Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
537492 | 2ll4 RC | 17667 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H CYS 10 HT1 CYS 10 1.003 3.173 -14.752
2 HA CYS 10 HA CYS 10 -0.519 3.047 -12.879
3 HB2 CYS 10 HB2 CYS 10 -0.857 0.170 -13.758
4 HB3 CYS 10 HB1 CYS 10 -1.560 0.913 -12.328
5 H VAL 11 HN VAL 11 0.406 2.551 -10.927
6 HA VAL 11 HA VAL 11 3.079 1.381 -11.086
7 HB VAL 11 HB VAL 11 1.879 2.584 -8.597
8 HG11 VAL 11 HG11 VAL 11 4.184 3.090 -8.053
9 HG12 VAL 11 HG12 VAL 11 4.714 2.489 -9.625
10 HG13 VAL 11 HG13 VAL 11 4.020 1.378 -8.443
11 HG21 VAL 11 HG21 VAL 11 3.187 4.105 -10.850
12 HG22 VAL 11 HG22 VAL 11 2.787 4.768 -9.266
13 HG23 VAL 11 HG23 VAL 11 1.502 4.225 -10.344
14 H HIS 12 HN HIS 12 3.671 -0.463 -9.962
15 HA HIS 12 HA HIS 12 1.765 -1.736 -8.180
16 HB2 HIS 12 HB2 HIS 12 2.203 -2.593 -10.956
17 HB3 HIS 12 HB1 HIS 12 2.382 -3.880 -9.771
18 HD1 HIS 12 HD1 HIS 12 0.260 -4.427 -8.312
19 HD2 HIS 12 HD2 HIS 12 -0.376 -1.801 -11.463
20 HE1 HIS 12 HE1 HIS 12 -2.232 -4.343 -8.626
21 HE2 HIS 12 HE2 HIS 12 -2.545 -3.009 -10.745
22 H THR 13 HN THR 13 4.484 -2.895 -10.132
23 HA THR 13 HA THR 13 5.737 -3.914 -7.696
24 HB THR 13 HB THR 13 6.682 -4.426 -10.507
25 HG1 THR 13 HG1 THR 13 4.351 -5.254 -9.278
26 HG21 THR 13 HG21 THR 13 7.436 -6.555 -9.506
27 HG22 THR 13 HG22 THR 13 6.836 -6.011 -7.938
28 HG23 THR 13 HG23 THR 13 8.164 -5.154 -8.722
29 H GLY 14 HN GLY 14 7.267 -2.768 -6.755
30 HA2 GLY 14 HA2 GLY 14 9.499 -1.717 -8.101
31 HA3 GLY 14 HA1 GLY 14 8.368 -0.412 -7.765
32 H ASN 15 HN ASN 15 10.452 0.177 -6.555
33 HA ASN 15 HA ASN 15 10.314 -0.930 -3.826
34 HB2 ASN 15 HB2 ASN 15 12.654 -0.163 -3.543
35 HB3 ASN 15 HB1 ASN 15 12.500 -1.332 -4.848
36 HD21 ASN 15 HD21 ASN 15 12.831 -0.683 -6.958
37 HD22 ASN 15 HD22 ASN 15 13.541 0.845 -7.364
38 H ILE 16 HN ILE 16 8.471 0.929 -4.612
39 HA ILE 16 HA ILE 16 9.392 3.392 -3.297
40 HB ILE 16 HB ILE 16 7.134 4.126 -4.721
41 HG12 ILE 16 HG12 ILE 16 8.011 3.493 -7.105
42 HG13 ILE 16 HG11 ILE 16 8.761 2.137 -6.273
43 HG21 ILE 16 HG21 ILE 16 8.678 5.475 -6.026
44 HG22 ILE 16 HG22 ILE 16 10.024 4.473 -5.488
45 HG23 ILE 16 HG23 ILE 16 9.138 5.460 -4.324
46 HD11 ILE 16 HD11 ILE 16 5.821 2.780 -6.297
47 HD12 ILE 16 HD12 ILE 16 6.572 1.413 -5.473
48 HD13 ILE 16 HD13 ILE 16 6.618 1.517 -7.234
49 H GLY 17 HN GLY 17 8.607 3.474 -1.336
50 HA2 GLY 17 HA2 GLY 17 5.985 2.305 -0.753
51 HA3 GLY 17 HA1 GLY 17 7.169 2.849 0.432
52 H SER 18 HN SER 18 4.371 3.529 0.398
53 HA SER 18 HA SER 18 4.505 6.371 -0.317
54 HB2 SER 18 HB2 SER 18 2.105 4.601 0.166
55 HB3 SER 18 HB1 SER 18 2.030 6.321 -0.213
56 HG SER 18 HG SER 18 3.166 4.297 -1.862
57 H LYS 19 HN LYS 19 5.176 7.533 1.357
58 HA LYS 19 HA LYS 19 4.538 6.795 4.077
59 HB2 LYS 19 HB2 LYS 19 6.715 7.884 3.287
60 HB3 LYS 19 HB1 LYS 19 5.800 9.378 3.161
61 HG2 LYS 19 HG2 LYS 19 5.365 9.394 5.509
62 HG3 LYS 19 HG1 LYS 19 6.040 7.774 5.695
63 HD2 LYS 19 HD2 LYS 19 7.727 9.245 6.436
64 HD3 LYS 19 HD1 LYS 19 8.218 8.742 4.819
65 HE2 LYS 19 HE2 LYS 19 8.591 11.072 4.922
66 HE3 LYS 19 HE1 LYS 19 7.126 10.852 3.964
67 HZ1 LYS 19 HZ1 LYS 19 5.864 11.282 6.050
68 HZ2 LYS 19 HZ2 LYS 19 6.736 12.608 5.478
69 HZ3 LYS 19 HZ3 LYS 19 7.319 11.720 6.792
70 H ALA 20 HN ALA 20 2.189 6.936 3.176
71 HA ALA 20 HA ALA 20 1.145 9.627 3.764
72 HB1 ALA 20 HB1 ALA 20 -0.896 8.731 2.426
73 HB2 ALA 20 HB2 ALA 20 0.267 7.579 1.767
74 HB3 ALA 20 HB3 ALA 20 0.524 9.310 1.559
75 H GLN 21 HN GLN 21 -1.095 9.571 4.661
76 HA GLN 21 HA GLN 21 -1.128 7.966 6.998
77 HB2 GLN 21 HB2 GLN 21 -2.054 10.288 6.794
78 HB3 GLN 21 HB1 GLN 21 -3.386 9.618 5.863
79 HG2 GLN 21 HG2 GLN 21 -3.584 8.052 7.992
80 HG3 GLN 21 HG1 GLN 21 -2.813 9.438 8.761
81 HE21 GLN 21 HE21 GLN 21 -3.888 11.432 8.766
82 HE22 GLN 21 HE22 GLN 21 -5.596 11.537 8.526
83 H THR 22 HN THR 22 -2.087 6.084 7.404
84 HA THR 22 HA THR 22 -3.451 4.685 5.267
85 HB THR 22 HB THR 22 -2.901 3.709 8.082
86 HG1 THR 22 HG1 THR 22 -0.880 3.946 7.407
87 HG21 THR 22 HG21 THR 22 -4.520 2.362 6.835
88 HG22 THR 22 HG22 THR 22 -3.005 1.481 7.037
89 HG23 THR 22 HG23 THR 22 -3.390 2.231 5.488
90 H ILE 23 HN ILE 23 -5.592 3.971 5.353
91 HA ILE 23 HA ILE 23 -7.451 5.705 6.546
92 HB ILE 23 HB ILE 23 -7.878 2.939 5.408
93 HG12 ILE 23 HG12 ILE 23 -8.346 5.640 4.134
94 HG13 ILE 23 HG11 ILE 23 -6.878 4.697 3.900
95 HG21 ILE 23 HG21 ILE 23 -9.738 3.556 6.834
96 HG22 ILE 23 HG22 ILE 23 -10.226 3.637 5.142
97 HG23 ILE 23 HG23 ILE 23 -9.869 5.120 6.027
98 HD11 ILE 23 HD11 ILE 23 -8.157 2.919 2.881
99 HD12 ILE 23 HD12 ILE 23 -8.453 4.450 2.056
100 HD13 ILE 23 HD13 ILE 23 -9.655 3.804 3.174
101 H GLY 24 HN GLY 24 -6.629 2.330 7.387
102 HA2 GLY 24 HA2 GLY 24 -7.600 2.925 10.104
103 HA3 GLY 24 HA1 GLY 24 -8.115 1.460 9.281
104 H GLU 25 HN GLU 25 -7.222 0.077 10.762
105 HA GLU 25 HA GLU 25 -4.514 0.239 11.631
106 HB2 GLU 25 HB2 GLU 25 -6.348 -0.908 12.892
107 HB3 GLU 25 HB1 GLU 25 -6.348 -2.166 11.662
108 HG2 GLU 25 HG2 GLU 25 -3.769 -2.238 12.294
109 HG3 GLU 25 HG1 GLU 25 -4.394 -1.610 13.816
110 H VAL 26 HN VAL 26 -2.720 -0.737 10.853
111 HA VAL 26 HA VAL 26 -2.797 -1.679 8.138
112 HB VAL 26 HB VAL 26 -0.482 -1.486 10.072
113 HG11 VAL 26 HG11 VAL 26 -0.508 -1.986 7.097
114 HG12 VAL 26 HG12 VAL 26 -0.008 -3.121 8.351
115 HG13 VAL 26 HG13 VAL 26 0.933 -1.658 8.061
116 HG21 VAL 26 HG21 VAL 26 -1.243 0.339 7.796
117 HG22 VAL 26 HG22 VAL 26 0.099 0.550 8.923
118 HG23 VAL 26 HG23 VAL 26 -1.564 0.667 9.498
119 H LYS 27 HN LYS 27 -3.703 -3.651 7.940
120 HA LYS 27 HA LYS 27 -2.762 -5.792 9.713
121 HB2 LYS 27 HB2 LYS 27 -5.105 -5.907 7.808
122 HB3 LYS 27 HB1 LYS 27 -4.727 -7.030 9.107
123 HG2 LYS 27 HG2 LYS 27 -5.001 -4.976 10.652
124 HG3 LYS 27 HG1 LYS 27 -5.838 -4.258 9.273
125 HD2 LYS 27 HD2 LYS 27 -7.543 -5.236 10.550
126 HD3 LYS 27 HD1 LYS 27 -7.247 -6.399 9.256
127 HE2 LYS 27 HE2 LYS 27 -7.395 -7.688 11.213
128 HE3 LYS 27 HE1 LYS 27 -5.670 -7.559 10.880
129 HZ1 LYS 27 HZ1 LYS 27 -5.593 -5.707 12.500
130 HZ2 LYS 27 HZ2 LYS 27 -6.035 -7.192 13.190
131 HZ3 LYS 27 HZ3 LYS 27 -7.210 -6.019 12.885
132 H ARG 28 HN ARG 28 -2.201 -7.857 8.760
133 HA ARG 28 HA ARG 28 -0.681 -7.479 6.336
134 HB2 ARG 28 HB2 ARG 28 0.187 -9.726 6.746
135 HB3 ARG 28 HB1 ARG 28 0.312 -8.723 8.185
136 HG2 ARG 28 HG2 ARG 28 -1.656 -9.804 9.121
137 HG3 ARG 28 HG1 ARG 28 -1.805 -10.795 7.669
138 HD2 ARG 28 HD2 ARG 28 0.183 -11.954 8.121
139 HD3 ARG 28 HD1 ARG 28 0.698 -10.765 9.316
140 HE ARG 28 HE ARG 28 -1.657 -12.469 9.783
141 HH11 ARG 28 HH11 ARG 28 1.509 -11.262 10.715
142 HH12 ARG 28 HH12 ARG 28 1.454 -12.041 12.340
143 HH21 ARG 28 HH21 ARG 28 -1.784 -13.458 11.829
144 HH22 ARG 28 HH22 ARG 28 -0.395 -13.281 12.967
145 H ALA 29 HN ALA 29 -0.774 -8.971 4.538
146 HA ALA 29 HA ALA 29 -3.438 -10.139 4.122
147 HB1 ALA 29 HB1 ALA 29 -2.030 -8.629 1.944
148 HB2 ALA 29 HB2 ALA 29 -3.144 -7.837 3.058
149 HB3 ALA 29 HB3 ALA 29 -3.715 -9.142 2.020
150 H SER 30 HN SER 30 -3.507 -11.909 2.751
151 HA SER 30 HA SER 30 -1.379 -13.674 2.814
152 HB2 SER 30 HB2 SER 30 -3.305 -14.048 0.607
153 HB3 SER 30 HB1 SER 30 -2.865 -15.139 1.920
154 HG SER 30 HG SER 30 -5.035 -13.622 1.720
155 H SER 31 HN SER 31 -2.228 -11.338 0.324
156 HA SER 31 HA SER 31 0.355 -11.656 -0.894
157 HB2 SER 31 HB2 SER 31 -0.586 -12.175 -3.150
158 HB3 SER 31 HB1 SER 31 -0.800 -13.481 -1.988
159 HG SER 31 HG SER 31 -2.701 -12.992 -3.233
160 H LEU 32 HN LEU 32 0.187 -10.306 -3.157
161 HA LEU 32 HA LEU 32 -0.350 -7.633 -2.357
162 HB2 LEU 32 HB2 LEU 32 1.424 -8.215 -3.959
163 HB3 LEU 32 HB1 LEU 32 0.213 -8.754 -5.106
164 HG LEU 32 HG LEU 32 -0.297 -6.023 -4.289
165 HD11 LEU 32 HD11 LEU 32 2.117 -5.942 -3.928
166 HD12 LEU 32 HD12 LEU 32 1.645 -4.987 -5.334
167 HD13 LEU 32 HD13 LEU 32 2.386 -6.574 -5.551
168 HD21 LEU 32 HD21 LEU 32 -0.297 -5.671 -6.711
169 HD22 LEU 32 HD22 LEU 32 -1.247 -7.088 -6.268
170 HD23 LEU 32 HD23 LEU 32 0.367 -7.288 -6.947
171 H SER 33 HN SER 33 -1.986 -9.938 -4.486
172 HA SER 33 HA SER 33 -4.015 -8.211 -5.386
173 HB2 SER 33 HB2 SER 33 -4.177 -11.210 -4.992
174 HB3 SER 33 HB1 SER 33 -5.183 -10.234 -6.063
175 HG SER 33 HG SER 33 -3.625 -11.007 -7.369
176 H GLU 34 HN GLU 34 -3.595 -10.096 -2.481
177 HA GLU 34 HA GLU 34 -6.223 -9.943 -1.472
178 HB2 GLU 34 HB2 GLU 34 -4.266 -11.388 -0.664
179 HB3 GLU 34 HB1 GLU 34 -3.720 -9.965 0.207
180 HG2 GLU 34 HG2 GLU 34 -4.922 -11.259 1.750
181 HG3 GLU 34 HG1 GLU 34 -5.982 -9.920 1.312
182 H CYS 35 HN CYS 35 -3.442 -7.821 -1.312
183 HA CYS 35 HA CYS 35 -4.591 -5.936 0.492
184 HB2 CYS 35 HB2 CYS 35 -2.104 -6.270 -0.044
185 HB3 CYS 35 HB1 CYS 35 -2.412 -5.353 -1.514
186 H ARG 36 HN ARG 36 -4.470 -6.337 -2.994
187 HA ARG 36 HA ARG 36 -5.551 -3.835 -3.716
188 HB2 ARG 36 HB2 ARG 36 -4.435 -5.437 -5.293
189 HB3 ARG 36 HB1 ARG 36 -5.860 -6.463 -5.189
190 HG2 ARG 36 HG2 ARG 36 -7.038 -4.158 -5.874
191 HG3 ARG 36 HG1 ARG 36 -5.456 -3.910 -6.618
192 HD2 ARG 36 HD2 ARG 36 -7.057 -6.420 -7.029
193 HD3 ARG 36 HD1 ARG 36 -7.265 -4.996 -8.046
194 HE ARG 36 HE ARG 36 -4.798 -6.595 -7.834
195 HH11 ARG 36 HH11 ARG 36 -6.926 -4.402 -9.587
196 HH12 ARG 36 HH12 ARG 36 -5.892 -4.410 -11.073
197 HH21 ARG 36 HH21 ARG 36 -3.480 -6.647 -9.704
198 HH22 ARG 36 HH22 ARG 36 -3.979 -5.664 -11.136
199 H ALA 37 HN ALA 37 -7.005 -6.967 -2.984
200 HA ALA 37 HA ALA 37 -9.678 -6.304 -3.536
201 HB1 ALA 37 HB1 ALA 37 -10.259 -8.228 -2.153
202 HB2 ALA 37 HB2 ALA 37 -8.615 -8.283 -1.520
203 HB3 ALA 37 HB3 ALA 37 -8.916 -8.609 -3.226
204 H ARG 38 HN ARG 38 -7.697 -5.921 -0.646
205 HA ARG 38 HA ARG 38 -9.791 -5.037 1.058
206 HB2 ARG 38 HB2 ARG 38 -7.022 -5.559 1.293
207 HB3 ARG 38 HB1 ARG 38 -7.259 -3.891 1.794
208 HG2 ARG 38 HG2 ARG 38 -8.833 -6.210 2.890
209 HG3 ARG 38 HG1 ARG 38 -7.371 -5.565 3.637
210 HD2 ARG 38 HD2 ARG 38 -8.499 -3.343 3.768
211 HD3 ARG 38 HD1 ARG 38 -9.974 -4.109 3.183
212 HE ARG 38 HE ARG 38 -9.528 -5.620 5.268
213 HH11 ARG 38 HH11 ARG 38 -9.297 -2.121 4.938
214 HH12 ARG 38 HH12 ARG 38 -9.507 -1.836 6.714
215 HH21 ARG 38 HH21 ARG 38 -9.851 -5.294 7.506
216 HH22 ARG 38 HH22 ARG 38 -9.823 -3.609 8.151
217 H CYS 39 HN CYS 39 -7.448 -3.399 -1.012
218 HA CYS 39 HA CYS 39 -8.204 -0.763 -0.319
219 HB2 CYS 39 HB2 CYS 39 -6.062 -1.414 -1.453
220 HB3 CYS 39 HB1 CYS 39 -6.982 -1.686 -2.927
221 H GLN 40 HN GLN 40 -9.640 -3.158 -2.314
222 HA GLN 40 HA GLN 40 -11.232 -1.310 -3.858
223 HB2 GLN 40 HB2 GLN 40 -11.052 -4.291 -3.640
224 HB3 GLN 40 HB1 GLN 40 -12.484 -3.571 -4.363
225 HG2 GLN 40 HG2 GLN 40 -9.642 -3.187 -5.288
226 HG3 GLN 40 HG1 GLN 40 -10.874 -4.182 -6.066
227 HE21 GLN 40 HE21 GLN 40 -9.761 -0.946 -5.467
228 HE22 GLN 40 HE22 GLN 40 -10.807 -0.163 -6.597
229 H ALA 41 HN ALA 41 -11.418 -2.995 -0.862
230 HA ALA 41 HA ALA 41 -14.260 -2.751 -0.539
231 HB1 ALA 41 HB1 ALA 41 -12.128 -3.304 1.528
232 HB2 ALA 41 HB2 ALA 41 -12.995 -4.524 0.595
233 HB3 ALA 41 HB3 ALA 41 -13.867 -3.511 1.742
234 H GLU 42 HN GLU 42 -11.390 -0.974 0.440
235 HA GLU 42 HA GLU 42 -12.884 0.974 1.949
236 HB2 GLU 42 HB2 GLU 42 -10.045 0.428 1.372
237 HB3 GLU 42 HB1 GLU 42 -10.452 2.128 1.553
238 HG2 GLU 42 HG2 GLU 42 -9.750 1.311 3.668
239 HG3 GLU 42 HG1 GLU 42 -11.491 1.580 3.741
240 H LYS 43 HN LYS 43 -13.966 2.584 1.063
241 HA LYS 43 HA LYS 43 -13.795 3.167 -1.726
242 HB2 LYS 43 HB2 LYS 43 -15.317 4.434 0.545
243 HB3 LYS 43 HB1 LYS 43 -15.428 5.015 -1.111
244 HG2 LYS 43 HG2 LYS 43 -16.406 3.000 -1.857
245 HG3 LYS 43 HG1 LYS 43 -16.003 2.163 -0.358
246 HD2 LYS 43 HD2 LYS 43 -17.681 3.221 0.833
247 HD3 LYS 43 HD1 LYS 43 -17.764 4.577 -0.291
248 HE2 LYS 43 HE2 LYS 43 -19.726 3.311 -0.643
249 HE3 LYS 43 HE1 LYS 43 -18.660 2.949 -1.995
250 HZ1 LYS 43 HZ1 LYS 43 -19.627 0.931 -1.206
251 HZ2 LYS 43 HZ2 LYS 43 -19.155 1.249 0.384
252 HZ3 LYS 43 HZ3 LYS 43 -17.989 0.909 -0.790
253 H GLU 44 HN GLU 44 -12.243 4.415 1.069
254 HA GLU 44 HA GLU 44 -11.485 6.893 -0.267
255 HB2 GLU 44 HB2 GLU 44 -11.006 5.827 2.509
256 HB3 GLU 44 HB1 GLU 44 -10.263 7.310 1.922
257 HG2 GLU 44 HG2 GLU 44 -12.400 8.331 1.612
258 HG3 GLU 44 HG1 GLU 44 -13.227 6.819 1.985
259 H CYS 45 HN CYS 45 -10.343 3.748 -0.076
260 HA CYS 45 HA CYS 45 -7.534 4.292 0.016
261 HB2 CYS 45 HB2 CYS 45 -8.527 2.080 0.630
262 HB3 CYS 45 HB1 CYS 45 -8.916 1.830 -1.068
263 H SER 46 HN SER 46 -6.733 5.589 -1.521
264 HA SER 46 HA SER 46 -7.623 5.238 -4.284
265 HB2 SER 46 HB2 SER 46 -5.616 7.279 -3.381
266 HB3 SER 46 HB1 SER 46 -6.776 7.375 -4.706
267 HG SER 46 HG SER 46 -8.159 7.031 -2.479
268 H HIS 47 HN HIS 47 -5.141 4.259 -2.227
269 HA HIS 47 HA HIS 47 -3.776 2.837 -4.270
270 HB2 HIS 47 HB2 HIS 47 -1.502 4.017 -3.517
271 HB3 HIS 47 HB1 HIS 47 -2.440 4.593 -4.889
272 HD1 HIS 47 HD1 HIS 47 -3.094 6.977 -4.853
273 HD2 HIS 47 HD2 HIS 47 -2.029 5.597 -1.077
274 HE1 HIS 47 HE1 HIS 47 -3.152 8.992 -3.359
275 HE2 HIS 47 HE2 HIS 47 -2.613 8.123 -1.060
276 H TYR 48 HN TYR 48 -2.556 1.189 -3.423
277 HA TYR 48 HA TYR 48 -2.411 1.096 -0.484
278 HB2 TYR 48 HB2 TYR 48 -2.786 -1.335 -0.618
279 HB3 TYR 48 HB1 TYR 48 -4.141 -0.433 -1.290
280 HD1 TYR 48 HD2 TYR 48 -4.560 -0.447 -3.709
281 HD2 TYR 48 HD1 TYR 48 -1.404 -2.742 -2.016
282 HE1 TYR 48 HE2 TYR 48 -4.384 -1.734 -5.795
283 HE2 TYR 48 HE1 TYR 48 -1.221 -4.038 -4.097
284 HH TYR 48 HH TYR 48 -3.090 -3.188 -6.958
285 H THR 49 HN THR 49 -0.543 0.396 0.415
286 HA THR 49 HA THR 49 1.649 -0.222 -1.445
287 HB THR 49 HB THR 49 1.869 0.896 1.361
288 HG1 THR 49 HG1 THR 49 2.269 2.206 -1.142
289 HG21 THR 49 HG21 THR 49 4.209 1.292 0.783
290 HG22 THR 49 HG22 THR 49 3.950 0.564 -0.803
291 HG23 THR 49 HG23 THR 49 3.817 -0.422 0.654
292 H TYR 50 HN TYR 50 1.837 -2.398 -1.531
293 HA TYR 50 HA TYR 50 1.383 -3.920 0.915
294 HB2 TYR 50 HB2 TYR 50 0.361 -4.735 -1.203
295 HB3 TYR 50 HB1 TYR 50 1.978 -4.967 -1.862
296 HD1 TYR 50 HD1 TYR 50 0.009 -5.899 1.174
297 HD2 TYR 50 HD2 TYR 50 2.885 -7.108 -1.721
298 HE1 TYR 50 HE1 TYR 50 0.093 -8.124 2.205
299 HE2 TYR 50 HE2 TYR 50 2.975 -9.346 -0.697
300 HH TYR 50 HH TYR 50 0.748 -10.312 1.840
301 H ASN 51 HN ASN 51 3.046 -3.909 2.219
302 HA ASN 51 HA ASN 51 5.763 -3.795 1.288
303 HB2 ASN 51 HB2 ASN 51 5.026 -2.750 3.427
304 HB3 ASN 51 HB1 ASN 51 4.690 -4.355 4.070
305 HD21 ASN 51 HD21 ASN 51 7.158 -2.115 3.085
306 HD22 ASN 51 HD22 ASN 51 8.476 -2.935 3.864
307 H VAL 52 HN VAL 52 6.193 -5.599 0.085
308 HA VAL 52 HA VAL 52 5.367 -8.220 0.753
309 HB VAL 52 HB VAL 52 6.055 -7.406 -1.535
310 HG11 VAL 52 HG11 VAL 52 8.133 -6.309 -0.963
311 HG12 VAL 52 HG12 VAL 52 8.430 -7.592 -2.138
312 HG13 VAL 52 HG13 VAL 52 8.828 -7.843 -0.438
313 HG21 VAL 52 HG21 VAL 52 7.297 -9.962 -0.525
314 HG22 VAL 52 HG22 VAL 52 7.005 -9.571 -2.220
315 HG23 VAL 52 HG23 VAL 52 5.646 -9.757 -1.109
316 H LYS 53 HN LYS 53 7.862 -6.275 2.011
317 HA LYS 53 HA LYS 53 9.719 -8.315 2.693
318 HB2 LYS 53 HB2 LYS 53 9.641 -5.530 2.841
319 HB3 LYS 53 HB1 LYS 53 9.732 -6.058 4.518
320 HG2 LYS 53 HG2 LYS 53 11.947 -5.703 3.720
321 HG3 LYS 53 HG1 LYS 53 11.706 -7.436 3.909
322 HD2 LYS 53 HD2 LYS 53 11.252 -7.603 1.483
323 HD3 LYS 53 HD1 LYS 53 11.592 -5.883 1.328
324 HE2 LYS 53 HE2 LYS 53 13.545 -7.927 2.365
325 HE3 LYS 53 HE1 LYS 53 13.504 -7.337 0.706
326 HZ1 LYS 53 HZ1 LYS 53 14.110 -5.782 3.155
327 HZ2 LYS 53 HZ2 LYS 53 13.849 -5.070 1.643
328 HZ3 LYS 53 HZ3 LYS 53 15.155 -6.126 1.865
329 H SER 54 HN SER 54 6.935 -6.902 4.344
330 HA SER 54 HA SER 54 7.295 -8.902 6.483
331 HB2 SER 54 HB2 SER 54 5.650 -6.402 6.781
332 HB3 SER 54 HB1 SER 54 6.384 -7.397 8.037
333 HG SER 54 HG SER 54 7.661 -5.615 6.238
334 H GLY 55 HN GLY 55 5.244 -7.806 3.969
335 HA2 GLY 55 HA2 GLY 55 3.409 -8.935 3.086
336 HA3 GLY 55 HA1 GLY 55 3.342 -9.926 4.536
337 H LEU 56 HN LEU 56 3.498 -6.461 4.728
338 HA LEU 56 HA LEU 56 0.871 -6.458 5.992
339 HB2 LEU 56 HB2 LEU 56 3.045 -4.373 5.908
340 HB3 LEU 56 HB1 LEU 56 1.504 -4.155 6.712
341 HG LEU 56 HG LEU 56 3.504 -6.293 7.442
342 HD11 LEU 56 HD11 LEU 56 2.956 -3.632 8.747
343 HD12 LEU 56 HD12 LEU 56 4.423 -4.082 7.878
344 HD13 LEU 56 HD13 LEU 56 4.006 -4.895 9.386
345 HD21 LEU 56 HD21 LEU 56 2.136 -6.433 9.500
346 HD22 LEU 56 HD22 LEU 56 1.257 -6.909 8.050
347 HD23 LEU 56 HD23 LEU 56 0.977 -5.325 8.771
348 H CYS 57 HN CYS 57 -0.854 -5.317 5.286
349 HA CYS 57 HA CYS 57 -0.674 -4.195 2.583
350 HB2 CYS 57 HB2 CYS 57 -2.368 -5.947 2.972
351 HB3 CYS 57 HB1 CYS 57 -3.092 -4.968 4.240
352 H TYR 58 HN TYR 58 -1.000 -2.033 2.225
353 HA TYR 58 HA TYR 58 -1.738 -0.435 4.586
354 HB2 TYR 58 HB2 TYR 58 0.392 0.088 2.528
355 HB3 TYR 58 HB1 TYR 58 -0.264 1.360 3.546
356 HD1 TYR 58 HD2 TYR 58 1.736 -1.732 3.527
357 HD2 TYR 58 HD1 TYR 58 0.344 1.547 5.848
358 HE1 TYR 58 HE2 TYR 58 3.372 -2.283 5.275
359 HE2 TYR 58 HE1 TYR 58 1.983 1.006 7.601
360 HH TYR 58 HH TYR 58 3.255 -1.024 8.372
361 HA PRO 59 HA PRO 59 -4.674 0.900 1.300
362 HB2 PRO 59 HB2 PRO 59 -6.624 1.103 3.449
363 HB3 PRO 59 HB1 PRO 59 -6.660 0.047 2.032
364 HG2 PRO 59 HG2 PRO 59 -6.341 -0.891 4.555
365 HG3 PRO 59 HG1 PRO 59 -5.681 -1.700 3.123
366 HD2 PRO 59 HD2 PRO 59 -4.282 0.049 5.103
367 HD3 PRO 59 HD1 PRO 59 -3.719 -1.444 4.318
368 H LYS 60 HN LYS 60 -3.771 2.941 1.040
369 HA LYS 60 HA LYS 60 -4.166 4.848 3.244
370 HB2 LYS 60 HB2 LYS 60 -2.159 4.901 0.997
371 HB3 LYS 60 HB1 LYS 60 -2.331 6.147 2.226
372 HG2 LYS 60 HG2 LYS 60 -1.733 4.565 3.957
373 HG3 LYS 60 HG1 LYS 60 -1.638 3.267 2.767
374 HD2 LYS 60 HD2 LYS 60 0.175 4.458 1.625
375 HD3 LYS 60 HD1 LYS 60 0.087 5.742 2.833
376 HE2 LYS 60 HE2 LYS 60 0.750 2.855 3.385
377 HE3 LYS 60 HE1 LYS 60 1.914 4.168 3.279
378 HZ1 LYS 60 HZ1 LYS 60 0.619 5.244 5.130
379 HZ2 LYS 60 HZ2 LYS 60 1.501 3.861 5.548
380 HZ3 LYS 60 HZ3 LYS 60 -0.179 3.763 5.337
381 H ARG 61 HN ARG 61 -4.410 7.101 2.641
382 HA ARG 61 HA ARG 61 -5.939 7.533 0.167
383 HB2 ARG 61 HB2 ARG 61 -7.509 8.967 1.499
384 HB3 ARG 61 HB1 ARG 61 -7.607 7.257 1.901
385 HG2 ARG 61 HG2 ARG 61 -6.085 7.714 3.834
386 HG3 ARG 61 HG1 ARG 61 -6.256 9.433 3.481
387 HD2 ARG 61 HD2 ARG 61 -8.562 9.411 3.986
388 HD3 ARG 61 HD1 ARG 61 -8.625 7.648 3.961
389 HE ARG 61 HE ARG 61 -6.869 8.789 5.962
390 HH11 ARG 61 HH11 ARG 61 -10.157 7.719 5.248
391 HH12 ARG 61 HH12 ARG 61 -10.493 7.290 6.971
392 HH21 ARG 61 HH21 ARG 61 -7.286 8.311 8.135
393 HH22 ARG 61 HH22 ARG 61 -8.903 7.644 8.591
394 H GLY 62 HN GLY 62 -6.252 9.996 -0.133
395 HA2 GLY 62 HA2 GLY 62 -5.405 12.129 -0.234
396 HA3 GLY 62 HA1 GLY 62 -4.406 11.751 1.158
397 H LYS 63 HN LYS 63 -2.825 13.048 0.045
398 HA LYS 63 HA LYS 63 -1.659 12.191 -2.419
399 HB2 LYS 63 HB2 LYS 63 -1.559 14.512 -1.868
400 HB3 LYS 63 HB1 LYS 63 -0.834 14.176 -0.305
401 HG2 LYS 63 HG2 LYS 63 1.143 13.240 -1.609
402 HG3 LYS 63 HG1 LYS 63 0.423 14.018 -3.022
403 HD2 LYS 63 HD2 LYS 63 1.995 15.554 -2.128
404 HD3 LYS 63 HD1 LYS 63 0.397 16.157 -1.688
405 HE2 LYS 63 HE2 LYS 63 0.685 15.020 0.532
406 HE3 LYS 63 HE1 LYS 63 2.353 14.688 0.073
407 HZ1 LYS 63 HZ1 LYS 63 1.104 17.362 0.388
408 HZ2 LYS 63 HZ2 LYS 63 2.676 17.100 -0.181
409 HZ3 LYS 63 HZ3 LYS 63 2.263 16.660 1.399
410 HA PRO 64 HA PRO 64 1.043 9.222 -0.447
411 HB2 PRO 64 HB2 PRO 64 1.919 8.016 -2.658
