60 2HB LYS 60 45.204 -7.023 0.750
92 1HG LYS 60 1HG LYS 60 43.380 -6.923 -0.789
93 2HG LYS 60 2HG LYS 60 43.504 -5.167 -0.903
94 1HD LYS 60 1HD LYS 60 45.770 -5.413 -1.897
95 2HD LYS 60 2HD LYS 60 45.583 -7.166 -1.841
96 1HE LYS 60 1HE LYS 60 44.829 -6.819 -3.984
97 2HE LYS 60 2HE LYS 60 43.309 -6.555 -3.131
98 1HZ LYS 60 1HZ LYS 60 44.487 -4.134 -3.004
99 2HZ LYS 60 2HZ LYS 60 44.976 -4.677 -4.537
100 3HZ LYS 60 3HZ LYS 60 43.325 -4.588 -4.156
101 H HIS 61 H HIS 61 43.387 -4.799 4.050
102 HA HIS 61 HA HIS 61 45.494 -2.789 4.166
103 1HB HIS 61 1HB HIS 61 43.801 -0.889 4.230
104 2HB HIS 61 2HB HIS 61 44.199 -1.530 2.622
105 HD1 HIS 61 HD1 HIS 61 42.208 -2.272 1.247
106 HD2 HIS 61 HD2 HIS 61 41.379 -2.335 5.335
107 HE1 HIS 61 HE1 HIS 61 39.799 -3.055 1.483
108 H TRP 62 H TRP 62 44.618 -0.985 5.832
109 HA TRP 62 HA TRP 62 43.658 -2.569 8.152
110 1HB TRP 62 1HB TRP 62 44.961 -0.149 8.938
111 2HB TRP 62 2HB TRP 62 45.488 -1.809 9.159
112 HD1 TRP 62 HD1 TRP 62 46.769 1.183 7.791
113 HE1 TRP 62 HE1 TRP 62 48.532 0.792 5.956
114 HE3 TRP 62 HE3 TRP 62 45.815 -3.694 6.720
115 HZ2 TRP 62 HZ2 TRP 62 49.399 -1.327 4.228
116 HZ3 TRP 62 HZ3 TRP 62 47.058 -4.851 4.948
117 HH2 TRP 62 HH2 TRP 62 48.884 -3.702 3.709
118 H ALA 63 H ALA 63 42.635 -1.125 9.898
119 HA ALA 63 HA ALA 63 40.208 -0.041 9.011
120 1HB ALA 63 1HB ALA 63 41.305 -0.518 11.462
121 2HB ALA 63 2HB ALA 63 41.325 1.246 11.428
122 3HB ALA 63 3HB ALA 63 39.805 0.377 11.215
123 H ASN 64 H ASN 64 42.942 1.928 10.237
124 HA ASN 64 HA ASN 64 42.110 4.469 9.631
125 1HB ASN 64 1HB ASN 64 44.659 3.162 9.898
126 2HB ASN 64 2HB ASN 64 44.748 4.337 8.581
127 1HD2 ASN 64 1HD2 ASN 64 43.026 4.321 11.762
128 2HD2 ASN 64 2HD2 ASN 64 43.621 5.834 12.251
129 H GLU 65 H GLU 65 42.993 1.978 7.340
130 HA GLU 65 HA GLU 65 42.000 3.728 5.143
131 1HB GLU 65 1HB GLU 65 44.414 3.828 4.958
132 2HB GLU 65 2HB GLU 65 44.550 2.076 5.147
133 1HG GLU 65 1HG GLU 65 44.449 1.934 2.894
134 2HG GLU 65 2HG GLU 65 42.759 2.423 3.018
135 H CYS 66 H CYS 66 40.144 2.170 5.930
136 HA CYS 66 HA CYS 66 40.356 -0.317 4.298
137 1HB CYS 66 1HB CYS 66 40.417 -1.217 6.450
138 2HB CYS 66 2HB CYS 66 39.393 0.047 7.117
139 H LYS 67 H LYS 67 38.341 -1.144 3.509
140 HA LYS 67 HA LYS 67 35.921 0.477 3.638
141 1HB LYS 67 1HB LYS 67 35.886 0.725 1.085
142 2HB LYS 67 2HB LYS 67 37.001 1.792 1.940
143 1HG LYS 67 1HG LYS 67 38.862 0.269 1.475
144 2HG LYS 67 2HG LYS 67 37.764 -0.859 0.679
145 1HD LYS 67 1HD LYS 67 37.261 1.582 -0.581
146 2HD LYS 67 2HD LYS 67 39.014 1.554 -0.376
147 1HE LYS 67 1HE LYS 67 37.812 -0.992 -1.290
148 2HE LYS 67 2HE LYS 67 37.724 0.340 -2.443
149 1HZ LYS 67 1HZ LYS 67 40.190 -0.595 -1.078
150 2HZ LYS 67 2HZ LYS 67 39.771 -0.925 -2.692
151 3HZ LYS 67 3HZ LYS 67 40.097 0.668 -2.211
152 H SER 68 H SER 68 34.189 -0.608 2.259
153 HA SER 68 HA SER 68 34.741 -3.328 1.385
154 1HB SER 68 1HB SER 68 34.315 -2.852 4.130
155 2HB SER 68 2HB SER 68 32.820 -3.593 3.532
156 HG SER 68 HG SER 68 34.564 -5.002 2.382
157 H LYS 69 H LYS 69 32.306 -0.956 2.422
158 HA LYS 69 HA LYS 69 30.080 -0.660 1.671
159 1HB LYS 69 1HB LYS 69 31.911 -0.042 -0.253
160 2HB LYS 69 2HB LYS 69 30.915 -1.218 -1.110
161 1HG LYS 69 1HG LYS 69 29.114 0.443 0.292
162 2HG LYS 69 2HG LYS 69 30.299 1.523 -0.442
163 1HD LYS 69 1HD LYS 69 29.790 -0.342 -2.444
164 2HD LYS 69 2HD LYS 69 28.206 -0.066 -1.717
165 1HE LYS 69 1HE LYS 69 29.214 2.487 -1.854
166 2HE LYS 69 2HE LYS 69 29.877 1.756 -3.315
167 1HZ LYS 69 1HZ LYS 69 27.583 0.947 -3.792
168 2HZ LYS 69 2HZ LYS 69 27.028 1.909 -2.507
169 3HZ LYS 69 3HZ LYS 69 27.761 2.632 -3.857
170 H THR 70 H THR 70 29.774 -2.992 2.662
171 HA THR 70 HA THR 70 28.812 -4.778 0.464
172 HB THR 70 HB THR 70 30.261 -5.351 3.023
173 HG1 THR 70 HG1 THR 70 30.256 -6.924 0.716
174 1HG2 THR 70 1HG2 THR 70 27.932 -6.901 2.006
175 2HG2 THR 70 2HG2 THR 70 29.354 -7.826 2.489
176 3HG2 THR 70 3HG2 THR 70 28.564 -6.756 3.641
177 H ASP 71 H ASP 71 28.130 -3.330 3.611
178 HA ASP 71 HA ASP 71 25.250 -3.870 3.120
179 1HB ASP 71 1HB ASP 71 26.098 -5.672 4.625
180 2HB ASP 71 2HB ASP 71 26.575 -4.435 5.787
181 H ASN 72 H ASN 72 25.698 -2.827 6.299
182 HA ASN 72 HA ASN 72 26.005 0.022 5.594
183 1HB ASN 72 1HB ASN 72 23.872 0.726 6.344
184 2HB ASN 72 2HB ASN 72 23.534 -0.690 5.342
185 1HD2 ASN 72 1HD2 ASN 72 23.943 -2.848 6.941
186 2HD2 ASN 72 2HD2 ASN 72 23.006 -2.772 8.354
187 H GLN 73 H GLN 73 27.347 -2.077 7.313
188 HA GLN 73 HA GLN 73 27.133 -0.640 9.924
189 1HB GLN 73 1HB GLN 73 27.589 -3.537 9.227
190 2HB GLN 73 2HB GLN 73 28.151 -2.886 10.765
191 1HG GLN 73 1HG GLN 73 26.035 -2.665 11.596
192 2HG GLN 73 2HG GLN 73 25.368 -2.189 10.033
193 1HE2 GLN 73 1HE2 GLN 73 24.574 -4.394 12.075
194 2HE2 GLN 73 2HE2 GLN 73 24.449 -5.797 11.113
195 H GLY 74 H GLY 74 29.562 -3.014 9.088
196 1HA GLY 74 1HA GLY 74 31.582 -0.918 8.536
197 2HA GLY 74 2HA GLY 74 31.860 -1.964 9.937
198 H ASN 75 H ASN 75 31.397 -4.409 9.314
199 HA ASN 75 HA ASN 75 32.532 -4.958 6.623
200 1HB ASN 75 1HB ASN 75 33.607 -6.960 7.959