412 HB3 PRO 64 HB1 PRO 64 0.240 7.846 -2.127
413 HG2 PRO 64 HG2 PRO 64 1.351 9.489 -4.337
414 HG3 PRO 64 HG1 PRO 64 -0.211 8.658 -4.220
415 HD2 PRO 64 HD2 PRO 64 0.261 11.390 -3.753
416 HD3 PRO 64 HD1 PRO 64 -1.213 10.487 -3.359
417 H GLN 65 HN GLN 65 3.010 9.573 0.344
418 HA GLN 65 HA GLN 65 4.922 11.169 -1.199
419 HB2 GLN 65 HB2 GLN 65 4.380 10.768 1.664
420 HB3 GLN 65 HB1 GLN 65 6.089 10.745 1.254
421 HG2 GLN 65 HG2 GLN 65 4.176 12.957 0.536
422 HG3 GLN 65 HG1 GLN 65 5.273 12.972 1.915
423 HE21 GLN 65 HE21 GLN 65 5.192 14.831 -0.272
424 HE22 GLN 65 HE22 GLN 65 6.734 14.755 -1.047
425 H PHE 66 HN PHE 66 5.727 9.676 -2.615
426 HA PHE 66 HA PHE 66 6.455 7.031 -1.923
427 HB2 PHE 66 HB2 PHE 66 7.214 8.754 -4.283
428 HB3 PHE 66 HB1 PHE 66 7.625 7.049 -4.140
429 HD1 PHE 66 HD1 PHE 66 5.625 5.433 -3.732
430 HD2 PHE 66 HD2 PHE 66 5.244 9.366 -5.317
431 HE1 PHE 66 HE1 PHE 66 3.458 4.821 -4.725
432 HE2 PHE 66 HE2 PHE 66 3.079 8.759 -6.309
433 HZ PHE 66 HZ PHE 66 2.183 6.487 -6.017
434 H TYR 67 HN TYR 67 8.245 6.205 -1.082
435 HA TYR 67 HA TYR 67 10.711 7.798 -1.134
436 HB2 TYR 67 HB2 TYR 67 11.251 7.157 1.156
437 HB3 TYR 67 HB1 TYR 67 9.729 8.034 1.112
438 HD1 TYR 67 HD1 TYR 67 11.320 4.790 1.714
439 HD2 TYR 67 HD2 TYR 67 7.644 6.929 1.692
440 HE1 TYR 67 HE1 TYR 67 10.271 2.986 3.008
441 HE2 TYR 67 HE2 TYR 67 6.582 5.124 2.987
442 HH TYR 67 HH TYR 67 7.737 2.128 3.251
443 H LYS 68 HN LYS 68 12.672 6.504 -0.939
444 HA LYS 68 HA LYS 68 12.442 4.079 -2.470
445 HB2 LYS 68 HB2 LYS 68 14.806 5.559 -1.320
446 HB3 LYS 68 HB1 LYS 68 14.963 4.066 -2.231
447 HG2 LYS 68 HG2 LYS 68 13.551 6.450 -3.373
448 HG3 LYS 68 HG1 LYS 68 15.304 6.272 -3.472
449 HD2 LYS 68 HD2 LYS 68 15.002 5.030 -5.297
450 HD3 LYS 68 HD1 LYS 68 14.260 3.803 -4.269
451 HE2 LYS 68 HE2 LYS 68 12.078 4.921 -4.568
452 HE3 LYS 68 HE1 LYS 68 12.842 6.065 -5.672
453 HZ1 LYS 68 HZ1 LYS 68 13.343 4.298 -7.180
454 HZ2 LYS 68 HZ2 LYS 68 11.700 4.197 -6.794
455 HZ3 LYS 68 HZ3 LYS 68 12.802 3.124 -6.085
456 H TYR 69 HN TYR 69 12.139 2.134 -1.681
457 HA TYR 69 HA TYR 69 13.601 1.164 0.591
458 HB2 TYR 69 HB2 TYR 69 11.744 2.249 1.771
459 HB3 TYR 69 HB1 TYR 69 10.583 1.367 0.785
460 HD1 TYR 69 HD1 TYR 69 13.031 1.092 3.517
461 HD2 TYR 69 HD2 TYR 69 10.090 -0.950 1.220
462 HE1 TYR 69 HE1 TYR 69 13.021 -0.739 5.160
463 HE2 TYR 69 HE2 TYR 69 10.074 -2.782 2.854
464 HH TYR 69 HH TYR 69 11.474 -2.537 5.912
465 H LEU 70 HN LEU 70 14.201 -0.824 0.004
466 HA LEU 70 HA LEU 70 12.900 -2.164 -2.167
467 HB2 LEU 70 HB2 LEU 70 15.417 -2.191 -1.421
468 HB3 LEU 70 HB1 LEU 70 14.898 -3.507 -0.388
469 HG LEU 70 HG LEU 70 15.917 -4.136 -2.638
470 HD11 LEU 70 HD11 LEU 70 13.145 -5.212 -2.175
471 HD12 LEU 70 HD12 LEU 70 14.536 -5.640 -1.179
472 HD13 LEU 70 HD13 LEU 70 14.527 -6.039 -2.897
473 HD21 LEU 70 HD21 LEU 70 13.195 -3.435 -3.706
474 HD22 LEU 70 HD22 LEU 70 14.614 -3.981 -4.597
475 HD23 LEU 70 HD23 LEU 70 14.592 -2.373 -3.875
476 H GLY 71 HN GLY 71 10.843 -2.746 -1.619
477 HA2 GLY 71 HA2 GLY 71 10.086 -5.093 -0.702
478 HA3 GLY 71 HA1 GLY 71 10.411 -4.289 0.827
479 H ASP 72 HN ASP 72 9.512 -1.706 -0.560
480 HA ASP 72 HA ASP 72 6.687 -2.069 0.081
481 HB2 ASP 72 HB2 ASP 72 8.558 0.241 0.011
482 HB3 ASP 72 HB1 ASP 72 6.860 0.564 -0.321
483 H MET 73 HN MET 73 5.350 -2.529 -1.527
484 HA MET 73 HA MET 73 5.899 -1.362 -4.175
485 HB2 MET 73 HB2 MET 73 4.483 -3.959 -3.523
486 HB3 MET 73 HB1 MET 73 4.706 -3.301 -5.139
487 HG2 MET 73 HG2 MET 73 7.158 -3.438 -4.796
488 HG3 MET 73 HG1 MET 73 6.855 -4.240 -3.257
489 HE1 MET 73 HE1 MET 73 8.204 -7.073 -5.656
490 HE2 MET 73 HE2 MET 73 8.458 -6.246 -4.119
491 HE3 MET 73 HE3 MET 73 8.672 -5.372 -5.636
492 H THR 74 HN THR 74 4.598 0.329 -4.448
493 HA THR 74 HA THR 74 1.930 0.311 -3.273
494 HB THR 74 HB THR 74 3.334 2.575 -4.705
495 HG1 THR 74 HG1 THR 74 4.518 2.207 -2.868
496 HG21 THR 74 HG21 THR 74 0.929 2.556 -2.871
497 HG22 THR 74 HG22 THR 74 0.888 2.793 -4.618
498 HG23 THR 74 HG23 THR 74 1.674 3.987 -3.583
499 H GLY 75 HN GLY 75 0.136 0.002 -4.395
500 HA2 GLY 75 HA2 GLY 75 0.340 -0.119 -7.339
501 HA3 GLY 75 HA1 GLY 75 -0.800 -1.046 -6.371
502 H SER 76 HN SER 76 -1.148 0.947 -8.608
503 HA SER 76 HA SER 76 -2.415 3.246 -7.477
504 HB2 SER 76 HB2 SER 76 -2.777 2.187 -10.281
505 HB3 SER 76 HB1 SER 76 -2.910 3.856 -9.725
506 HG SER 76 HG SER 76 -0.829 4.069 -9.903
507 H ARG 77 HN ARG 77 -3.496 0.880 -6.389
508 HA ARG 77 HA ARG 77 -5.468 0.030 -5.693
509 HB2 ARG 77 HB2 ARG 77 -6.185 2.467 -5.851
510 HB3 ARG 77 HB1 ARG 77 -6.903 2.053 -7.405
511 HG2 ARG 77 HG2 ARG 77 -8.237 0.297 -6.223
512 HG3 ARG 77 HG1 ARG 77 -7.625 0.953 -4.703
513 HD2 ARG 77 HD2 ARG 77 -8.526 3.207 -5.587
514 HD3 ARG 77 HD1 ARG 77 -9.462 2.214 -6.703
515 HE ARG 77 HE ARG 77 -9.621 1.688 -3.822
516 HH11 ARG 77 HH11 ARG 77 -11.125 2.819 -6.794
517 HH12 ARG 77 HH12 ARG 77 -12.792 2.739 -6.110
518 HH21 ARG 77 HH21 ARG 77 -11.714 1.596 -2.913
519 HH22 ARG 77 HH22 ARG 77 -13.122 2.043 -3.950
520 H THR 78 HN THR 78 -6.221 1.040 -9.018
521 HA THR 78 HA THR 78 -7.385 -1.568 -9.564
522 HB THR 78 HB THR 78 -7.391 0.085 -11.872
523 HG1 THR 78 HG1 THR 78 -7.368 2.023 -11.034
524 HG21 THR 78 HG21 THR 78 -9.806 0.112 -11.489
525 HG22 THR 78 HG22 THR 78 -9.556 -0.465 -9.842
526 HG23 THR 78 HG23 THR 78 -9.146 -1.500 -11.211
527 H CYS 79 HN CYS 79 -6.845 -1.403 -12.422
528 HA CYS 79 HA CYS 79 -5.414 -2.168 -13.985
529 HB2 CYS 79 HB2 CYS 79 -3.125 -1.193 -12.278
530 HB3 CYS 79 HB1 CYS 79 -3.188 -1.349 -14.030
531 H1 GAL 83 H1 GTP 1 6.036 2.262 8.444
532 H2 GAL 83 H2 GTP 1 5.705 4.181 6.076
533 H3 GAL 83 H3 GTP 1 3.763 2.358 7.538
534 H4 GAL 83 H4 GTP 1 3.661 1.239 5.350
535 H5 GAL 83 H5 GTP 1 5.239 0.491 7.066
536 H61 GAL 83 H61 GTP 1 5.670 0.132 4.226
537 H62 GAL 83 H62 GTP 1 5.864 -1.006 5.563
538 HO2 GAL 83 HO2 GTP 1 5.742 4.753 8.582
539 HO3 GAL 83 HO3 GTP 1 3.415 4.652 6.301
540 HO4 GAL 83 HO4 GTP 1 5.964 2.498 4.405
541 HO6 GAL 83 HO6 GTP 1 7.702 0.225 4.023
542 H1 NAG 84 H1 GCP 2 10.240 3.143 4.827
543 H2 NAG 84 H2 GCP 2 10.233 3.316 7.880
544 H3 NAG 84 H3 GCP 2 8.035 3.584 5.794
545 H4 NAG 84 H4 GCP 2 9.350 5.511 7.761
546 H5 NAG 84 H5 GCP 2 9.336 5.325 4.712
547 H61 NAG 84 H61 GCP 2 10.832 7.259 6.502
548 H62 NAG 84 H62 GCP 2 9.367 7.651 5.601
549 H81 NAG 84 HC23 GCP 2 10.458 -1.318 7.473
550 H82 NAG 84 HC21 GCP 2 9.065 -0.958 8.493
551 H83 NAG 84 HC22 GCP 2 8.942 -0.788 6.741
552 HN2 NAG 84 HN2 GCP 2 8.784 1.290 6.247
553 HO1 NAG 84 HO1 GCP 2 12.136 2.218 5.134
554 HO4 NAG 84 HO4 GCP 2 7.253 6.145 7.513
555 HO6 NAG 84 HO6 GCP 2 11.221 8.244 4.396
Start of MODEL 2
1 H CYS 10 HT1 CYS 10 0.618 -0.347 -15.518
2 HA CYS 10 HA CYS 10 -0.724 1.999 -14.321
3 HB2 CYS 10 HB2 CYS 10 -1.615 0.322 -12.708
4 HB3 CYS 10 HB1 CYS 10 -2.199 0.068 -14.349
5 H VAL 11 HN VAL 11 -0.147 2.251 -12.012
6 HA VAL 11 HA VAL 11 2.721 1.935 -11.689
7 HB VAL 11 HB VAL 11 0.780 3.195 -9.745
8 HG11 VAL 11 HG11 VAL 11 2.976 2.619 -8.822
9 HG12 VAL 11 HG12 VAL 11 2.747 4.366 -8.910
10 HG13 VAL 11 HG13 VAL 11 3.756 3.549 -10.105
11 HG21 VAL 11 HG21 VAL 11 2.292 4.461 -12.028
12 HG22 VAL 11 HG22 VAL 11 1.462 5.354 -10.754
13 HG23 VAL 11 HG23 VAL 11 0.542 4.332 -11.855
14 H HIS 12 HN HIS 12 3.590 0.243 -10.704
15 HA HIS 12 HA HIS 12 2.544 -0.836 -8.277
16 HB2 HIS 12 HB2 HIS 12 2.099 -3.111 -9.037
17 HB3 HIS 12 HB1 HIS 12 1.061 -1.988 -9.903
18 HD1 HIS 12 HD1 HIS 12 4.033 -4.249 -10.406
19 HD2 HIS 12 HD2 HIS 12 1.401 -1.939 -12.655
20 HE1 HIS 12 HE1 HIS 12 4.442 -4.887 -12.803
21 HE2 HIS 12 HE2 HIS 12 2.722 -3.613 -14.124
22 H THR 13 HN THR 13 3.994 -2.341 -7.307
23 HA THR 13 HA THR 13 6.055 -3.063 -6.700
24 HB THR 13 HB THR 13 6.922 -3.280 -9.559
25 HG1 THR 13 HG1 THR 13 5.579 -5.374 -9.388
26 HG21 THR 13 HG21 THR 13 7.819 -5.405 -8.810
27 HG22 THR 13 HG22 THR 13 7.007 -5.238 -7.257
28 HG23 THR 13 HG23 THR 13 8.320 -4.142 -7.682
29 H GLY 14 HN GLY 14 8.433 -2.562 -8.650
30 HA2 GLY 14 HA2 GLY 14 10.002 -0.933 -9.033
31 HA3 GLY 14 HA1 GLY 14 8.741 0.264 -8.791
32 H ASN 15 HN ASN 15 9.189 -1.969 -6.251
33 HA ASN 15 HA ASN 15 9.592 -1.597 -4.043
34 HB2 ASN 15 HB2 ASN 15 12.006 -1.069 -3.563
35 HB3 ASN 15 HB1 ASN 15 11.725 -2.433 -4.632
36 HD21 ASN 15 HD21 ASN 15 12.804 0.890 -4.448
37 HD22 ASN 15 HD22 ASN 15 13.675 0.886 -5.945
38 H ILE 16 HN ILE 16 8.031 0.367 -4.669
39 HA ILE 16 HA ILE 16 9.219 2.737 -3.389
40 HB ILE 16 HB ILE 16 7.158 2.680 -5.605
41 HG12 ILE 16 HG12 ILE 16 9.513 2.457 -6.333
42 HG13 ILE 16 HG11 ILE 16 8.784 3.961 -6.881
43 HG21 ILE 16 HG21 ILE 16 6.556 4.348 -3.925
44 HG22 ILE 16 HG22 ILE 16 7.066 5.105 -5.432
45 HG23 ILE 16 HG23 ILE 16 8.164 5.063 -4.051
46 HD11 ILE 16 HD11 ILE 16 11.017 4.392 -6.152
47 HD12 ILE 16 HD12 ILE 16 10.710 3.608 -4.604
48 HD13 ILE 16 HD13 ILE 16 9.899 5.123 -5.000
49 H GLY 17 HN GLY 17 8.244 3.315 -1.562
50 HA2 GLY 17 HA2 GLY 17 5.617 2.121 -0.942
51 HA3 GLY 17 HA1 GLY 17 6.813 2.602 0.257
52 H SER 18 HN SER 18 4.670 3.669 1.016
53 HA SER 18 HA SER 18 4.790 6.434 0.082
54 HB2 SER 18 HB2 SER 18 2.316 4.723 0.204
55 HB3 SER 18 HB1 SER 18 2.223 6.482 0.332
56 HG SER 18 HG SER 18 3.686 5.325 -1.765
57 H LYS 19 HN LYS 19 5.096 7.733 1.751
58 HA LYS 19 HA LYS 19 4.673 6.777 4.455
59 HB2 LYS 19 HB2 LYS 19 6.677 8.147 3.659
60 HB3 LYS 19 HB1 LYS 19 5.591 9.529 3.614
61 HG2 LYS 19 HG2 LYS 19 5.237 9.430 5.961
62 HG3 LYS 19 HG1 LYS 19 6.072 7.880 6.081
63 HD2 LYS 19 HD2 LYS 19 7.497 9.700 6.860
64 HD3 LYS 19 HD1 LYS 19 8.168 8.961 5.406
65 HE2 LYS 19 HE2 LYS 19 8.365 11.360 5.251
66 HE3 LYS 19 HE1 LYS 19 7.186 10.796 4.070
67 HZ1 LYS 19 HZ1 LYS 19 6.810 12.777 5.890
68 HZ2 LYS 19 HZ2 LYS 19 5.987 11.470 6.578
69 HZ3 LYS 19 HZ3 LYS 19 5.595 11.991 5.017
70 H ALA 20 HN ALA 20 2.425 7.403 2.554
71 HA ALA 20 HA ALA 20 1.071 9.705 3.577
72 HB1 ALA 20 HB1 ALA 20 -0.855 8.843 2.269
73 HB2 ALA 20 HB2 ALA 20 0.090 7.403 1.890
74 HB3 ALA 20 HB3 ALA 20 0.625 8.982 1.319
75 H GLN 21 HN GLN 21 -0.986 9.606 4.707
76 HA GLN 21 HA GLN 21 -0.829 8.001 7.030
77 HB2 GLN 21 HB2 GLN 21 -1.890 10.346 6.672
78 HB3 GLN 21 HB1 GLN 21 -3.317 9.451 6.172
79 HG2 GLN 21 HG2 GLN 21 -2.233 8.480 8.681
80 HG3 GLN 21 HG1 GLN 21 -2.657 10.189 8.746
81 HE21 GLN 21 HE21 GLN 21 -3.915 8.010 10.138
82 HE22 GLN 21 HE22 GLN 21 -5.563 7.971 9.621
83 H THR 22 HN THR 22 -1.764 6.137 7.566
84 HA THR 22 HA THR 22 -3.096 4.610 5.509
85 HB THR 22 HB THR 22 -2.559 3.806 8.377
86 HG1 THR 22 HG1 THR 22 -0.528 3.665 7.816
87 HG21 THR 22 HG21 THR 22 -2.605 1.522 7.468
88 HG22 THR 22 HG22 THR 22 -2.996 2.168 5.874
89 HG23 THR 22 HG23 THR 22 -4.141 2.352 7.204
90 H ILE 23 HN ILE 23 -5.230 4.027 5.460
91 HA ILE 23 HA ILE 23 -7.136 5.744 6.538
92 HB ILE 23 HB ILE 23 -7.552 2.930 5.530
93 HG12 ILE 23 HG12 ILE 23 -7.928 5.543 4.069
94 HG13 ILE 23 HG11 ILE 23 -6.430 4.624 3.999
95 HG21 ILE 23 HG21 ILE 23 -9.450 3.750 6.857
96 HG22 ILE 23 HG22 ILE 23 -9.867 3.599 5.152
97 HG23 ILE 23 HG23 ILE 23 -9.530 5.188 5.840
98 HD11 ILE 23 HD11 ILE 23 -7.604 2.751 3.008
99 HD12 ILE 23 HD12 ILE 23 -7.855 4.218 2.062
100 HD13 ILE 23 HD13 ILE 23 -9.130 3.627 3.127
101 H GLY 24 HN GLY 24 -6.268 2.461 7.658
102 HA2 GLY 24 HA2 GLY 24 -7.323 3.224 10.280
103 HA3 GLY 24 HA1 GLY 24 -8.004 1.803 9.510
104 H GLU 25 HN GLU 25 -7.211 -0.008 10.182
105 HA GLU 25 HA GLU 25 -4.720 -0.102 11.663
106 HB2 GLU 25 HB2 GLU 25 -6.489 -1.262 12.707
107 HB3 GLU 25 HB1 GLU 25 -7.009 -2.000 11.200
108 HG2 GLU 25 HG2 GLU 25 -4.763 -3.237 11.260
109 HG3 GLU 25 HG1 GLU 25 -4.689 -2.729 12.947
110 H VAL 26 HN VAL 26 -2.931 -1.312 11.117
111 HA VAL 26 HA VAL 26 -2.578 -1.864 8.299
112 HB VAL 26 HB VAL 26 -0.662 -2.287 10.609
113 HG11 VAL 26 HG11 VAL 26 -0.158 -3.705 8.669
114 HG12 VAL 26 HG12 VAL 26 1.071 -2.463 8.911
115 HG13 VAL 26 HG13 VAL 26 -0.135 -2.274 7.637
116 HG21 VAL 26 HG21 VAL 26 -1.258 0.064 10.305
117 HG22 VAL 26 HG22 VAL 26 -0.831 -0.045 8.598
118 HG23 VAL 26 HG23 VAL 26 0.415 -0.232 9.832
119 H LYS 27 HN LYS 27 -3.571 -3.654 7.615
120 HA LYS 27 HA LYS 27 -3.632 -6.027 9.303
121 HB2 LYS 27 HB2 LYS 27 -4.962 -5.473 6.646
122 HB3 LYS 27 HB1 LYS 27 -5.203 -6.915 7.627
123 HG2 LYS 27 HG2 LYS 27 -6.189 -5.611 9.391
124 HG3 LYS 27 HG1 LYS 27 -5.841 -4.114 8.523
125 HD2 LYS 27 HD2 LYS 27 -7.342 -4.775 6.732
126 HD3 LYS 27 HD1 LYS 27 -7.638 -6.320 7.530
127 HE2 LYS 27 HE2 LYS 27 -8.303 -3.617 8.691
128 HE3 LYS 27 HE1 LYS 27 -9.453 -4.686 7.890
129 HZ1 LYS 27 HZ1 LYS 27 -8.008 -5.151 10.438
130 HZ2 LYS 27 HZ2 LYS 27 -8.824 -6.383 9.607
131 HZ3 LYS 27 HZ3 LYS 27 -9.684 -5.047 10.188
132 H ARG 28 HN ARG 28 -3.071 -8.101 8.481
133 HA ARG 28 HA ARG 28 -0.675 -7.998 6.827
134 HB2 ARG 28 HB2 ARG 28 -1.281 -9.392 9.114
135 HB3 ARG 28 HB1 ARG 28 -1.531 -10.609 7.870
136 HG2 ARG 28 HG2 ARG 28 0.726 -10.302 7.062
137 HG3 ARG 28 HG1 ARG 28 0.987 -8.993 8.217
138 HD2 ARG 28 HD2 ARG 28 1.996 -10.976 9.091
139 HD3 ARG 28 HD1 ARG 28 0.564 -10.615 10.055
140 HE ARG 28 HE ARG 28 -0.151 -12.388 7.997
141 HH11 ARG 28 HH11 ARG 28 1.701 -12.287 10.986
142 HH12 ARG 28 HH12 ARG 28 1.501 -14.051 11.302
143 HH21 ARG 28 HH21 ARG 28 -0.424 -14.615 8.348
144 HH22 ARG 28 HH22 ARG 28 0.282 -15.353 9.835
145 H ALA 29 HN ALA 29 -0.419 -9.167 4.936
146 HA ALA 29 HA ALA 29 -2.781 -10.520 3.843
147 HB1 ALA 29 HB1 ALA 29 -1.339 -8.180 2.652
148 HB2 ALA 29 HB2 ALA 29 -3.072 -8.462 2.803
149 HB3 ALA 29 HB3 ALA 29 -2.133 -9.363 1.614
150 H SER 30 HN SER 30 -2.278 -12.014 2.140
151 HA SER 30 HA SER 30 0.491 -12.963 2.315
152 HB2 SER 30 HB2 SER 30 -1.925 -14.498 1.354
153 HB3 SER 30 HB1 SER 30 -0.343 -15.148 1.797
154 HG SER 30 HG SER 30 -1.065 -13.837 3.886
155 H SER 31 HN SER 31 -1.127 -11.017 0.353
156 HA SER 31 HA SER 31 0.591 -11.496 -1.864
157 HB2 SER 31 HB2 SER 31 -1.093 -12.034 -3.547
158 HB3 SER 31 HB1 SER 31 -1.136 -13.254 -2.273
159 HG SER 31 HG SER 31 -3.168 -12.768 -2.096
160 H LEU 32 HN LEU 32 0.244 -9.894 -3.596
161 HA LEU 32 HA LEU 32 -0.335 -7.325 -2.549
162 HB2 LEU 32 HB2 LEU 32 1.278 -7.792 -4.396
163 HB3 LEU 32 HB1 LEU 32 -0.083 -8.158 -5.442
164 HG LEU 32 HG LEU 32 -0.734 -5.663 -4.524
165 HD11 LEU 32 HD11 LEU 32 2.222 -5.629 -5.059
166 HD12 LEU 32 HD12 LEU 32 1.510 -5.525 -3.451
167 HD13 LEU 32 HD13 LEU 32 1.192 -4.261 -4.639
168 HD21 LEU 32 HD21 LEU 32 -0.033 -4.889 -6.751
169 HD22 LEU 32 HD22 LEU 32 -0.931 -6.403 -6.816
170 HD23 LEU 32 HD23 LEU 32 0.824 -6.411 -6.993
171 H SER 33 HN SER 33 -2.077 -9.637 -4.521
172 HA SER 33 HA SER 33 -4.245 -8.033 -5.274
173 HB2 SER 33 HB2 SER 33 -4.426 -10.999 -4.757
174 HB3 SER 33 HB1 SER 33 -5.283 -10.041 -5.968
175 HG SER 33 HG SER 33 -3.516 -11.245 -6.844
176 H GLU 34 HN GLU 34 -3.610 -9.916 -2.367
177 HA GLU 34 HA GLU 34 -6.189 -9.733 -1.234
178 HB2 GLU 34 HB2 GLU 34 -4.251 -11.231 -0.507
179 HB3 GLU 34 HB1 GLU 34 -3.596 -9.820 0.310
180 HG2 GLU 34 HG2 GLU 34 -4.828 -11.283 1.827
181 HG3 GLU 34 HG1 GLU 34 -5.547 -9.677 1.715
182 H CYS 35 HN CYS 35 -3.316 -7.696 -1.059
183 HA CYS 35 HA CYS 35 -4.336 -5.801 0.777
184 HB2 CYS 35 HB2 CYS 35 -1.907 -6.127 0.123
185 HB3 CYS 35 HB1 CYS 35 -2.275 -5.290 -1.381
186 H ARG 36 HN ARG 36 -4.286 -5.997 -2.747
187 HA ARG 36 HA ARG 36 -5.434 -3.510 -3.329
188 HB2 ARG 36 HB2 ARG 36 -4.348 -4.991 -4.995
189 HB3 ARG 36 HB1 ARG 36 -5.702 -6.105 -4.866
190 HG2 ARG 36 HG2 ARG 36 -7.027 -3.851 -5.461
191 HG3 ARG 36 HG1 ARG 36 -5.494 -3.526 -6.273
192 HD2 ARG 36 HD2 ARG 36 -6.860 -4.608 -7.871
193 HD3 ARG 36 HD1 ARG 36 -5.704 -5.817 -7.316
194 HE ARG 36 HE ARG 36 -8.413 -5.691 -6.173
195 HH11 ARG 36 HH11 ARG 36 -5.913 -7.424 -7.956
196 HH12 ARG 36 HH12 ARG 36 -6.753 -9.014 -7.800
197 HH21 ARG 36 HH21 ARG 36 -9.507 -7.676 -5.969
198 HH22 ARG 36 HH22 ARG 36 -8.765 -9.152 -6.694
199 H ALA 37 HN ALA 37 -6.908 -6.701 -2.862
200 HA ALA 37 HA ALA 37 -9.573 -5.946 -3.299
201 HB1 ALA 37 HB1 ALA 37 -8.864 -8.276 -3.285
202 HB2 ALA 37 HB2 ALA 37 -10.165 -8.015 -2.123
203 HB3 ALA 37 HB3 ALA 37 -8.500 -8.170 -1.562
204 H ARG 38 HN ARG 38 -7.590 -5.929 -0.378
205 HA ARG 38 HA ARG 38 -9.703 -5.269 1.399
206 HB2 ARG 38 HB2 ARG 38 -7.327 -6.194 1.911
207 HB3 ARG 38 HB1 ARG 38 -6.841 -4.505 1.891
208 HG2 ARG 38 HG2 ARG 38 -7.252 -5.109 4.149
209 HG3 ARG 38 HG1 ARG 38 -8.576 -4.063 3.631
210 HD2 ARG 38 HD2 ARG 38 -9.821 -5.691 4.599
211 HD3 ARG 38 HD1 ARG 38 -9.648 -6.431 3.010
212 HE ARG 38 HE ARG 38 -8.295 -7.229 5.475
213 HH11 ARG 38 HH11 ARG 38 -8.803 -7.704 2.024
214 HH12 ARG 38 HH12 ARG 38 -8.090 -9.364 2.022
215 HH21 ARG 38 HH21 ARG 38 -7.382 -9.322 5.522
216 HH22 ARG 38 HH22 ARG 38 -7.290 -10.265 3.985
217 H CYS 39 HN CYS 39 -7.385 -3.336 -0.443
218 HA CYS 39 HA CYS 39 -8.181 -0.852 0.712
219 HB2 CYS 39 HB2 CYS 39 -6.064 -1.664 -0.826
220 HB3 CYS 39 HB1 CYS 39 -7.006 -0.719 -1.974
221 H GLN 40 HN GLN 40 -9.362 -2.784 -1.931
222 HA GLN 40 HA GLN 40 -10.733 -0.778 -3.360
223 HB2 GLN 40 HB2 GLN 40 -11.039 -3.750 -3.148
224 HB3 GLN 40 HB1 GLN 40 -12.223 -2.804 -4.038
225 HG2 GLN 40 HG2 GLN 40 -10.461 -1.951 -5.488
226 HG3 GLN 40 HG1 GLN 40 -9.264 -2.876 -4.581
227 HE21 GLN 40 HE21 GLN 40 -11.833 -3.001 -6.898
228 HE22 GLN 40 HE22 GLN 40 -11.573 -4.638 -7.399
229 H ALA 41 HN ALA 41 -11.472 -2.462 -0.427
230 HA ALA 41 HA ALA 41 -14.273 -1.956 -0.394
231 HB1 ALA 41 HB1 ALA 41 -12.389 -2.514 1.897
232 HB2 ALA 41 HB2 ALA 41 -13.260 -3.726 0.957
233 HB3 ALA 41 HB3 ALA 41 -14.150 -2.585 1.967
234 H GLU 42 HN GLU 42 -11.462 -0.116 0.363
235 HA GLU 42 HA GLU 42 -12.972 1.917 1.813
236 HB2 GLU 42 HB2 GLU 42 -10.041 1.987 1.085
237 HB3 GLU 42 HB1 GLU 42 -10.860 2.901 2.341
238 HG2 GLU 42 HG2 GLU 42 -10.478 -0.083 2.351
239 HG3 GLU 42 HG1 GLU 42 -9.476 1.074 3.225
240 H LYS 43 HN LYS 43 -14.060 3.326 0.584
241 HA LYS 43 HA LYS 43 -13.428 3.811 -2.149
242 HB2 LYS 43 HB2 LYS 43 -15.240 5.499 -2.030
243 HB3 LYS 43 HB1 LYS 43 -15.717 3.915 -1.438
244 HG2 LYS 43 HG2 LYS 43 -15.518 4.665 0.850
245 HG3 LYS 43 HG1 LYS 43 -14.914 6.233 0.312
246 HD2 LYS 43 HD2 LYS 43 -17.246 6.444 0.876
247 HD3 LYS 43 HD1 LYS 43 -17.068 6.600 -0.871
248 HE2 LYS 43 HE2 LYS 43 -17.751 4.272 -1.149
249 HE3 LYS 43 HE1 LYS 43 -17.916 4.103 0.596
250 HZ1 LYS 43 HZ1 LYS 43 -19.483 5.956 -1.108
251 HZ2 LYS 43 HZ2 LYS 43 -19.660 5.767 0.560
252 HZ3 LYS 43 HZ3 LYS 43 -20.046 4.492 -0.483
253 H GLU 44 HN GLU 44 -11.813 4.855 0.459
254 HA GLU 44 HA GLU 44 -11.202 7.484 -0.704
255 HB2 GLU 44 HB2 GLU 44 -11.930 7.032 1.830
256 HB3 GLU 44 HB1 GLU 44 -10.208 6.724 2.001
257 HG2 GLU 44 HG2 GLU 44 -9.632 8.906 1.492
258 HG3 GLU 44 HG1 GLU 44 -11.160 9.223 0.675
259 H CYS 45 HN CYS 45 -10.176 4.442 -0.905
260 HA CYS 45 HA CYS 45 -7.324 4.953 -0.601
261 HB2 CYS 45 HB2 CYS 45 -7.949 2.828 0.229
262 HB3 CYS 45 HB1 CYS 45 -8.920 2.465 -1.195
263 H SER 46 HN SER 46 -6.145 5.682 -2.212
264 HA SER 46 HA SER 46 -6.932 5.021 -4.971
265 HB2 SER 46 HB2 SER 46 -5.874 7.238 -5.591
266 HB3 SER 46 HB1 SER 46 -7.372 7.363 -4.669
267 HG SER 46 HG SER 46 -6.016 8.720 -3.646
268 H HIS 47 HN HIS 47 -4.867 4.256 -2.688
269 HA HIS 47 HA HIS 47 -2.849 3.294 -4.415
270 HB2 HIS 47 HB2 HIS 47 -0.945 4.594 -3.349
271 HB3 HIS 47 HB1 HIS 47 -1.946 5.498 -4.476
272 HD1 HIS 47 HD1 HIS 47 -3.597 7.276 -3.418
273 HD2 HIS 47 HD2 HIS 47 -0.900 5.567 -0.751
274 HE1 HIS 47 HE1 HIS 47 -3.624 8.754 -1.392
275 HE2 HIS 47 HE2 HIS 47 -2.143 7.598 0.275
276 H TYR 48 HN TYR 48 -2.231 1.451 -3.517
277 HA TYR 48 HA TYR 48 -2.371 1.244 -0.584
278 HB2 TYR 48 HB2 TYR 48 -2.813 -1.173 -0.893
279 HB3 TYR 48 HB1 TYR 48 -4.063 -0.164 -1.605
280 HD1 TYR 48 HD2 TYR 48 -4.270 0.003 -4.054
281 HD2 TYR 48 HD1 TYR 48 -1.422 -2.585 -2.249
282 HE1 TYR 48 HE2 TYR 48 -4.006 -1.185 -6.188
283 HE2 TYR 48 HE1 TYR 48 -1.153 -3.778 -4.379
284 HH TYR 48 HH TYR 48 -2.295 -2.569 -7.318
285 H THR 49 HN THR 49 -0.583 0.694 0.484
286 HA THR 49 HA THR 49 1.779 -0.023 -1.113
287 HB THR 49 HB THR 49 1.643 1.055 1.716
288 HG1 THR 49 HG1 THR 49 2.466 2.332 -0.709
289 HG21 THR 49 HG21 THR 49 4.065 1.363 1.493
290 HG22 THR 49 HG22 THR 49 4.017 0.605 -0.100
291 HG23 THR 49 HG23 THR 49 3.623 -0.338 1.338
292 H TYR 50 HN TYR 50 2.304 -2.107 -1.125
293 HA TYR 50 HA TYR 50 1.581 -3.731 1.222
294 HB2 TYR 50 HB2 TYR 50 0.398 -4.443 -0.783
295 HB3 TYR 50 HB1 TYR 50 1.913 -4.546 -1.672
296 HD1 TYR 50 HD1 TYR 50 0.428 -5.905 1.486
297 HD2 TYR 50 HD2 TYR 50 2.788 -6.658 -1.975
298 HE1 TYR 50 HE1 TYR 50 0.655 -8.259 2.156
299 HE2 TYR 50 HE2 TYR 50 3.016 -9.012 -1.310
300 HH TYR 50 HH TYR 50 2.910 -10.325 0.865
301 H ASN 51 HN ASN 51 3.212 -4.395 2.420
302 HA ASN 51 HA ASN 51 5.927 -4.278 1.350
303 HB2 ASN 51 HB2 ASN 51 5.468 -3.237 3.544
304 HB3 ASN 51 HB1 ASN 51 4.960 -4.800 4.177
305 HD21 ASN 51 HD21 ASN 51 7.638 -2.834 3.170
306 HD22 ASN 51 HD22 ASN 51 8.882 -3.858 3.817
307 H VAL 52 HN VAL 52 6.582 -6.038 0.311
308 HA VAL 52 HA VAL 52 5.384 -8.601 0.696
309 HB VAL 52 HB VAL 52 7.061 -9.421 -0.924
310 HG11 VAL 52 HG11 VAL 52 4.998 -8.528 -1.769
311 HG12 VAL 52 HG12 VAL 52 6.311 -8.002 -2.821
312 HG13 VAL 52 HG13 VAL 52 5.615 -6.881 -1.653
313 HG21 VAL 52 HG21 VAL 52 8.929 -7.980 -0.251
314 HG22 VAL 52 HG22 VAL 52 8.072 -6.579 -0.896
315 HG23 VAL 52 HG23 VAL 52 8.604 -7.862 -1.982
316 H LYS 53 HN LYS 53 7.896 -7.036 2.356
317 HA LYS 53 HA LYS 53 9.464 -9.369 2.917
318 HB2 LYS 53 HB2 LYS 53 9.498 -6.525 3.716
319 HB3 LYS 53 HB1 LYS 53 10.138 -7.647 4.909
320 HG2 LYS 53 HG2 LYS 53 11.056 -7.577 2.044
321 HG3 LYS 53 HG1 LYS 53 11.827 -6.664 3.344
322 HD2 LYS 53 HD2 LYS 53 12.396 -8.682 4.510
323 HD3 LYS 53 HD1 LYS 53 11.436 -9.654 3.394
324 HE2 LYS 53 HE2 LYS 53 12.968 -8.855 1.559
325 HE3 LYS 53 HE1 LYS 53 13.998 -8.183 2.823
326 HZ1 LYS 53 HZ1 LYS 53 14.736 -10.384 2.134
327 HZ2 LYS 53 HZ2 LYS 53 13.239 -11.045 2.563
328 HZ3 LYS 53 HZ3 LYS 53 14.248 -10.396 3.753
329 H SER 54 HN SER 54 7.280 -7.376 4.906
330 HA SER 54 HA SER 54 7.151 -9.524 6.881
331 HB2 SER 54 HB2 SER 54 5.722 -6.881 7.063
332 HB3 SER 54 HB1 SER 54 6.263 -7.933 8.372
333 HG SER 54 HG SER 54 8.282 -7.083 6.718
334 H GLY 55 HN GLY 55 5.311 -8.263 4.265
335 HA2 GLY 55 HA2 GLY 55 3.406 -9.202 3.311
336 HA3 GLY 55 HA1 GLY 55 3.248 -10.248 4.718
337 H LEU 56 HN LEU 56 3.600 -6.768 4.852
338 HA LEU 56 HA LEU 56 0.986 -6.633 6.163
339 HB2 LEU 56 HB2 LEU 56 3.389 -4.822 6.242
340 HB3 LEU 56 HB1 LEU 56 1.837 -4.356 6.907
341 HG LEU 56 HG LEU 56 3.347 -6.807 7.799
342 HD11 LEU 56 HD11 LEU 56 3.363 -4.011 8.915
343 HD12 LEU 56 HD12 LEU 56 4.737 -4.937 8.306
344 HD13 LEU 56 HD13 LEU 56 3.930 -5.431 9.794
345 HD21 LEU 56 HD21 LEU 56 0.916 -6.785 8.220
346 HD22 LEU 56 HD22 LEU 56 1.105 -5.270 9.100
347 HD23 LEU 56 HD23 LEU 56 1.865 -6.741 9.705
348 H CYS 57 HN CYS 57 -0.621 -5.382 5.462
349 HA CYS 57 HA CYS 57 -0.245 -4.021 2.878
350 HB2 CYS 57 HB2 CYS 57 -1.856 -5.816 2.729
351 HB3 CYS 57 HB1 CYS 57 -2.704 -5.236 4.158
352 H TYR 58 HN TYR 58 -0.499 -1.868 2.802
353 HA TYR 58 HA TYR 58 -1.664 -0.569 5.179
354 HB2 TYR 58 HB2 TYR 58 0.418 0.605 3.336
355 HB3 TYR 58 HB1 TYR 58 -0.191 1.310 4.825
356 HD1 TYR 58 HD2 TYR 58 1.945 -1.321 3.402
357 HD2 TYR 58 HD1 TYR 58 0.654 0.630 6.957
358 HE1 TYR 58 HE2 TYR 58 3.791 -2.366 4.635
359 HE2 TYR 58 HE1 TYR 58 2.512 -0.400 8.198
360 HH TYR 58 HH TYR 58 5.110 -1.965 6.643
361 HA PRO 59 HA PRO 59 -4.428 0.737 1.760
362 HB2 PRO 59 HB2 PRO 59 -6.391 1.052 3.912
363 HB3 PRO 59 HB1 PRO 59 -6.469 0.010 2.486
364 HG2 PRO 59 HG2 PRO 59 -6.187 -0.986 4.976
365 HG3 PRO 59 HG1 PRO 59 -5.496 -1.768 3.540
366 HD2 PRO 59 HD2 PRO 59 -4.143 -0.061 5.590
367 HD3 PRO 59 HD1 PRO 59 -3.566 -1.542 4.795
368 H LYS 60 HN LYS 60 -3.563 2.753 1.378
369 HA LYS 60 HA LYS 60 -3.884 4.756 3.497
370 HB2 LYS 60 HB2 LYS 60 -1.963 4.596 1.187
371 HB3 LYS 60 HB1 LYS 60 -2.150 6.038 2.182
372 HG2 LYS 60 HG2 LYS 60 -1.370 4.946 4.110
373 HG3 LYS 60 HG1 LYS 60 -1.541 3.354 3.372
374 HD2 LYS 60 HD2 LYS 60 0.246 3.970 1.761
375 HD3 LYS 60 HD1 LYS 60 0.463 5.482 2.643
376 HE2 LYS 60 HE2 LYS 60 0.852 2.695 3.714
377 HE3 LYS 60 HE1 LYS 60 2.110 3.881 3.378
378 HZ1 LYS 60 HZ1 LYS 60 0.866 5.321 5.060
379 HZ2 LYS 60 HZ2 LYS 60 1.792 4.035 5.658
380 HZ3 LYS 60 HZ3 LYS 60 0.105 3.889 5.550
381 H ARG 61 HN ARG 61 -4.543 6.849 3.017
382 HA ARG 61 HA ARG 61 -6.273 7.040 0.639
383 HB2 ARG 61 HB2 ARG 61 -7.735 8.480 2.059
384 HB3 ARG 61 HB1 ARG 61 -7.636 6.812 2.610
385 HG2 ARG 61 HG2 ARG 61 -5.974 7.505 4.299
386 HG3 ARG 61 HG1 ARG 61 -6.175 9.179 3.774
387 HD2 ARG 61 HD2 ARG 61 -8.630 8.907 4.286
388 HD3 ARG 61 HD1 ARG 61 -8.214 7.378 5.061
389 HE ARG 61 HE ARG 61 -6.658 8.835 6.474
390 HH11 ARG 61 HH11 ARG 61 -9.720 9.932 5.113
391 HH12 ARG 61 HH12 ARG 61 -9.984 11.158 6.419
392 HH21 ARG 61 HH21 ARG 61 -6.959 10.348 8.150
393 HH22 ARG 61 HH22 ARG 61 -8.444 11.373 8.134
394 H GLY 62 HN GLY 62 -7.023 9.554 0.624
395 HA2 GLY 62 HA2 GLY 62 -6.440 11.696 0.082
396 HA3 GLY 62 HA1 GLY 62 -5.170 11.556 1.287
397 H LYS 63 HN LYS 63 -3.496 12.473 0.262
398 HA LYS 63 HA LYS 63 -2.854 11.620 -2.450
399 HB2 LYS 63 HB2 LYS 63 -1.390 13.471 -2.584
400 HB3 LYS 63 HB1 LYS 63 -2.805 14.064 -1.728
401 HG2 LYS 63 HG2 LYS 63 -1.668 14.021 0.359
402 HG3 LYS 63 HG1 LYS 63 -0.307 13.134 -0.333
403 HD2 LYS 63 HD2 LYS 63 -1.116 15.874 -1.285
404 HD3 LYS 63 HD1 LYS 63 0.028 15.627 0.034
405 HE2 LYS 63 HE2 LYS 63 0.365 14.420 -2.705
406 HE3 LYS 63 HE1 LYS 63 1.043 15.979 -2.244
407 HZ1 LYS 63 HZ1 LYS 63 2.154 14.724 -0.366
408 HZ2 LYS 63 HZ2 LYS 63 2.745 14.428 -1.922
409 HZ3 LYS 63 HZ3 LYS 63 1.726 13.300 -1.179
410 HA PRO 64 HA PRO 64 0.253 8.887 -0.946
411 HB2 PRO 64 HB2 PRO 64 1.800 8.584 -3.112
412 HB3 PRO 64 HB1 PRO 64 0.131 7.994 -3.076
413 HG2 PRO 64 HG2 PRO 64 1.224 10.452 -4.356
414 HG3 PRO 64 HG1 PRO 64 -0.026 9.338 -4.940
415 HD2 PRO 64 HD2 PRO 64 -0.537 11.758 -3.719
416 HD3 PRO 64 HD1 PRO 64 -1.683 10.408 -3.814
417 H GLN 65 HN GLN 65 2.634 8.582 -0.843
418 HA GLN 65 HA GLN 65 4.275 10.974 -0.960
419 HB2 GLN 65 HB2 GLN 65 3.387 9.669 1.566
420 HB3 GLN 65 HB1 GLN 65 5.087 10.108 1.461
421 HG2 GLN 65 HG2 GLN 65 4.448 12.421 0.970
422 HG3 GLN 65 HG1 GLN 65 2.747 11.974 1.108
423 HE21 GLN 65 HE21 GLN 65 1.866 11.659 3.120
424 HE22 GLN 65 HE22 GLN 65 2.691 12.040 4.588
425 H PHE 66 HN PHE 66 4.760 9.425 -2.718
426 HA PHE 66 HA PHE 66 5.850 6.898 -2.377
427 HB2 PHE 66 HB2 PHE 66 6.355 8.963 -4.517
428 HB3 PHE 66 HB1 PHE 66 6.878 7.287 -4.622
429 HD1 PHE 66 HD1 PHE 66 4.812 5.609 -3.964
430 HD2 PHE 66 HD2 PHE 66 4.500 9.462 -5.740
431 HE1 PHE 66 HE1 PHE 66 2.637 4.987 -4.926
432 HE2 PHE 66 HE2 PHE 66 2.323 8.848 -6.703
433 HZ PHE 66 HZ PHE 66 1.387 6.606 -6.300
434 H TYR 67 HN TYR 67 7.601 6.196 -1.483
435 HA TYR 67 HA TYR 67 10.075 7.739 -1.674
436 HB2 TYR 67 HB2 TYR 67 10.596 7.629 0.601
437 HB3 TYR 67 HB1 TYR 67 8.895 8.059 0.600
438 HD1 TYR 67 HD2 TYR 67 7.188 6.312 1.177
439 HD2 TYR 67 HD1 TYR 67 11.365 5.631 1.602
440 HE1 TYR 67 HE2 TYR 67 6.720 4.423 2.683
441 HE2 TYR 67 HE1 TYR 67 10.912 3.748 3.112
442 HH TYR 67 HH TYR 67 8.202 2.150 3.325
443 H LYS 68 HN LYS 68 11.976 6.382 -1.518
444 HA LYS 68 HA LYS 68 11.470 3.799 -2.701
445 HB2 LYS 68 HB2 LYS 68 13.246 5.431 -3.462
446 HB3 LYS 68 HB1 LYS 68 14.147 5.000 -2.017
447 HG2 LYS 68 HG2 LYS 68 14.332 2.720 -2.744
448 HG3 LYS 68 HG1 LYS 68 13.286 3.038 -4.130
449 HD2 LYS 68 HD2 LYS 68 15.934 4.399 -3.659
450 HD3 LYS 68 HD1 LYS 68 15.721 2.973 -4.677
451 HE2 LYS 68 HE2 LYS 68 14.188 4.206 -6.108
452 HE3 LYS 68 HE1 LYS 68 14.347 5.625 -5.078
453 HZ1 LYS 68 HZ1 LYS 68 16.573 4.360 -6.573
454 HZ2 LYS 68 HZ2 LYS 68 16.659 5.783 -5.662
455 HZ3 LYS 68 HZ3 LYS 68 15.729 5.736 -7.075
456 H TYR 69 HN TYR 69 11.662 1.852 -1.813
457 HA TYR 69 HA TYR 69 13.306 1.299 0.451
458 HB2 TYR 69 HB2 TYR 69 11.350 2.351 1.581
459 HB3 TYR 69 HB1 TYR 69 10.312 1.113 0.880
460 HD1 TYR 69 HD1 TYR 69 13.356 1.479 3.003
461 HD2 TYR 69 HD2 TYR 69 9.911 -0.835 2.081
462 HE1 TYR 69 HE1 TYR 69 13.848 0.003 4.903
463 HE2 TYR 69 HE2 TYR 69 10.388 -2.322 3.979
464 HH TYR 69 HH TYR 69 12.961 -1.598 6.269
465 H LEU 70 HN LEU 70 13.845 -0.816 0.457
466 HA LEU 70 HA LEU 70 12.841 -2.458 -1.674
467 HB2 LEU 70 HB2 LEU 70 15.232 -2.438 -0.972
468 HB3 LEU 70 HB1 LEU 70 14.755 -3.188 0.540
469 HG LEU 70 HG LEU 70 13.807 -5.089 -0.865
470 HD11 LEU 70 HD11 LEU 70 14.790 -5.359 -3.093
471 HD12 LEU 70 HD12 LEU 70 15.502 -3.750 -2.970
472 HD13 LEU 70 HD13 LEU 70 13.750 -3.940 -3.005
473 HD21 LEU 70 HD21 LEU 70 16.034 -6.119 -1.149
474 HD22 LEU 70 HD22 LEU 70 15.824 -5.348 0.422
475 HD23 LEU 70 HD23 LEU 70 16.772 -4.549 -0.833
476 H GLY 71 HN GLY 71 10.916 -3.383 -1.456
477 HA2 GLY 71 HA2 GLY 71 9.945 -5.426 -0.378
478 HA3 GLY 71 HA1 GLY 71 10.254 -4.606 1.147
479 H ASP 72 HN ASP 72 9.532 -2.009 -0.075
480 HA ASP 72 HA ASP 72 6.677 -2.197 0.405
481 HB2 ASP 72 HB2 ASP 72 8.622 0.077 0.138
482 HB3 ASP 72 HB1 ASP 72 6.894 0.374 0.011
483 H MET 73 HN MET 73 5.323 -2.582 -1.203
484 HA MET 73 HA MET 73 5.992 -1.506 -3.864
485 HB2 MET 73 HB2 MET 73 4.739 -4.148 -3.120
486 HB3 MET 73 HB1 MET 73 4.626 -3.475 -4.739
487 HG2 MET 73 HG2 MET 73 6.996 -3.552 -5.016
488 HG3 MET 73 HG1 MET 73 7.227 -4.002 -3.329
489 HE1 MET 73 HE1 MET 73 5.092 -5.204 -6.460
490 HE2 MET 73 HE2 MET 73 4.153 -5.567 -5.013
491 HE3 MET 73 HE3 MET 73 4.815 -6.880 -5.985
492 H THR 74 HN THR 74 4.764 0.275 -3.956
493 HA THR 74 HA THR 74 2.007 0.187 -3.033
494 HB THR 74 HB THR 74 3.488 2.530 -4.229
495 HG1 THR 74 HG1 THR 74 4.586 1.890 -2.382
496 HG21 THR 74 HG21 THR 74 1.067 2.800 -4.201
497 HG22 THR 74 HG22 THR 74 1.808 3.852 -2.995
498 HG23 THR 74 HG23 THR 74 1.017 2.357 -2.494
499 H GLY 75 HN GLY 75 0.280 0.134 -4.303
500 HA2 GLY 75 HA2 GLY 75 0.699 0.326 -7.223
501 HA3 GLY 75 HA1 GLY 75 -0.356 -0.882 -6.495
502 H SER 76 HN SER 76 -1.285 0.914 -8.423
503 HA SER 76 HA SER 76 -2.522 3.181 -7.249
504 HB2 SER 76 HB2 SER 76 -3.958 2.996 -9.416
505 HB3 SER 76 HB1 SER 76 -2.234 3.343 -9.566
506 HG SER 76 HG SER 76 -3.003 1.662 -10.981
507 H ARG 77 HN ARG 77 -4.314 0.566 -8.812
508 HA ARG 77 HA ARG 77 -5.743 -0.297 -6.546
509 HB2 ARG 77 HB2 ARG 77 -6.609 2.143 -7.010
510 HB3 ARG 77 HB1 ARG 77 -7.512 1.367 -8.302
511 HG2 ARG 77 HG2 ARG 77 -8.778 0.088 -6.812
512 HG3 ARG 77 HG1 ARG 77 -7.648 0.359 -5.483
513 HD2 ARG 77 HD2 ARG 77 -9.717 1.665 -5.228
514 HD3 ARG 77 HD1 ARG 77 -8.292 2.693 -5.375
515 HE ARG 77 HE ARG 77 -9.713 2.173 -7.841
516 HH11 ARG 77 HH11 ARG 77 -9.314 4.313 -5.065
517 HH12 ARG 77 HH12 ARG 77 -10.027 5.731 -5.931
518 HH21 ARG 77 HH21 ARG 77 -10.598 3.942 -8.960
519 HH22 ARG 77 HH22 ARG 77 -10.733 5.528 -8.108
520 H THR 78 HN THR 78 -5.770 0.274 -10.020
521 HA THR 78 HA THR 78 -6.273 -2.527 -10.499
522 HB THR 78 HB THR 78 -8.565 -1.619 -10.289
523 HG1 THR 78 HG1 THR 78 -8.241 -2.106 -13.047
524 HG21 THR 78 HG21 THR 78 -7.775 0.145 -12.606
525 HG22 THR 78 HG22 THR 78 -8.203 0.668 -10.977
526 HG23 THR 78 HG23 THR 78 -9.419 -0.078 -12.011
527 H CYS 79 HN CYS 79 -5.867 -3.117 -12.724
528 HA CYS 79 HA CYS 79 -4.319 -1.069 -14.173
529 HB2 CYS 79 HB2 CYS 79 -3.800 -4.044 -13.984
530 HB3 CYS 79 HB1 CYS 79 -2.913 -2.936 -15.028
531 H1 GAL 83 H1 GTP 1 6.139 2.157 8.379
532 H2 GAL 83 H2 GTP 1 5.509 4.551 6.574
533 H3 GAL 83 H3 GTP 1 3.745 2.430 7.866
534 H4 GAL 83 H4 GTP 1 3.338 1.790 5.527
535 H5 GAL 83 H5 GTP 1 5.127 0.713 6.811
536 H61 GAL 83 H61 GTP 1 6.369 1.166 4.103
537 H62 GAL 83 H62 GTP 1 4.793 0.385 4.224
538 HO2 GAL 83 HO2 GTP 1 4.913 3.963 9.328
539 HO3 GAL 83 HO3 GTP 1 3.031 4.734 7.579
540 HO4 GAL 83 HO4 GTP 1 5.514 3.275 4.631
541 HO6 GAL 83 HO6 GTP 1 6.841 -0.921 4.273
542 H1 NAG 84 H1 GCP 2 10.167 3.135 4.789
543 H2 NAG 84 H2 GCP 2 10.226 3.152 7.853
544 H3 NAG 84 H3 GCP 2 8.029 3.657 5.816
545 H4 NAG 84 H4 GCP 2 9.492 5.433 7.848
546 H5 NAG 84 H5 GCP 2 9.436 5.383 4.792
547 H61 NAG 84 H61 GCP 2 10.682 7.277 6.789
548 H62 NAG 84 H62 GCP 2 9.703 7.617 5.358
549 H81 NAG 84 HC23 GCP 2 9.820 -1.367 7.416
550 H82 NAG 84 HC21 GCP 2 8.430 -1.001 8.437
551 H83 NAG 84 HC22 GCP 2 8.350 -0.704 6.702
552 HN2 NAG 84 HN2 GCP 2 8.919 1.247 5.954
553 HO1 NAG 84 HO1 GCP 2 11.698 1.694 5.359
554 HO4 NAG 84 HO4 GCP 2 7.436 6.201 7.637
555 HO6 NAG 84 HO6 GCP 2 11.986 6.209 4.771
Start of MODEL 3
1 H CYS 10 HT1 CYS 10 -0.611 0.721 -15.599
2 HA CYS 10 HA CYS 10 -1.662 2.693 -13.667
3 HB2 CYS 10 HB2 CYS 10 -2.404 0.714 -12.426
4 HB3 CYS 10 HB1 CYS 10 -3.117 0.745 -14.031
5 H VAL 11 HN VAL 11 -0.561 2.871 -11.717
6 HA VAL 11 HA VAL 11 2.220 2.155 -11.803
7 HB VAL 11 HB VAL 11 0.586 3.528 -9.661
8 HG11 VAL 11 HG11 VAL 11 2.496 2.308 -8.684
9 HG12 VAL 11 HG12 VAL 11 2.676 4.057 -8.547
10 HG13 VAL 11 HG13 VAL 11 3.581 3.171 -9.773
11 HG21 VAL 11 HG21 VAL 11 2.678 4.634 -11.531
12 HG22 VAL 11 HG22 VAL 11 1.690 5.540 -10.384
13 HG23 VAL 11 HG23 VAL 11 0.937 4.770 -11.780
14 H HIS 12 HN HIS 12 3.106 0.371 -11.009
15 HA HIS 12 HA HIS 12 1.943 -0.979 -8.733
16 HB2 HIS 12 HB2 HIS 12 1.779 -3.167 -9.814
17 HB3 HIS 12 HB1 HIS 12 0.722 -2.011 -10.610
18 HD1 HIS 12 HD1 HIS 12 3.258 -4.496 -11.319
19 HD2 HIS 12 HD2 HIS 12 1.927 -0.991 -13.117
20 HE1 HIS 12 HE1 HIS 12 4.107 -4.580 -13.683
21 HE2 HIS 12 HE2 HIS 12 3.370 -2.408 -14.721
22 H THR 13 HN THR 13 3.406 -2.238 -7.628
23 HA THR 13 HA THR 13 5.425 -2.908 -6.856
24 HB THR 13 HB THR 13 6.452 -2.945 -9.692
25 HG1 THR 13 HG1 THR 13 5.538 -5.160 -9.667
26 HG21 THR 13 HG21 THR 13 7.721 -4.882 -8.904
27 HG22 THR 13 HG22 THR 13 6.961 -4.753 -7.317
28 HG23 THR 13 HG23 THR 13 8.044 -3.480 -7.884
29 H GLY 14 HN GLY 14 7.565 -1.798 -9.208
30 HA2 GLY 14 HA2 GLY 14 8.857 0.082 -9.449
31 HA3 GLY 14 HA1 GLY 14 7.663 0.966 -8.519
32 H ASN 15 HN ASN 15 8.491 -1.611 -6.667
33 HA ASN 15 HA ASN 15 9.482 -1.699 -4.622
34 HB2 ASN 15 HB2 ASN 15 11.998 -1.508 -4.717
35 HB3 ASN 15 HB1 ASN 15 11.275 -2.641 -5.846
36 HD21 ASN 15 HD21 ASN 15 12.792 0.497 -5.519
37 HD22 ASN 15 HD22 ASN 15 13.275 0.642 -7.173
38 H ILE 16 HN ILE 16 8.137 0.576 -4.725
39 HA ILE 16 HA ILE 16 9.791 2.419 -3.164
40 HB ILE 16 HB ILE 16 8.029 3.183 -5.501
41 HG12 ILE 16 HG12 ILE 16 10.402 2.680 -5.993
42 HG13 ILE 16 HG11 ILE 16 9.990 4.360 -6.311
43 HG21 ILE 16 HG21 ILE 16 7.474 4.595 -3.576
44 HG22 ILE 16 HG22 ILE 16 8.259 5.504 -4.867
45 HG23 ILE 16 HG23 ILE 16 9.172 5.045 -3.429
46 HD11 ILE 16 HD11 ILE 16 12.139 4.274 -5.279
47 HD12 ILE 16 HD12 ILE 16 11.522 3.280 -3.959
48 HD13 ILE 16 HD13 ILE 16 10.999 4.957 -4.119
49 H GLY 17 HN GLY 17 8.755 3.106 -1.358
50 HA2 GLY 17 HA2 GLY 17 6.023 2.115 -0.951
51 HA3 GLY 17 HA1 GLY 17 7.146 2.601 0.313
52 H SER 18 HN SER 18 4.588 3.496 0.411
53 HA SER 18 HA SER 18 4.894 6.330 -0.314
54 HB2 SER 18 HB2 SER 18 2.310 4.747 -0.205
55 HB3 SER 18 HB1 SER 18 2.459 6.459 -0.605
56 HG SER 18 HG SER 18 3.597 4.296 -2.064
57 H LYS 19 HN LYS 19 5.288 7.431 1.499
58 HA LYS 19 HA LYS 19 4.402 6.472 4.078
59 HB2 LYS 19 HB2 LYS 19 6.626 7.586 3.660
60 HB3 LYS 19 HB1 LYS 19 5.755 9.094 3.420
61 HG2 LYS 19 HG2 LYS 19 4.776 8.603 5.776
62 HG3 LYS 19 HG1 LYS 19 6.158 7.518 5.924
63 HD2 LYS 19 HD2 LYS 19 6.744 9.654 6.860
64 HD3 LYS 19 HD1 LYS 19 7.653 9.421 5.367
65 HE2 LYS 19 HE2 LYS 19 6.727 11.709 5.622
66 HE3 LYS 19 HE1 LYS 19 6.168 10.888 4.168
67 HZ1 LYS 19 HZ1 LYS 19 4.652 11.284 6.694
68 HZ2 LYS 19 HZ2 LYS 19 4.117 10.311 5.415
69 HZ3 LYS 19 HZ3 LYS 19 4.322 11.973 5.182
70 H ALA 20 HN ALA 20 2.154 6.809 2.723
71 HA ALA 20 HA ALA 20 1.065 9.463 3.304
72 HB1 ALA 20 HB1 ALA 20 -0.942 8.599 2.065
73 HB2 ALA 20 HB2 ALA 20 -0.019 7.134 1.725
74 HB3 ALA 20 HB3 ALA 20 0.539 8.693 1.115
75 H GLN 21 HN GLN 21 -1.326 9.345 4.098
76 HA GLN 21 HA GLN 21 -1.243 8.098 6.675
77 HB2 GLN 21 HB2 GLN 21 -2.251 10.323 6.339
78 HB3 GLN 21 HB1 GLN 21 -3.488 9.606 5.317
79 HG2 GLN 21 HG2 GLN 21 -3.953 8.133 7.429
80 HG3 GLN 21 HG1 GLN 21 -3.144 9.451 8.271
81 HE21 GLN 21 HE21 GLN 21 -5.905 8.580 8.453
82 HE22 GLN 21 HE22 GLN 21 -6.876 9.948 8.022
83 H THR 22 HN THR 22 -2.068 6.197 7.263
84 HA THR 22 HA THR 22 -3.369 4.520 5.322
85 HB THR 22 HB THR 22 -2.931 3.923 8.254
86 HG1 THR 22 HG1 THR 22 -0.884 3.338 7.757
87 HG21 THR 22 HG21 THR 22 -2.876 1.599 7.499
88 HG22 THR 22 HG22 THR 22 -3.134 2.124 5.836
89 HG23 THR 22 HG23 THR 22 -4.397 2.365 7.042
90 H ILE 23 HN ILE 23 -5.506 3.895 5.314
91 HA ILE 23 HA ILE 23 -7.395 5.706 6.403
92 HB ILE 23 HB ILE 23 -7.896 2.967 5.230
93 HG12 ILE 23 HG12 ILE 23 -8.039 5.643 3.842
94 HG13 ILE 23 HG11 ILE 23 -6.614 4.612 3.793
95 HG21 ILE 23 HG21 ILE 23 -9.829 3.754 6.446
96 HG22 ILE 23 HG22 ILE 23 -10.142 3.888 4.716
97 HG23 ILE 23 HG23 ILE 23 -9.733 5.327 5.651
98 HD11 ILE 23 HD11 ILE 23 -7.890 2.868 2.703
99 HD12 ILE 23 HD12 ILE 23 -8.000 4.380 1.799
100 HD13 ILE 23 HD13 ILE 23 -9.349 3.852 2.804
101 H GLY 24 HN GLY 24 -6.510 2.369 7.293
102 HA2 GLY 24 HA2 GLY 24 -7.714 2.893 9.912
103 HA3 GLY 24 HA1 GLY 24 -8.243 1.477 9.020
104 H GLU 25 HN GLU 25 -7.546 0.049 10.537
105 HA GLU 25 HA GLU 25 -4.929 0.022 11.631
106 HB2 GLU 25 HB2 GLU 25 -6.559 -1.044 12.926
107 HB3 GLU 25 HB1 GLU 25 -7.229 -1.903 11.547
108 HG2 GLU 25 HG2 GLU 25 -4.616 -2.825 11.745
109 HG3 GLU 25 HG1 GLU 25 -5.186 -2.712 13.409
110 H VAL 26 HN VAL 26 -3.120 -1.072 11.031
111 HA VAL 26 HA VAL 26 -2.851 -1.905 8.315
112 HB VAL 26 HB VAL 26 -0.917 -2.311 10.607
113 HG11 VAL 26 HG11 VAL 26 -0.455 -3.717 8.650
114 HG12 VAL 26 HG12 VAL 26 0.788 -2.487 8.880
115 HG13 VAL 26 HG13 VAL 26 -0.437 -2.279 7.630
116 HG21 VAL 26 HG21 VAL 26 -1.438 0.035 10.397
117 HG22 VAL 26 HG22 VAL 26 -1.163 -0.028 8.656
118 HG23 VAL 26 HG23 VAL 26 0.185 -0.264 9.770
119 H LYS 27 HN LYS 27 -3.257 -3.878 7.498
120 HA LYS 27 HA LYS 27 -3.477 -6.124 9.392
121 HB2 LYS 27 HB2 LYS 27 -4.950 -6.059 6.785
122 HB3 LYS 27 HB1 LYS 27 -5.334 -6.952 8.252
123 HG2 LYS 27 HG2 LYS 27 -6.007 -4.904 9.355
124 HG3 LYS 27 HG1 LYS 27 -5.555 -3.964 7.933
125 HD2 LYS 27 HD2 LYS 27 -7.222 -5.482 6.682
126 HD3 LYS 27 HD1 LYS 27 -7.834 -5.873 8.291
127 HE2 LYS 27 HE2 LYS 27 -7.868 -3.265 6.831
128 HE3 LYS 27 HE1 LYS 27 -9.180 -4.094 7.664
129 HZ1 LYS 27 HZ1 LYS 27 -6.982 -2.493 8.816
130 HZ2 LYS 27 HZ2 LYS 27 -7.805 -3.631 9.764
131 HZ3 LYS 27 HZ3 LYS 27 -8.652 -2.341 9.065
132 H ARG 28 HN ARG 28 -2.674 -8.108 8.793
133 HA ARG 28 HA ARG 28 -0.571 -8.036 6.805