201 2HB ASN 75 2HB ASN 75 34.444 -5.423 7.797
202 1HD2 ASN 75 1HD2 ASN 75 31.655 -6.180 9.913
203 2HD2 ASN 75 2HD2 ASN 75 32.466 -5.836 11.374
204 HA PRO 76 HA PRO 76 28.881 -7.623 7.297
205 1HB PRO 76 1HB PRO 76 27.541 -6.686 5.107
206 2HB PRO 76 2HB PRO 76 27.480 -5.858 6.674
207 1HG PRO 76 1HG PRO 76 28.847 -5.005 4.193
208 2HG PRO 76 2HG PRO 76 28.428 -4.043 5.618
209 1HD PRO 76 1HD PRO 76 31.008 -5.226 4.929
210 2HD PRO 76 2HD PRO 76 30.622 -4.174 6.308
211 H ILE 77 H ILE 77 31.515 -7.862 5.843
212 HA ILE 77 HA ILE 77 31.165 -8.762 3.218
213 HB ILE 77 HB ILE 77 33.244 -10.067 4.927
214 1HG1 ILE 77 1HG1 ILE 77 33.332 -7.852 5.842
215 2HG1 ILE 77 2HG1 ILE 77 34.602 -7.925 4.625
216 1HG2 ILE 77 1HG2 ILE 77 32.865 -9.168 2.118
217 2HG2 ILE 77 2HG2 ILE 77 34.499 -9.063 2.773
218 3HG2 ILE 77 3HG2 ILE 77 33.661 -10.613 2.742
219 1HD1 ILE 77 1HD1 ILE 77 31.880 -6.968 3.795
220 2HD1 ILE 77 2HD1 ILE 77 32.928 -5.874 4.691
221 3HD1 ILE 77 3HD1 ILE 77 33.462 -6.538 3.147
222 HA PRO 78 HA PRO 78 30.670 -13.186 4.988
223 1HB PRO 78 1HB PRO 78 30.149 -13.406 7.682
224 2HB PRO 78 2HB PRO 78 31.781 -13.455 6.986
225 1HG PRO 78 1HG PRO 78 30.446 -11.254 8.491
226 2HG PRO 78 2HG PRO 78 32.173 -11.617 8.327
227 1HD PRO 78 1HD PRO 78 30.758 -9.605 6.934
228 2HD PRO 78 2HD PRO 78 32.391 -10.188 6.550
229 HA PRO 79 HA PRO 79 26.255 -12.649 4.862
230 1HB PRO 79 1HB PRO 79 25.661 -15.246 4.193
231 2HB PRO 79 2HB PRO 79 26.279 -14.054 3.033
232 1HG PRO 79 1HG PRO 79 27.700 -16.346 4.303
233 2HG PRO 79 2HG PRO 79 28.026 -15.539 2.760
234 1HD PRO 79 1HD PRO 79 29.455 -15.154 5.179
235 2HD PRO 79 2HD PRO 79 29.568 -14.144 3.721
236 H HIS 80 H HIS 80 27.013 -15.912 6.080
237 HA HIS 80 HA HIS 80 26.213 -15.354 8.796
238 1HB HIS 80 1HB HIS 80 24.036 -15.394 7.253
239 2HB HIS 80 2HB HIS 80 24.224 -17.135 7.453
240 HD1 HIS 80 HD1 HIS 80 21.836 -15.680 8.766
241 HD2 HIS 80 HD2 HIS 80 25.451 -16.410 10.709
242 HE1 HIS 80 HE1 HIS 80 21.336 -15.633 11.248
Start of MODEL 10
1 H VAL 49 H VAL 49 53.083 -4.599 8.636
2 HA VAL 49 HA VAL 49 53.063 -4.477 5.652
3 HB VAL 49 HB VAL 49 54.181 -6.816 7.214
4 1HG1 VAL 49 1HG1 VAL 49 53.497 -6.327 4.482
5 2HG1 VAL 49 2HG1 VAL 49 55.252 -6.466 4.591
6 3HG1 VAL 49 3HG1 VAL 49 54.225 -7.772 5.181
7 1HG2 VAL 49 1HG2 VAL 49 55.489 -4.286 6.251
8 2HG2 VAL 49 2HG2 VAL 49 55.754 -5.173 7.753
9 3HG2 VAL 49 3HG2 VAL 49 56.403 -5.796 6.236
10 HA PRO 50 HA PRO 50 49.406 -6.731 7.575
11 1HB PRO 50 1HB PRO 50 47.512 -4.792 7.102
12 2HB PRO 50 2HB PRO 50 48.401 -4.959 8.614
13 1HG PRO 50 1HG PRO 50 48.776 -2.920 6.474
14 2HG PRO 50 2HG PRO 50 49.133 -2.815 8.200
15 1HD PRO 50 1HD PRO 50 51.020 -3.251 6.150
16 2HD PRO 50 2HD PRO 50 51.277 -3.489 7.893
17 H GLY 51 H GLY 51 47.313 -7.272 6.234
18 1HA GLY 51 1HA GLY 51 47.828 -6.832 3.326
19 2HA GLY 51 2HA GLY 51 47.629 -8.474 3.930
20 H LEU 52 H LEU 52 45.731 -9.183 3.226
21 HA LEU 52 HA LEU 52 43.576 -8.345 2.097
22 1HB LEU 52 1HB LEU 52 43.500 -10.548 3.041
23 2HB LEU 52 2HB LEU 52 43.365 -9.890 4.678
24 HG LEU 52 HG LEU 52 41.360 -8.958 2.692
25 1HD1 LEU 52 1HD1 LEU 52 41.784 -11.612 2.627
26 2HD1 LEU 52 2HD1 LEU 52 40.745 -11.537 4.050
27 3HD1 LEU 52 3HD1 LEU 52 40.169 -10.916 2.503
28 1HD2 LEU 52 1HD2 LEU 52 41.759 -9.035 5.520
29 2HD2 LEU 52 2HD2 LEU 52 40.512 -8.192 4.600
30 3HD2 LEU 52 3HD2 LEU 52 40.251 -9.855 5.127
31 H CYS 53 H CYS 53 43.441 -7.980 5.563
32 HA CYS 53 HA CYS 53 43.003 -5.504 6.248
33 1HB CYS 53 1HB CYS 53 41.588 -5.072 4.306
34 2HB CYS 53 2HB CYS 53 40.432 -6.289 4.838
35 HA PRO 54 HA PRO 54 41.609 -7.981 9.676
36 1HB PRO 54 1HB PRO 54 42.185 -6.087 11.583
37 2HB PRO 54 2HB PRO 54 43.406 -7.147 10.857
38 1HG PRO 54 1HG PRO 54 42.911 -4.249 10.373
39 2HG PRO 54 2HG PRO 54 44.406 -5.183 10.173
40 1HD PRO 54 1HD PRO 54 42.651 -4.370 8.095
41 2HD PRO 54 2HD PRO 54 43.982 -5.537 7.951
42 H ARG 55 H ARG 55 39.993 -5.684 8.146
43 HA ARG 55 HA ARG 55 37.945 -5.331 10.290
44 1HB ARG 55 1HB ARG 55 39.148 -3.240 9.315
45 2HB ARG 55 2HB ARG 55 38.205 -3.556 7.858
46 1HG ARG 55 1HG ARG 55 36.385 -2.622 8.790
47 2HG ARG 55 2HG ARG 55 36.482 -3.737 10.153
48 1HD ARG 55 1HD ARG 55 38.558 -1.951 10.632
49 2HD ARG 55 2HD ARG 55 37.266 -0.925 10.004
50 HE ARG 55 HE ARG 55 36.168 -1.249 12.054
51 1HH1 ARG 55 1HH1 ARG 55 38.928 -3.146 12.099
52 2HH1 ARG 55 2HH1 ARG 55 38.333 -4.302 13.243
53 1HH2 ARG 55 1HH2 ARG 55 35.094 -3.068 13.207
54 2HH2 ARG 55 2HH2 ARG 55 36.164 -4.258 13.870
55 H CYS 56 H CYS 56 38.176 -5.230 6.710
56 HA CYS 56 HA CYS 56 35.631 -6.741 6.608
57 1HB CYS 56 1HB CYS 56 35.419 -6.009 4.331
58 2HB CYS 56 2HB CYS 56 35.958 -4.602 5.243
59 H LYS 57 H LYS 57 36.538 -7.628 3.846
60 HA LYS 57 HA LYS 57 38.740 -9.371 4.224
61 1HB LYS 57 1HB LYS 57 35.988 -10.352 4.717
62 2HB LYS 57 2HB LYS 57 37.002 -11.381 3.698
63 1HG LYS 57 1HG LYS 57 38.531 -10.436 5.957
64 2HG LYS 57 2HG LYS 57 37.043 -11.199 6.519
65 1HD LYS 57 1HD LYS 57 37.536 -13.227 5.325
66 2HD LYS 57 2HD LYS 57 38.881 -12.468 4.474
67 1HE LYS 57 1HE LYS 57 39.630 -13.912 6.371