134 HB2 ARG 28 HB2 ARG 28 -0.216 -9.075 9.036
135 HB3 ARG 28 HB1 ARG 28 -1.429 -10.284 8.643
136 HG2 ARG 28 HG2 ARG 28 -0.064 -11.229 6.947
137 HG3 ARG 28 HG1 ARG 28 1.074 -9.882 7.024
138 HD2 ARG 28 HD2 ARG 28 1.832 -11.987 8.167
139 HD3 ARG 28 HD1 ARG 28 1.842 -10.541 9.174
140 HE ARG 28 HE ARG 28 -0.563 -12.142 9.350
141 HH11 ARG 28 HH11 ARG 28 2.646 -11.493 10.638
142 HH12 ARG 28 HH12 ARG 28 2.272 -12.213 12.246
143 HH21 ARG 28 HH21 ARG 28 -1.088 -13.049 11.385
144 HH22 ARG 28 HH22 ARG 28 0.171 -13.064 12.677
145 H ALA 29 HN ALA 29 -0.644 -8.951 4.844
146 HA ALA 29 HA ALA 29 -3.100 -10.422 4.134
147 HB1 ALA 29 HB1 ALA 29 -2.915 -8.232 3.045
148 HB2 ALA 29 HB2 ALA 29 -2.847 -9.554 1.879
149 HB3 ALA 29 HB3 ALA 29 -1.368 -8.718 2.347
150 H SER 30 HN SER 30 -2.492 -11.549 1.808
151 HA SER 30 HA SER 30 -0.198 -13.276 2.435
152 HB2 SER 30 HB2 SER 30 -2.645 -13.922 0.775
153 HB3 SER 30 HB1 SER 30 -1.349 -15.041 1.196
154 HG SER 30 HG SER 30 -2.159 -15.264 3.135
155 H SER 31 HN SER 31 -1.522 -11.114 0.090
156 HA SER 31 HA SER 31 0.865 -11.318 -1.498
157 HB2 SER 31 HB2 SER 31 -0.296 -11.850 -3.604
158 HB3 SER 31 HB1 SER 31 -0.480 -13.158 -2.436
159 HG SER 31 HG SER 31 -2.527 -12.906 -2.914
160 H LEU 32 HN LEU 32 0.469 -9.868 -3.586
161 HA LEU 32 HA LEU 32 -0.132 -7.261 -2.645
162 HB2 LEU 32 HB2 LEU 32 1.522 -7.734 -4.425
163 HB3 LEU 32 HB1 LEU 32 0.220 -8.237 -5.483
164 HG LEU 32 HG LEU 32 -0.707 -5.875 -5.218
165 HD11 LEU 32 HD11 LEU 32 2.068 -5.445 -4.130
166 HD12 LEU 32 HD12 LEU 32 0.548 -5.175 -3.283
167 HD13 LEU 32 HD13 LEU 32 0.982 -4.161 -4.658
168 HD21 LEU 32 HD21 LEU 32 0.815 -4.987 -6.930
169 HD22 LEU 32 HD22 LEU 32 0.342 -6.653 -7.262
170 HD23 LEU 32 HD23 LEU 32 1.938 -6.304 -6.598
171 H SER 33 HN SER 33 -1.802 -9.579 -4.719
172 HA SER 33 HA SER 33 -4.002 -7.943 -5.365
173 HB2 SER 33 HB2 SER 33 -3.883 -10.966 -5.180
174 HB3 SER 33 HB1 SER 33 -5.106 -10.027 -6.036
175 HG SER 33 HG SER 33 -2.342 -10.257 -6.638
176 H GLU 34 HN GLU 34 -3.302 -10.094 -2.680
177 HA GLU 34 HA GLU 34 -5.860 -10.074 -1.490
178 HB2 GLU 34 HB2 GLU 34 -3.788 -11.562 -0.998
179 HB3 GLU 34 HB1 GLU 34 -3.300 -10.263 0.077
180 HG2 GLU 34 HG2 GLU 34 -4.416 -11.942 1.351
181 HG3 GLU 34 HG1 GLU 34 -5.445 -10.511 1.280
182 H CYS 35 HN CYS 35 -3.066 -7.938 -1.251
183 HA CYS 35 HA CYS 35 -4.086 -6.316 0.850
184 HB2 CYS 35 HB2 CYS 35 -1.689 -6.373 0.280
185 HB3 CYS 35 HB1 CYS 35 -2.044 -5.667 -1.292
186 H ARG 36 HN ARG 36 -4.190 -6.177 -2.656
187 HA ARG 36 HA ARG 36 -5.360 -3.676 -3.016
188 HB2 ARG 36 HB2 ARG 36 -4.442 -4.988 -4.850
189 HB3 ARG 36 HB1 ARG 36 -5.685 -6.210 -4.632
190 HG2 ARG 36 HG2 ARG 36 -7.375 -4.428 -5.186
191 HG3 ARG 36 HG1 ARG 36 -6.014 -3.400 -5.645
192 HD2 ARG 36 HD2 ARG 36 -6.929 -4.503 -7.600
193 HD3 ARG 36 HD1 ARG 36 -5.302 -5.094 -7.269
194 HE ARG 36 HE ARG 36 -7.638 -6.618 -6.341
195 HH11 ARG 36 HH11 ARG 36 -4.765 -6.348 -8.355
196 HH12 ARG 36 HH12 ARG 36 -4.730 -8.103 -8.754
197 HH21 ARG 36 HH21 ARG 36 -7.653 -8.844 -6.831
198 HH22 ARG 36 HH22 ARG 36 -6.373 -9.498 -7.923
199 H ALA 37 HN ALA 37 -6.808 -6.806 -2.319
200 HA ALA 37 HA ALA 37 -9.499 -6.146 -2.692
201 HB1 ALA 37 HB1 ALA 37 -8.684 -8.442 -2.445
202 HB2 ALA 37 HB2 ALA 37 -10.001 -8.093 -1.325
203 HB3 ALA 37 HB3 ALA 37 -8.337 -8.133 -0.743
204 H ARG 38 HN ARG 38 -7.341 -5.464 -0.015
205 HA ARG 38 HA ARG 38 -9.431 -4.820 1.841
206 HB2 ARG 38 HB2 ARG 38 -6.463 -4.574 1.812
207 HB3 ARG 38 HB1 ARG 38 -7.347 -3.533 2.916
208 HG2 ARG 38 HG2 ARG 38 -6.807 -5.409 4.187
209 HG3 ARG 38 HG1 ARG 38 -8.494 -5.658 3.734
210 HD2 ARG 38 HD2 ARG 38 -7.511 -6.959 1.726
211 HD3 ARG 38 HD1 ARG 38 -6.035 -7.011 2.689
212 HE ARG 38 HE ARG 38 -7.849 -7.920 4.426
213 HH11 ARG 38 HH11 ARG 38 -7.161 -8.731 1.086
214 HH12 ARG 38 HH12 ARG 38 -7.742 -10.435 1.248
215 HH21 ARG 38 HH21 ARG 38 -8.607 -10.060 4.694
216 HH22 ARG 38 HH22 ARG 38 -8.565 -11.174 3.277
217 H CYS 39 HN CYS 39 -7.411 -3.033 -0.407
218 HA CYS 39 HA CYS 39 -8.422 -0.476 0.402
219 HB2 CYS 39 HB2 CYS 39 -6.475 -1.489 -1.536
220 HB3 CYS 39 HB1 CYS 39 -7.379 -0.090 -2.110
221 H GLN 40 HN GLN 40 -9.439 -2.958 -1.743
222 HA GLN 40 HA GLN 40 -11.034 -1.378 -3.476
223 HB2 GLN 40 HB2 GLN 40 -10.899 -4.292 -2.803
224 HB3 GLN 40 HB1 GLN 40 -12.250 -3.686 -3.749
225 HG2 GLN 40 HG2 GLN 40 -10.702 -2.814 -5.418
226 HG3 GLN 40 HG1 GLN 40 -9.341 -3.401 -4.465
227 HE21 GLN 40 HE21 GLN 40 -12.050 -4.310 -6.455
228 HE22 GLN 40 HE22 GLN 40 -11.535 -5.933 -6.756
229 H ALA 41 HN ALA 41 -11.408 -2.454 -0.256
230 HA ALA 41 HA ALA 41 -14.299 -2.130 -0.251
231 HB1 ALA 41 HB1 ALA 41 -12.383 -2.851 1.968
232 HB2 ALA 41 HB2 ALA 41 -13.381 -3.966 1.034
233 HB3 ALA 41 HB3 ALA 41 -14.140 -2.799 2.115
234 H GLU 42 HN GLU 42 -11.763 -0.076 -0.199
235 HA GLU 42 HA GLU 42 -13.228 1.870 1.444
236 HB2 GLU 42 HB2 GLU 42 -10.342 1.155 1.469
237 HB3 GLU 42 HB1 GLU 42 -10.763 2.848 1.677
238 HG2 GLU 42 HG2 GLU 42 -11.618 0.534 3.394
239 HG3 GLU 42 HG1 GLU 42 -10.534 1.855 3.830
240 H LYS 43 HN LYS 43 -14.063 3.331 0.145
241 HA LYS 43 HA LYS 43 -13.163 3.818 -2.502
242 HB2 LYS 43 HB2 LYS 43 -14.862 5.544 -2.575
243 HB3 LYS 43 HB1 LYS 43 -15.505 4.124 -1.765
244 HG2 LYS 43 HG2 LYS 43 -15.093 5.200 0.403
245 HG3 LYS 43 HG1 LYS 43 -14.522 6.638 -0.442
246 HD2 LYS 43 HD2 LYS 43 -16.783 7.047 0.147
247 HD3 LYS 43 HD1 LYS 43 -16.762 6.719 -1.586
248 HE2 LYS 43 HE2 LYS 43 -18.610 5.542 -0.652
249 HE3 LYS 43 HE1 LYS 43 -17.377 4.354 -1.055
250 HZ1 LYS 43 HZ1 LYS 43 -17.590 5.483 1.665
251 HZ2 LYS 43 HZ2 LYS 43 -16.832 4.051 1.172
252 HZ3 LYS 43 HZ3 LYS 43 -18.519 4.151 1.188
253 H GLU 44 HN GLU 44 -11.957 4.887 0.440
254 HA GLU 44 HA GLU 44 -11.047 7.467 -0.527
255 HB2 GLU 44 HB2 GLU 44 -10.850 6.013 2.086
256 HB3 GLU 44 HB1 GLU 44 -9.809 7.392 1.764
257 HG2 GLU 44 HG2 GLU 44 -11.850 8.739 1.305
258 HG3 GLU 44 HG1 GLU 44 -12.815 7.360 1.827
259 H CYS 45 HN CYS 45 -9.975 4.275 -0.702
260 HA CYS 45 HA CYS 45 -7.157 4.962 -0.599
261 HB2 CYS 45 HB2 CYS 45 -7.819 2.794 0.310
262 HB3 CYS 45 HB1 CYS 45 -8.488 2.325 -1.249
263 H SER 46 HN SER 46 -6.240 5.892 -2.256
264 HA SER 46 HA SER 46 -7.106 5.154 -4.970
265 HB2 SER 46 HB2 SER 46 -5.785 7.393 -5.453
266 HB3 SER 46 HB1 SER 46 -7.446 7.443 -4.859
267 HG SER 46 HG SER 46 -6.384 8.779 -3.517
268 H HIS 47 HN HIS 47 -4.887 4.375 -2.789
269 HA HIS 47 HA HIS 47 -3.054 3.251 -4.622
270 HB2 HIS 47 HB2 HIS 47 -1.031 4.539 -3.616
271 HB3 HIS 47 HB1 HIS 47 -1.955 5.294 -4.907
272 HD1 HIS 47 HD1 HIS 47 -2.746 7.596 -4.473
273 HD2 HIS 47 HD2 HIS 47 -1.835 5.598 -0.945
274 HE1 HIS 47 HE1 HIS 47 -3.013 9.296 -2.647
275 HE2 HIS 47 HE2 HIS 47 -2.667 8.013 -0.507
276 H TYR 48 HN TYR 48 -2.340 1.445 -3.669
277 HA TYR 48 HA TYR 48 -2.337 1.393 -0.728
278 HB2 TYR 48 HB2 TYR 48 -2.823 -1.008 -0.848
279 HB3 TYR 48 HB1 TYR 48 -4.071 -0.056 -1.635
280 HD1 TYR 48 HD2 TYR 48 -4.192 -0.028 -4.142
281 HD2 TYR 48 HD1 TYR 48 -1.575 -2.646 -2.032
282 HE1 TYR 48 HE2 TYR 48 -3.973 -1.425 -6.152
283 HE2 TYR 48 HE1 TYR 48 -1.358 -4.047 -4.038
284 HH TYR 48 HH TYR 48 -2.218 -3.064 -7.069
285 H THR 49 HN THR 49 -0.616 0.578 0.342
286 HA THR 49 HA THR 49 1.728 -0.100 -1.299
287 HB THR 49 HB THR 49 1.754 0.996 1.520
288 HG1 THR 49 HG1 THR 49 1.765 2.272 -1.001
289 HG21 THR 49 HG21 THR 49 4.113 1.472 1.022
290 HG22 THR 49 HG22 THR 49 3.923 0.729 -0.567
291 HG23 THR 49 HG23 THR 49 3.759 -0.251 0.890
292 H TYR 50 HN TYR 50 2.325 -2.161 -1.197
293 HA TYR 50 HA TYR 50 1.587 -3.704 1.199
294 HB2 TYR 50 HB2 TYR 50 0.432 -4.506 -0.795
295 HB3 TYR 50 HB1 TYR 50 1.960 -4.636 -1.657
296 HD1 TYR 50 HD1 TYR 50 0.507 -5.855 1.573
297 HD2 TYR 50 HD2 TYR 50 2.781 -6.762 -1.907
298 HE1 TYR 50 HE1 TYR 50 0.735 -8.182 2.335
299 HE2 TYR 50 HE2 TYR 50 3.014 -9.089 -1.155
300 HH TYR 50 HH TYR 50 2.839 -10.451 0.699
301 H ASN 51 HN ASN 51 3.235 -4.182 2.451
302 HA ASN 51 HA ASN 51 5.951 -4.091 1.400
303 HB2 ASN 51 HB2 ASN 51 5.517 -2.964 3.523
304 HB3 ASN 51 HB1 ASN 51 4.905 -4.459 4.219
305 HD21 ASN 51 HD21 ASN 51 7.729 -2.742 3.122
306 HD22 ASN 51 HD22 ASN 51 8.885 -3.757 3.932
307 H VAL 52 HN VAL 52 6.523 -5.886 0.353
308 HA VAL 52 HA VAL 52 5.432 -8.457 0.894
309 HB VAL 52 HB VAL 52 7.099 -9.319 -0.699
310 HG11 VAL 52 HG11 VAL 52 4.973 -8.328 -1.474
311 HG12 VAL 52 HG12 VAL 52 6.277 -8.167 -2.650
312 HG13 VAL 52 HG13 VAL 52 5.795 -6.780 -1.670
313 HG21 VAL 52 HG21 VAL 52 8.098 -6.479 -0.874
314 HG22 VAL 52 HG22 VAL 52 8.682 -7.872 -1.785
315 HG23 VAL 52 HG23 VAL 52 8.936 -7.786 -0.042
316 H LYS 53 HN LYS 53 7.964 -6.734 2.370
317 HA LYS 53 HA LYS 53 9.656 -8.901 3.072
318 HB2 LYS 53 HB2 LYS 53 9.299 -6.119 4.153
319 HB3 LYS 53 HB1 LYS 53 10.414 -7.257 4.896
320 HG2 LYS 53 HG2 LYS 53 10.543 -6.593 1.975
321 HG3 LYS 53 HG1 LYS 53 11.362 -5.618 3.198
322 HD2 LYS 53 HD2 LYS 53 12.588 -7.594 3.952
323 HD3 LYS 53 HD1 LYS 53 11.760 -8.575 2.742
324 HE2 LYS 53 HE2 LYS 53 12.790 -7.337 0.957
325 HE3 LYS 53 HE1 LYS 53 13.493 -6.193 2.100
326 HZ1 LYS 53 HZ1 LYS 53 14.984 -7.782 2.880
327 HZ2 LYS 53 HZ2 LYS 53 14.979 -8.030 1.207
328 HZ3 LYS 53 HZ3 LYS 53 14.121 -9.075 2.220
329 H SER 54 HN SER 54 6.965 -7.308 4.727
330 HA SER 54 HA SER 54 7.062 -9.433 6.763
331 HB2 SER 54 HB2 SER 54 5.564 -6.848 7.082
332 HB3 SER 54 HB1 SER 54 6.203 -7.918 8.332
333 HG SER 54 HG SER 54 7.607 -6.134 6.641
334 H GLY 55 HN GLY 55 5.273 -8.237 4.131
335 HA2 GLY 55 HA2 GLY 55 3.361 -9.136 3.165
336 HA3 GLY 55 HA1 GLY 55 3.211 -10.212 4.550
337 H LEU 56 HN LEU 56 3.579 -6.812 5.026
338 HA LEU 56 HA LEU 56 0.917 -6.719 6.199
339 HB2 LEU 56 HB2 LEU 56 3.246 -4.810 6.350
340 HB3 LEU 56 HB1 LEU 56 1.690 -4.513 7.101
341 HG LEU 56 HG LEU 56 3.470 -6.860 7.763
342 HD11 LEU 56 HD11 LEU 56 3.048 -4.277 9.260
343 HD12 LEU 56 HD12 LEU 56 4.520 -4.752 8.409
344 HD13 LEU 56 HD13 LEU 56 3.985 -5.662 9.823
345 HD21 LEU 56 HD21 LEU 56 1.144 -7.324 8.204
346 HD22 LEU 56 HD22 LEU 56 0.959 -5.783 9.042
347 HD23 LEU 56 HD23 LEU 56 1.982 -7.045 9.727
348 H CYS 57 HN CYS 57 -0.714 -5.550 5.433
349 HA CYS 57 HA CYS 57 -0.295 -4.155 2.887
350 HB2 CYS 57 HB2 CYS 57 -1.952 -5.951 2.846
351 HB3 CYS 57 HB1 CYS 57 -2.814 -5.219 4.193
352 H TYR 58 HN TYR 58 -0.512 -1.988 2.768
353 HA TYR 58 HA TYR 58 -1.632 -0.618 5.125
354 HB2 TYR 58 HB2 TYR 58 0.483 0.445 3.247
355 HB3 TYR 58 HB1 TYR 58 -0.115 1.226 4.704
356 HD1 TYR 58 HD2 TYR 58 2.041 -1.403 3.364
357 HD2 TYR 58 HD1 TYR 58 0.610 0.474 6.901
358 HE1 TYR 58 HE2 TYR 58 3.851 -2.458 4.648
359 HE2 TYR 58 HE1 TYR 58 2.420 -0.575 8.195
360 HH TYR 58 HH TYR 58 5.113 -1.954 6.794
361 HA PRO 59 HA PRO 59 -4.398 0.651 1.678
362 HB2 PRO 59 HB2 PRO 59 -6.353 0.912 3.851
363 HB3 PRO 59 HB1 PRO 59 -6.443 -0.087 2.395
364 HG2 PRO 59 HG2 PRO 59 -6.140 -1.174 4.829
365 HG3 PRO 59 HG1 PRO 59 -5.401 -1.881 3.379
366 HD2 PRO 59 HD2 PRO 59 -4.143 -0.178 5.497
367 HD3 PRO 59 HD1 PRO 59 -3.515 -1.640 4.702
368 H LYS 60 HN LYS 60 -3.440 2.663 1.381
369 HA LYS 60 HA LYS 60 -3.893 4.670 3.472
370 HB2 LYS 60 HB2 LYS 60 -1.867 4.594 1.237
371 HB3 LYS 60 HB1 LYS 60 -2.058 5.929 2.369
372 HG2 LYS 60 HG2 LYS 60 -1.513 4.460 4.230
373 HG3 LYS 60 HG1 LYS 60 -1.371 3.094 3.124
374 HD2 LYS 60 HD2 LYS 60 0.499 4.157 2.009
375 HD3 LYS 60 HD1 LYS 60 0.328 5.578 3.039
376 HE2 LYS 60 HE2 LYS 60 0.964 2.795 4.005
377 HE3 LYS 60 HE1 LYS 60 2.142 4.085 3.787
378 HZ1 LYS 60 HZ1 LYS 60 0.749 5.396 5.408
379 HZ2 LYS 60 HZ2 LYS 60 1.597 4.079 6.052
380 HZ3 LYS 60 HZ3 LYS 60 -0.069 3.953 5.760
381 H ARG 61 HN ARG 61 -4.288 6.866 2.815
382 HA ARG 61 HA ARG 61 -5.902 7.062 0.356
383 HB2 ARG 61 HB2 ARG 61 -7.425 8.573 1.660
384 HB3 ARG 61 HB1 ARG 61 -7.444 6.901 2.200
385 HG2 ARG 61 HG2 ARG 61 -6.266 7.381 4.147
386 HG3 ARG 61 HG1 ARG 61 -5.663 8.912 3.513
387 HD2 ARG 61 HD2 ARG 61 -8.464 9.090 3.461
388 HD3 ARG 61 HD1 ARG 61 -8.042 8.381 5.019
389 HE ARG 61 HE ARG 61 -6.327 10.483 4.766
390 HH11 ARG 61 HH11 ARG 61 -9.813 10.117 4.511
391 HH12 ARG 61 HH12 ARG 61 -10.141 11.757 5.200
392 HH21 ARG 61 HH21 ARG 61 -6.700 12.579 5.602
393 HH22 ARG 61 HH22 ARG 61 -8.407 13.132 5.815
394 H GLY 62 HN GLY 62 -6.594 9.750 0.703
395 HA2 GLY 62 HA2 GLY 62 -5.859 11.870 0.268
396 HA3 GLY 62 HA1 GLY 62 -4.547 11.515 1.376
397 H LYS 63 HN LYS 63 -2.822 12.331 0.383
398 HA LYS 63 HA LYS 63 -2.374 11.690 -2.444
399 HB2 LYS 63 HB2 LYS 63 -0.964 13.547 -2.567
400 HB3 LYS 63 HB1 LYS 63 -2.216 14.089 -1.462
401 HG2 LYS 63 HG2 LYS 63 -0.803 13.802 0.419
402 HG3 LYS 63 HG1 LYS 63 0.402 12.935 -0.534
403 HD2 LYS 63 HD2 LYS 63 -0.376 15.795 -1.063
404 HD3 LYS 63 HD1 LYS 63 0.944 15.338 0.013
405 HE2 LYS 63 HE2 LYS 63 0.796 14.404 -2.841
406 HE3 LYS 63 HE1 LYS 63 1.547 15.931 -2.391
407 HZ1 LYS 63 HZ1 LYS 63 2.989 14.609 -0.859
408 HZ2 LYS 63 HZ2 LYS 63 3.250 14.322 -2.501
409 HZ3 LYS 63 HZ3 LYS 63 2.381 13.200 -1.581
410 HA PRO 64 HA PRO 64 0.760 8.797 -1.280
411 HB2 PRO 64 HB2 PRO 64 2.243 8.699 -3.525
412 HB3 PRO 64 HB1 PRO 64 0.598 8.053 -3.469
413 HG2 PRO 64 HG2 PRO 64 1.558 10.644 -4.587
414 HG3 PRO 64 HG1 PRO 64 0.340 9.524 -5.228
415 HD2 PRO 64 HD2 PRO 64 -0.270 11.811 -3.845
416 HD3 PRO 64 HD1 PRO 64 -1.325 10.388 -3.931
417 H GLN 65 HN GLN 65 3.024 8.609 -0.845
418 HA GLN 65 HA GLN 65 4.656 11.000 -1.103
419 HB2 GLN 65 HB2 GLN 65 3.748 9.811 1.497
420 HB3 GLN 65 HB1 GLN 65 5.345 10.537 1.393
421 HG2 GLN 65 HG2 GLN 65 4.507 12.661 1.045
422 HG3 GLN 65 HG1 GLN 65 2.962 12.062 0.447
423 HE21 GLN 65 HE21 GLN 65 1.389 11.431 1.899
424 HE22 GLN 65 HE22 GLN 65 1.447 11.851 3.576
425 H PHE 66 HN PHE 66 5.441 9.476 -2.672
426 HA PHE 66 HA PHE 66 6.511 6.982 -2.189
427 HB2 PHE 66 HB2 PHE 66 7.362 9.087 -4.178
428 HB3 PHE 66 HB1 PHE 66 7.918 7.419 -4.213
429 HD1 PHE 66 HD1 PHE 66 5.457 5.938 -3.610
430 HD2 PHE 66 HD2 PHE 66 6.084 9.350 -6.077
431 HE1 PHE 66 HE1 PHE 66 3.502 5.316 -4.966
432 HE2 PHE 66 HE2 PHE 66 4.129 8.735 -7.433
433 HZ PHE 66 HZ PHE 66 2.836 6.715 -6.880
434 H TYR 67 HN TYR 67 8.252 6.194 -1.303
435 HA TYR 67 HA TYR 67 10.632 7.817 -0.948
436 HB2 TYR 67 HB2 TYR 67 10.851 7.491 1.388
437 HB3 TYR 67 HB1 TYR 67 9.196 8.027 1.152
438 HD1 TYR 67 HD2 TYR 67 7.329 6.431 1.438
439 HD2 TYR 67 HD1 TYR 67 11.351 5.319 2.251
440 HE1 TYR 67 HE2 TYR 67 6.530 4.489 2.723
441 HE2 TYR 67 HE1 TYR 67 10.564 3.385 3.536
442 HH TYR 67 HH TYR 67 7.749 2.039 3.316
443 H LYS 68 HN LYS 68 12.536 6.536 -0.713
444 HA LYS 68 HA LYS 68 12.327 4.038 -2.089
445 HB2 LYS 68 HB2 LYS 68 14.208 5.615 -2.419
446 HB3 LYS 68 HB1 LYS 68 14.751 5.278 -0.784
447 HG2 LYS 68 HG2 LYS 68 15.299 3.044 -1.321
448 HG3 LYS 68 HG1 LYS 68 14.453 3.133 -2.865
449 HD2 LYS 68 HD2 LYS 68 16.799 4.902 -2.231
450 HD3 LYS 68 HD1 LYS 68 17.006 3.283 -2.902
451 HE2 LYS 68 HE2 LYS 68 15.635 3.894 -4.827
452 HE3 LYS 68 HE1 LYS 68 15.390 5.502 -4.149
453 HZ1 LYS 68 HZ1 LYS 68 18.019 4.368 -4.930
454 HZ2 LYS 68 HZ2 LYS 68 17.743 5.934 -4.350
455 HZ3 LYS 68 HZ3 LYS 68 17.122 5.464 -5.852
456 H TYR 69 HN TYR 69 12.199 2.056 -1.318
457 HA TYR 69 HA TYR 69 13.353 1.268 1.179
458 HB2 TYR 69 HB2 TYR 69 11.110 2.327 1.801
459 HB3 TYR 69 HB1 TYR 69 10.360 0.967 0.971
460 HD1 TYR 69 HD1 TYR 69 12.790 1.757 3.674
461 HD2 TYR 69 HD2 TYR 69 9.967 -1.020 2.128
462 HE1 TYR 69 HE1 TYR 69 13.022 0.398 5.706
463 HE2 TYR 69 HE2 TYR 69 10.186 -2.388 4.160
464 HH TYR 69 HH TYR 69 11.712 -2.773 5.969
465 H LEU 70 HN LEU 70 13.856 -0.856 1.128
466 HA LEU 70 HA LEU 70 13.231 -2.312 -1.294
467 HB2 LEU 70 HB2 LEU 70 15.512 -2.253 -0.248
468 HB3 LEU 70 HB1 LEU 70 14.869 -3.205 1.076
469 HG LEU 70 HG LEU 70 14.204 -4.906 -0.760
470 HD11 LEU 70 HD11 LEU 70 15.684 -4.885 -2.709
471 HD12 LEU 70 HD12 LEU 70 16.330 -3.326 -2.201
472 HD13 LEU 70 HD13 LEU 70 14.636 -3.467 -2.673
473 HD21 LEU 70 HD21 LEU 70 16.391 -5.971 -0.604
474 HD22 LEU 70 HD22 LEU 70 15.899 -5.299 0.949
475 HD23 LEU 70 HD23 LEU 70 17.096 -4.458 -0.037
476 H GLY 71 HN GLY 71 11.173 -3.076 -1.274
477 HA2 GLY 71 HA2 GLY 71 10.162 -5.280 -0.573
478 HA3 GLY 71 HA1 GLY 71 10.376 -4.690 1.066
479 H ASP 72 HN ASP 72 9.642 -1.965 -0.388
480 HA ASP 72 HA ASP 72 6.801 -2.233 0.239
481 HB2 ASP 72 HB2 ASP 72 8.725 0.037 0.096
482 HB3 ASP 72 HB1 ASP 72 7.035 0.382 -0.243
483 H MET 73 HN MET 73 5.431 -2.644 -1.343
484 HA MET 73 HA MET 73 6.052 -1.647 -4.051
485 HB2 MET 73 HB2 MET 73 4.664 -4.148 -3.117
486 HB3 MET 73 HB1 MET 73 4.409 -3.523 -4.740
487 HG2 MET 73 HG2 MET 73 6.731 -3.772 -5.262
488 HG3 MET 73 HG1 MET 73 7.103 -4.214 -3.597
489 HE1 MET 73 HE1 MET 73 4.971 -5.232 -6.734
490 HE2 MET 73 HE2 MET 73 3.837 -5.514 -5.411
491 HE3 MET 73 HE3 MET 73 4.487 -6.878 -6.323
492 H THR 74 HN THR 74 4.839 0.055 -4.571
493 HA THR 74 HA THR 74 2.201 0.333 -3.332
494 HB THR 74 HB THR 74 3.782 2.384 -4.899
495 HG1 THR 74 HG1 THR 74 4.876 2.090 -3.001
496 HG21 THR 74 HG21 THR 74 1.397 2.847 -4.954
497 HG22 THR 74 HG22 THR 74 2.201 3.995 -3.884
498 HG23 THR 74 HG23 THR 74 1.292 2.647 -3.204
499 H GLY 75 HN GLY 75 0.351 0.307 -4.462
500 HA2 GLY 75 HA2 GLY 75 0.516 0.149 -7.405
501 HA3 GLY 75 HA1 GLY 75 -0.465 -0.985 -6.480
502 H SER 76 HN SER 76 -1.418 0.814 -8.513
503 HA SER 76 HA SER 76 -2.605 3.117 -7.403
504 HB2 SER 76 HB2 SER 76 -4.158 2.888 -9.442
505 HB3 SER 76 HB1 SER 76 -2.432 3.055 -9.762
506 HG SER 76 HG SER 76 -3.735 1.293 -10.860
507 H ARG 77 HN ARG 77 -4.474 0.378 -8.626
508 HA ARG 77 HA ARG 77 -5.778 -0.345 -6.264
509 HB2 ARG 77 HB2 ARG 77 -6.679 2.016 -6.524
510 HB3 ARG 77 HB1 ARG 77 -7.490 1.460 -7.980
511 HG2 ARG 77 HG2 ARG 77 -8.894 0.007 -6.774
512 HG3 ARG 77 HG1 ARG 77 -7.912 0.148 -5.314
513 HD2 ARG 77 HD2 ARG 77 -9.959 1.447 -5.095
514 HD3 ARG 77 HD1 ARG 77 -8.549 2.509 -5.122
515 HE ARG 77 HE ARG 77 -9.941 2.064 -7.648
516 HH11 ARG 77 HH11 ARG 77 -9.284 4.157 -4.893
517 HH12 ARG 77 HH12 ARG 77 -9.948 5.621 -5.714
518 HH21 ARG 77 HH21 ARG 77 -10.784 3.905 -8.712
519 HH22 ARG 77 HH22 ARG 77 -10.770 5.489 -7.848
520 H THR 78 HN THR 78 -6.108 0.176 -9.723
521 HA THR 78 HA THR 78 -6.725 -2.629 -10.092
522 HB THR 78 HB THR 78 -8.892 -1.114 -9.861
523 HG1 THR 78 HG1 THR 78 -9.247 -2.687 -12.066
524 HG21 THR 78 HG21 THR 78 -8.346 0.541 -11.527
525 HG22 THR 78 HG22 THR 78 -9.713 -0.413 -12.104
526 HG23 THR 78 HG23 THR 78 -8.097 -0.708 -12.748
527 H CYS 79 HN CYS 79 -6.403 -3.306 -12.314
528 HA CYS 79 HA CYS 79 -4.999 -1.356 -13.996
529 HB2 CYS 79 HB2 CYS 79 -3.982 -4.081 -13.182
530 HB3 CYS 79 HB1 CYS 79 -3.352 -3.199 -14.568
531 H1 GAL 83 H1 GTP 1 6.096 2.078 8.647
532 H2 GAL 83 H2 GTP 1 5.669 4.342 6.642
533 H3 GAL 83 H3 GTP 1 3.763 2.375 7.961
534 H4 GAL 83 H4 GTP 1 3.462 1.626 5.647
535 H5 GAL 83 H5 GTP 1 5.156 0.568 7.095
536 H61 GAL 83 H61 GTP 1 6.495 0.909 4.402
537 H62 GAL 83 H62 GTP 1 4.968 0.043 4.579
538 HO2 GAL 83 HO2 GTP 1 5.759 4.387 9.334
539 HO3 GAL 83 HO3 GTP 1 3.285 4.760 7.404
540 HO4 GAL 83 HO4 GTP 1 5.703 2.828 4.637
541 HO6 GAL 83 HO6 GTP 1 7.139 -1.108 4.740
542 H1 NAG 84 H1 GCP 2 10.464 3.255 5.280
543 H2 NAG 84 H2 GCP 2 10.272 3.781 8.296
544 H3 NAG 84 H3 GCP 2 8.194 3.349 6.117
545 H4 NAG 84 H4 GCP 2 8.967 5.721 7.877
546 H5 NAG 84 H5 GCP 2 9.160 5.205 4.877
547 H61 NAG 84 H61 GCP 2 9.255 7.656 6.489
548 H62 NAG 84 H62 GCP 2 9.124 7.419 4.747
549 H81 NAG 84 HC23 GCP 2 11.005 -0.627 9.291
550 H82 NAG 84 HC21 GCP 2 9.251 -0.493 9.206
551 H83 NAG 84 HC22 GCP 2 10.196 -0.638 7.725
552 HN2 NAG 84 HN2 GCP 2 9.607 1.288 6.779
553 HO1 NAG 84 HO1 GCP 2 12.180 2.463 6.974
554 HO4 NAG 84 HO4 GCP 2 6.710 5.617 7.423
555 HO6 NAG 84 HO6 GCP 2 11.609 6.746 5.557
Start of MODEL 4
1 H CYS 10 HT1 CYS 10 0.497 0.242 -15.445
2 HA CYS 10 HA CYS 10 -0.997 2.394 -14.078
3 HB2 CYS 10 HB2 CYS 10 -1.879 0.462 -12.693
4 HB3 CYS 10 HB1 CYS 10 -2.502 0.557 -14.338
5 H VAL 11 HN VAL 11 -0.409 2.661 -11.876
6 HA VAL 11 HA VAL 11 2.381 2.232 -11.393
7 HB VAL 11 HB VAL 11 0.290 3.296 -9.483
8 HG11 VAL 11 HG11 VAL 11 2.353 2.575 -8.386
9 HG12 VAL 11 HG12 VAL 11 2.177 4.330 -8.330
10 HG13 VAL 11 HG13 VAL 11 3.293 3.589 -9.478
11 HG21 VAL 11 HG21 VAL 11 0.928 5.510 -10.193
12 HG22 VAL 11 HG22 VAL 11 0.413 4.576 -11.597
13 HG23 VAL 11 HG23 VAL 11 2.131 4.846 -11.302
14 H HIS 12 HN HIS 12 3.265 0.498 -10.515
15 HA HIS 12 HA HIS 12 2.209 -0.832 -8.249
16 HB2 HIS 12 HB2 HIS 12 1.643 -2.981 -9.164
17 HB3 HIS 12 HB1 HIS 12 0.719 -1.773 -10.048
18 HD1 HIS 12 HD1 HIS 12 3.314 -4.396 -10.479
19 HD2 HIS 12 HD2 HIS 12 1.542 -1.396 -12.750
20 HE1 HIS 12 HE1 HIS 12 3.924 -4.905 -12.866
21 HE2 HIS 12 HE2 HIS 12 2.974 -2.990 -14.197
22 H THR 13 HN THR 13 3.698 -2.206 -7.307
23 HA THR 13 HA THR 13 5.749 -3.016 -6.774
24 HB THR 13 HB THR 13 6.515 -3.336 -9.642
25 HG1 THR 13 HG1 THR 13 5.054 -5.314 -9.467
26 HG21 THR 13 HG21 THR 13 7.696 -5.120 -8.886
27 HG22 THR 13 HG22 THR 13 6.429 -5.608 -7.761
28 HG23 THR 13 HG23 THR 13 7.535 -4.305 -7.331
29 H GLY 14 HN GLY 14 8.186 -2.801 -8.459
30 HA2 GLY 14 HA2 GLY 14 9.849 -1.310 -9.030
31 HA3 GLY 14 HA1 GLY 14 8.669 -0.011 -8.932
32 H ASN 15 HN ASN 15 9.070 -2.158 -6.261
33 HA ASN 15 HA ASN 15 9.422 -1.676 -4.061
34 HB2 ASN 15 HB2 ASN 15 11.837 -1.079 -3.591
35 HB3 ASN 15 HB1 ASN 15 11.559 -2.528 -4.544
36 HD21 ASN 15 HD21 ASN 15 12.509 0.842 -4.693
37 HD22 ASN 15 HD22 ASN 15 13.418 0.713 -6.159
38 H ILE 16 HN ILE 16 7.863 0.233 -4.751
39 HA ILE 16 HA ILE 16 9.046 2.710 -3.688
40 HB ILE 16 HB ILE 16 6.764 2.371 -5.645
41 HG12 ILE 16 HG12 ILE 16 8.995 2.250 -6.655
42 HG13 ILE 16 HG11 ILE 16 8.165 3.725 -7.141
43 HG21 ILE 16 HG21 ILE 16 6.213 4.105 -4.018
44 HG22 ILE 16 HG22 ILE 16 6.518 4.794 -5.611
45 HG23 ILE 16 HG23 ILE 16 7.748 4.910 -4.352
46 HD11 ILE 16 HD11 ILE 16 10.442 4.249 -6.689
47 HD12 ILE 16 HD12 ILE 16 10.372 3.461 -5.114
48 HD13 ILE 16 HD13 ILE 16 9.459 4.944 -5.401
49 H GLY 17 HN GLY 17 8.317 3.280 -1.757
50 HA2 GLY 17 HA2 GLY 17 5.842 2.034 -0.769
51 HA3 GLY 17 HA1 GLY 17 7.128 2.689 0.237
52 H SER 18 HN SER 18 4.721 3.497 0.933
53 HA SER 18 HA SER 18 4.671 6.279 0.020
54 HB2 SER 18 HB2 SER 18 2.254 4.481 0.287
55 HB3 SER 18 HB1 SER 18 2.169 6.232 0.098
56 HG SER 18 HG SER 18 3.503 4.527 -1.731
57 H LYS 19 HN LYS 19 5.146 7.447 1.749
58 HA LYS 19 HA LYS 19 4.483 6.486 4.410
59 HB2 LYS 19 HB2 LYS 19 6.690 7.598 3.767
60 HB3 LYS 19 HB1 LYS 19 5.794 9.109 3.702
61 HG2 LYS 19 HG2 LYS 19 5.073 8.594 6.095
62 HG3 LYS 19 HG1 LYS 19 6.342 7.368 6.081
63 HD2 LYS 19 HD2 LYS 19 7.171 9.433 7.045
64 HD3 LYS 19 HD1 LYS 19 7.990 9.102 5.519
65 HE2 LYS 19 HE2 LYS 19 7.328 11.481 5.831
66 HE3 LYS 19 HE1 LYS 19 6.657 10.734 4.387
67 HZ1 LYS 19 HZ1 LYS 19 5.198 11.081 6.950
68 HZ2 LYS 19 HZ2 LYS 19 4.556 10.462 5.510
69 HZ3 LYS 19 HZ3 LYS 19 5.034 12.082 5.596
70 H ALA 20 HN ALA 20 2.212 6.911 3.017
71 HA ALA 20 HA ALA 20 1.164 9.535 3.782
72 HB1 ALA 20 HB1 ALA 20 -0.800 8.903 2.424
73 HB2 ALA 20 HB2 ALA 20 -0.031 7.354 2.077
74 HB3 ALA 20 HB3 ALA 20 0.706 8.851 1.508
75 H GLN 21 HN GLN 21 -1.262 9.373 4.512
76 HA GLN 21 HA GLN 21 -1.211 7.940 6.993
77 HB2 GLN 21 HB2 GLN 21 -2.239 10.236 6.600
78 HB3 GLN 21 HB1 GLN 21 -3.576 9.397 5.827
79 HG2 GLN 21 HG2 GLN 21 -3.183 8.112 8.285
80 HG3 GLN 21 HG1 GLN 21 -3.074 9.842 8.611
81 HE21 GLN 21 HE21 GLN 21 -5.113 7.935 9.394
82 HE22 GLN 21 HE22 GLN 21 -6.605 8.529 8.752
83 H THR 22 HN THR 22 -2.132 6.066 7.505
84 HA THR 22 HA THR 22 -3.352 4.481 5.423
85 HB THR 22 HB THR 22 -3.024 3.704 8.327
86 HG1 THR 22 HG1 THR 22 -0.939 3.735 7.977
87 HG21 THR 22 HG21 THR 22 -2.910 1.434 7.422
88 HG22 THR 22 HG22 THR 22 -3.103 2.069 5.788
89 HG23 THR 22 HG23 THR 22 -4.418 2.222 6.953
90 H ILE 23 HN ILE 23 -5.483 3.861 5.297
91 HA ILE 23 HA ILE 23 -7.447 5.581 6.338
92 HB ILE 23 HB ILE 23 -7.741 2.824 5.135
93 HG12 ILE 23 HG12 ILE 23 -8.155 5.557 3.900
94 HG13 ILE 23 HG11 ILE 23 -6.693 4.593 3.708
95 HG21 ILE 23 HG21 ILE 23 -9.712 3.327 6.424
96 HG22 ILE 23 HG22 ILE 23 -10.089 3.487 4.708
97 HG23 ILE 23 HG23 ILE 23 -9.831 4.927 5.693
98 HD11 ILE 23 HD11 ILE 23 -8.155 4.396 1.782
99 HD12 ILE 23 HD12 ILE 23 -9.454 3.801 2.815
100 HD13 ILE 23 HD13 ILE 23 -7.985 2.846 2.610
101 H GLY 24 HN GLY 24 -6.612 2.239 7.253
102 HA2 GLY 24 HA2 GLY 24 -7.781 2.768 9.881
103 HA3 GLY 24 HA1 GLY 24 -8.389 1.394 8.975
104 H GLU 25 HN GLU 25 -7.725 0.106 10.736
105 HA GLU 25 HA GLU 25 -5.134 -0.091 11.730
106 HB2 GLU 25 HB2 GLU 25 -7.105 -1.066 12.814
107 HB3 GLU 25 HB1 GLU 25 -7.241 -2.243 11.515
108 HG2 GLU 25 HG2 GLU 25 -4.670 -2.602 12.341
109 HG3 GLU 25 HG1 GLU 25 -5.495 -2.208 13.849
110 H VAL 26 HN VAL 26 -3.331 -1.015 11.055
111 HA VAL 26 HA VAL 26 -3.156 -2.038 8.379
112 HB VAL 26 HB VAL 26 -1.039 -1.918 10.531
113 HG11 VAL 26 HG11 VAL 26 -0.475 -3.497 8.766
114 HG12 VAL 26 HG12 VAL 26 0.561 -2.071 8.688
115 HG13 VAL 26 HG13 VAL 26 -0.770 -2.256 7.548
116 HG21 VAL 26 HG21 VAL 26 -1.914 0.296 10.040
117 HG22 VAL 26 HG22 VAL 26 -1.658 0.030 8.315
118 HG23 VAL 26 HG23 VAL 26 -0.278 0.119 9.408
119 H LYS 27 HN LYS 27 -3.234 -4.116 7.767
120 HA LYS 27 HA LYS 27 -2.840 -6.184 9.816
121 HB2 LYS 27 HB2 LYS 27 -5.062 -5.936 7.801
122 HB3 LYS 27 HB1 LYS 27 -4.624 -7.489 8.499
123 HG2 LYS 27 HG2 LYS 27 -5.172 -6.743 10.697
124 HG3 LYS 27 HG1 LYS 27 -5.381 -5.084 10.135
125 HD2 LYS 27 HD2 LYS 27 -7.046 -7.330 9.048
126 HD3 LYS 27 HD1 LYS 27 -7.480 -6.508 10.545
127 HE2 LYS 27 HE2 LYS 27 -7.095 -5.197 7.860
128 HE3 LYS 27 HE1 LYS 27 -8.642 -5.551 8.620
129 HZ1 LYS 27 HZ1 LYS 27 -6.745 -3.428 9.188
130 HZ2 LYS 27 HZ2 LYS 27 -7.465 -4.148 10.546
131 HZ3 LYS 27 HZ3 LYS 27 -8.432 -3.450 9.340
132 H ARG 28 HN ARG 28 -2.329 -8.325 8.885
133 HA ARG 28 HA ARG 28 -0.393 -8.011 6.761
134 HB2 ARG 28 HB2 ARG 28 -0.098 -9.388 8.917
135 HB3 ARG 28 HB1 ARG 28 -1.104 -10.594 8.125
136 HG2 ARG 28 HG2 ARG 28 0.496 -10.777 6.311
137 HG3 ARG 28 HG1 ARG 28 1.492 -9.517 7.044
138 HD2 ARG 28 HD2 ARG 28 2.548 -11.440 7.740
139 HD3 ARG 28 HD1 ARG 28 1.494 -11.080 9.105
140 HE ARG 28 HE ARG 28 0.126 -12.778 7.340
141 HH11 ARG 28 HH11 ARG 28 2.844 -12.788 9.573
142 HH12 ARG 28 HH12 ARG 28 2.723 -14.560 9.892
143 HH21 ARG 28 HH21 ARG 28 -0.073 -15.012 7.726
144 HH22 ARG 28 HH22 ARG 28 1.089 -15.808 8.855
145 H ALA 29 HN ALA 29 -0.473 -8.927 4.759
146 HA ALA 29 HA ALA 29 -3.039 -10.156 3.976
147 HB1 ALA 29 HB1 ALA 29 -1.214 -8.398 2.331
148 HB2 ALA 29 HB2 ALA 29 -2.785 -7.945 2.993
149 HB3 ALA 29 HB3 ALA 29 -2.679 -9.184 1.744
150 H SER 30 HN SER 30 -2.828 -11.593 2.042
151 HA SER 30 HA SER 30 -0.535 -13.335 2.423
152 HB2 SER 30 HB2 SER 30 -3.015 -13.752 0.743
153 HB3 SER 30 HB1 SER 30 -1.818 -14.978 1.164
154 HG SER 30 HG SER 30 -2.936 -15.294 2.896
155 H SER 31 HN SER 31 -1.653 -11.009 0.134
156 HA SER 31 HA SER 31 0.717 -11.305 -1.446
157 HB2 SER 31 HB2 SER 31 -0.524 -11.740 -3.585
158 HB3 SER 31 HB1 SER 31 -0.547 -13.102 -2.466
159 HG SER 31 HG SER 31 -2.631 -12.988 -2.647
160 H LEU 32 HN LEU 32 0.382 -9.875 -3.554
161 HA LEU 32 HA LEU 32 -0.175 -7.243 -2.658
162 HB2 LEU 32 HB2 LEU 32 1.504 -7.742 -4.385
163 HB3 LEU 32 HB1 LEU 32 0.238 -8.303 -5.460
164 HG LEU 32 HG LEU 32 -0.731 -5.948 -5.310
165 HD11 LEU 32 HD11 LEU 32 2.005 -5.438 -4.156
166 HD12 LEU 32 HD12 LEU 32 0.452 -5.157 -3.369
167 HD13 LEU 32 HD13 LEU 32 0.919 -4.192 -4.768
168 HD21 LEU 32 HD21 LEU 32 0.850 -5.090 -6.995
169 HD22 LEU 32 HD22 LEU 32 0.368 -6.759 -7.299
170 HD23 LEU 32 HD23 LEU 32 1.951 -6.410 -6.604
171 H SER 33 HN SER 33 -1.876 -9.578 -4.690
172 HA SER 33 HA SER 33 -4.015 -7.932 -5.471
173 HB2 SER 33 HB2 SER 33 -4.637 -10.781 -5.052
174 HB3 SER 33 HB1 SER 33 -4.757 -9.802 -6.516
175 HG SER 33 HG SER 33 -3.068 -11.584 -6.303
176 H GLU 34 HN GLU 34 -3.483 -10.006 -2.678
177 HA GLU 34 HA GLU 34 -6.038 -9.830 -1.531
178 HB2 GLU 34 HB2 GLU 34 -4.164 -11.402 -0.877
179 HB3 GLU 34 HB1 GLU 34 -3.422 -10.051 -0.032
180 HG2 GLU 34 HG2 GLU 34 -4.622 -11.405 1.538
181 HG3 GLU 34 HG1 GLU 34 -5.448 -9.858 1.362
182 H CYS 35 HN CYS 35 -3.141 -7.832 -1.184
183 HA CYS 35 HA CYS 35 -4.226 -6.049 0.739
184 HB2 CYS 35 HB2 CYS 35 -1.784 -6.334 0.294
185 HB3 CYS 35 HB1 CYS 35 -2.005 -5.522 -1.252
186 H ARG 36 HN ARG 36 -4.047 -6.064 -2.779
187 HA ARG 36 HA ARG 36 -5.045 -3.507 -3.296
188 HB2 ARG 36 HB2 ARG 36 -4.049 -5.101 -4.965
189 HB3 ARG 36 HB1 ARG 36 -5.563 -5.994 -4.937
190 HG2 ARG 36 HG2 ARG 36 -6.716 -3.895 -5.660
191 HG3 ARG 36 HG1 ARG 36 -5.120 -3.173 -5.880
192 HD2 ARG 36 HD2 ARG 36 -5.702 -3.952 -8.006
193 HD3 ARG 36 HD1 ARG 36 -4.616 -5.187 -7.370
194 HE ARG 36 HE ARG 36 -7.528 -5.522 -7.149
195 HH11 ARG 36 HH11 ARG 36 -4.407 -6.588 -8.362
196 HH12 ARG 36 HH12 ARG 36 -5.038 -8.172 -8.941
197 HH21 ARG 36 HH21 ARG 36 -8.374 -7.522 -7.886
198 HH22 ARG 36 HH22 ARG 36 -7.260 -8.680 -8.704
199 H ALA 37 HN ALA 37 -6.765 -6.612 -3.048
200 HA ALA 37 HA ALA 37 -9.354 -5.619 -3.412
201 HB1 ALA 37 HB1 ALA 37 -8.779 -7.996 -3.545
202 HB2 ALA 37 HB2 ALA 37 -10.117 -7.711 -2.432
203 HB3 ALA 37 HB3 ALA 37 -8.498 -8.023 -1.804
204 H ARG 38 HN ARG 38 -7.361 -5.890 -0.513
205 HA ARG 38 HA ARG 38 -9.438 -5.261 1.318
206 HB2 ARG 38 HB2 ARG 38 -7.056 -6.300 1.711
207 HB3 ARG 38 HB1 ARG 38 -6.579 -4.617 1.906
208 HG2 ARG 38 HG2 ARG 38 -7.050 -5.552 4.060
209 HG3 ARG 38 HG1 ARG 38 -8.301 -4.374 3.666
210 HD2 ARG 38 HD2 ARG 38 -9.565 -6.122 4.476
211 HD3 ARG 38 HD1 ARG 38 -9.577 -6.464 2.750
212 HE ARG 38 HE ARG 38 -8.073 -7.904 4.805
213 HH11 ARG 38 HH11 ARG 38 -9.081 -7.592 1.442
214 HH12 ARG 38 HH12 ARG 38 -8.531 -9.260 1.015
215 HH21 ARG 38 HH21 ARG 38 -7.433 -10.047 4.293
216 HH22 ARG 38 HH22 ARG 38 -7.650 -10.620 2.588
217 H CYS 39 HN CYS 39 -7.324 -3.355 -0.674
218 HA CYS 39 HA CYS 39 -7.934 -0.885 0.701
219 HB2 CYS 39 HB2 CYS 39 -5.796 -1.548 -0.727
220 HB3 CYS 39 HB1 CYS 39 -6.767 -0.918 -2.052
221 H GLN 40 HN GLN 40 -8.919 -2.586 -2.219
222 HA GLN 40 HA GLN 40 -10.538 -0.544 -3.319
223 HB2 GLN 40 HB2 GLN 40 -10.644 -3.545 -3.658
224 HB3 GLN 40 HB1 GLN 40 -11.593 -2.414 -4.609
225 HG2 GLN 40 HG2 GLN 40 -9.587 -1.440 -5.525
226 HG3 GLN 40 HG1 GLN 40 -8.585 -2.471 -4.506
227 HE21 GLN 40 HE21 GLN 40 -10.628 -2.313 -7.295
228 HE22 GLN 40 HE22 GLN 40 -10.225 -3.865 -7.943
229 H ALA 41 HN ALA 41 -10.932 -2.323 -0.531
230 HA ALA 41 HA ALA 41 -13.728 -2.757 -0.506
231 HB1 ALA 41 HB1 ALA 41 -11.846 -2.408 1.824
232 HB2 ALA 41 HB2 ALA 41 -12.173 -3.929 0.996
233 HB3 ALA 41 HB3 ALA 41 -13.459 -3.113 1.888
234 H GLU 42 HN GLU 42 -11.798 0.067 -0.094
235 HA GLU 42 HA GLU 42 -14.200 1.516 0.779
236 HB2 GLU 42 HB2 GLU 42 -11.821 1.241 2.245
237 HB3 GLU 42 HB1 GLU 42 -11.797 2.879 1.602
238 HG2 GLU 42 HG2 GLU 42 -14.100 1.687 3.131
239 HG3 GLU 42 HG1 GLU 42 -12.832 2.682 3.848
240 H LYS 43 HN LYS 43 -14.441 3.624 0.029
241 HA LYS 43 HA LYS 43 -13.379 4.030 -2.628
242 HB2 LYS 43 HB2 LYS 43 -14.875 6.025 -2.611
243 HB3 LYS 43 HB1 LYS 43 -15.701 4.514 -2.258
244 HG2 LYS 43 HG2 LYS 43 -15.286 5.181 0.227
245 HG3 LYS 43 HG1 LYS 43 -15.068 6.798 -0.442
246 HD2 LYS 43 HD2 LYS 43 -17.351 6.597 0.209
247 HD3 LYS 43 HD1 LYS 43 -17.301 6.538 -1.555
248 HE2 LYS 43 HE2 LYS 43 -18.809 4.844 -0.836
249 HE3 LYS 43 HE1 LYS 43 -17.343 4.036 -1.379
250 HZ1 LYS 43 HZ1 LYS 43 -18.157 3.092 0.681
251 HZ2 LYS 43 HZ2 LYS 43 -18.065 4.594 1.446
252 HZ3 LYS 43 HZ3 LYS 43 -16.648 3.822 0.935
253 H GLU 44 HN GLU 44 -12.503 4.949 0.506
254 HA GLU 44 HA GLU 44 -11.297 7.472 -0.128
255 HB2 GLU 44 HB2 GLU 44 -11.408 5.678 2.250
256 HB3 GLU 44 HB1 GLU 44 -10.105 6.859 2.170
257 HG2 GLU 44 HG2 GLU 44 -12.940 7.690 1.730
258 HG3 GLU 44 HG1 GLU 44 -12.301 7.487 3.360
259 H CYS 45 HN CYS 45 -10.390 4.222 -0.556
260 HA CYS 45 HA CYS 45 -7.569 4.520 -0.295
261 HB2 CYS 45 HB2 CYS 45 -8.419 2.314 -0.103
262 HB3 CYS 45 HB1 CYS 45 -9.293 2.436 -1.626
263 H SER 46 HN SER 46 -6.206 5.453 -1.604
264 HA SER 46 HA SER 46 -6.939 5.777 -4.440
265 HB2 SER 46 HB2 SER 46 -5.350 7.846 -4.210
266 HB3 SER 46 HB1 SER 46 -7.016 7.966 -3.644
267 HG SER 46 HG SER 46 -6.133 8.518 -1.821
268 H HIS 47 HN HIS 47 -4.741 4.572 -2.174
269 HA HIS 47 HA HIS 47 -3.047 3.423 -4.145
270 HB2 HIS 47 HB2 HIS 47 -0.935 4.541 -3.036
271 HB3 HIS 47 HB1 HIS 47 -1.781 5.357 -4.345
272 HD1 HIS 47 HD1 HIS 47 -2.526 7.688 -3.889
273 HD2 HIS 47 HD2 HIS 47 -1.699 5.606 -0.389
274 HE1 HIS 47 HE1 HIS 47 -2.732 9.372 -2.038
275 HE2 HIS 47 HE2 HIS 47 -2.449 8.041 0.079
276 H TYR 48 HN TYR 48 -2.350 1.545 -3.348
277 HA TYR 48 HA TYR 48 -2.387 1.227 -0.421
278 HB2 TYR 48 HB2 TYR 48 -2.845 -1.162 -0.784
279 HB3 TYR 48 HB1 TYR 48 -4.094 -0.150 -1.494
280 HD1 TYR 48 HD2 TYR 48 -4.146 0.165 -3.985
281 HD2 TYR 48 HD1 TYR 48 -1.582 -2.669 -2.115
282 HE1 TYR 48 HE2 TYR 48 -3.873 -0.998 -6.133
283 HE2 TYR 48 HE1 TYR 48 -1.304 -3.843 -4.259
284 HH TYR 48 HH TYR 48 -2.227 -2.511 -7.223
285 H THR 49 HN THR 49 -0.630 0.460 0.598
286 HA THR 49 HA THR 49 1.710 -0.146 -1.083
287 HB THR 49 HB THR 49 1.704 0.908 1.755
288 HG1 THR 49 HG1 THR 49 2.299 2.278 -0.679
289 HG21 THR 49 HG21 THR 49 4.093 1.358 1.306
290 HG22 THR 49 HG22 THR 49 3.933 0.543 -0.251
291 HG23 THR 49 HG23 THR 49 3.710 -0.363 1.245
292 H TYR 50 HN TYR 50 2.125 -2.257 -1.148
293 HA TYR 50 HA TYR 50 1.507 -3.880 1.224
294 HB2 TYR 50 HB2 TYR 50 0.423 -4.683 -0.790
295 HB3 TYR 50 HB1 TYR 50 1.950 -4.671 -1.662
296 HD1 TYR 50 HD1 TYR 50 0.794 -6.088 1.614
297 HD2 TYR 50 HD2 TYR 50 2.722 -6.786 -2.117
298 HE1 TYR 50 HE1 TYR 50 1.185 -8.428 2.255
299 HE2 TYR 50 HE2 TYR 50 3.116 -9.129 -1.482
300 HH TYR 50 HH TYR 50 3.168 -10.567 0.310
301 H ASN 51 HN ASN 51 3.178 -4.102 2.517
302 HA ASN 51 HA ASN 51 5.895 -3.985 1.489
303 HB2 ASN 51 HB2 ASN 51 5.399 -2.788 3.560
304 HB3 ASN 51 HB1 ASN 51 4.811 -4.269 4.308
305 HD21 ASN 51 HD21 ASN 51 7.603 -2.486 3.267
306 HD22 ASN 51 HD22 ASN 51 8.768 -3.456 4.113
307 H VAL 52 HN VAL 52 6.639 -5.801 0.585
308 HA VAL 52 HA VAL 52 5.589 -8.387 1.211
309 HB VAL 52 HB VAL 52 7.216 -9.272 -0.365
310 HG11 VAL 52 HG11 VAL 52 5.152 -8.240 -1.210
311 HG12 VAL 52 HG12 VAL 52 6.489 -8.102 -2.355
312 HG13 VAL 52 HG13 VAL 52 6.011 -6.708 -1.387
313 HG21 VAL 52 HG21 VAL 52 9.141 -7.905 0.229
314 HG22 VAL 52 HG22 VAL 52 8.350 -6.479 -0.443
315 HG23 VAL 52 HG23 VAL 52 8.818 -7.809 -1.503
316 H LYS 53 HN LYS 53 7.880 -6.514 2.781
317 HA LYS 53 HA LYS 53 9.703 -8.578 3.537
318 HB2 LYS 53 HB2 LYS 53 9.191 -5.787 4.535
319 HB3 LYS 53 HB1 LYS 53 10.319 -6.860 5.354
320 HG2 LYS 53 HG2 LYS 53 10.508 -6.138 2.441
321 HG3 LYS 53 HG1 LYS 53 11.374 -5.298 3.730
322 HD2 LYS 53 HD2 LYS 53 12.534 -7.321 4.330
323 HD3 LYS 53 HD1 LYS 53 11.594 -8.256 3.171
324 HE2 LYS 53 HE2 LYS 53 12.554 -6.804 1.370
325 HE3 LYS 53 HE1 LYS 53 13.615 -6.106 2.593
326 HZ1 LYS 53 HZ1 LYS 53 14.633 -7.936 1.308
327 HZ2 LYS 53 HZ2 LYS 53 13.489 -8.997 1.959
328 HZ3 LYS 53 HZ3 LYS 53 14.602 -8.229 2.973
329 H SER 54 HN SER 54 6.998 -6.961 5.182
330 HA SER 54 HA SER 54 7.030 -9.129 7.175
331 HB2 SER 54 HB2 SER 54 5.629 -6.458 7.392
332 HB3 SER 54 HB1 SER 54 5.923 -7.624 8.684
333 HG SER 54 HG SER 54 8.156 -6.728 7.303
334 H GLY 55 HN GLY 55 5.380 -8.016 4.466
335 HA2 GLY 55 HA2 GLY 55 3.552 -8.956 3.407
336 HA3 GLY 55 HA1 GLY 55 3.300 -9.977 4.816
337 H LEU 56 HN LEU 56 3.648 -6.660 5.472
338 HA LEU 56 HA LEU 56 0.928 -6.529 6.404
339 HB2 LEU 56 HB2 LEU 56 3.171 -4.521 6.507
340 HB3 LEU 56 HB1 LEU 56 1.596 -4.285 7.237
341 HG LEU 56 HG LEU 56 3.504 -6.499 7.989
342 HD11 LEU 56 HD11 LEU 56 2.899 -3.908 9.405
343 HD12 LEU 56 HD12 LEU 56 4.402 -4.301 8.570
344 HD13 LEU 56 HD13 LEU 56 3.929 -5.206 10.007
345 HD21 LEU 56 HD21 LEU 56 1.198 -7.085 8.411
346 HD22 LEU 56 HD22 LEU 56 0.926 -5.547 9.226
347 HD23 LEU 56 HD23 LEU 56 2.014 -6.740 9.937
348 H CYS 57 HN CYS 57 -0.715 -5.438 5.568
349 HA CYS 57 HA CYS 57 -0.305 -4.151 2.961
350 HB2 CYS 57 HB2 CYS 57 -1.947 -5.951 2.950
351 HB3 CYS 57 HB1 CYS 57 -2.812 -5.213 4.295
352 H TYR 58 HN TYR 58 -0.614 -2.003 2.732
353 HA TYR 58 HA TYR 58 -1.736 -0.572 5.050
354 HB2 TYR 58 HB2 TYR 58 0.456 0.318 3.177
355 HB3 TYR 58 HB1 TYR 58 -0.277 1.325 4.416
356 HD1 TYR 58 HD2 TYR 58 1.880 -1.602 3.818
357 HD2 TYR 58 HD1 TYR 58 0.324 1.110 6.705
358 HE1 TYR 58 HE2 TYR 58 3.539 -2.393 5.449
359 HE2 TYR 58 HE1 TYR 58 1.982 0.328 8.338
360 HH TYR 58 HH TYR 58 3.414 -1.518 8.780
361 HA PRO 59 HA PRO 59 -4.481 0.693 1.601
362 HB2 PRO 59 HB2 PRO 59 -6.501 0.963 3.686
363 HB3 PRO 59 HB1 PRO 59 -6.503 -0.118 2.286
364 HG2 PRO 59 HG2 PRO 59 -6.262 -1.020 4.834
365 HG3 PRO 59 HG1 PRO 59 -5.553 -1.848 3.437
366 HD2 PRO 59 HD2 PRO 59 -4.229 -0.072 5.439
367 HD3 PRO 59 HD1 PRO 59 -3.635 -1.568 4.688
368 H LYS 60 HN LYS 60 -3.515 2.724 1.344
369 HA LYS 60 HA LYS 60 -4.002 4.679 3.480
370 HB2 LYS 60 HB2 LYS 60 -1.904 4.603 1.317
371 HB3 LYS 60 HB1 LYS 60 -2.147 5.970 2.397
372 HG2 LYS 60 HG2 LYS 60 -1.589 4.638 4.309
373 HG3 LYS 60 HG1 LYS 60 -1.524 3.176 3.323
374 HD2 LYS 60 HD2 LYS 60 0.357 4.134 2.068
375 HD3 LYS 60 HD1 LYS 60 0.300 5.569 3.095
376 HE2 LYS 60 HE2 LYS 60 0.860 2.747 4.001
377 HE3 LYS 60 HE1 LYS 60 2.047 4.034 3.822
378 HZ1 LYS 60 HZ1 LYS 60 0.681 5.296 5.498
379 HZ2 LYS 60 HZ2 LYS 60 1.525 3.952 6.088
380 HZ3 LYS 60 HZ3 LYS 60 -0.145 3.847 5.811
381 H ARG 61 HN ARG 61 -4.318 6.902 2.868
382 HA ARG 61 HA ARG 61 -5.805 7.256 0.352
383 HB2 ARG 61 HB2 ARG 61 -7.474 8.596 1.597
384 HB3 ARG 61 HB1 ARG 61 -7.432 6.926 2.145
385 HG2 ARG 61 HG2 ARG 61 -6.241 7.519 4.118
386 HG3 ARG 61 HG1 ARG 61 -5.974 9.160 3.531
387 HD2 ARG 61 HD2 ARG 61 -8.492 9.422 3.518
388 HD3 ARG 61 HD1 ARG 61 -8.558 7.898 4.405
389 HE ARG 61 HE ARG 61 -6.808 9.396 5.845
390 HH11 ARG 61 HH11 ARG 61 -10.090 9.934 4.678
391 HH12 ARG 61 HH12 ARG 61 -10.521 10.990 6.080
392 HH21 ARG 61 HH21 ARG 61 -7.317 10.747 7.612
393 HH22 ARG 61 HH22 ARG 61 -8.974 11.452 7.708
394 H GLY 62 HN GLY 62 -6.472 9.902 0.656
395 HA2 GLY 62 HA2 GLY 62 -5.696 12.059 0.638
396 HA3 GLY 62 HA1 GLY 62 -4.382 11.539 1.677
397 H LYS 63 HN LYS 63 -2.781 12.633 0.691
398 HA LYS 63 HA LYS 63 -2.376 12.402 -2.164
399 HB2 LYS 63 HB2 LYS 63 -0.635 14.031 -1.888
400 HB3 LYS 63 HB1 LYS 63 -2.006 14.545 -0.917
401 HG2 LYS 63 HG2 LYS 63 -0.789 13.352 1.024
402 HG3 LYS 63 HG1 LYS 63 0.628 13.447 -0.022
403 HD2 LYS 63 HD2 LYS 63 -1.058 15.778 0.884
404 HD3 LYS 63 HD1 LYS 63 0.523 15.337 1.529
405 HE2 LYS 63 HE2 LYS 63 -0.046 16.127 -1.325