68 2HE LYS 57 2HE LYS 57 40.125 -12.230 6.556
69 1HZ LYS 57 1HZ LYS 57 37.605 -13.233 7.727
70 2HZ LYS 57 2HZ LYS 57 39.082 -13.382 8.553
71 3HZ LYS 57 3HZ LYS 57 38.491 -11.846 8.145
72 H ARG 58 H ARG 58 37.467 -7.373 2.329
73 HA ARG 58 HA ARG 58 37.539 -9.127 -0.094
74 1HB ARG 58 1HB ARG 58 35.336 -7.798 0.686
75 2HB ARG 58 2HB ARG 58 36.138 -6.503 -0.209
76 1HG ARG 58 1HG ARG 58 35.999 -7.625 -2.230
77 2HG ARG 58 2HG ARG 58 36.004 -9.215 -1.468
78 1HD ARG 58 1HD ARG 58 33.768 -9.240 -1.751
79 2HD ARG 58 2HD ARG 58 33.684 -7.999 -0.501
80 HE ARG 58 HE ARG 58 34.057 -6.397 -2.572
81 1HH1 ARG 58 1HH1 ARG 58 31.228 -7.116 -1.835
82 2HH1 ARG 58 2HH1 ARG 58 30.591 -7.652 -3.352
83 1HH2 ARG 58 1HH2 ARG 58 33.705 -8.056 -4.822
84 2HH2 ARG 58 2HH2 ARG 58 31.991 -8.184 -5.043
85 H GLY 59 H GLY 59 39.609 -7.388 1.422
86 1HA GLY 59 1HA GLY 59 40.717 -6.230 -1.057
87 2HA GLY 59 2HA GLY 59 40.365 -5.069 0.226
88 H LYS 60 H LYS 60 42.678 -4.687 0.251
89 HA LYS 60 HA LYS 60 44.102 -6.501 2.100
90 1HB LYS 60 1HB LYS 60 46.063 -5.514 0.344
91 2HB LYS 60 2HB LYS 60 45.496 -7.174 0.476
92 1HG LYS 60 1HG LYS 60 43.898 -6.899 -1.252
93 2HG LYS 60 2HG LYS 60 44.070 -5.143 -1.227
94 1HD LYS 60 1HD LYS 60 45.648 -5.316 -2.822
95 2HD LYS 60 2HD LYS 60 46.662 -6.193 -1.674
96 1HE LYS 60 1HE LYS 60 45.488 -8.302 -2.313
97 2HE LYS 60 2HE LYS 60 44.597 -7.399 -3.538
98 1HZ LYS 60 1HZ LYS 60 47.409 -6.925 -3.679
99 2HZ LYS 60 2HZ LYS 60 47.041 -8.575 -3.856
100 3HZ LYS 60 3HZ LYS 60 46.336 -7.435 -4.896
101 H HIS 61 H HIS 61 43.654 -4.853 3.681
102 HA HIS 61 HA HIS 61 45.603 -2.717 3.733
103 1HB HIS 61 1HB HIS 61 43.831 -0.909 3.721
104 2HB HIS 61 2HB HIS 61 44.274 -1.576 2.137
105 HD1 HIS 61 HD1 HIS 61 42.401 -2.663 0.793
106 HD2 HIS 61 HD2 HIS 61 41.366 -2.211 4.810
107 HE1 HIS 61 HE1 HIS 61 39.981 -3.421 1.009
108 H TRP 62 H TRP 62 44.643 -0.914 5.328
109 HA TRP 62 HA TRP 62 43.910 -2.471 7.734
110 1HB TRP 62 1HB TRP 62 44.812 0.268 8.179
111 2HB TRP 62 2HB TRP 62 45.477 -1.249 8.760
112 HD1 TRP 62 HD1 TRP 62 46.762 1.487 7.048
113 HE1 TRP 62 HE1 TRP 62 48.540 0.887 5.275
114 HE3 TRP 62 HE3 TRP 62 45.823 -3.482 6.536
115 HZ2 TRP 62 HZ2 TRP 62 49.425 -1.435 3.808
116 HZ3 TRP 62 HZ3 TRP 62 47.080 -4.845 4.926
117 HH2 TRP 62 HH2 TRP 62 48.892 -3.851 3.581
118 H ALA 63 H ALA 63 42.701 -1.137 9.431
119 HA ALA 63 HA ALA 63 40.104 -0.521 8.531
120 1HB ALA 63 1HB ALA 63 41.646 -0.087 11.031
121 2HB ALA 63 2HB ALA 63 40.210 0.916 10.819
122 3HB ALA 63 3HB ALA 63 40.069 -0.842 10.796
123 H ASN 64 H ASN 64 42.429 1.911 9.781
124 HA ASN 64 HA ASN 64 41.150 4.240 9.077
125 1HB ASN 64 1HB ASN 64 43.817 3.516 9.664
126 2HB ASN 64 2HB ASN 64 43.886 4.460 8.172
127 1HD2 ASN 64 1HD2 ASN 64 43.243 6.711 8.267
128 2HD2 ASN 64 2HD2 ASN 64 42.950 7.503 9.739
129 H GLU 65 H GLU 65 42.938 2.111 6.876
130 HA GLU 65 HA GLU 65 41.830 3.695 4.592
131 1HB GLU 65 1HB GLU 65 44.307 3.642 4.694
132 2HB GLU 65 2HB GLU 65 44.260 1.875 4.664
133 1HG GLU 65 1HG GLU 65 42.724 2.417 2.499
134 2HG GLU 65 2HG GLU 65 43.796 3.818 2.469
135 H CYS 66 H CYS 66 39.951 2.107 5.489
136 HA CYS 66 HA CYS 66 40.076 -0.308 3.734
137 1HB CYS 66 1HB CYS 66 40.275 -1.228 5.909
138 2HB CYS 66 2HB CYS 66 39.140 -0.072 6.595
139 H LYS 67 H LYS 67 37.970 -1.051 3.018
140 HA LYS 67 HA LYS 67 35.628 0.644 3.414
141 1HB LYS 67 1HB LYS 67 37.376 1.201 1.229
142 2HB LYS 67 2HB LYS 67 35.941 0.422 0.562
143 1HG LYS 67 1HG LYS 67 34.490 2.068 1.457
144 2HG LYS 67 2HG LYS 67 35.725 2.671 2.564
145 1HD LYS 67 1HD LYS 67 36.514 2.771 -0.271
146 2HD LYS 67 2HD LYS 67 35.134 3.796 0.125
147 1HE LYS 67 1HE LYS 67 36.877 4.224 2.245
148 2HE LYS 67 2HE LYS 67 37.952 4.112 0.851
149 1HZ LYS 67 1HZ LYS 67 35.517 5.802 0.889
150 2HZ LYS 67 2HZ LYS 67 37.054 6.379 1.329
151 3HZ LYS 67 3HZ LYS 67 36.773 5.819 -0.252
152 H SER 68 H SER 68 33.722 -0.419 2.681
153 HA SER 68 HA SER 68 33.947 -2.987 1.321
154 1HB SER 68 1HB SER 68 34.322 -2.798 4.138
155 2HB SER 68 2HB SER 68 32.780 -3.623 3.857
156 HG SER 68 HG SER 68 34.271 -4.716 2.127
157 H LYS 69 H LYS 69 32.396 -1.175 0.319
158 HA LYS 69 HA LYS 69 29.865 -0.606 1.410
159 1HB LYS 69 1HB LYS 69 31.001 -0.771 -1.328
160 2HB LYS 69 2HB LYS 69 29.243 -0.876 -1.217
161 1HG LYS 69 1HG LYS 69 29.904 1.465 -1.452
162 2HG LYS 69 2HG LYS 69 29.239 1.200 0.161
163 1HD LYS 69 1HD LYS 69 31.712 0.752 0.850
164 2HD LYS 69 2HD LYS 69 32.111 1.587 -0.651
165 1HE LYS 69 1HE LYS 69 31.968 3.470 0.615
166 2HE LYS 69 2HE LYS 69 30.227 3.266 0.409
167 1HZ LYS 69 1HZ LYS 69 30.294 1.850 2.447
168 2HZ LYS 69 2HZ LYS 69 31.901 2.350 2.677
169 3HZ LYS 69 3HZ LYS 69 30.641 3.489 2.713
170 H THR 70 H THR 70 29.124 -2.466 2.548
171 HA THR 70 HA THR 70 27.923 -4.530 0.773
172 HB THR 70 HB THR 70 29.735 -4.966 3.144
173 HG1 THR 70 HG1 THR 70 29.543 -5.718 0.474
174 1HG2 THR 70 1HG2 THR 70 27.664 -6.908 2.091
175 2HG2 THR 70 2HG2 THR 70 28.950 -7.292 3.230
176 3HG2 THR 70 3HG2 THR 70 27.676 -6.169 3.693
177 H ASP 71 H ASP 71 27.996 -2.972 3.964
178 HA ASP 71 HA ASP 71 25.047 -3.117 4.029
179 1HB ASP 71 1HB ASP 71 26.217 -5.157 5.241
180 2HB ASP 71 2HB ASP 71 26.461 -3.975 6.527
181 H ASN 72 H ASN 72 25.177 -2.395 6.964
182 HA ASN 72 HA ASN 72 26.340 0.341 6.648
183 1HB ASN 72 1HB ASN 72 24.431 1.336 7.609
184 2HB ASN 72 2HB ASN 72 23.761 0.116 6.522
185 1HD2 ASN 72 1HD2 ASN 72 23.387 -2.127 7.670
186 2HD2 ASN 72 2HD2 ASN 72 22.773 -2.062 9.251
187 H GLN 73 H GLN 73 27.603 -1.950 7.925
188 HA GLN 73 HA GLN 73 27.586 -1.015 10.759
189 1HB GLN 73 1HB GLN 73 28.053 -3.755 9.559
190 2HB GLN 73 2HB GLN 73 28.487 -3.349 11.214
191 1HG GLN 73 1HG GLN 73 26.354 -3.558 11.904
192 2HG GLN 73 2HG GLN 73 25.796 -2.458 10.644
193 1HE2 GLN 73 1HE2 GLN 73 23.911 -4.081 10.568
194 2HE2 GLN 73 2HE2 GLN 73 24.102 -5.461 9.584
195 H GLY 74 H GLY 74 29.842 -3.197 9.176
196 1HA GLY 74 1HA GLY 74 31.893 -1.141 8.830
197 2HA GLY 74 2HA GLY 74 32.214 -2.260 10.163
198 H ASN 75 H ASN 75 31.456 -4.668 9.286
199 HA ASN 75 HA ASN 75 32.595 -5.084 6.598
200 1HB ASN 75 1HB ASN 75 33.982 -6.852 7.434
201 2HB ASN 75 2HB ASN 75 34.435 -5.352 8.224
202 1HD2 ASN 75 1HD2 ASN 75 32.897 -5.041 10.346
203 2HD2 ASN 75 2HD2 ASN 75 32.829 -6.413 11.353
204 HA PRO 76 HA PRO 76 28.944 -7.743 7.426
205 1HB PRO 76 1HB PRO 76 27.386 -6.622 5.469
206 2HB PRO 76 2HB PRO 76 27.478 -5.956 7.112
207 1HG PRO 76 1HG PRO 76 28.582 -4.838 4.605
208 2HG PRO 76 2HG PRO 76 28.304 -4.033 6.155
209 1HD PRO 76 1HD PRO 76 30.811 -5.085 5.103
210 2HD PRO 76 2HD PRO 76 30.551 -4.203 6.624
211 H ILE 77 H ILE 77 31.403 -7.638 5.527
212 HA ILE 77 HA ILE 77 30.710 -8.424 2.955
213 HB ILE 77 HB ILE 77 33.039 -9.844 4.155
214 1HG1 ILE 77 1HG1 ILE 77 33.186 -7.754 5.391
215 2HG1 ILE 77 2HG1 ILE 77 34.375 -7.717 4.092
216 1HG2 ILE 77 1HG2 ILE 77 32.268 -8.471 1.626
217 2HG2 ILE 77 2HG2 ILE 77 33.981 -8.492 2.048
218 3HG2 ILE 77 3HG2 ILE 77 33.099 -10.009 1.865
219 1HD1 ILE 77 1HD1 ILE 77 31.618 -6.467 3.909
220 2HD1 ILE 77 2HD1 ILE 77 33.090 -5.582 4.301
221 3HD1 ILE 77 3HD1 ILE 77 32.914 -6.341 2.720
222 HA PRO 78 HA PRO 78 28.765 -12.300 4.146
223 1HB PRO 78 1HB PRO 78 27.639 -12.770 1.675
224 2HB PRO 78 2HB PRO 78 26.924 -11.746 2.935
225 1HG PRO 78 1HG PRO 78 28.305 -10.938 0.418
226 2HG PRO 78 2HG PRO 78 27.070 -10.078 1.349
227 1HD PRO 78 1HD PRO 78 29.831 -9.496 1.385
228 2HD PRO 78 2HD PRO 78 28.635 -8.933 2.569
229 HA PRO 79 HA PRO 79 31.228 -14.761 0.831
230 1HB PRO 79 1HB PRO 79 33.313 -13.445 -0.381
231 2HB PRO 79 2HB PRO 79 31.683 -13.547 -1.072
232 1HG PRO 79 1HG PRO 79 33.019 -11.234 0.257
233 2HG PRO 79 2HG PRO 79 31.748 -11.240 -0.977
234 1HD PRO 79 1HD PRO 79 31.355 -10.787 1.778
235 2HD PRO 79 2HD PRO 79 30.094 -11.172 0.590
236 H HIS 80 H HIS 80 33.740 -15.430 0.754
237 HA HIS 80 HA HIS 80 34.763 -15.005 3.518
238 1HB HIS 80 1HB HIS 80 35.277 -17.163 1.456
239 2HB HIS 80 2HB HIS 80 36.169 -17.044 2.973
240 HD1 HIS 80 HD1 HIS 80 35.193 -19.091 4.140
241 HD2 HIS 80 HD2 HIS 80 32.256 -16.474 2.757
242 HE1 HIS 80 HE1 HIS 80 33.001 -19.894 5.120
Start of MODEL 11
1 H VAL 49 H VAL 49 53.192 -3.241 6.260
2 HA VAL 49 HA VAL 49 52.798 -3.999 3.404
3 HB VAL 49 HB VAL 49 54.378 -5.528 5.478
4 1HG1 VAL 49 1HG1 VAL 49 53.589 -5.964 2.645
5 2HG1 VAL 49 2HG1 VAL 49 55.251 -6.372 3.069
6 3HG1 VAL 49 3HG1 VAL 49 53.910 -7.143 3.918
7 1HG2 VAL 49 1HG2 VAL 49 55.060 -3.293 3.659
8 2HG2 VAL 49 2HG2 VAL 49 55.867 -3.833 5.132
9 3HG2 VAL 49 3HG2 VAL 49 56.168 -4.665 3.606
10 HA PRO 50 HA PRO 50 49.909 -6.600 6.193
11 1HB PRO 50 1HB PRO 50 47.746 -4.925 6.631
12 2HB PRO 50 2HB PRO 50 49.045 -5.216 7.800
13 1HG PRO 50 1HG PRO 50 48.563 -2.803 6.134
14 2HG PRO 50 2HG PRO 50 49.443 -2.959 7.652
15 1HD PRO 50 1HD PRO 50 50.587 -2.731 5.076
16 2HD PRO 50 2HD PRO 50 51.414 -3.180 6.582
17 H GLY 51 H GLY 51 47.698 -7.416 5.316
18 1HA GLY 51 1HA GLY 51 47.296 -6.412 2.524
19 2HA GLY 51 2HA GLY 51 47.436 -8.136 2.851
20 H LEU 52 H LEU 52 45.463 -8.819 2.244
21 HA LEU 52 HA LEU 52 43.059 -8.442 1.869
22 1HB LEU 52 1HB LEU 52 43.532 -10.592 2.877
23 2HB LEU 52 2HB LEU 52 43.575 -9.857 4.487
24 HG LEU 52 HG LEU 52 41.150 -9.433 2.787
25 1HD1 LEU 52 1HD1 LEU 52 42.100 -12.032 3.757
26 2HD1 LEU 52 2HD1 LEU 52 40.492 -11.618 4.354
27 3HD1 LEU 52 3HD1 LEU 52 40.803 -11.668 2.619
28 1HD2 LEU 52 1HD2 LEU 52 41.956 -9.230 5.595
29 2HD2 LEU 52 2HD2 LEU 52 40.714 -8.345 4.708
30 3HD2 LEU 52 3HD2 LEU 52 40.370 -9.952 5.353
31 H CYS 53 H CYS 53 43.527 -8.111 5.276
32 HA CYS 53 HA CYS 53 43.091 -5.729 6.166
33 1HB CYS 53 1HB CYS 53 41.421 -5.213 4.474
34 2HB CYS 53 2HB CYS 53 40.376 -6.500 5.072
35 HA PRO 54 HA PRO 54 42.262 -8.408 9.617
36 1HB PRO 54 1HB PRO 54 42.994 -6.574 11.529
37 2HB PRO 54 2HB PRO 54 44.154 -7.538 10.597
38 1HG PRO 54 1HG PRO 54 43.467 -4.649 10.327
39 2HG PRO 54 2HG PRO 54 44.966 -5.494 9.896
40 1HD PRO 54 1HD PRO 54 42.932 -4.683 8.093
41 2HD PRO 54 2HD PRO 54 44.278 -5.786 7.732
42 H ARG 55 H ARG 55 40.339 -6.121 8.450
43 HA ARG 55 HA ARG 55 38.582 -6.030 10.865
44 1HB ARG 55 1HB ARG 55 39.487 -3.923 9.087
45 2HB ARG 55 2HB ARG 55 37.730 -4.064 9.025