406 HE3 LYS 63 HE1 LYS 63 0.643 17.180 -0.094
407 HZ1 LYS 63 HZ1 LYS 63 2.442 15.421 0.101
408 HZ2 LYS 63 HZ2 LYS 63 2.459 16.387 -1.286
409 HZ3 LYS 63 HZ3 LYS 63 1.859 14.810 -1.366
410 HA PRO 64 HA PRO 64 0.565 9.124 -1.813
411 HB2 PRO 64 HB2 PRO 64 1.874 9.768 -4.263
412 HB3 PRO 64 HB1 PRO 64 0.587 8.587 -4.002
413 HG2 PRO 64 HG2 PRO 64 0.332 10.916 -5.478
414 HG3 PRO 64 HG1 PRO 64 -1.004 9.956 -4.821
415 HD2 PRO 64 HD2 PRO 64 0.185 12.476 -3.789
416 HD3 PRO 64 HD1 PRO 64 -1.495 11.903 -3.726
417 H GLN 65 HN GLN 65 2.310 9.060 -0.581
418 HA GLN 65 HA GLN 65 4.419 11.074 -0.981
419 HB2 GLN 65 HB2 GLN 65 3.442 9.714 1.529
420 HB3 GLN 65 HB1 GLN 65 5.014 10.501 1.448
421 HG2 GLN 65 HG2 GLN 65 4.064 12.618 1.129
422 HG3 GLN 65 HG1 GLN 65 2.485 11.943 0.728
423 HE21 GLN 65 HE21 GLN 65 1.099 11.362 2.358
424 HE22 GLN 65 HE22 GLN 65 1.390 11.722 4.023
425 H PHE 66 HN PHE 66 5.079 9.573 -2.655
426 HA PHE 66 HA PHE 66 5.890 6.918 -2.086
427 HB2 PHE 66 HB2 PHE 66 6.644 8.734 -4.379
428 HB3 PHE 66 HB1 PHE 66 6.936 7.000 -4.316
429 HD1 PHE 66 HD1 PHE 66 4.509 5.832 -3.399
430 HD2 PHE 66 HD2 PHE 66 5.036 9.205 -5.937
431 HE1 PHE 66 HE1 PHE 66 2.304 5.419 -4.408
432 HE2 PHE 66 HE2 PHE 66 2.833 8.796 -6.942
433 HZ PHE 66 HZ PHE 66 1.463 6.900 -6.178
434 H TYR 67 HN TYR 67 7.880 6.017 -1.929
435 HA TYR 67 HA TYR 67 10.288 7.577 -1.916
436 HB2 TYR 67 HB2 TYR 67 10.989 7.117 0.337
437 HB3 TYR 67 HB1 TYR 67 9.433 7.927 0.401
438 HD1 TYR 67 HD1 TYR 67 11.233 4.799 1.041
439 HD2 TYR 67 HD2 TYR 67 7.455 6.752 1.220
440 HE1 TYR 67 HE1 TYR 67 10.396 3.029 2.530
441 HE2 TYR 67 HE2 TYR 67 6.610 4.982 2.705
442 HH TYR 67 HH TYR 67 7.568 2.204 3.012
443 H LYS 68 HN LYS 68 12.167 6.222 -1.985
444 HA LYS 68 HA LYS 68 11.534 3.658 -3.193
445 HB2 LYS 68 HB2 LYS 68 13.212 5.481 -4.028
446 HB3 LYS 68 HB1 LYS 68 14.313 4.727 -2.884
447 HG2 LYS 68 HG2 LYS 68 14.319 2.702 -4.046
448 HG3 LYS 68 HG1 LYS 68 12.867 3.120 -4.959
449 HD2 LYS 68 HD2 LYS 68 15.408 4.702 -5.207
450 HD3 LYS 68 HD1 LYS 68 15.114 3.260 -6.178
451 HE2 LYS 68 HE2 LYS 68 13.285 4.231 -7.267
452 HE3 LYS 68 HE1 LYS 68 13.122 5.498 -6.056
453 HZ1 LYS 68 HZ1 LYS 68 14.087 6.318 -8.124
454 HZ2 LYS 68 HZ2 LYS 68 15.376 5.236 -7.970
455 HZ3 LYS 68 HZ3 LYS 68 15.177 6.474 -6.838
456 H TYR 69 HN TYR 69 11.532 1.825 -2.104
457 HA TYR 69 HA TYR 69 13.598 1.260 -0.155
458 HB2 TYR 69 HB2 TYR 69 11.935 2.330 1.263
459 HB3 TYR 69 HB1 TYR 69 10.667 1.295 0.612
460 HD1 TYR 69 HD1 TYR 69 13.851 1.192 2.540
461 HD2 TYR 69 HD2 TYR 69 10.159 -0.733 1.658
462 HE1 TYR 69 HE1 TYR 69 14.279 -0.439 4.334
463 HE2 TYR 69 HE2 TYR 69 10.578 -2.370 3.442
464 HH TYR 69 HH TYR 69 12.984 -1.953 5.788
465 H LEU 70 HN LEU 70 14.288 -0.720 -0.619
466 HA LEU 70 HA LEU 70 12.869 -2.469 -2.338
467 HB2 LEU 70 HB2 LEU 70 15.329 -2.814 -0.643
468 HB3 LEU 70 HB1 LEU 70 14.666 -4.134 -1.588
469 HG LEU 70 HG LEU 70 15.426 -1.508 -2.845
470 HD11 LEU 70 HD11 LEU 70 17.555 -2.534 -3.457
471 HD12 LEU 70 HD12 LEU 70 17.156 -3.948 -2.483
472 HD13 LEU 70 HD13 LEU 70 17.393 -2.382 -1.708
473 HD21 LEU 70 HD21 LEU 70 15.520 -2.827 -4.874
474 HD22 LEU 70 HD22 LEU 70 13.947 -3.024 -4.104
475 HD23 LEU 70 HD23 LEU 70 15.160 -4.296 -3.966
476 H GLY 71 HN GLY 71 10.953 -3.169 -1.615
477 HA2 GLY 71 HA2 GLY 71 10.352 -5.318 -0.290
478 HA3 GLY 71 HA1 GLY 71 10.770 -4.300 1.083
479 H ASP 72 HN ASP 72 9.722 -1.944 -0.479
480 HA ASP 72 HA ASP 72 6.928 -2.260 0.333
481 HB2 ASP 72 HB2 ASP 72 8.818 -0.012 0.107
482 HB3 ASP 72 HB1 ASP 72 7.191 0.349 -0.453
483 H MET 73 HN MET 73 5.325 -2.450 -1.121
484 HA MET 73 HA MET 73 5.899 -1.671 -3.895
485 HB2 MET 73 HB2 MET 73 4.688 -4.234 -2.886
486 HB3 MET 73 HB1 MET 73 4.396 -3.662 -4.524
487 HG2 MET 73 HG2 MET 73 6.703 -3.798 -5.071
488 HG3 MET 73 HG1 MET 73 7.146 -4.081 -3.390
489 HE1 MET 73 HE1 MET 73 4.660 -7.154 -5.772
490 HE2 MET 73 HE2 MET 73 4.882 -5.475 -6.264
491 HE3 MET 73 HE3 MET 73 3.937 -5.856 -4.826
492 H THR 74 HN THR 74 4.730 0.164 -3.960
493 HA THR 74 HA THR 74 1.981 0.157 -2.998
494 HB THR 74 HB THR 74 3.570 2.430 -4.210
495 HG1 THR 74 HG1 THR 74 4.527 1.828 -2.271
496 HG21 THR 74 HG21 THR 74 1.173 2.807 -4.357
497 HG22 THR 74 HG22 THR 74 1.866 3.852 -3.116
498 HG23 THR 74 HG23 THR 74 0.980 2.401 -2.651
499 H GLY 75 HN GLY 75 0.215 0.317 -4.270
500 HA2 GLY 75 HA2 GLY 75 0.629 0.416 -7.193
501 HA3 GLY 75 HA1 GLY 75 -0.438 -0.777 -6.458
502 H SER 76 HN SER 76 -1.315 1.066 -8.382
503 HA SER 76 HA SER 76 -2.512 3.351 -7.214
504 HB2 SER 76 HB2 SER 76 -3.988 3.173 -9.345
505 HB3 SER 76 HB1 SER 76 -2.258 3.456 -9.541
506 HG SER 76 HG SER 76 -3.080 1.790 -10.920
507 H ARG 77 HN ARG 77 -4.299 0.649 -8.652
508 HA ARG 77 HA ARG 77 -5.752 -0.057 -6.344
509 HB2 ARG 77 HB2 ARG 77 -6.633 2.333 -7.103
510 HB3 ARG 77 HB1 ARG 77 -7.565 1.370 -8.240
511 HG2 ARG 77 HG2 ARG 77 -8.795 0.349 -6.576
512 HG3 ARG 77 HG1 ARG 77 -7.586 0.682 -5.333
513 HD2 ARG 77 HD2 ARG 77 -9.592 2.083 -5.085
514 HD3 ARG 77 HD1 ARG 77 -8.143 3.041 -5.387
515 HE ARG 77 HE ARG 77 -9.578 2.418 -7.784
516 HH11 ARG 77 HH11 ARG 77 -9.426 4.595 -5.021
517 HH12 ARG 77 HH12 ARG 77 -10.239 5.945 -5.904
518 HH21 ARG 77 HH21 ARG 77 -10.606 4.099 -8.930
519 HH22 ARG 77 HH22 ARG 77 -10.920 5.656 -8.076
520 H THR 78 HN THR 78 -5.556 0.122 -9.836
521 HA THR 78 HA THR 78 -6.052 -2.690 -10.053
522 HB THR 78 HB THR 78 -8.379 -1.689 -9.967
523 HG1 THR 78 HG1 THR 78 -9.083 -3.103 -11.520
524 HG21 THR 78 HG21 THR 78 -7.536 -0.552 -12.635
525 HG22 THR 78 HG22 THR 78 -7.987 0.364 -11.196
526 HG23 THR 78 HG23 THR 78 -9.193 -0.609 -12.038
527 H CYS 79 HN CYS 79 -6.188 -3.208 -12.558
528 HA CYS 79 HA CYS 79 -4.569 -1.374 -14.137
529 HB2 CYS 79 HB2 CYS 79 -3.719 -4.182 -13.402
530 HB3 CYS 79 HB1 CYS 79 -3.071 -3.330 -14.798
531 H1 GAL 83 H1 GTP 1 6.236 1.883 8.572
532 H2 GAL 83 H2 GTP 1 5.728 4.096 6.504
533 H3 GAL 83 H3 GTP 1 3.857 2.151 7.936
534 H4 GAL 83 H4 GTP 1 3.508 1.301 5.659
535 H5 GAL 83 H5 GTP 1 5.219 0.315 7.100
536 H61 GAL 83 H61 GTP 1 5.382 0.294 4.187
537 H62 GAL 83 H62 GTP 1 5.583 -1.014 5.355
538 HO2 GAL 83 HO2 GTP 1 6.075 4.408 8.971
539 HO3 GAL 83 HO3 GTP 1 3.459 4.552 7.114
540 HO4 GAL 83 HO4 GTP 1 5.661 2.392 4.459
541 HO6 GAL 83 HO6 GTP 1 7.409 -0.181 3.858
542 H1 NAG 84 H1 GCP 2 9.838 3.234 4.500
543 H2 NAG 84 H2 GCP 2 10.386 3.072 7.502
544 H3 NAG 84 H3 GCP 2 7.890 3.511 5.857
545 H4 NAG 84 H4 GCP 2 9.501 5.212 7.797
546 H5 NAG 84 H5 GCP 2 8.937 5.416 4.801
547 H61 NAG 84 H61 GCP 2 9.763 7.415 6.719
548 H62 NAG 84 H62 GCP 2 9.449 7.552 4.987
549 H81 NAG 84 HC23 GCP 2 8.516 -0.889 6.581
550 H82 NAG 84 HC21 GCP 2 10.214 -1.336 6.752
551 H83 NAG 84 HC22 GCP 2 9.163 -1.314 8.166
552 HN2 NAG 84 HN2 GCP 2 9.079 1.115 5.653
553 HO1 NAG 84 HO1 GCP 2 11.790 1.984 5.853
554 HO4 NAG 84 HO4 GCP 2 7.407 5.880 8.025
555 HO6 NAG 84 HO6 GCP 2 11.768 6.341 5.189
Start of MODEL 5
1 H CYS 10 HT1 CYS 10 -0.496 -4.676 -13.955
2 HA CYS 10 HA CYS 10 -1.572 -3.364 -12.344
3 HB2 CYS 10 HB2 CYS 10 -2.754 -5.997 -11.531
4 HB3 CYS 10 HB1 CYS 10 -2.631 -4.683 -10.361
5 H VAL 11 HN VAL 11 0.879 -5.338 -12.685
6 HA VAL 11 HA VAL 11 1.828 -5.395 -9.938
7 HB VAL 11 HB VAL 11 3.314 -6.219 -12.442
8 HG11 VAL 11 HG11 VAL 11 4.756 -5.790 -10.529
9 HG12 VAL 11 HG12 VAL 11 4.696 -7.518 -10.886
10 HG13 VAL 11 HG13 VAL 11 3.773 -6.864 -9.532
11 HG21 VAL 11 HG21 VAL 11 1.251 -7.511 -12.216
12 HG22 VAL 11 HG22 VAL 11 1.687 -7.924 -10.557
13 HG23 VAL 11 HG23 VAL 11 2.666 -8.515 -11.902
14 H HIS 12 HN HIS 12 2.543 -3.517 -9.161
15 HA HIS 12 HA HIS 12 3.847 -1.614 -10.958
16 HB2 HIS 12 HB2 HIS 12 2.739 -1.370 -8.166
17 HB3 HIS 12 HB1 HIS 12 3.724 -0.107 -8.892
18 HD1 HIS 12 HD1 HIS 12 2.473 1.612 -10.160
19 HD2 HIS 12 HD2 HIS 12 0.322 -1.917 -9.785
20 HE1 HIS 12 HE1 HIS 12 0.206 2.100 -11.123
21 HE2 HIS 12 HE2 HIS 12 -1.155 0.041 -10.597
22 H THR 13 HN THR 13 4.425 -2.472 -7.561
23 HA THR 13 HA THR 13 6.315 -2.819 -6.364
24 HB THR 13 HB THR 13 7.831 -3.584 -8.842
25 HG1 THR 13 HG1 THR 13 6.402 -5.064 -9.293
26 HG21 THR 13 HG21 THR 13 8.807 -5.247 -7.394
27 HG22 THR 13 HG22 THR 13 7.650 -4.874 -6.117
28 HG23 THR 13 HG23 THR 13 8.870 -3.687 -6.573
29 H GLY 14 HN GLY 14 8.971 -2.460 -8.170
30 HA2 GLY 14 HA2 GLY 14 10.323 -0.686 -8.800
31 HA3 GLY 14 HA1 GLY 14 8.988 0.414 -8.484
32 H ASN 15 HN ASN 15 9.099 -1.414 -5.834
33 HA ASN 15 HA ASN 15 9.756 -1.104 -3.687
34 HB2 ASN 15 HB2 ASN 15 12.288 -0.158 -5.044
35 HB3 ASN 15 HB1 ASN 15 12.142 -0.446 -3.315
36 HD21 ASN 15 HD21 ASN 15 10.541 -2.762 -3.423
37 HD22 ASN 15 HD22 ASN 15 11.498 -4.042 -4.081
38 H ILE 16 HN ILE 16 8.061 0.721 -4.406
39 HA ILE 16 HA ILE 16 9.149 3.277 -3.440
40 HB ILE 16 HB ILE 16 6.661 3.094 -5.114
41 HG12 ILE 16 HG12 ILE 16 9.422 3.582 -6.241
42 HG13 ILE 16 HG11 ILE 16 8.620 2.016 -6.312
43 HG21 ILE 16 HG21 ILE 16 7.202 5.417 -5.630
44 HG22 ILE 16 HG22 ILE 16 8.676 5.293 -4.665
45 HG23 ILE 16 HG23 ILE 16 7.097 5.159 -3.887
46 HD11 ILE 16 HD11 ILE 16 6.808 3.016 -7.611
47 HD12 ILE 16 HD12 ILE 16 8.373 3.215 -8.396
48 HD13 ILE 16 HD13 ILE 16 7.632 4.573 -7.549
49 H GLY 17 HN GLY 17 8.375 3.890 -1.548
50 HA2 GLY 17 HA2 GLY 17 5.986 2.551 -0.505
51 HA3 GLY 17 HA1 GLY 17 7.186 3.415 0.447
52 H SER 18 HN SER 18 5.224 4.376 1.401
53 HA SER 18 HA SER 18 4.655 6.893 0.100
54 HB2 SER 18 HB2 SER 18 2.849 5.775 -0.896
55 HB3 SER 18 HB1 SER 18 2.567 4.767 0.521
56 HG SER 18 HG SER 18 1.632 6.470 1.561
57 H LYS 19 HN LYS 19 4.721 8.427 1.592
58 HA LYS 19 HA LYS 19 4.874 7.776 4.374
59 HB2 LYS 19 HB2 LYS 19 4.836 10.410 2.897
60 HB3 LYS 19 HB1 LYS 19 4.991 10.292 4.642
61 HG2 LYS 19 HG2 LYS 19 6.896 9.004 2.703
62 HG3 LYS 19 HG1 LYS 19 7.135 10.601 3.412
63 HD2 LYS 19 HD2 LYS 19 6.739 8.115 5.061
64 HD3 LYS 19 HD1 LYS 19 8.323 8.693 4.558
65 HE2 LYS 19 HE2 LYS 19 8.009 10.762 5.749
66 HE3 LYS 19 HE1 LYS 19 6.346 10.327 6.137
67 HZ1 LYS 19 HZ1 LYS 19 8.702 8.764 7.044
68 HZ2 LYS 19 HZ2 LYS 19 7.095 8.601 7.556
69 HZ3 LYS 19 HZ3 LYS 19 7.973 9.983 7.964
70 H ALA 20 HN ALA 20 2.285 8.135 2.343
71 HA ALA 20 HA ALA 20 0.465 9.581 3.948
72 HB1 ALA 20 HB1 ALA 20 -1.271 8.646 2.537
73 HB2 ALA 20 HB2 ALA 20 -0.138 7.457 1.897
74 HB3 ALA 20 HB3 ALA 20 0.096 9.172 1.556
75 H GLN 21 HN GLN 21 -0.941 8.933 5.498
76 HA GLN 21 HA GLN 21 -0.271 6.594 6.989
77 HB2 GLN 21 HB2 GLN 21 -0.959 8.772 7.984
78 HB3 GLN 21 HB1 GLN 21 -2.580 8.508 7.360
79 HG2 GLN 21 HG2 GLN 21 -2.066 6.198 8.766
80 HG3 GLN 21 HG1 GLN 21 -1.310 7.455 9.745
81 HE21 GLN 21 HE21 GLN 21 -2.789 7.379 11.392
82 HE22 GLN 21 HE22 GLN 21 -4.433 7.883 11.214
83 H THR 22 HN THR 22 -1.609 4.858 7.516
84 HA THR 22 HA THR 22 -3.165 3.787 5.400
85 HB THR 22 HB THR 22 -3.159 2.716 8.208
86 HG1 THR 22 HG1 THR 22 -1.096 2.187 8.058
87 HG21 THR 22 HG21 THR 22 -4.509 1.528 6.572
88 HG22 THR 22 HG22 THR 22 -3.115 0.550 7.030
89 HG23 THR 22 HG23 THR 22 -3.123 1.408 5.489
90 H ILE 23 HN ILE 23 -5.383 3.427 5.296
91 HA ILE 23 HA ILE 23 -7.088 5.337 6.476
92 HB ILE 23 HB ILE 23 -7.858 2.686 5.236
93 HG12 ILE 23 HG12 ILE 23 -7.764 5.413 3.935
94 HG13 ILE 23 HG11 ILE 23 -6.469 4.229 3.801
95 HG21 ILE 23 HG21 ILE 23 -10.034 3.724 4.841
96 HG22 ILE 23 HG22 ILE 23 -9.494 5.188 5.663
97 HG23 ILE 23 HG23 ILE 23 -9.655 3.681 6.563
98 HD11 ILE 23 HD11 ILE 23 -8.101 2.654 2.798
99 HD12 ILE 23 HD12 ILE 23 -7.822 4.112 1.845
100 HD13 ILE 23 HD13 ILE 23 -9.290 3.955 2.807
101 H GLY 24 HN GLY 24 -6.780 1.850 7.106
102 HA2 GLY 24 HA2 GLY 24 -8.012 2.319 9.747
103 HA3 GLY 24 HA1 GLY 24 -8.245 0.845 8.815
104 H GLU 25 HN GLU 25 -7.356 -0.643 10.141
105 HA GLU 25 HA GLU 25 -4.771 -0.163 11.357
106 HB2 GLU 25 HB2 GLU 25 -6.781 -2.396 11.509
107 HB3 GLU 25 HB1 GLU 25 -5.161 -2.593 12.157
108 HG2 GLU 25 HG2 GLU 25 -6.600 -1.981 13.945
109 HG3 GLU 25 HG1 GLU 25 -5.563 -0.599 13.592
110 H VAL 26 HN VAL 26 -3.028 -1.763 11.114
111 HA VAL 26 HA VAL 26 -2.580 -2.327 8.326
112 HB VAL 26 HB VAL 26 -0.824 -3.052 10.678
113 HG11 VAL 26 HG11 VAL 26 -0.384 -4.232 8.528
114 HG12 VAL 26 HG12 VAL 26 0.955 -3.228 9.083
115 HG13 VAL 26 HG13 VAL 26 -0.091 -2.663 7.780
116 HG21 VAL 26 HG21 VAL 26 -0.777 -0.577 8.956
117 HG22 VAL 26 HG22 VAL 26 0.415 -0.999 10.188
118 HG23 VAL 26 HG23 VAL 26 -1.252 -0.653 10.653
119 H LYS 27 HN LYS 27 -3.167 -4.146 7.356
120 HA LYS 27 HA LYS 27 -3.490 -6.570 8.999
121 HB2 LYS 27 HB2 LYS 27 -5.594 -5.478 8.032
122 HB3 LYS 27 HB1 LYS 27 -5.002 -5.985 6.459
123 HG2 LYS 27 HG2 LYS 27 -5.560 -8.136 6.793
124 HG3 LYS 27 HG1 LYS 27 -5.103 -8.098 8.496
125 HD2 LYS 27 HD2 LYS 27 -7.594 -6.795 7.412
126 HD3 LYS 27 HD1 LYS 27 -7.554 -8.436 8.059
127 HE2 LYS 27 HE2 LYS 27 -6.631 -7.482 10.181
128 HE3 LYS 27 HE1 LYS 27 -6.927 -5.875 9.520
129 HZ1 LYS 27 HZ1 LYS 27 -9.284 -6.492 9.307
130 HZ2 LYS 27 HZ2 LYS 27 -8.753 -6.517 10.909
131 HZ3 LYS 27 HZ3 LYS 27 -8.962 -7.968 10.064
132 H ARG 28 HN ARG 28 -2.956 -8.583 7.982
133 HA ARG 28 HA ARG 28 -0.714 -8.330 6.187
134 HB2 ARG 28 HB2 ARG 28 -1.903 -10.532 7.806
135 HB3 ARG 28 HB1 ARG 28 -0.906 -10.967 6.422
136 HG2 ARG 28 HG2 ARG 28 0.825 -9.361 7.431
137 HG3 ARG 28 HG1 ARG 28 -0.136 -9.483 8.907
138 HD2 ARG 28 HD2 ARG 28 0.171 -11.888 8.940
139 HD3 ARG 28 HD1 ARG 28 1.029 -11.826 7.400
140 HE ARG 28 HE ARG 28 2.108 -10.354 9.689
141 HH11 ARG 28 HH11 ARG 28 2.350 -13.034 7.413
142 HH12 ARG 28 HH12 ARG 28 4.081 -13.353 7.813
143 HH21 ARG 28 HH21 ARG 28 4.289 -10.721 10.204
144 HH22 ARG 28 HH22 ARG 28 5.169 -12.051 9.356
145 H ALA 29 HN ALA 29 -0.518 -9.215 4.147
146 HA ALA 29 HA ALA 29 -2.999 -10.137 2.866
147 HB1 ALA 29 HB1 ALA 29 -1.086 -8.060 1.813
148 HB2 ALA 29 HB2 ALA 29 -2.793 -7.852 2.202
149 HB3 ALA 29 HB3 ALA 29 -2.318 -8.852 0.832
150 H SER 30 HN SER 30 -2.765 -11.858 1.585
151 HA SER 30 HA SER 30 -0.350 -13.327 1.659
152 HB2 SER 30 HB2 SER 30 -2.082 -14.393 -0.314
153 HB3 SER 30 HB1 SER 30 -1.844 -14.950 1.342
154 HG SER 30 HG SER 30 -4.052 -14.155 0.503
155 H SER 31 HN SER 31 -1.763 -11.171 -0.708
156 HA SER 31 HA SER 31 0.671 -11.362 -2.285
157 HB2 SER 31 HB2 SER 31 -0.991 -13.041 -3.208
158 HB3 SER 31 HB1 SER 31 -2.023 -11.673 -3.621
159 HG SER 31 HG SER 31 0.507 -12.374 -4.658
160 H LEU 32 HN LEU 32 0.462 -9.733 -4.213
161 HA LEU 32 HA LEU 32 0.120 -7.159 -3.131
162 HB2 LEU 32 HB2 LEU 32 1.638 -7.711 -5.003
163 HB3 LEU 32 HB1 LEU 32 0.247 -8.002 -6.029
164 HG LEU 32 HG LEU 32 -0.398 -5.576 -5.643
165 HD11 LEU 32 HD11 LEU 32 1.576 -4.121 -5.034
166 HD12 LEU 32 HD12 LEU 32 2.329 -5.581 -4.391
167 HD13 LEU 32 HD13 LEU 32 0.810 -5.000 -3.710
168 HD21 LEU 32 HD21 LEU 32 0.560 -6.252 -7.736
169 HD22 LEU 32 HD22 LEU 32 2.184 -6.240 -7.047
170 HD23 LEU 32 HD23 LEU 32 1.300 -4.726 -7.245
171 H SER 33 HN SER 33 -1.843 -8.983 -5.481
172 HA SER 33 HA SER 33 -3.836 -7.005 -5.752
173 HB2 SER 33 HB2 SER 33 -3.893 -9.988 -6.251
174 HB3 SER 33 HB1 SER 33 -5.217 -8.900 -6.675
175 HG SER 33 HG SER 33 -3.302 -9.461 -8.225
176 H GLU 34 HN GLU 34 -3.282 -9.495 -3.398
177 HA GLU 34 HA GLU 34 -5.858 -9.602 -2.255
178 HB2 GLU 34 HB2 GLU 34 -3.832 -11.161 -1.878
179 HB3 GLU 34 HB1 GLU 34 -3.305 -9.969 -0.700
180 HG2 GLU 34 HG2 GLU 34 -4.448 -11.699 0.457
181 HG3 GLU 34 HG1 GLU 34 -5.472 -10.261 0.476
182 H CYS 35 HN CYS 35 -3.151 -7.432 -1.920
183 HA CYS 35 HA CYS 35 -4.149 -6.038 0.374
184 HB2 CYS 35 HB2 CYS 35 -1.739 -6.068 -0.221
185 HB3 CYS 35 HB1 CYS 35 -2.101 -5.165 -1.687
186 H ARG 36 HN ARG 36 -4.291 -5.632 -3.122
187 HA ARG 36 HA ARG 36 -5.506 -3.086 -3.167
188 HB2 ARG 36 HB2 ARG 36 -4.429 -4.310 -5.117
189 HB3 ARG 36 HB1 ARG 36 -5.905 -5.260 -5.224
190 HG2 ARG 36 HG2 ARG 36 -7.174 -3.152 -5.550
191 HG3 ARG 36 HG1 ARG 36 -5.639 -2.282 -5.589
192 HD2 ARG 36 HD2 ARG 36 -6.618 -4.380 -7.517
193 HD3 ARG 36 HD1 ARG 36 -6.319 -2.677 -7.844
194 HE ARG 36 HE ARG 36 -3.981 -3.092 -7.733
195 HH11 ARG 36 HH11 ARG 36 -5.996 -5.988 -7.617
196 HH12 ARG 36 HH12 ARG 36 -4.621 -7.088 -8.021
197 HH21 ARG 36 HH21 ARG 36 -2.223 -4.454 -8.198
198 HH22 ARG 36 HH22 ARG 36 -2.512 -6.232 -8.337
199 H ALA 37 HN ALA 37 -6.733 -6.325 -2.757
200 HA ALA 37 HA ALA 37 -9.458 -5.906 -3.218
201 HB1 ALA 37 HB1 ALA 37 -8.163 -7.810 -1.268
202 HB2 ALA 37 HB2 ALA 37 -8.490 -8.130 -2.971
203 HB3 ALA 37 HB3 ALA 37 -9.826 -7.897 -1.845
204 H ARG 38 HN ARG 38 -7.455 -5.136 -0.453
205 HA ARG 38 HA ARG 38 -9.717 -4.509 1.247
206 HB2 ARG 38 HB2 ARG 38 -6.744 -4.438 1.557
207 HB3 ARG 38 HB1 ARG 38 -7.724 -3.459 2.639
208 HG2 ARG 38 HG2 ARG 38 -7.410 -5.446 3.802
209 HG3 ARG 38 HG1 ARG 38 -9.024 -5.616 3.112
210 HD2 ARG 38 HD2 ARG 38 -7.733 -6.746 1.144
211 HD3 ARG 38 HD1 ARG 38 -6.479 -6.972 2.363
212 HE ARG 38 HE ARG 38 -8.688 -7.905 3.597
213 HH11 ARG 38 HH11 ARG 38 -7.212 -8.524 0.466
214 HH12 ARG 38 HH12 ARG 38 -7.835 -10.220 0.370
215 HH21 ARG 38 HH21 ARG 38 -9.507 -10.031 3.525
216 HH22 ARG 38 HH22 ARG 38 -9.147 -11.048 2.077
217 H CYS 39 HN CYS 39 -7.363 -2.849 -0.734
218 HA CYS 39 HA CYS 39 -8.063 -0.231 0.133
219 HB2 CYS 39 HB2 CYS 39 -6.028 -1.331 -1.398
220 HB3 CYS 39 HB1 CYS 39 -6.930 -0.337 -2.537
221 H GLN 40 HN GLN 40 -9.162 -2.320 -2.491
222 HA GLN 40 HA GLN 40 -10.608 -0.287 -3.849
223 HB2 GLN 40 HB2 GLN 40 -11.594 -2.041 -5.145
224 HB3 GLN 40 HB1 GLN 40 -9.910 -2.456 -4.871
225 HG2 GLN 40 HG2 GLN 40 -10.742 -3.887 -2.940
226 HG3 GLN 40 HG1 GLN 40 -12.355 -3.655 -3.614
227 HE21 GLN 40 HE21 GLN 40 -12.558 -5.854 -4.036
228 HE22 GLN 40 HE22 GLN 40 -11.714 -6.622 -5.335
229 H ALA 41 HN ALA 41 -11.252 -2.186 -1.055
230 HA ALA 41 HA ALA 41 -14.086 -1.978 -1.072
231 HB1 ALA 41 HB1 ALA 41 -13.978 -2.739 1.222
232 HB2 ALA 41 HB2 ALA 41 -12.252 -2.386 1.286
233 HB3 ALA 41 HB3 ALA 41 -12.850 -3.671 0.236
234 H GLU 42 HN GLU 42 -11.479 -0.011 0.222
235 HA GLU 42 HA GLU 42 -13.388 1.844 1.406
236 HB2 GLU 42 HB2 GLU 42 -10.371 1.793 1.463
237 HB3 GLU 42 HB1 GLU 42 -11.364 2.998 2.270
238 HG2 GLU 42 HG2 GLU 42 -11.529 0.046 2.824
239 HG3 GLU 42 HG1 GLU 42 -10.525 1.168 3.739
240 H LYS 43 HN LYS 43 -13.980 3.705 0.492
241 HA LYS 43 HA LYS 43 -13.151 4.303 -2.180
242 HB2 LYS 43 HB2 LYS 43 -15.456 4.709 -1.371
243 HB3 LYS 43 HB1 LYS 43 -14.841 5.935 -0.272
244 HG2 LYS 43 HG2 LYS 43 -14.027 7.211 -2.240
245 HG3 LYS 43 HG1 LYS 43 -14.813 6.021 -3.281
246 HD2 LYS 43 HD2 LYS 43 -16.971 6.582 -2.394
247 HD3 LYS 43 HD1 LYS 43 -16.247 7.632 -1.172
248 HE2 LYS 43 HE2 LYS 43 -15.430 9.123 -2.913
249 HE3 LYS 43 HE1 LYS 43 -16.087 8.056 -4.154
250 HZ1 LYS 43 HZ1 LYS 43 -17.548 9.911 -3.759
251 HZ2 LYS 43 HZ2 LYS 43 -17.664 9.525 -2.115
252 HZ3 LYS 43 HZ3 LYS 43 -18.304 8.476 -3.277
253 H GLU 44 HN GLU 44 -12.199 5.333 0.980
254 HA GLU 44 HA GLU 44 -11.012 7.808 0.286
255 HB2 GLU 44 HB2 GLU 44 -10.819 5.946 2.606
256 HB3 GLU 44 HB1 GLU 44 -9.620 7.221 2.446
257 HG2 GLU 44 HG2 GLU 44 -11.667 8.781 2.199
258 HG3 GLU 44 HG1 GLU 44 -12.561 7.440 2.914
259 H CYS 45 HN CYS 45 -9.978 4.546 -0.117
260 HA CYS 45 HA CYS 45 -7.192 4.924 -0.057
261 HB2 CYS 45 HB2 CYS 45 -7.927 2.689 0.039
262 HB3 CYS 45 HB1 CYS 45 -8.937 2.870 -1.394
263 H SER 46 HN SER 46 -5.913 5.993 -1.346
264 HA SER 46 HA SER 46 -6.818 6.599 -4.083