46 1HG ARG 55 1HG ARG 55 39.349 -3.857 11.583
47 2HG ARG 55 2HG ARG 55 38.501 -2.510 10.821
48 1HD ARG 55 1HD ARG 55 36.660 -3.124 11.963
49 2HD ARG 55 2HD ARG 55 36.609 -4.577 10.965
50 HE ARG 55 HE ARG 55 38.364 -4.705 13.333
51 1HH1 ARG 55 1HH1 ARG 55 35.128 -4.954 12.251
52 2HH1 ARG 55 2HH1 ARG 55 34.779 -6.386 13.163
53 1HH2 ARG 55 1HH2 ARG 55 38.019 -6.747 14.340
54 2HH2 ARG 55 2HH2 ARG 55 36.415 -7.398 14.345
55 H CYS 56 H CYS 56 38.460 -5.834 7.284
56 HA CYS 56 HA CYS 56 35.962 -7.452 7.407
57 1HB CYS 56 1HB CYS 56 35.413 -6.601 5.215
58 2HB CYS 56 2HB CYS 56 35.908 -5.215 6.179
59 H LYS 57 H LYS 57 36.533 -8.055 4.477
60 HA LYS 57 HA LYS 57 38.896 -9.605 4.396
61 1HB LYS 57 1HB LYS 57 37.648 -11.815 4.072
62 2HB LYS 57 2HB LYS 57 37.757 -11.223 5.732
63 1HG LYS 57 1HG LYS 57 35.494 -10.078 5.292
64 2HG LYS 57 2HG LYS 57 35.394 -11.092 3.853
65 1HD LYS 57 1HD LYS 57 35.524 -11.970 6.743
66 2HD LYS 57 2HD LYS 57 34.269 -12.321 5.553
67 1HE LYS 57 1HE LYS 57 36.077 -13.540 4.215
68 2HE LYS 57 2HE LYS 57 37.086 -13.414 5.657
69 1HZ LYS 57 1HZ LYS 57 35.330 -14.537 6.911
70 2HZ LYS 57 2HZ LYS 57 34.420 -14.711 5.487
71 3HZ LYS 57 3HZ LYS 57 35.914 -15.502 5.644
72 H ARG 58 H ARG 58 37.336 -7.586 2.906
73 HA ARG 58 HA ARG 58 37.096 -9.099 0.341
74 1HB ARG 58 1HB ARG 58 35.101 -7.652 1.694
75 2HB ARG 58 2HB ARG 58 35.617 -6.606 0.369
76 1HG ARG 58 1HG ARG 58 35.183 -9.502 -0.232
77 2HG ARG 58 2HG ARG 58 33.757 -8.495 0.016
78 1HD ARG 58 1HD ARG 58 35.888 -7.396 -1.752
79 2HD ARG 58 2HD ARG 58 34.933 -8.736 -2.386
80 HE ARG 58 HE ARG 58 33.193 -6.758 -1.241
81 1HH1 ARG 58 1HH1 ARG 58 34.552 -8.033 -4.075
82 2HH1 ARG 58 2HH1 ARG 58 33.995 -6.760 -5.106
83 1HH2 ARG 58 1HH2 ARG 58 32.770 -4.825 -2.501
84 2HH2 ARG 58 2HH2 ARG 58 32.986 -4.944 -4.216
85 H GLY 59 H GLY 59 39.331 -7.401 1.720
86 1HA GLY 59 1HA GLY 59 39.935 -5.930 -0.781
87 2HA GLY 59 2HA GLY 59 39.796 -4.947 0.676
88 H LYS 60 H LYS 60 41.842 -4.360 1.003
89 HA LYS 60 HA LYS 60 43.767 -6.308 2.026
90 1HB LYS 60 1HB LYS 60 43.864 -5.771 -0.722
91 2HB LYS 60 2HB LYS 60 45.068 -4.677 -0.031
92 1HG LYS 60 1HG LYS 60 46.258 -6.477 0.988
93 2HG LYS 60 2HG LYS 60 44.941 -7.611 0.690
94 1HD LYS 60 1HD LYS 60 46.903 -7.809 -0.908
95 2HD LYS 60 2HD LYS 60 45.334 -7.573 -1.680
96 1HE LYS 60 1HE LYS 60 45.779 -5.209 -1.990
97 2HE LYS 60 2HE LYS 60 47.273 -5.326 -1.060
98 1HZ LYS 60 1HZ LYS 60 48.072 -6.935 -2.743
99 2HZ LYS 60 2HZ LYS 60 46.686 -6.617 -3.668
100 3HZ LYS 60 3HZ LYS 60 47.811 -5.377 -3.369
101 H HIS 61 H HIS 61 43.166 -4.784 3.831
102 HA HIS 61 HA HIS 61 45.076 -2.584 3.942
103 1HB HIS 61 1HB HIS 61 43.204 -0.898 4.303
104 2HB HIS 61 2HB HIS 61 43.567 -1.356 2.630
105 HD1 HIS 61 HD1 HIS 61 41.703 -2.492 1.302
106 HD2 HIS 61 HD2 HIS 61 40.873 -2.375 5.390
107 HE1 HIS 61 HE1 HIS 61 39.328 -3.364 1.586
108 H TRP 62 H TRP 62 44.183 -0.988 5.807
109 HA TRP 62 HA TRP 62 43.714 -2.819 8.095
110 1HB TRP 62 1HB TRP 62 44.768 -0.242 8.846
111 2HB TRP 62 2HB TRP 62 45.499 -1.832 8.990
112 HD1 TRP 62 HD1 TRP 62 46.355 1.283 7.578
113 HE1 TRP 62 HE1 TRP 62 47.902 1.083 5.522
114 HE3 TRP 62 HE3 TRP 62 45.710 -3.649 6.482
115 HZ2 TRP 62 HZ2 TRP 62 48.735 -0.927 3.637
116 HZ3 TRP 62 HZ3 TRP 62 46.826 -4.662 4.538
117 HH2 TRP 62 HH2 TRP 62 48.360 -3.327 3.125
118 H ALA 63 H ALA 63 42.631 -1.796 10.003
119 HA ALA 63 HA ALA 63 40.043 -0.865 9.390
120 1HB ALA 63 1HB ALA 63 40.799 -1.852 11.583
121 2HB ALA 63 2HB ALA 63 41.547 -0.299 11.960
122 3HB ALA 63 3HB ALA 63 39.798 -0.410 11.752
123 H ASN 64 H ASN 64 42.724 1.098 10.766
124 HA ASN 64 HA ASN 64 41.582 3.609 10.733
125 1HB ASN 64 1HB ASN 64 44.354 2.655 10.101
126 2HB ASN 64 2HB ASN 64 43.961 4.357 9.835
127 1HD2 ASN 64 1HD2 ASN 64 45.780 3.347 11.917
128 2HD2 ASN 64 2HD2 ASN 64 45.101 3.782 13.411
129 H GLU 65 H GLU 65 42.472 1.658 7.988
130 HA GLU 65 HA GLU 65 41.170 3.654 6.209
131 1HB GLU 65 1HB GLU 65 43.584 3.993 5.940
132 2HB GLU 65 2HB GLU 65 43.816 2.262 5.681
133 1HG GLU 65 1HG GLU 65 42.802 2.306 3.577
134 2HG GLU 65 2HG GLU 65 41.912 3.787 3.927
135 H CYS 66 H CYS 66 39.641 1.683 6.974
136 HA CYS 66 HA CYS 66 39.915 -0.439 4.891
137 1HB CYS 66 1HB CYS 66 40.127 -1.603 6.927
138 2HB CYS 66 2HB CYS 66 38.965 -0.561 7.747
139 H LYS 67 H LYS 67 38.245 -0.685 3.512
140 HA LYS 67 HA LYS 67 35.610 0.475 4.222
141 1HB LYS 67 1HB LYS 67 37.315 1.803 2.488
142 2HB LYS 67 2HB LYS 67 36.324 0.839 1.391
143 1HG LYS 67 1HG LYS 67 34.906 2.264 3.590
144 2HG LYS 67 2HG LYS 67 35.536 3.252 2.273
145 1HD LYS 67 1HD LYS 67 34.422 1.335 0.789
146 2HD LYS 67 2HD LYS 67 33.411 1.151 2.222
147 1HE LYS 67 1HE LYS 67 32.179 2.858 1.395
148 2HE LYS 67 2HE LYS 67 33.518 3.904 1.870
149 1HZ LYS 67 1HZ LYS 67 33.888 2.530 -0.645
150 2HZ LYS 67 2HZ LYS 67 32.605 3.644 -0.640
151 3HZ LYS 67 3HZ LYS 67 34.171 4.156 -0.242
152 H SER 68 H SER 68 33.870 -0.598 3.219
153 HA SER 68 HA SER 68 34.305 -2.708 1.291
154 1HB SER 68 1HB SER 68 34.934 -3.219 3.999
155 2HB SER 68 2HB SER 68 33.424 -4.083 3.665
156 HG SER 68 HG SER 68 35.559 -5.127 3.131
157 H LYS 69 H LYS 69 32.467 -1.163 0.663
158 HA LYS 69 HA LYS 69 29.998 -1.149 2.089
159 1HB LYS 69 1HB LYS 69 30.983 -0.108 -0.364
160 2HB LYS 69 2HB LYS 69 29.525 -1.025 -0.745
161 1HG LYS 69 1HG LYS 69 28.697 0.271 1.492
162 2HG LYS 69 2HG LYS 69 29.834 1.457 0.849
163 1HD LYS 69 1HD LYS 69 28.562 1.869 -1.016
164 2HD LYS 69 2HD LYS 69 27.964 0.212 -1.102
165 1HE LYS 69 1HE LYS 69 26.031 1.073 -0.280
166 2HE LYS 69 2HE LYS 69 26.875 1.083 1.268
167 1HZ LYS 69 1HZ LYS 69 26.835 3.326 -0.677
168 2HZ LYS 69 2HZ LYS 69 25.908 3.244 0.745
169 3HZ LYS 69 3HZ LYS 69 27.603 3.334 0.834
170 H THR 70 H THR 70 29.341 -3.188 2.736
171 HA THR 70 HA THR 70 28.732 -5.124 0.541
172 HB THR 70 HB THR 70 30.192 -5.466 3.030
173 HG1 THR 70 HG1 THR 70 30.717 -6.264 0.943
174 1HG2 THR 70 1HG2 THR 70 27.988 -6.157 3.947
175 2HG2 THR 70 2HG2 THR 70 27.841 -7.340 2.652
176 3HG2 THR 70 3HG2 THR 70 29.122 -7.499 3.849
177 H ASP 71 H ASP 71 27.705 -3.723 3.621
178 HA ASP 71 HA ASP 71 24.884 -4.274 2.803
179 1HB ASP 71 1HB ASP 71 26.189 -4.828 5.462
180 2HB ASP 71 2HB ASP 71 24.461 -4.499 5.361
181 H ASN 72 H ASN 72 25.815 -2.837 5.856
182 HA ASN 72 HA ASN 72 25.512 -0.088 4.817
183 1HB ASN 72 1HB ASN 72 23.693 0.433 6.418
184 2HB ASN 72 2HB ASN 72 23.188 -0.799 5.254
185 1HD2 ASN 72 1HD2 ASN 72 23.457 -0.117 8.601
186 2HD2 ASN 72 2HD2 ASN 72 23.202 -1.693 9.179
187 H GLN 73 H GLN 73 27.830 -1.044 5.791
188 HA GLN 73 HA GLN 73 28.194 0.494 8.256
189 1HB GLN 73 1HB GLN 73 27.411 -2.060 8.664
190 2HB GLN 73 2HB GLN 73 29.149 -2.314 8.513
191 1HG GLN 73 1HG GLN 73 29.597 -0.719 10.281
192 2HG GLN 73 2HG GLN 73 27.896 -0.257 10.351
193 1HE2 GLN 73 1HE2 GLN 73 26.360 -2.241 10.787
194 2HE2 GLN 73 2HE2 GLN 73 26.909 -3.364 11.948
195 H GLY 74 H GLY 74 30.667 -1.387 8.669
196 1HA GLY 74 1HA GLY 74 32.284 -0.227 6.437
197 2HA GLY 74 2HA GLY 74 32.896 -0.400 8.089
198 H ASN 75 H ASN 75 31.763 -2.988 8.596
199 HA ASN 75 HA ASN 75 33.038 -4.711 6.544
200 1HB ASN 75 1HB ASN 75 33.752 -6.066 8.653
201 2HB ASN 75 2HB ASN 75 34.790 -4.793 8.027
202 1HD2 ASN 75 1HD2 ASN 75 31.748 -4.341 9.845
203 2HD2 ASN 75 2HD2 ASN 75 32.469 -3.555 11.175
204 HA PRO 76 HA PRO 76 29.006 -6.421 8.040
205 1HB PRO 76 1HB PRO 76 27.628 -5.917 5.737
206 2HB PRO 76 2HB PRO 76 27.767 -4.715 7.034
207 1HG PRO 76 1HG PRO 76 29.050 -4.712 4.364
208 2HG PRO 76 2HG PRO 76 28.822 -3.368 5.491
209 1HD PRO 76 1HD PRO 76 31.222 -4.959 5.061
210 2HD PRO 76 2HD PRO 76 31.014 -3.576 6.152
211 H ILE 77 H ILE 77 31.488 -7.297 6.424
212 HA ILE 77 HA ILE 77 30.699 -8.798 4.211
213 HB ILE 77 HB ILE 77 32.861 -9.911 5.942
214 1HG1 ILE 77 1HG1 ILE 77 33.307 -7.593 6.296
215 2HG1 ILE 77 2HG1 ILE 77 34.363 -8.077 4.969
216 1HG2 ILE 77 1HG2 ILE 77 32.246 -9.530 3.037
217 2HG2 ILE 77 2HG2 ILE 77 33.934 -9.653 3.533
218 3HG2 ILE 77 3HG2 ILE 77 32.814 -10.970 3.882
219 1HD1 ILE 77 1HD1 ILE 77 31.663 -7.026 4.231
220 2HD1 ILE 77 2HD1 ILE 77 32.833 -5.869 4.856
221 3HD1 ILE 77 3HD1 ILE 77 33.211 -6.817 3.421
222 HA PRO 78 HA PRO 78 28.337 -11.894 6.425
223 1HB PRO 78 1HB PRO 78 27.328 -13.088 4.165
224 2HB PRO 78 2HB PRO 78 26.674 -11.593 4.863
225 1HG PRO 78 1HG PRO 78 28.349 -11.950 2.421
226 2HG PRO 78 2HG PRO 78 27.188 -10.669 2.808
227 1HD PRO 78 1HD PRO 78 30.007 -10.466 2.989
228 2HD PRO 78 2HD PRO 78 28.829 -9.326 3.673
229 HA PRO 79 HA PRO 79 31.417 -15.130 5.935
230 1HB PRO 79 1HB PRO 79 30.594 -16.577 8.123
231 2HB PRO 79 2HB PRO 79 31.625 -15.137 8.232
232 1HG PRO 79 1HG PRO 79 28.730 -15.428 8.892
233 2HG PRO 79 2HG PRO 79 29.919 -14.285 9.539
234 1HD PRO 79 1HD PRO 79 27.960 -13.709 7.579
235 2HD PRO 79 2HD PRO 79 29.355 -12.691 7.992
236 H HIS 80 H HIS 80 28.832 -16.906 7.497
237 HA HIS 80 HA HIS 80 27.586 -18.757 6.761
238 1HB HIS 80 1HB HIS 80 27.323 -16.647 4.744
239 2HB HIS 80 2HB HIS 80 27.065 -18.262 4.084
240 HD1 HIS 80 HD1 HIS 80 24.539 -16.903 4.036
241 HD2 HIS 80 HD2 HIS 80 25.900 -18.537 7.620
242 HE1 HIS 80 HE1 HIS 80 22.501 -17.191 5.510
Start of MODEL 12
1 H VAL 49 H VAL 49 51.052 -2.983 4.111
2 HA VAL 49 HA VAL 49 53.374 -4.760 3.869
3 HB VAL 49 HB VAL 49 52.701 -3.042 6.191
4 1HG1 VAL 49 1HG1 VAL 49 54.118 -5.726 6.307
5 2HG1 VAL 49 2HG1 VAL 49 54.160 -4.527 7.598
6 3HG1 VAL 49 3HG1 VAL 49 52.634 -5.296 7.156
7 1HG2 VAL 49 1HG2 VAL 49 55.272 -3.956 4.887
8 2HG2 VAL 49 2HG2 VAL 49 54.470 -2.408 4.619
9 3HG2 VAL 49 3HG2 VAL 49 55.149 -2.785 6.201
10 HA PRO 50 HA PRO 50 50.152 -7.205 6.379
11 1HB PRO 50 1HB PRO 50 47.898 -5.784 7.164
12 2HB PRO 50 2HB PRO 50 49.325 -6.073 8.175
13 1HG PRO 50 1HG PRO 50 48.532 -3.569 6.752
14 2HG PRO 50 2HG PRO 50 49.487 -3.771 8.221
15 1HD PRO 50 1HD PRO 50 50.550 -3.201 5.702
16 2HD PRO 50 2HD PRO 50 51.451 -3.888 7.059
17 H GLY 51 H GLY 51 47.755 -7.997 5.795
18 1HA GLY 51 1HA GLY 51 47.341 -7.195 2.939
19 2HA GLY 51 2HA GLY 51 47.244 -8.865 3.479
20 H LEU 52 H LEU 52 45.234 -9.123 2.644
21 HA LEU 52 HA LEU 52 42.947 -8.482 2.204
22 1HB LEU 52 1HB LEU 52 42.995 -10.630 3.269
23 2HB LEU 52 2HB LEU 52 43.216 -9.893 4.859