265 HB2 SER 46 HB2 SER 46 -5.155 8.472 -3.956
266 HB3 SER 46 HB1 SER 46 -6.441 8.603 -2.754
267 HG SER 46 HG SER 46 -4.530 8.963 -1.688
268 H HIS 47 HN HIS 47 -4.672 4.820 -2.207
269 HA HIS 47 HA HIS 47 -3.425 3.510 -4.335
270 HB2 HIS 47 HB2 HIS 47 -1.123 4.328 -4.158
271 HB3 HIS 47 HB1 HIS 47 -2.198 5.642 -4.623
272 HD1 HIS 47 HD1 HIS 47 -3.088 7.005 -2.241
273 HD2 HIS 47 HD2 HIS 47 0.635 5.143 -2.299
274 HE1 HIS 47 HE1 HIS 47 -1.761 8.086 -0.403
275 HE2 HIS 47 HE2 HIS 47 0.427 6.829 -0.354
276 H TYR 48 HN TYR 48 -2.434 1.656 -3.588
277 HA TYR 48 HA TYR 48 -2.419 1.346 -0.661
278 HB2 TYR 48 HB2 TYR 48 -2.710 -1.046 -1.020
279 HB3 TYR 48 HB1 TYR 48 -3.970 -0.158 -1.867
280 HD1 TYR 48 HD2 TYR 48 -4.031 -0.108 -4.295
281 HD2 TYR 48 HD1 TYR 48 -0.992 -2.267 -2.248
282 HE1 TYR 48 HE2 TYR 48 -3.460 -1.276 -6.380
283 HE2 TYR 48 HE1 TYR 48 -0.416 -3.442 -4.331
284 HH TYR 48 HH TYR 48 -1.875 -2.541 -7.415
285 H THR 49 HN THR 49 -0.710 0.211 0.328
286 HA THR 49 HA THR 49 1.720 -0.067 -1.308
287 HB THR 49 HB THR 49 1.600 1.024 1.517
288 HG1 THR 49 HG1 THR 49 2.296 2.301 -0.948
289 HG21 THR 49 HG21 THR 49 3.611 -0.309 1.113
290 HG22 THR 49 HG22 THR 49 4.006 1.406 1.248
291 HG23 THR 49 HG23 THR 49 3.951 0.631 -0.337
292 H TYR 50 HN TYR 50 2.003 -2.212 -1.418
293 HA TYR 50 HA TYR 50 1.435 -3.854 0.940
294 HB2 TYR 50 HB2 TYR 50 0.486 -4.637 -1.165
295 HB3 TYR 50 HB1 TYR 50 2.074 -4.611 -1.921
296 HD1 TYR 50 HD1 TYR 50 0.709 -6.037 1.268
297 HD2 TYR 50 HD2 TYR 50 2.855 -6.729 -2.341
298 HE1 TYR 50 HE1 TYR 50 1.054 -8.381 1.926
299 HE2 TYR 50 HE2 TYR 50 3.205 -9.074 -1.693
300 HH TYR 50 HH TYR 50 1.603 -10.471 1.078
301 H ASN 51 HN ASN 51 3.028 -4.274 2.289
302 HA ASN 51 HA ASN 51 5.787 -3.965 1.392
303 HB2 ASN 51 HB2 ASN 51 5.135 -2.852 3.479
304 HB3 ASN 51 HB1 ASN 51 4.649 -4.397 4.168
305 HD21 ASN 51 HD21 ASN 51 7.325 -2.401 3.162
306 HD22 ASN 51 HD22 ASN 51 8.542 -3.287 4.033
307 H VAL 52 HN VAL 52 6.403 -5.724 0.303
308 HA VAL 52 HA VAL 52 5.588 -8.376 0.937
309 HB VAL 52 HB VAL 52 6.278 -7.596 -1.337
310 HG11 VAL 52 HG11 VAL 52 9.033 -7.689 -0.125
311 HG12 VAL 52 HG12 VAL 52 8.211 -6.286 -0.809
312 HG13 VAL 52 HG13 VAL 52 8.707 -7.616 -1.856
313 HG21 VAL 52 HG21 VAL 52 7.795 -9.982 -0.291
314 HG22 VAL 52 HG22 VAL 52 7.392 -9.665 -1.980
315 HG23 VAL 52 HG23 VAL 52 6.109 -9.981 -0.809
316 H LYS 53 HN LYS 53 7.872 -6.331 2.334
317 HA LYS 53 HA LYS 53 9.888 -8.197 3.039
318 HB2 LYS 53 HB2 LYS 53 9.125 -5.447 3.866
319 HB3 LYS 53 HB1 LYS 53 10.147 -6.361 4.964
320 HG2 LYS 53 HG2 LYS 53 10.860 -6.139 2.070
321 HG3 LYS 53 HG1 LYS 53 11.237 -4.831 3.196
322 HD2 LYS 53 HD2 LYS 53 12.286 -6.676 4.650
323 HD3 LYS 53 HD1 LYS 53 12.234 -7.661 3.188
324 HE2 LYS 53 HE2 LYS 53 13.502 -4.935 3.282
325 HE3 LYS 53 HE1 LYS 53 14.393 -6.417 3.627
326 HZ1 LYS 53 HZ1 LYS 53 13.115 -5.614 1.083
327 HZ2 LYS 53 HZ2 LYS 53 13.616 -7.201 1.384
328 HZ3 LYS 53 HZ3 LYS 53 14.748 -5.947 1.373
329 H SER 54 HN SER 54 6.782 -7.388 4.403
330 HA SER 54 HA SER 54 7.242 -9.433 6.465
331 HB2 SER 54 HB2 SER 54 7.186 -6.808 7.104
332 HB3 SER 54 HB1 SER 54 5.467 -7.182 7.211
333 HG SER 54 HG SER 54 6.527 -9.139 8.455
334 H GLY 55 HN GLY 55 5.335 -8.342 3.929
335 HA2 GLY 55 HA2 GLY 55 3.470 -9.352 2.996
336 HA3 GLY 55 HA1 GLY 55 3.370 -10.401 4.406
337 H LEU 56 HN LEU 56 3.563 -6.955 4.735
338 HA LEU 56 HA LEU 56 0.867 -6.952 5.874
339 HB2 LEU 56 HB2 LEU 56 3.178 -5.035 6.164
340 HB3 LEU 56 HB1 LEU 56 1.585 -4.740 6.835
341 HG LEU 56 HG LEU 56 3.228 -7.160 7.549
342 HD11 LEU 56 HD11 LEU 56 3.081 -4.506 8.977
343 HD12 LEU 56 HD12 LEU 56 4.494 -5.179 8.164
344 HD13 LEU 56 HD13 LEU 56 3.845 -5.968 9.601
345 HD21 LEU 56 HD21 LEU 56 1.738 -7.362 9.404
346 HD22 LEU 56 HD22 LEU 56 0.761 -7.201 7.946
347 HD23 LEU 56 HD23 LEU 56 0.967 -5.821 9.026
348 H CYS 57 HN CYS 57 -0.722 -5.656 5.153
349 HA CYS 57 HA CYS 57 -0.240 -4.247 2.620
350 HB2 CYS 57 HB2 CYS 57 -1.916 -5.967 2.416
351 HB3 CYS 57 HB1 CYS 57 -2.748 -5.395 3.856
352 H TYR 58 HN TYR 58 -0.626 -2.097 2.461
353 HA TYR 58 HA TYR 58 -1.728 -0.764 4.844
354 HB2 TYR 58 HB2 TYR 58 0.527 0.223 3.094
355 HB3 TYR 58 HB1 TYR 58 -0.186 1.111 4.432
356 HD1 TYR 58 HD2 TYR 58 1.996 -1.682 3.492
357 HD2 TYR 58 HD1 TYR 58 0.364 0.555 6.722
358 HE1 TYR 58 HE2 TYR 58 3.679 -2.642 5.002
359 HE2 TYR 58 HE1 TYR 58 2.053 -0.394 8.239
360 HH TYR 58 HH TYR 58 4.778 -2.105 7.093
361 HA PRO 59 HA PRO 59 -4.283 0.673 1.274
362 HB2 PRO 59 HB2 PRO 59 -6.351 0.861 3.357
363 HB3 PRO 59 HB1 PRO 59 -6.397 -0.018 1.824
364 HG2 PRO 59 HG2 PRO 59 -6.260 -1.300 4.182
365 HG3 PRO 59 HG1 PRO 59 -5.477 -1.924 2.717
366 HD2 PRO 59 HD2 PRO 59 -4.262 -0.483 5.032
367 HD3 PRO 59 HD1 PRO 59 -3.637 -1.865 4.107
368 H LYS 60 HN LYS 60 -3.420 2.714 1.058
369 HA LYS 60 HA LYS 60 -3.742 4.561 3.307
370 HB2 LYS 60 HB2 LYS 60 -1.867 4.611 0.948
371 HB3 LYS 60 HB1 LYS 60 -2.001 5.914 2.125
372 HG2 LYS 60 HG2 LYS 60 -1.133 4.618 3.846
373 HG3 LYS 60 HG1 LYS 60 -1.465 3.109 3.001
374 HD2 LYS 60 HD2 LYS 60 0.256 3.729 1.329
375 HD3 LYS 60 HD1 LYS 60 0.648 5.142 2.316
376 HE2 LYS 60 HE2 LYS 60 1.076 3.579 4.221
377 HE3 LYS 60 HE1 LYS 60 0.887 2.242 3.091
378 HZ1 LYS 60 HZ1 LYS 60 2.736 3.142 1.804
379 HZ2 LYS 60 HZ2 LYS 60 3.202 2.771 3.390
380 HZ3 LYS 60 HZ3 LYS 60 2.938 4.379 2.943
381 H ARG 61 HN ARG 61 -4.210 6.744 2.928
382 HA ARG 61 HA ARG 61 -5.956 7.256 0.611
383 HB2 ARG 61 HB2 ARG 61 -7.368 8.603 2.157
384 HB3 ARG 61 HB1 ARG 61 -7.329 6.898 2.590
385 HG2 ARG 61 HG2 ARG 61 -5.529 7.465 4.248
386 HG3 ARG 61 HG1 ARG 61 -5.864 9.164 3.916
387 HD2 ARG 61 HD2 ARG 61 -7.961 9.071 4.889
388 HD3 ARG 61 HD1 ARG 61 -8.082 7.320 4.698
389 HE ARG 61 HE ARG 61 -5.960 8.151 6.451
390 HH11 ARG 61 HH11 ARG 61 -9.398 7.406 6.227
391 HH12 ARG 61 HH12 ARG 61 -9.507 6.938 7.969
392 HH21 ARG 61 HH21 ARG 61 -6.054 7.541 8.637
393 HH22 ARG 61 HH22 ARG 61 -7.642 6.997 9.310
394 H GLY 62 HN GLY 62 -6.490 9.858 0.936
395 HA2 GLY 62 HA2 GLY 62 -5.678 11.993 0.833
396 HA3 GLY 62 HA1 GLY 62 -4.305 11.465 1.790
397 H LYS 63 HN LYS 63 -3.178 13.007 0.363
398 HA LYS 63 HA LYS 63 -2.825 12.279 -2.385
399 HB2 LYS 63 HB2 LYS 63 -1.267 14.125 -2.496
400 HB3 LYS 63 HB1 LYS 63 -2.706 14.627 -1.620
401 HG2 LYS 63 HG2 LYS 63 -1.575 14.501 0.471
402 HG3 LYS 63 HG1 LYS 63 -0.167 13.738 -0.274
403 HD2 LYS 63 HD2 LYS 63 -0.054 15.871 -1.714
404 HD3 LYS 63 HD1 LYS 63 -1.124 16.566 -0.496
405 HE2 LYS 63 HE2 LYS 63 0.469 16.235 1.226
406 HE3 LYS 63 HE1 LYS 63 1.474 15.222 0.191
407 HZ1 LYS 63 HZ1 LYS 63 2.451 17.375 0.342
408 HZ2 LYS 63 HZ2 LYS 63 1.007 18.136 -0.091
409 HZ3 LYS 63 HZ3 LYS 63 1.837 17.200 -1.224
410 HA PRO 64 HA PRO 64 0.380 9.326 -1.821
411 HB2 PRO 64 HB2 PRO 64 1.564 9.460 -4.262
412 HB3 PRO 64 HB1 PRO 64 0.000 8.679 -3.988
413 HG2 PRO 64 HG2 PRO 64 0.579 11.390 -5.081
414 HG3 PRO 64 HG1 PRO 64 -0.640 10.206 -5.594
415 HD2 PRO 64 HD2 PRO 64 -1.240 12.350 -4.043
416 HD3 PRO 64 HD1 PRO 64 -2.120 10.810 -3.951
417 H GLN 65 HN GLN 65 2.253 9.404 -0.851
418 HA GLN 65 HA GLN 65 4.182 11.523 -1.517
419 HB2 GLN 65 HB2 GLN 65 3.494 10.416 1.220
420 HB3 GLN 65 HB1 GLN 65 4.870 11.461 0.897
421 HG2 GLN 65 HG2 GLN 65 3.609 13.315 0.746
422 HG3 GLN 65 HG1 GLN 65 2.252 12.468 0.002
423 HE21 GLN 65 HE21 GLN 65 0.639 11.659 1.279
424 HE22 GLN 65 HE22 GLN 65 0.543 11.944 2.983
425 H PHE 66 HN PHE 66 5.166 10.046 -2.927
426 HA PHE 66 HA PHE 66 5.919 7.418 -2.101
427 HB2 PHE 66 HB2 PHE 66 6.771 9.020 -4.512
428 HB3 PHE 66 HB1 PHE 66 7.040 7.298 -4.283
429 HD1 PHE 66 HD1 PHE 66 4.327 6.637 -3.080
430 HD2 PHE 66 HD2 PHE 66 5.464 8.963 -6.457
431 HE1 PHE 66 HE1 PHE 66 2.154 6.172 -4.136
432 HE2 PHE 66 HE2 PHE 66 3.292 8.500 -7.515
433 HZ PHE 66 HZ PHE 66 1.636 7.104 -6.353
434 H TYR 67 HN TYR 67 7.950 6.548 -1.912
435 HA TYR 67 HA TYR 67 10.330 8.125 -1.840
436 HB2 TYR 67 HB2 TYR 67 10.866 8.025 0.459
437 HB3 TYR 67 HB1 TYR 67 9.200 8.571 0.414
438 HD1 TYR 67 HD2 TYR 67 7.368 6.965 1.026
439 HD2 TYR 67 HD1 TYR 67 11.482 6.010 1.553
440 HE1 TYR 67 HE2 TYR 67 6.750 5.172 2.592
441 HE2 TYR 67 HE1 TYR 67 10.869 4.220 3.121
442 HH TYR 67 HH TYR 67 7.894 2.921 3.357
443 H LYS 68 HN LYS 68 12.194 6.806 -1.843
444 HA LYS 68 HA LYS 68 11.760 4.213 -2.919
445 HB2 LYS 68 HB2 LYS 68 14.246 5.698 -2.102
446 HB3 LYS 68 HB1 LYS 68 14.302 4.062 -2.738
447 HG2 LYS 68 HG2 LYS 68 12.748 5.921 -4.372
448 HG3 LYS 68 HG1 LYS 68 14.458 6.332 -4.226
449 HD2 LYS 68 HD2 LYS 68 14.259 4.932 -6.135
450 HD3 LYS 68 HD1 LYS 68 14.968 3.944 -4.860
451 HE2 LYS 68 HE2 LYS 68 12.796 2.944 -4.404
452 HE3 LYS 68 HE1 LYS 68 12.049 3.970 -5.626
453 HZ1 LYS 68 HZ1 LYS 68 12.430 1.818 -6.549
454 HZ2 LYS 68 HZ2 LYS 68 14.058 1.837 -6.083
455 HZ3 LYS 68 HZ3 LYS 68 13.512 2.894 -7.277
456 H TYR 69 HN TYR 69 11.539 2.318 -1.938
457 HA TYR 69 HA TYR 69 12.903 1.747 0.558
458 HB2 TYR 69 HB2 TYR 69 10.570 2.837 1.013
459 HB3 TYR 69 HB1 TYR 69 9.943 1.264 0.528
460 HD1 TYR 69 HD1 TYR 69 12.688 2.560 2.706
461 HD2 TYR 69 HD2 TYR 69 9.445 -0.162 2.279
462 HE1 TYR 69 HE1 TYR 69 13.096 1.722 4.977
463 HE2 TYR 69 HE2 TYR 69 9.851 -1.008 4.552
464 HH TYR 69 HH TYR 69 12.002 0.593 6.733
465 H LEU 70 HN LEU 70 13.789 -0.181 0.232
466 HA LEU 70 HA LEU 70 12.874 -1.939 -1.829
467 HB2 LEU 70 HB2 LEU 70 15.263 -1.541 -0.507
468 HB3 LEU 70 HB1 LEU 70 14.731 -3.096 0.101
469 HG LEU 70 HG LEU 70 15.082 -2.397 -2.815
470 HD11 LEU 70 HD11 LEU 70 17.195 -2.532 -1.558
471 HD12 LEU 70 HD12 LEU 70 17.025 -3.816 -2.753
472 HD13 LEU 70 HD13 LEU 70 16.758 -4.160 -1.045
473 HD21 LEU 70 HD21 LEU 70 14.434 -5.019 -1.471
474 HD22 LEU 70 HD22 LEU 70 14.786 -4.803 -3.185
475 HD23 LEU 70 HD23 LEU 70 13.346 -4.067 -2.483
476 H GLY 71 HN GLY 71 10.728 -2.386 -1.157
477 HA2 GLY 71 HA2 GLY 71 10.154 -4.800 -0.163
478 HA3 GLY 71 HA1 GLY 71 10.333 -3.860 1.312
479 H ASP 72 HN ASP 72 9.294 -1.461 -0.207
480 HA ASP 72 HA ASP 72 6.481 -2.023 0.287
481 HB2 ASP 72 HB2 ASP 72 8.148 0.446 0.098
482 HB3 ASP 72 HB1 ASP 72 6.434 0.579 -0.272
483 H MET 73 HN MET 73 5.066 -2.382 -1.264
484 HA MET 73 HA MET 73 5.762 -1.634 -4.031
485 HB2 MET 73 HB2 MET 73 3.987 -3.905 -3.103
486 HB3 MET 73 HB1 MET 73 4.408 -3.534 -4.768
487 HG2 MET 73 HG2 MET 73 6.682 -4.156 -4.407
488 HG3 MET 73 HG1 MET 73 6.428 -4.289 -2.669
489 HE1 MET 73 HE1 MET 73 4.653 -7.218 -5.777
490 HE2 MET 73 HE2 MET 73 5.722 -5.881 -6.193
491 HE3 MET 73 HE3 MET 73 4.092 -5.556 -5.607
492 H THR 74 HN THR 74 4.744 0.344 -4.105
493 HA THR 74 HA THR 74 1.977 0.547 -3.236
494 HB THR 74 HB THR 74 3.836 2.662 -4.340
495 HG1 THR 74 HG1 THR 74 4.582 2.227 -2.350
496 HG21 THR 74 HG21 THR 74 1.497 3.245 -4.741
497 HG22 THR 74 HG22 THR 74 2.187 4.267 -3.481
498 HG23 THR 74 HG23 THR 74 1.118 2.933 -3.048
499 H GLY 75 HN GLY 75 0.243 0.795 -4.528
500 HA2 GLY 75 HA2 GLY 75 0.625 1.115 -7.417
501 HA3 GLY 75 HA1 GLY 75 -0.250 -0.302 -6.848
502 H SER 76 HN SER 76 -1.801 1.006 -8.410
503 HA SER 76 HA SER 76 -3.185 3.167 -7.037
504 HB2 SER 76 HB2 SER 76 -3.808 1.913 -9.720
505 HB3 SER 76 HB1 SER 76 -4.405 3.455 -9.105
506 HG SER 76 HG SER 76 -2.491 4.367 -9.454
507 H ARG 77 HN ARG 77 -5.460 3.087 -6.598
508 HA ARG 77 HA ARG 77 -6.288 0.814 -5.225
509 HB2 ARG 77 HB2 ARG 77 -7.168 3.065 -4.803
510 HB3 ARG 77 HB1 ARG 77 -8.002 3.034 -6.350
511 HG2 ARG 77 HG2 ARG 77 -9.357 1.146 -5.580
512 HG3 ARG 77 HG1 ARG 77 -8.534 1.194 -4.022
513 HD2 ARG 77 HD2 ARG 77 -9.485 3.267 -3.463
514 HD3 ARG 77 HD1 ARG 77 -9.973 3.583 -5.125
515 HE ARG 77 HE ARG 77 -11.286 1.759 -3.243
516 HH11 ARG 77 HH11 ARG 77 -11.214 3.466 -6.318
517 HH12 ARG 77 HH12 ARG 77 -12.891 2.979 -6.763
518 HH21 ARG 77 HH21 ARG 77 -13.414 1.099 -3.771
519 HH22 ARG 77 HH22 ARG 77 -14.128 1.656 -5.336
520 H THR 78 HN THR 78 -6.764 1.661 -8.590
521 HA THR 78 HA THR 78 -8.580 -0.615 -8.910
522 HB THR 78 HB THR 78 -9.268 1.574 -9.881
523 HG1 THR 78 HG1 THR 78 -8.803 -0.593 -11.681
524 HG21 THR 78 HG21 THR 78 -8.149 2.305 -11.977
525 HG22 THR 78 HG22 THR 78 -6.884 1.116 -11.677
526 HG23 THR 78 HG23 THR 78 -7.121 2.453 -10.553
527 H CYS 79 HN CYS 79 -5.332 -0.189 -8.956
528 HA CYS 79 HA CYS 79 -4.777 -2.597 -10.277
529 HB2 CYS 79 HB2 CYS 79 -5.359 -0.954 -12.229
530 HB3 CYS 79 HB1 CYS 79 -3.765 -0.282 -11.910
531 H1 GAL 83 H1 GTP 1 5.449 2.302 8.314
532 H2 GAL 83 H2 GTP 1 5.325 4.178 5.908
533 H3 GAL 83 H3 GTP 1 3.292 2.334 7.222
534 H4 GAL 83 H4 GTP 1 3.459 1.119 5.094
535 H5 GAL 83 H5 GTP 1 4.894 0.491 6.952
536 H61 GAL 83 H61 GTP 1 6.893 0.336 4.782
537 H62 GAL 83 H62 GTP 1 5.292 -0.284 4.377
538 HO2 GAL 83 HO2 GTP 1 4.717 4.455 8.589
539 HO3 GAL 83 HO3 GTP 1 2.614 4.437 6.238
540 HO4 GAL 83 HO4 GTP 1 5.496 1.893 3.815
541 HO6 GAL 83 HO6 GTP 1 6.853 -1.800 5.376
542 H1 NAG 84 H1 GCP 2 10.250 2.991 5.549
543 H2 NAG 84 H2 GCP 2 9.595 3.472 8.508
544 H3 NAG 84 H3 GCP 2 7.887 3.487 5.992
545 H4 NAG 84 H4 GCP 2 8.768 5.636 7.965
546 H5 NAG 84 H5 GCP 2 9.384 5.110 5.013
547 H61 NAG 84 H61 GCP 2 9.420 7.434 5.193
548 H62 NAG 84 H62 GCP 2 11.093 6.953 5.489
549 H81 NAG 84 HC23 GCP 2 7.769 -0.692 9.428
550 H82 NAG 84 HC21 GCP 2 7.839 -0.589 7.671
551 H83 NAG 84 HC22 GCP 2 9.294 -0.978 8.591
552 HN2 NAG 84 HN2 GCP 2 9.117 1.140 6.734
553 HO1 NAG 84 HO1 GCP 2 12.413 3.249 6.792
554 HO4 NAG 84 HO4 GCP 2 6.582 5.756 7.005
555 HO6 NAG 84 HO6 GCP 2 10.649 7.291 7.732
Start of MODEL 6
1 H CYS 10 HT1 CYS 10 0.361 0.444 -15.195
2 HA CYS 10 HA CYS 10 -1.173 2.318 -13.514
3 HB2 CYS 10 HB2 CYS 10 -1.964 0.243 -12.350
4 HB3 CYS 10 HB1 CYS 10 -2.607 0.446 -13.975
5 H VAL 11 HN VAL 11 -0.458 2.370 -11.336
6 HA VAL 11 HA VAL 11 2.365 1.991 -11.054
7 HB VAL 11 HB VAL 11 0.360 2.655 -8.888
8 HG11 VAL 11 HG11 VAL 11 2.539 1.901 -8.053
9 HG12 VAL 11 HG12 VAL 11 2.266 3.608 -7.709
10 HG13 VAL 11 HG13 VAL 11 3.337 3.135 -9.028
11 HG21 VAL 11 HG21 VAL 11 2.005 4.572 -10.531
12 HG22 VAL 11 HG22 VAL 11 0.794 4.969 -9.313
13 HG23 VAL 11 HG23 VAL 11 0.304 4.217 -10.833
14 H HIS 12 HN HIS 12 3.387 0.202 -10.439
15 HA HIS 12 HA HIS 12 2.314 -1.524 -8.417
16 HB2 HIS 12 HB2 HIS 12 2.196 -3.568 -9.708
17 HB3 HIS 12 HB1 HIS 12 1.141 -2.371 -10.444
18 HD1 HIS 12 HD1 HIS 12 3.998 -4.586 -11.149
19 HD2 HIS 12 HD2 HIS 12 2.166 -1.306 -12.933
20 HE1 HIS 12 HE1 HIS 12 4.836 -4.546 -13.515
21 HE2 HIS 12 HE2 HIS 12 3.595 -2.654 -14.615
22 H THR 13 HN THR 13 3.921 -2.282 -7.243
23 HA THR 13 HA THR 13 5.996 -2.792 -6.496
24 HB THR 13 HB THR 13 6.964 -3.545 -9.209
25 HG1 THR 13 HG1 THR 13 5.441 -5.544 -8.329
26 HG21 THR 13 HG21 THR 13 6.866 -5.080 -6.608
27 HG22 THR 13 HG22 THR 13 8.198 -4.032 -7.085
28 HG23 THR 13 HG23 THR 13 7.819 -5.466 -8.040
29 H GLY 14 HN GLY 14 8.427 -2.666 -8.338
30 HA2 GLY 14 HA2 GLY 14 9.928 -1.099 -9.141
31 HA3 GLY 14 HA1 GLY 14 8.682 0.130 -8.985
32 H ASN 15 HN ASN 15 9.462 -1.909 -6.298
33 HA ASN 15 HA ASN 15 10.004 -1.364 -4.154
34 HB2 ASN 15 HB2 ASN 15 12.380 -0.528 -3.934
35 HB3 ASN 15 HB1 ASN 15 12.156 -2.004 -4.856
36 HD21 ASN 15 HD21 ASN 15 12.792 1.439 -5.091
37 HD22 ASN 15 HD22 ASN 15 13.535 1.385 -6.654
38 H ILE 16 HN ILE 16 8.192 0.373 -4.692
39 HA ILE 16 HA ILE 16 9.222 2.928 -3.658
40 HB ILE 16 HB ILE 16 7.070 2.518 -5.741
41 HG12 ILE 16 HG12 ILE 16 9.341 2.608 -6.633
42 HG13 ILE 16 HG11 ILE 16 8.442 4.050 -7.087
43 HG21 ILE 16 HG21 ILE 16 6.257 4.136 -4.135
44 HG22 ILE 16 HG22 ILE 16 6.676 4.937 -5.649
45 HG23 ILE 16 HG23 ILE 16 7.760 5.051 -4.263
46 HD11 ILE 16 HD11 ILE 16 10.617 4.742 -6.495
47 HD12 ILE 16 HD12 ILE 16 10.587 3.801 -5.005
48 HD13 ILE 16 HD13 ILE 16 9.555 5.222 -5.171
49 H GLY 17 HN GLY 17 8.367 3.458 -1.775
50 HA2 GLY 17 HA2 GLY 17 5.911 2.072 -0.915
51 HA3 GLY 17 HA1 GLY 17 7.137 2.731 0.163
52 H SER 18 HN SER 18 4.616 3.417 0.721
53 HA SER 18 HA SER 18 4.472 6.197 -0.219
54 HB2 SER 18 HB2 SER 18 2.163 4.331 0.353
55 HB3 SER 18 HB1 SER 18 2.004 6.052 0.002
56 HG SER 18 HG SER 18 3.203 4.135 -1.728
57 H LYS 19 HN LYS 19 5.186 7.361 1.438
58 HA LYS 19 HA LYS 19 4.600 6.599 4.176
59 HB2 LYS 19 HB2 LYS 19 6.823 7.541 3.472
60 HB3 LYS 19 HB1 LYS 19 6.016 9.071 3.158
61 HG2 LYS 19 HG2 LYS 19 5.269 9.010 5.579
62 HG3 LYS 19 HG1 LYS 19 6.424 7.692 5.792
63 HD2 LYS 19 HD2 LYS 19 7.431 9.814 6.424
64 HD3 LYS 19 HD1 LYS 19 8.228 9.157 4.994
65 HE2 LYS 19 HE2 LYS 19 7.757 11.622 4.899
66 HE3 LYS 19 HE1 LYS 19 7.099 10.688 3.559
67 HZ1 LYS 19 HZ1 LYS 19 5.584 11.659 5.924
68 HZ2 LYS 19 HZ2 LYS 19 4.938 10.708 4.685
69 HZ3 LYS 19 HZ3 LYS 19 5.483 12.274 4.349
70 H ALA 20 HN ALA 20 2.253 6.818 3.436
71 HA ALA 20 HA ALA 20 1.320 9.564 3.947
72 HB1 ALA 20 HB1 ALA 20 -0.654 9.000 2.531
73 HB2 ALA 20 HB2 ALA 20 0.149 7.493 2.093
74 HB3 ALA 20 HB3 ALA 20 0.873 9.040 1.649
75 H GLN 21 HN GLN 21 -1.111 9.463 4.599
76 HA GLN 21 HA GLN 21 -1.246 8.028 7.055
77 HB2 GLN 21 HB2 GLN 21 -2.286 10.332 6.313
78 HB3 GLN 21 HB1 GLN 21 -3.640 9.329 5.813
79 HG2 GLN 21 HG2 GLN 21 -2.620 8.867 8.541
80 HG3 GLN 21 HG1 GLN 21 -3.409 10.417 8.253
81 HE21 GLN 21 HE21 GLN 21 -4.283 8.217 9.914
82 HE22 GLN 21 HE22 GLN 21 -5.816 7.705 9.303
83 H THR 22 HN THR 22 -2.207 6.165 7.541
84 HA THR 22 HA THR 22 -3.255 4.520 5.404
85 HB THR 22 HB THR 22 -3.102 3.694 8.293
86 HG1 THR 22 HG1 THR 22 -1.012 3.991 8.214
87 HG21 THR 22 HG21 THR 22 -2.570 1.499 7.280
88 HG22 THR 22 HG22 THR 22 -2.746 2.219 5.678
89 HG23 THR 22 HG23 THR 22 -4.137 2.121 6.757
90 H ILE 23 HN ILE 23 -5.335 3.696 5.279
91 HA ILE 23 HA ILE 23 -7.422 5.349 6.196
92 HB ILE 23 HB ILE 23 -7.502 2.567 5.025
93 HG12 ILE 23 HG12 ILE 23 -8.146 5.238 3.768
94 HG13 ILE 23 HG11 ILE 23 -6.586 4.441 3.620
95 HG21 ILE 23 HG21 ILE 23 -9.519 3.164 6.410
96 HG22 ILE 23 HG22 ILE 23 -9.840 2.793 4.716
97 HG23 ILE 23 HG23 ILE 23 -9.822 4.469 5.261
98 HD11 ILE 23 HD11 ILE 23 -7.597 2.594 2.455
99 HD12 ILE 23 HD12 ILE 23 -8.021 4.109 1.661
100 HD13 ILE 23 HD13 ILE 23 -9.201 3.290 2.683
101 H GLY 24 HN GLY 24 -6.357 2.127 7.333
102 HA2 GLY 24 HA2 GLY 24 -7.602 2.724 9.891
103 HA3 GLY 24 HA1 GLY 24 -8.266 1.350 9.027
104 H GLU 25 HN GLU 25 -7.684 -0.189 10.444
105 HA GLU 25 HA GLU 25 -5.146 -0.421 11.674
106 HB2 GLU 25 HB2 GLU 25 -7.056 -1.448 12.702
107 HB3 GLU 25 HB1 GLU 25 -7.394 -2.397 11.262
108 HG2 GLU 25 HG2 GLU 25 -4.781 -3.065 12.003
109 HG3 GLU 25 HG1 GLU 25 -5.706 -3.012 13.503
110 H VAL 26 HN VAL 26 -3.328 -1.444 11.089
111 HA VAL 26 HA VAL 26 -2.979 -2.226 8.363
112 HB VAL 26 HB VAL 26 -1.104 -2.545 10.717
113 HG11 VAL 26 HG11 VAL 26 -0.549 -4.041 8.863
114 HG12 VAL 26 HG12 VAL 26 0.661 -2.773 9.055
115 HG13 VAL 26 HG13 VAL 26 -0.528 -2.666 7.759
116 HG21 VAL 26 HG21 VAL 26 -1.682 -0.210 10.327
117 HG22 VAL 26 HG22 VAL 26 -1.249 -0.372 8.625
118 HG23 VAL 26 HG23 VAL 26 -0.008 -0.525 9.871
119 H LYS 27 HN LYS 27 -3.332 -4.175 7.524
120 HA LYS 27 HA LYS 27 -3.486 -6.467 9.369
121 HB2 LYS 27 HB2 LYS 27 -5.047 -6.198 6.801
122 HB3 LYS 27 HB1 LYS 27 -5.270 -7.385 8.077
123 HG2 LYS 27 HG2 LYS 27 -6.208 -5.800 9.540
124 HG3 LYS 27 HG1 LYS 27 -5.668 -4.448 8.541
125 HD2 LYS 27 HD2 LYS 27 -7.191 -5.794 6.759
126 HD3 LYS 27 HD1 LYS 27 -8.033 -6.190 8.261
127 HE2 LYS 27 HE2 LYS 27 -7.315 -3.393 7.387