24 HG LEU 52 HG LEU 52 40.810 -10.682 4.039
25 1HD1 LEU 52 1HD1 LEU 52 41.689 -9.260 6.107
26 2HD1 LEU 52 2HD1 LEU 52 40.713 -8.032 5.304
27 3HD1 LEU 52 3HD1 LEU 52 39.976 -9.554 5.801
28 1HD2 LEU 52 1HD2 LEU 52 41.249 -8.808 2.113
29 2HD2 LEU 52 2HD2 LEU 52 39.667 -9.325 2.648
30 3HD2 LEU 52 3HD2 LEU 52 40.383 -7.866 3.324
31 H CYS 53 H CYS 53 43.211 -8.142 5.598
32 HA CYS 53 HA CYS 53 43.103 -5.603 6.301
33 1HB CYS 53 1HB CYS 53 41.468 -5.069 4.592
34 2HB CYS 53 2HB CYS 53 40.329 -6.229 5.257
35 HA PRO 54 HA PRO 54 42.127 -7.792 10.020
36 1HB PRO 54 1HB PRO 54 42.747 -5.731 11.729
37 2HB PRO 54 2HB PRO 54 43.964 -6.759 10.950
38 1HG PRO 54 1HG PRO 54 43.217 -3.941 10.334
39 2HG PRO 54 2HG PRO 54 44.744 -4.790 10.033
40 1HD PRO 54 1HD PRO 54 42.725 -4.241 8.112
41 2HD PRO 54 2HD PRO 54 44.119 -5.321 7.896
42 H ARG 55 H ARG 55 40.233 -5.652 8.543
43 HA ARG 55 HA ARG 55 38.341 -5.415 10.837
44 1HB ARG 55 1HB ARG 55 39.453 -3.285 9.583
45 2HB ARG 55 2HB ARG 55 38.063 -3.556 8.531
46 1HG ARG 55 1HG ARG 55 37.110 -2.170 10.131
47 2HG ARG 55 2HG ARG 55 36.769 -3.752 10.834
48 1HD ARG 55 1HD ARG 55 39.418 -2.702 11.549
49 2HD ARG 55 2HD ARG 55 38.086 -1.703 12.129
50 HE ARG 55 HE ARG 55 38.458 -4.588 12.814
51 1HH1 ARG 55 1HH1 ARG 55 38.454 -1.662 14.264
52 2HH1 ARG 55 2HH1 ARG 55 37.152 -1.963 15.365
53 1HH2 ARG 55 1HH2 ARG 55 36.180 -4.912 13.824
54 2HH2 ARG 55 2HH2 ARG 55 35.863 -3.803 15.114
55 H CYS 56 H CYS 56 38.485 -5.456 7.248
56 HA CYS 56 HA CYS 56 35.915 -6.961 7.311
57 1HB CYS 56 1HB CYS 56 35.463 -6.127 5.093
58 2HB CYS 56 2HB CYS 56 35.977 -4.748 6.059
59 H LYS 57 H LYS 57 36.515 -7.637 4.431
60 HA LYS 57 HA LYS 57 38.784 -9.321 4.378
61 1HB LYS 57 1HB LYS 57 37.391 -11.445 4.066
62 2HB LYS 57 2HB LYS 57 37.494 -10.833 5.721
63 1HG LYS 57 1HG LYS 57 35.325 -9.455 4.812
64 2HG LYS 57 2HG LYS 57 35.163 -10.954 3.898
65 1HD LYS 57 1HD LYS 57 35.890 -11.539 6.632
66 2HD LYS 57 2HD LYS 57 34.451 -10.520 6.595
67 1HE LYS 57 1HE LYS 57 34.027 -12.376 4.549
68 2HE LYS 57 2HE LYS 57 34.741 -13.324 5.855
69 1HZ LYS 57 1HZ LYS 57 32.515 -11.424 6.302
70 2HZ LYS 57 2HZ LYS 57 32.251 -13.051 5.903
71 3HZ LYS 57 3HZ LYS 57 33.071 -12.652 7.338
72 H ARG 58 H ARG 58 37.398 -7.192 2.866
73 HA ARG 58 HA ARG 58 37.092 -8.659 0.277
74 1HB ARG 58 1HB ARG 58 35.132 -7.135 1.605
75 2HB ARG 58 2HB ARG 58 35.729 -6.101 0.305
76 1HG ARG 58 1HG ARG 58 35.521 -8.564 -0.931
77 2HG ARG 58 2HG ARG 58 34.131 -8.560 0.154
78 1HD ARG 58 1HD ARG 58 33.074 -6.909 -0.999
79 2HD ARG 58 2HD ARG 58 34.571 -6.026 -1.298
80 HE ARG 58 HE ARG 58 34.838 -8.210 -2.936
81 1HH1 ARG 58 1HH1 ARG 58 31.748 -7.149 -2.306
82 2HH1 ARG 58 2HH1 ARG 58 31.371 -6.682 -3.930
83 1HH2 ARG 58 1HH2 ARG 58 34.620 -7.075 -5.078
84 2HH2 ARG 58 2HH2 ARG 58 32.998 -6.640 -5.501
85 H GLY 59 H GLY 59 39.517 -7.486 1.382
86 1HA GLY 59 1HA GLY 59 40.295 -5.880 -0.892
87 2HA GLY 59 2HA GLY 59 40.107 -4.889 0.554
88 H LYS 60 H LYS 60 42.185 -4.433 0.996
89 HA LYS 60 HA LYS 60 43.889 -6.484 2.215
90 1HB LYS 60 1HB LYS 60 44.207 -6.228 -0.502
91 2HB LYS 60 2HB LYS 60 45.301 -4.967 0.071
92 1HG LYS 60 1HG LYS 60 46.834 -6.544 0.532
93 2HG LYS 60 2HG LYS 60 45.730 -7.241 1.712
94 1HD LYS 60 1HD LYS 60 46.182 -9.016 0.204
95 2HD LYS 60 2HD LYS 60 44.599 -8.408 -0.283
96 1HE LYS 60 1HE LYS 60 46.053 -6.824 -1.836
97 2HE LYS 60 2HE LYS 60 47.247 -8.109 -1.650
98 1HZ LYS 60 1HZ LYS 60 44.441 -8.638 -2.437
99 2HZ LYS 60 2HZ LYS 60 45.668 -8.339 -3.574
100 3HZ LYS 60 3HZ LYS 60 45.774 -9.686 -2.548
101 H HIS 61 H HIS 61 43.368 -4.843 3.958
102 HA HIS 61 HA HIS 61 45.407 -2.781 4.087
103 1HB HIS 61 1HB HIS 61 43.691 -0.927 4.216
104 2HB HIS 61 2HB HIS 61 44.078 -1.524 2.589
105 HD1 HIS 61 HD1 HIS 61 42.170 -2.579 1.251
106 HD2 HIS 61 HD2 HIS 61 41.203 -2.149 5.283
107 HE1 HIS 61 HE1 HIS 61 39.730 -3.259 1.483
108 H TRP 62 H TRP 62 44.598 -1.044 5.794
109 HA TRP 62 HA TRP 62 43.754 -2.684 8.114
110 1HB TRP 62 1HB TRP 62 44.987 -0.166 8.807
111 2HB TRP 62 2HB TRP 62 45.526 -1.806 9.126
112 HD1 TRP 62 HD1 TRP 62 46.877 1.073 7.644
113 HE1 TRP 62 HE1 TRP 62 48.565 0.575 5.760
114 HE3 TRP 62 HE3 TRP 62 45.705 -3.790 6.702
115 HZ2 TRP 62 HZ2 TRP 62 49.303 -1.623 4.048
116 HZ3 TRP 62 HZ3 TRP 62 46.851 -5.035 4.917
117 HH2 TRP 62 HH2 TRP 62 48.660 -3.972 3.601
118 H ALA 63 H ALA 63 42.526 -1.616 9.818
119 HA ALA 63 HA ALA 63 40.091 -0.573 9.139
120 1HB ALA 63 1HB ALA 63 41.794 0.061 11.554
121 2HB ALA 63 2HB ALA 63 40.123 0.602 11.405
122 3HB ALA 63 3HB ALA 63 40.494 -1.122 11.428
123 H ASN 64 H ASN 64 42.718 1.609 10.251
124 HA ASN 64 HA ASN 64 41.608 4.057 9.669
125 1HB ASN 64 1HB ASN 64 44.441 3.153 9.070
126 2HB ASN 64 2HB ASN 64 43.918 4.842 9.059
127 1HD2 ASN 64 1HD2 ASN 64 42.536 5.346 11.239
128 2HD2 ASN 64 2HD2 ASN 64 43.287 4.816 12.666
129 H GLU 65 H GLU 65 43.392 2.078 7.287
130 HA GLU 65 HA GLU 65 42.078 3.659 5.128
131 1HB GLU 65 1HB GLU 65 44.468 3.587 4.855
132 2HB GLU 65 2HB GLU 65 44.512 1.846 5.155
133 1HG GLU 65 1HG GLU 65 43.724 1.326 3.046
134 2HG GLU 65 2HG GLU 65 42.815 2.830 2.897
135 H CYS 66 H CYS 66 40.229 2.129 6.214
136 HA CYS 66 HA CYS 66 40.070 -0.258 4.426
137 1HB CYS 66 1HB CYS 66 40.405 -1.166 6.613
138 2HB CYS 66 2HB CYS 66 39.289 -0.010 7.338
139 H LYS 67 H LYS 67 38.017 -0.777 3.662
140 HA LYS 67 HA LYS 67 35.677 0.804 4.368
141 1HB LYS 67 1HB LYS 67 35.308 1.566 1.980
142 2HB LYS 67 2HB LYS 67 36.638 2.386 2.794
143 1HG LYS 67 1HG LYS 67 38.228 0.780 1.741
144 2HG LYS 67 2HG LYS 67 36.878 0.064 0.859
145 1HD LYS 67 1HD LYS 67 36.431 2.578 0.148
146 2HD LYS 67 2HD LYS 67 38.145 2.759 0.520
147 1HE LYS 67 1HE LYS 67 38.754 1.679 -1.364
148 2HE LYS 67 2HE LYS 67 37.640 0.351 -1.039
149 1HZ LYS 67 1HZ LYS 67 35.894 2.168 -1.735
150 2HZ LYS 67 2HZ LYS 67 37.221 2.793 -2.590
151 3HZ LYS 67 3HZ LYS 67 36.686 1.214 -2.895
152 H SER 68 H SER 68 33.807 -0.288 3.775
153 HA SER 68 HA SER 68 34.077 -2.676 2.064
154 1HB SER 68 1HB SER 68 34.204 -2.612 4.967
155 2HB SER 68 2HB SER 68 32.912 -3.685 4.400
156 HG SER 68 HG SER 68 34.396 -4.868 3.296
157 H LYS 69 H LYS 69 32.493 -0.955 1.067
158 HA LYS 69 HA LYS 69 29.883 -0.651 2.258
159 1HB LYS 69 1HB LYS 69 31.143 -0.034 -0.355
160 2HB LYS 69 2HB LYS 69 29.402 -0.313 -0.401
161 1HG LYS 69 1HG LYS 69 29.461 1.961 0.079
162 2HG LYS 69 2HG LYS 69 29.401 1.281 1.706
163 1HD LYS 69 1HD LYS 69 31.816 1.475 1.929
164 2HD LYS 69 2HD LYS 69 31.961 2.014 0.256
165 1HE LYS 69 1HE LYS 69 30.246 3.505 2.243
166 2HE LYS 69 2HE LYS 69 31.970 3.836 2.085
167 1HZ LYS 69 1HZ LYS 69 31.235 3.871 -0.464
168 2HZ LYS 69 2HZ LYS 69 29.792 4.411 0.251
169 3HZ LYS 69 3HZ LYS 69 31.242 5.255 0.516
170 H THR 70 H THR 70 29.255 -2.775 2.860
171 HA THR 70 HA THR 70 28.577 -4.561 0.561
172 HB THR 70 HB THR 70 29.831 -5.079 3.204
173 HG1 THR 70 HG1 THR 70 30.436 -5.453 0.784
174 1HG2 THR 70 1HG2 THR 70 27.755 -6.964 2.046
175 2HG2 THR 70 2HG2 THR 70 28.915 -7.390 3.298
176 3HG2 THR 70 3HG2 THR 70 27.685 -6.172 3.619
177 H ASP 71 H ASP 71 27.592 -3.649 3.875
178 HA ASP 71 HA ASP 71 24.759 -3.961 2.950
179 1HB ASP 71 1HB ASP 71 26.123 -5.237 5.203
180 2HB ASP 71 2HB ASP 71 24.656 -4.390 5.686
181 H ASN 72 H ASN 72 25.700 -2.954 6.181
182 HA ASN 72 HA ASN 72 25.207 -0.113 5.455
183 1HB ASN 72 1HB ASN 72 23.625 0.171 7.289
184 2HB ASN 72 2HB ASN 72 23.047 -1.123 6.231
185 1HD2 ASN 72 1HD2 ASN 72 23.330 -0.416 9.441
186 2HD2 ASN 72 2HD2 ASN 72 23.543 -1.978 10.069
187 H GLN 73 H GLN 73 27.431 -2.019 6.478
188 HA GLN 73 HA GLN 73 28.391 -0.142 8.577
189 1HB GLN 73 1HB GLN 73 27.405 -2.504 9.363
190 2HB GLN 73 2HB GLN 73 29.024 -3.045 8.906
191 1HG GLN 73 1HG GLN 73 29.850 -2.209 10.819
192 2HG GLN 73 2HG GLN 73 29.287 -0.601 10.363
193 1HE2 GLN 73 1HE2 GLN 73 27.229 0.136 11.227
194 2HE2 GLN 73 2HE2 GLN 73 26.440 -0.698 12.489
195 H GLY 74 H GLY 74 30.710 -2.160 8.860
196 1HA GLY 74 1HA GLY 74 32.022 -1.546 6.244
197 2HA GLY 74 2HA GLY 74 32.860 -1.300 7.780
198 H ASN 75 H ASN 75 31.111 -3.928 8.458
199 HA ASN 75 HA ASN 75 33.103 -5.804 7.256
200 1HB ASN 75 1HB ASN 75 32.010 -5.975 10.031
201 2HB ASN 75 2HB ASN 75 33.394 -6.850 9.373
202 1HD2 ASN 75 1HD2 ASN 75 32.281 -3.493 10.001
203 2HD2 ASN 75 2HD2 ASN 75 33.832 -2.876 10.356
204 HA PRO 76 HA PRO 76 28.776 -7.782 7.473
205 1HB PRO 76 1HB PRO 76 27.390 -6.725 5.367
206 2HB PRO 76 2HB PRO 76 27.306 -6.033 6.999
207 1HG PRO 76 1HG PRO 76 28.668 -4.962 4.594
208 2HG PRO 76 2HG PRO 76 28.137 -4.109 6.049
209 1HD PRO 76 1HD PRO 76 30.817 -4.976 5.416
210 2HD PRO 76 2HD PRO 76 30.239 -4.202 6.901
211 H ILE 77 H ILE 77 31.377 -7.518 5.729
212 HA ILE 77 HA ILE 77 31.095 -8.275 3.152
213 HB ILE 77 HB ILE 77 33.102 -9.777 4.802
214 1HG1 ILE 77 1HG1 ILE 77 33.205 -7.627 5.856
215 2HG1 ILE 77 2HG1 ILE 77 34.504 -7.638 4.659
216 1HG2 ILE 77 1HG2 ILE 77 33.125 -8.353 2.126
217 2HG2 ILE 77 2HG2 ILE 77 34.543 -9.104 2.859
218 3HG2 ILE 77 3HG2 ILE 77 33.158 -10.096 2.399
219 1HD1 ILE 77 1HD1 ILE 77 31.753 -6.513 4.065
220 2HD1 ILE 77 2HD1 ILE 77 33.063 -5.529 4.712
221 3HD1 ILE 77 3HD1 ILE 77 33.232 -6.297 3.134
222 HA PRO 78 HA PRO 78 29.063 -12.214 3.272
223 1HB PRO 78 1HB PRO 78 29.326 -12.754 0.586
224 2HB PRO 78 2HB PRO 78 28.132 -11.620 1.246
225 1HG PRO 78 1HG PRO 78 30.648 -11.046 -0.237
226 2HG PRO 78 2HG PRO 78 29.192 -10.052 -0.069
227 1HD PRO 78 1HD PRO 78 31.638 -9.715 1.345
228 2HD PRO 78 2HD PRO 78 30.102 -8.885 1.674
229 HA PRO 79 HA PRO 79 32.182 -15.339 3.154
230 1HB PRO 79 1HB PRO 79 30.860 -17.479 2.041
231 2HB PRO 79 2HB PRO 79 30.567 -16.895 3.691
232 1HG PRO 79 1HG PRO 79 28.874 -16.570 1.257
233 2HG PRO 79 2HG PRO 79 28.396 -16.591 2.963
234 1HD PRO 79 1HD PRO 79 28.673 -14.284 1.351
235 2HD PRO 79 2HD PRO 79 28.530 -14.308 3.121
236 H HIS 80 H HIS 80 31.179 -13.910 0.337
237 HA HIS 80 HA HIS 80 32.540 -15.699 -1.552
238 1HB HIS 80 1HB HIS 80 30.645 -14.493 -2.421
239 2HB HIS 80 2HB HIS 80 31.290 -12.954 -1.846
240 HD1 HIS 80 HD1 HIS 80 33.777 -15.250 -3.313
241 HD2 HIS 80 HD2 HIS 80 31.349 -12.144 -4.666
242 HE1 HIS 80 HE1 HIS 80 34.689 -14.561 -5.572