128 HE3 LYS 27 HE1 LYS 27 -8.885 -4.147 7.115
129 HZ1 LYS 27 HZ1 LYS 27 -8.459 -2.649 9.194
130 HZ2 LYS 27 HZ2 LYS 27 -7.827 -4.076 9.857
131 HZ3 LYS 27 HZ3 LYS 27 -9.430 -4.025 9.311
132 H ARG 28 HN ARG 28 -2.843 -8.516 8.539
133 HA ARG 28 HA ARG 28 -0.615 -8.335 6.717
134 HB2 ARG 28 HB2 ARG 28 -0.385 -9.721 8.683
135 HB3 ARG 28 HB1 ARG 28 -1.811 -10.651 8.252
136 HG2 ARG 28 HG2 ARG 28 -0.703 -11.673 6.424
137 HG3 ARG 28 HG1 ARG 28 0.659 -10.557 6.538
138 HD2 ARG 28 HD2 ARG 28 1.205 -12.759 7.459
139 HD3 ARG 28 HD1 ARG 28 1.278 -11.497 8.685
140 HE ARG 28 HE ARG 28 -1.221 -12.959 8.513
141 HH11 ARG 28 HH11 ARG 28 1.923 -12.602 10.054
142 HH12 ARG 28 HH12 ARG 28 1.430 -13.508 11.533
143 HH21 ARG 28 HH21 ARG 28 -1.889 -14.113 10.376
144 HH22 ARG 28 HH22 ARG 28 -0.697 -14.354 11.710
145 H ALA 29 HN ALA 29 -0.477 -9.198 4.691
146 HA ALA 29 HA ALA 29 -2.965 -10.291 3.557
147 HB1 ALA 29 HB1 ALA 29 -0.992 -8.436 2.230
148 HB2 ALA 29 HB2 ALA 29 -2.631 -8.029 2.739
149 HB3 ALA 29 HB3 ALA 29 -2.372 -9.187 1.434
150 H SER 30 HN SER 30 -2.721 -11.901 1.971
151 HA SER 30 HA SER 30 -0.274 -13.426 2.235
152 HB2 SER 30 HB2 SER 30 -1.911 -14.862 0.555
153 HB3 SER 30 HB1 SER 30 -1.876 -15.011 2.312
154 HG SER 30 HG SER 30 -3.831 -14.017 0.697
155 H SER 31 HN SER 31 -1.560 -11.163 0.070
156 HA SER 31 HA SER 31 0.620 -11.466 -1.739
157 HB2 SER 31 HB2 SER 31 -0.883 -11.845 -3.760
158 HB3 SER 31 HB1 SER 31 -0.646 -13.240 -2.708
159 HG SER 31 HG SER 31 -2.725 -13.278 -2.480
160 H LEU 32 HN LEU 32 0.187 -9.984 -3.754
161 HA LEU 32 HA LEU 32 -0.305 -7.375 -2.769
162 HB2 LEU 32 HB2 LEU 32 1.245 -7.926 -4.632
163 HB3 LEU 32 HB1 LEU 32 -0.140 -8.310 -5.635
164 HG LEU 32 HG LEU 32 -0.907 -5.921 -5.308
165 HD11 LEU 32 HD11 LEU 32 1.835 -5.728 -4.088
166 HD12 LEU 32 HD12 LEU 32 0.290 -5.269 -3.374
167 HD13 LEU 32 HD13 LEU 32 0.955 -4.335 -4.714
168 HD21 LEU 32 HD21 LEU 32 0.647 -5.033 -6.978
169 HD22 LEU 32 HD22 LEU 32 0.141 -6.676 -7.371
170 HD23 LEU 32 HD23 LEU 32 1.738 -6.388 -6.684
171 H SER 33 HN SER 33 -2.135 -9.528 -4.920
172 HA SER 33 HA SER 33 -4.293 -7.804 -5.403
173 HB2 SER 33 HB2 SER 33 -4.543 -10.807 -5.236
174 HB3 SER 33 HB1 SER 33 -5.408 -9.693 -6.299
175 HG SER 33 HG SER 33 -3.872 -10.008 -7.686
176 H GLU 34 HN GLU 34 -3.578 -10.015 -2.781
177 HA GLU 34 HA GLU 34 -6.084 -9.990 -1.499
178 HB2 GLU 34 HB2 GLU 34 -3.880 -11.395 -1.084
179 HB3 GLU 34 HB1 GLU 34 -3.546 -10.123 0.083
180 HG2 GLU 34 HG2 GLU 34 -4.601 -11.993 1.171
181 HG3 GLU 34 HG1 GLU 34 -5.687 -10.604 1.188
182 H CYS 35 HN CYS 35 -3.300 -7.863 -1.369
183 HA CYS 35 HA CYS 35 -4.272 -6.213 0.752
184 HB2 CYS 35 HB2 CYS 35 -1.872 -6.365 0.225
185 HB3 CYS 35 HB1 CYS 35 -2.168 -5.659 -1.361
186 H ARG 36 HN ARG 36 -4.329 -6.081 -2.772
187 HA ARG 36 HA ARG 36 -5.387 -3.521 -3.126
188 HB2 ARG 36 HB2 ARG 36 -4.491 -5.071 -4.912
189 HB3 ARG 36 HB1 ARG 36 -6.021 -5.933 -4.833
190 HG2 ARG 36 HG2 ARG 36 -7.081 -3.625 -5.298
191 HG3 ARG 36 HG1 ARG 36 -5.460 -3.174 -5.833
192 HD2 ARG 36 HD2 ARG 36 -6.670 -3.901 -7.752
193 HD3 ARG 36 HD1 ARG 36 -5.509 -5.166 -7.349
194 HE ARG 36 HE ARG 36 -8.315 -5.349 -6.469
195 HH11 ARG 36 HH11 ARG 36 -5.579 -6.609 -8.283
196 HH12 ARG 36 HH12 ARG 36 -6.351 -8.213 -8.558
197 HH21 ARG 36 HH21 ARG 36 -9.333 -7.363 -6.801
198 HH22 ARG 36 HH22 ARG 36 -8.453 -8.635 -7.729
199 H ALA 37 HN ALA 37 -6.996 -6.615 -2.544
200 HA ALA 37 HA ALA 37 -9.646 -5.804 -2.882
201 HB1 ALA 37 HB1 ALA 37 -8.929 -8.146 -2.665
202 HB2 ALA 37 HB2 ALA 37 -10.254 -7.749 -1.570
203 HB3 ALA 37 HB3 ALA 37 -8.606 -7.875 -0.953
204 H ARG 38 HN ARG 38 -7.511 -5.533 -0.091
205 HA ARG 38 HA ARG 38 -9.524 -4.668 1.730
206 HB2 ARG 38 HB2 ARG 38 -6.553 -4.786 1.739
207 HB3 ARG 38 HB1 ARG 38 -7.317 -3.671 2.863
208 HG2 ARG 38 HG2 ARG 38 -7.041 -5.628 4.090
209 HG3 ARG 38 HG1 ARG 38 -8.735 -5.666 3.593
210 HD2 ARG 38 HD2 ARG 38 -7.756 -6.977 1.536
211 HD3 ARG 38 HD1 ARG 38 -6.439 -7.313 2.657
212 HE ARG 38 HE ARG 38 -8.684 -7.926 4.068
213 HH11 ARG 38 HH11 ARG 38 -7.353 -8.884 0.971
214 HH12 ARG 38 HH12 ARG 38 -8.101 -10.531 1.014
215 HH21 ARG 38 HH21 ARG 38 -9.688 -9.972 4.177
216 HH22 ARG 38 HH22 ARG 38 -9.430 -11.136 2.821
217 H CYS 39 HN CYS 39 -7.333 -3.079 -0.481
218 HA CYS 39 HA CYS 39 -7.878 -0.441 0.445
219 HB2 CYS 39 HB2 CYS 39 -5.967 -1.512 -1.159
220 HB3 CYS 39 HB1 CYS 39 -7.028 -0.788 -2.361
221 H GLN 40 HN GLN 40 -9.180 -2.523 -2.091
222 HA GLN 40 HA GLN 40 -10.861 -0.553 -3.261
223 HB2 GLN 40 HB2 GLN 40 -10.811 -3.557 -3.355
224 HB3 GLN 40 HB1 GLN 40 -12.087 -2.640 -4.145
225 HG2 GLN 40 HG2 GLN 40 -10.349 -1.423 -5.425
226 HG3 GLN 40 HG1 GLN 40 -9.138 -2.488 -4.713
227 HE21 GLN 40 HE21 GLN 40 -11.812 -2.248 -6.907
228 HE22 GLN 40 HE22 GLN 40 -11.558 -3.763 -7.707
229 H ALA 41 HN ALA 41 -11.040 -2.234 -0.338
230 HA ALA 41 HA ALA 41 -13.862 -2.443 -0.074
231 HB1 ALA 41 HB1 ALA 41 -11.877 -2.222 2.180
232 HB2 ALA 41 HB2 ALA 41 -12.132 -3.707 1.265
233 HB3 ALA 41 HB3 ALA 41 -13.457 -3.007 2.197
234 H GLU 42 HN GLU 42 -11.653 0.143 0.103
235 HA GLU 42 HA GLU 42 -13.721 1.860 1.300
236 HB2 GLU 42 HB2 GLU 42 -10.978 1.474 2.070
237 HB3 GLU 42 HB1 GLU 42 -11.216 3.137 1.550
238 HG2 GLU 42 HG2 GLU 42 -12.656 1.666 3.736
239 HG3 GLU 42 HG1 GLU 42 -11.588 3.061 3.886
240 H LYS 43 HN LYS 43 -13.836 4.023 0.487
241 HA LYS 43 HA LYS 43 -13.153 4.150 -2.352
242 HB2 LYS 43 HB2 LYS 43 -14.677 6.039 -2.457
243 HB3 LYS 43 HB1 LYS 43 -15.457 4.692 -1.640
244 HG2 LYS 43 HG2 LYS 43 -15.036 5.737 0.520
245 HG3 LYS 43 HG1 LYS 43 -14.213 7.078 -0.280
246 HD2 LYS 43 HD2 LYS 43 -16.343 7.923 0.077
247 HD3 LYS 43 HD1 LYS 43 -16.431 7.342 -1.585
248 HE2 LYS 43 HE2 LYS 43 -18.415 6.618 -0.503
249 HE3 LYS 43 HE1 LYS 43 -17.381 5.200 -0.667
250 HZ1 LYS 43 HZ1 LYS 43 -18.410 5.356 1.525
251 HZ2 LYS 43 HZ2 LYS 43 -17.639 6.835 1.795
252 HZ3 LYS 43 HZ3 LYS 43 -16.724 5.426 1.626
253 H GLU 44 HN GLU 44 -12.121 5.299 0.663
254 HA GLU 44 HA GLU 44 -10.868 7.724 -0.148
255 HB2 GLU 44 HB2 GLU 44 -10.627 5.930 2.254
256 HB3 GLU 44 HB1 GLU 44 -9.582 7.331 2.053
257 HG2 GLU 44 HG2 GLU 44 -12.539 7.649 1.843
258 HG3 GLU 44 HG1 GLU 44 -11.777 7.515 3.428
259 H CYS 45 HN CYS 45 -10.063 4.441 -0.533
260 HA CYS 45 HA CYS 45 -7.249 4.583 -0.429
261 HB2 CYS 45 HB2 CYS 45 -8.173 2.424 -0.310
262 HB3 CYS 45 HB1 CYS 45 -9.162 2.676 -1.745
263 H SER 46 HN SER 46 -5.987 5.747 -1.672
264 HA SER 46 HA SER 46 -6.710 6.065 -4.507
265 HB2 SER 46 HB2 SER 46 -5.261 8.124 -4.420
266 HB3 SER 46 HB1 SER 46 -6.703 8.221 -3.408
267 HG SER 46 HG SER 46 -4.990 8.925 -2.182
268 H HIS 47 HN HIS 47 -4.748 4.455 -2.429
269 HA HIS 47 HA HIS 47 -3.067 3.347 -4.367
270 HB2 HIS 47 HB2 HIS 47 -0.886 4.296 -3.679
271 HB3 HIS 47 HB1 HIS 47 -1.934 5.521 -4.383
272 HD1 HIS 47 HD1 HIS 47 -3.221 7.074 -2.511
273 HD2 HIS 47 HD2 HIS 47 0.138 4.965 -1.258
274 HE1 HIS 47 HE1 HIS 47 -2.495 8.169 -0.373
275 HE2 HIS 47 HE2 HIS 47 -0.586 6.757 0.458
276 H TYR 48 HN TYR 48 -2.312 1.447 -3.565
277 HA TYR 48 HA TYR 48 -2.445 1.124 -0.639
278 HB2 TYR 48 HB2 TYR 48 -2.803 -1.293 -1.039
279 HB3 TYR 48 HB1 TYR 48 -4.081 -0.300 -1.722
280 HD1 TYR 48 HD2 TYR 48 -4.252 -0.028 -4.174
281 HD2 TYR 48 HD1 TYR 48 -1.410 -2.660 -2.420
282 HE1 TYR 48 HE2 TYR 48 -3.977 -1.160 -6.338
283 HE2 TYR 48 HE1 TYR 48 -1.129 -3.807 -4.579
284 HH TYR 48 HH TYR 48 -2.320 -2.544 -7.509
285 H THR 49 HN THR 49 -0.742 0.274 0.454
286 HA THR 49 HA THR 49 1.681 -0.237 -1.142
287 HB THR 49 HB THR 49 1.703 0.737 1.710
288 HG1 THR 49 HG1 THR 49 1.266 2.135 -0.671
289 HG21 THR 49 HG21 THR 49 3.963 1.470 1.148
290 HG22 THR 49 HG22 THR 49 3.749 0.902 -0.509
291 HG23 THR 49 HG23 THR 49 3.779 -0.254 0.823
292 H TYR 50 HN TYR 50 2.179 -2.329 -1.143
293 HA TYR 50 HA TYR 50 1.531 -3.914 1.251
294 HB2 TYR 50 HB2 TYR 50 0.439 -4.732 -0.769
295 HB3 TYR 50 HB1 TYR 50 1.982 -4.795 -1.610
296 HD1 TYR 50 HD1 TYR 50 0.821 -6.020 1.734
297 HD2 TYR 50 HD2 TYR 50 2.596 -6.979 -2.016
298 HE1 TYR 50 HE1 TYR 50 1.129 -8.342 2.480
299 HE2 TYR 50 HE2 TYR 50 2.907 -9.304 -1.280
300 HH TYR 50 HH TYR 50 3.055 -10.590 0.736
301 H ASN 51 HN ASN 51 3.205 -4.207 2.545
302 HA ASN 51 HA ASN 51 5.911 -4.070 1.490
303 HB2 ASN 51 HB2 ASN 51 5.326 -2.894 3.602
304 HB3 ASN 51 HB1 ASN 51 4.971 -4.452 4.345
305 HD21 ASN 51 HD21 ASN 51 7.443 -2.320 3.183
306 HD22 ASN 51 HD22 ASN 51 8.782 -3.173 3.886
307 H VAL 52 HN VAL 52 6.749 -5.863 0.652
308 HA VAL 52 HA VAL 52 5.696 -8.465 1.278
309 HB VAL 52 HB VAL 52 7.479 -9.302 -0.268
310 HG11 VAL 52 HG11 VAL 52 5.594 -7.153 -1.219
311 HG12 VAL 52 HG12 VAL 52 5.297 -8.889 -1.136
312 HG13 VAL 52 HG13 VAL 52 6.461 -8.248 -2.298
313 HG21 VAL 52 HG21 VAL 52 9.123 -7.523 0.103
314 HG22 VAL 52 HG22 VAL 52 8.040 -6.362 -0.662
315 HG23 VAL 52 HG23 VAL 52 8.724 -7.686 -1.607
316 H LYS 53 HN LYS 53 7.832 -6.607 2.964
317 HA LYS 53 HA LYS 53 9.660 -8.754 3.659
318 HB2 LYS 53 HB2 LYS 53 9.529 -5.857 4.103
319 HB3 LYS 53 HB1 LYS 53 10.116 -6.762 5.494
320 HG2 LYS 53 HG2 LYS 53 11.252 -7.084 2.728
321 HG3 LYS 53 HG1 LYS 53 11.867 -5.922 3.904
322 HD2 LYS 53 HD2 LYS 53 12.185 -7.840 5.490
323 HD3 LYS 53 HD1 LYS 53 11.791 -8.924 4.153
324 HE2 LYS 53 HE2 LYS 53 14.183 -8.752 4.341
325 HE3 LYS 53 HE1 LYS 53 13.664 -7.941 2.866
326 HZ1 LYS 53 HZ1 LYS 53 15.311 -6.636 4.036
327 HZ2 LYS 53 HZ2 LYS 53 14.355 -6.606 5.426
328 HZ3 LYS 53 HZ3 LYS 53 13.832 -5.817 4.028
329 H SER 54 HN SER 54 7.277 -6.736 5.347
330 HA SER 54 HA SER 54 7.206 -8.603 7.570
331 HB2 SER 54 HB2 SER 54 5.368 -6.251 7.337
332 HB3 SER 54 HB1 SER 54 6.147 -6.925 8.768
333 HG SER 54 HG SER 54 7.186 -5.027 8.270
334 H GLY 55 HN GLY 55 5.422 -7.879 4.701
335 HA2 GLY 55 HA2 GLY 55 3.749 -9.150 3.717
336 HA3 GLY 55 HA1 GLY 55 3.653 -10.117 5.182
337 H LEU 56 HN LEU 56 3.496 -6.667 5.363
338 HA LEU 56 HA LEU 56 0.704 -6.909 6.215
339 HB2 LEU 56 HB2 LEU 56 2.724 -4.748 6.792
340 HB3 LEU 56 HB1 LEU 56 1.068 -4.760 7.367
341 HG LEU 56 HG LEU 56 3.167 -6.808 8.097
342 HD11 LEU 56 HD11 LEU 56 2.016 -4.530 9.700
343 HD12 LEU 56 HD12 LEU 56 3.653 -4.613 9.048
344 HD13 LEU 56 HD13 LEU 56 3.141 -5.753 10.292
345 HD21 LEU 56 HD21 LEU 56 0.975 -7.785 8.163
346 HD22 LEU 56 HD22 LEU 56 0.333 -6.393 9.034
347 HD23 LEU 56 HD23 LEU 56 1.499 -7.462 9.816
348 H CYS 57 HN CYS 57 -0.877 -5.650 5.403
349 HA CYS 57 HA CYS 57 -0.272 -4.256 2.894
350 HB2 CYS 57 HB2 CYS 57 -1.941 -5.970 2.647
351 HB3 CYS 57 HB1 CYS 57 -2.827 -5.385 4.049
352 H TYR 58 HN TYR 58 -0.508 -2.084 2.738
353 HA TYR 58 HA TYR 58 -1.761 -0.715 5.027
354 HB2 TYR 58 HB2 TYR 58 0.506 0.332 3.334
355 HB3 TYR 58 HB1 TYR 58 -0.185 1.099 4.756
356 HD1 TYR 58 HD1 TYR 58 0.327 0.271 6.990
357 HD2 TYR 58 HD2 TYR 58 2.047 -1.529 3.535
358 HE1 TYR 58 HE1 TYR 58 2.003 -0.842 8.404
359 HE2 TYR 58 HE2 TYR 58 3.718 -2.651 4.948
360 HH TYR 58 HH TYR 58 4.734 -2.477 7.086
361 HA PRO 59 HA PRO 59 -4.175 0.707 1.390
362 HB2 PRO 59 HB2 PRO 59 -6.378 0.884 3.298
363 HB3 PRO 59 HB1 PRO 59 -6.265 -0.108 1.841
364 HG2 PRO 59 HG2 PRO 59 -6.259 -1.177 4.326
365 HG3 PRO 59 HG1 PRO 59 -5.411 -1.915 2.950
366 HD2 PRO 59 HD2 PRO 59 -4.300 -0.264 5.184
367 HD3 PRO 59 HD1 PRO 59 -3.630 -1.718 4.410
368 H LYS 60 HN LYS 60 -3.355 2.768 1.219
369 HA LYS 60 HA LYS 60 -3.907 4.600 3.446
370 HB2 LYS 60 HB2 LYS 60 -1.748 4.653 1.344
371 HB3 LYS 60 HB1 LYS 60 -2.041 5.970 2.472
372 HG2 LYS 60 HG2 LYS 60 -1.516 4.582 4.344
373 HG3 LYS 60 HG1 LYS 60 -1.439 3.146 3.325
374 HD2 LYS 60 HD2 LYS 60 0.491 4.089 2.155
375 HD3 LYS 60 HD1 LYS 60 0.408 5.521 3.182
376 HE2 LYS 60 HE2 LYS 60 0.855 2.707 4.155
377 HE3 LYS 60 HE1 LYS 60 2.118 3.914 3.934
378 HZ1 LYS 60 HZ1 LYS 60 0.807 5.316 5.560
379 HZ2 LYS 60 HZ2 LYS 60 1.587 3.954 6.200
380 HZ3 LYS 60 HZ3 LYS 60 -0.085 3.918 5.922
381 H ARG 61 HN ARG 61 -4.435 6.766 3.016
382 HA ARG 61 HA ARG 61 -5.876 7.150 0.479
383 HB2 ARG 61 HB2 ARG 61 -7.530 8.458 1.741
384 HB3 ARG 61 HB1 ARG 61 -7.438 6.803 2.318
385 HG2 ARG 61 HG2 ARG 61 -6.216 7.465 4.255
386 HG3 ARG 61 HG1 ARG 61 -6.024 9.107 3.637
387 HD2 ARG 61 HD2 ARG 61 -8.479 9.387 3.722
388 HD3 ARG 61 HD1 ARG 61 -8.616 7.775 4.421
389 HE ARG 61 HE ARG 61 -6.917 8.990 6.120
390 HH11 ARG 61 HH11 ARG 61 -10.052 9.951 4.785
391 HH12 ARG 61 HH12 ARG 61 -10.493 10.909 6.254
392 HH21 ARG 61 HH21 ARG 61 -7.448 10.211 7.968
393 HH22 ARG 61 HH22 ARG 61 -9.047 11.045 8.032
394 H GLY 62 HN GLY 62 -6.575 9.785 0.806
395 HA2 GLY 62 HA2 GLY 62 -5.808 11.937 0.628
396 HA3 GLY 62 HA1 GLY 62 -4.474 11.474 1.674
397 H LYS 63 HN LYS 63 -2.830 12.449 0.610
398 HA LYS 63 HA LYS 63 -2.503 11.977 -2.244
399 HB2 LYS 63 HB2 LYS 63 -0.864 13.680 -2.232
400 HB3 LYS 63 HB1 LYS 63 -2.120 14.243 -1.143
401 HG2 LYS 63 HG2 LYS 63 -0.680 13.289 0.735
402 HG3 LYS 63 HG1 LYS 63 0.604 13.186 -0.469
403 HD2 LYS 63 HD2 LYS 63 -0.888 15.684 0.338
404 HD3 LYS 63 HD1 LYS 63 0.758 15.262 0.811
405 HE2 LYS 63 HE2 LYS 63 -0.118 15.601 -2.055
406 HE3 LYS 63 HE1 LYS 63 0.563 16.905 -1.083
407 HZ1 LYS 63 HZ1 LYS 63 2.280 15.907 -2.393
408 HZ2 LYS 63 HZ2 LYS 63 1.908 14.362 -1.821
409 HZ3 LYS 63 HZ3 LYS 63 2.553 15.518 -0.774
410 HA PRO 64 HA PRO 64 0.373 8.711 -1.477
411 HB2 PRO 64 HB2 PRO 64 1.276 8.341 -3.980
412 HB3 PRO 64 HB1 PRO 64 -0.378 7.930 -3.508
413 HG2 PRO 64 HG2 PRO 64 0.604 10.245 -5.075
414 HG3 PRO 64 HG1 PRO 64 -0.928 9.361 -5.200
415 HD2 PRO 64 HD2 PRO 64 -0.541 11.814 -3.910
416 HD3 PRO 64 HD1 PRO 64 -1.951 10.752 -3.750
417 H GLN 65 HN GLN 65 2.035 9.450 -0.234
418 HA GLN 65 HA GLN 65 4.124 11.097 -1.410
419 HB2 GLN 65 HB2 GLN 65 4.045 9.933 1.379
420 HB3 GLN 65 HB1 GLN 65 5.009 11.291 0.809
421 HG2 GLN 65 HG2 GLN 65 2.876 12.526 0.399
422 HG3 GLN 65 HG1 GLN 65 2.025 11.201 1.190
423 HE21 GLN 65 HE21 GLN 65 1.271 12.409 2.898
424 HE22 GLN 65 HE22 GLN 65 2.306 13.055 4.124
425 H PHE 66 HN PHE 66 4.969 9.670 -2.927
426 HA PHE 66 HA PHE 66 5.775 7.014 -2.308
427 HB2 PHE 66 HB2 PHE 66 6.694 8.736 -4.616
428 HB3 PHE 66 HB1 PHE 66 6.763 6.984 -4.515
429 HD1 PHE 66 HD1 PHE 66 4.417 5.826 -4.126
430 HD2 PHE 66 HD2 PHE 66 4.993 9.700 -5.789
431 HE1 PHE 66 HE1 PHE 66 2.230 5.670 -5.241
432 HE2 PHE 66 HE2 PHE 66 2.807 9.553 -6.904
433 HZ PHE 66 HZ PHE 66 1.423 7.533 -6.633
434 H TYR 67 HN TYR 67 7.704 6.182 -1.772
435 HA TYR 67 HA TYR 67 10.091 7.834 -1.824
436 HB2 TYR 67 HB2 TYR 67 10.672 7.626 0.457
437 HB3 TYR 67 HB1 TYR 67 8.991 8.127 0.459
438 HD1 TYR 67 HD2 TYR 67 7.212 6.445 1.023
439 HD2 TYR 67 HD1 TYR 67 11.355 5.583 1.442
440 HE1 TYR 67 HE2 TYR 67 6.665 4.573 2.522
441 HE2 TYR 67 HE1 TYR 67 10.819 3.716 2.945
442 HH TYR 67 HH TYR 67 7.993 2.262 3.168
443 H LYS 68 HN LYS 68 11.957 6.652 -2.086
444 HA LYS 68 HA LYS 68 11.610 4.046 -3.178
445 HB2 LYS 68 HB2 LYS 68 13.278 5.746 -3.960
446 HB3 LYS 68 HB1 LYS 68 14.198 5.437 -2.495
447 HG2 LYS 68 HG2 LYS 68 14.749 3.262 -3.166
448 HG3 LYS 68 HG1 LYS 68 13.500 3.244 -4.414
449 HD2 LYS 68 HD2 LYS 68 14.717 4.957 -5.663
450 HD3 LYS 68 HD1 LYS 68 15.966 4.983 -4.415
451 HE2 LYS 68 HE2 LYS 68 16.653 2.784 -4.924
452 HE3 LYS 68 HE1 LYS 68 15.217 2.485 -5.901
453 HZ1 LYS 68 HZ1 LYS 68 17.271 4.500 -6.604
454 HZ2 LYS 68 HZ2 LYS 68 16.007 3.941 -7.574
455 HZ3 LYS 68 HZ3 LYS 68 17.289 2.912 -7.183
456 H TYR 69 HN TYR 69 11.606 2.169 -2.179
457 HA TYR 69 HA TYR 69 13.379 1.607 0.009
458 HB2 TYR 69 HB2 TYR 69 11.551 2.727 1.213
459 HB3 TYR 69 HB1 TYR 69 10.394 1.599 0.512
460 HD1 TYR 69 HD1 TYR 69 13.682 1.318 2.292
461 HD2 TYR 69 HD2 TYR 69 9.643 0.015 1.991
462 HE1 TYR 69 HE1 TYR 69 14.044 -0.224 4.169
463 HE2 TYR 69 HE2 TYR 69 9.996 -1.530 3.868
464 HH TYR 69 HH TYR 69 12.902 -1.461 5.779
465 H LEU 70 HN LEU 70 14.077 -0.380 -0.341
466 HA LEU 70 HA LEU 70 12.771 -2.152 -2.149
467 HB2 LEU 70 HB2 LEU 70 15.106 -2.560 -0.282
468 HB3 LEU 70 HB1 LEU 70 14.548 -3.772 -1.416
469 HG LEU 70 HG LEU 70 15.500 -1.035 -2.260
470 HD11 LEU 70 HD11 LEU 70 17.599 -2.123 -2.878
471 HD12 LEU 70 HD12 LEU 70 17.030 -3.632 -2.164
472 HD13 LEU 70 HD13 LEU 70 17.312 -2.222 -1.143
473 HD21 LEU 70 HD21 LEU 70 15.705 -2.099 -4.454
474 HD22 LEU 70 HD22 LEU 70 14.047 -2.170 -3.859
475 HD23 LEU 70 HD23 LEU 70 15.072 -3.604 -3.789
476 H GLY 71 HN GLY 71 10.941 -3.125 -1.607
477 HA2 GLY 71 HA2 GLY 71 10.284 -5.157 -0.229
478 HA3 GLY 71 HA1 GLY 71 10.647 -4.128 1.149
479 H ASP 72 HN ASP 72 9.553 -1.785 -0.408
480 HA ASP 72 HA ASP 72 6.769 -2.243 0.338
481 HB2 ASP 72 HB2 ASP 72 8.513 0.148 0.065
482 HB3 ASP 72 HB1 ASP 72 6.809 0.366 -0.315
483 H MET 73 HN MET 73 5.318 -2.728 -1.128
484 HA MET 73 HA MET 73 5.854 -2.031 -3.937
485 HB2 MET 73 HB2 MET 73 4.286 -4.295 -2.703
486 HB3 MET 73 HB1 MET 73 4.147 -3.868 -4.402
487 HG2 MET 73 HG2 MET 73 6.528 -4.305 -4.709
488 HG3 MET 73 HG1 MET 73 6.668 -4.721 -3.003
489 HE1 MET 73 HE1 MET 73 4.887 -5.627 -6.377
490 HE2 MET 73 HE2 MET 73 3.541 -5.667 -5.240
491 HE3 MET 73 HE3 MET 73 4.110 -7.161 -5.983
492 H THR 74 HN THR 74 4.896 -0.031 -4.062
493 HA THR 74 HA THR 74 2.189 0.328 -3.101
494 HB THR 74 HB THR 74 4.015 2.226 -4.587
495 HG1 THR 74 HG1 THR 74 4.771 1.978 -2.533
496 HG21 THR 74 HG21 THR 74 2.410 3.975 -3.966
497 HG22 THR 74 HG22 THR 74 1.342 2.751 -3.282
498 HG23 THR 74 HG23 THR 74 1.665 2.769 -5.016
499 H GLY 75 HN GLY 75 0.399 0.252 -4.286
500 HA2 GLY 75 HA2 GLY 75 0.658 0.051 -7.216
501 HA3 GLY 75 HA1 GLY 75 -0.421 -1.000 -6.301
502 H SER 76 HN SER 76 -1.247 0.773 -8.394
503 HA SER 76 HA SER 76 -2.332 3.139 -7.238
504 HB2 SER 76 HB2 SER 76 -3.735 3.102 -9.414
505 HB3 SER 76 HB1 SER 76 -1.987 3.278 -9.552
506 HG SER 76 HG SER 76 -3.396 1.532 -10.785
507 H ARG 77 HN ARG 77 -4.344 0.722 -8.856
508 HA ARG 77 HA ARG 77 -5.779 -0.053 -6.531
509 HB2 ARG 77 HB2 ARG 77 -6.522 2.408 -7.132
510 HB3 ARG 77 HB1 ARG 77 -7.493 1.593 -8.349
511 HG2 ARG 77 HG2 ARG 77 -8.797 0.507 -6.769
512 HG3 ARG 77 HG1 ARG 77 -7.598 0.712 -5.492
513 HD2 ARG 77 HD2 ARG 77 -9.478 2.189 -5.111
514 HD3 ARG 77 HD1 ARG 77 -8.035 3.131 -5.493
515 HE ARG 77 HE ARG 77 -9.787 2.529 -7.728
516 HH11 ARG 77 HH11 ARG 77 -8.898 4.810 -5.194
517 HH12 ARG 77 HH12 ARG 77 -9.594 6.222 -6.074
518 HH21 ARG 77 HH21 ARG 77 -10.702 4.283 -8.857
519 HH22 ARG 77 HH22 ARG 77 -10.627 5.925 -8.114
520 H THR 78 HN THR 78 -5.619 0.267 -10.018
521 HA THR 78 HA THR 78 -6.302 -2.504 -10.329
522 HB THR 78 HB THR 78 -8.533 -1.276 -10.189
523 HG1 THR 78 HG1 THR 78 -8.594 -2.407 -12.690
524 HG21 THR 78 HG21 THR 78 -7.622 -0.267 -12.882
525 HG22 THR 78 HG22 THR 78 -7.999 0.708 -11.463
526 HG23 THR 78 HG23 THR 78 -9.278 -0.185 -12.284
527 H CYS 79 HN CYS 79 -6.110 -3.174 -12.636
528 HA CYS 79 HA CYS 79 -4.456 -1.328 -14.212
529 HB2 CYS 79 HB2 CYS 79 -3.870 -4.226 -13.582
530 HB3 CYS 79 HB1 CYS 79 -3.070 -3.341 -14.875
531 H1 GAL 83 H1 GTP 1 6.225 2.194 8.672
532 H2 GAL 83 H2 GTP 1 5.185 4.327 6.752
533 H3 GAL 83 H3 GTP 1 3.845 2.128 8.353
534 H4 GAL 83 H4 GTP 1 3.310 1.268 6.116
535 H5 GAL 83 H5 GTP 1 5.326 0.532 7.283
536 H61 GAL 83 H61 GTP 1 5.342 0.797 4.304
537 H62 GAL 83 H62 GTP 1 5.366 -0.641 5.325
538 HO2 GAL 83 HO2 GTP 1 5.757 4.620 9.258
539 HO3 GAL 83 HO3 GTP 1 2.753 4.244 8.045
540 HO4 GAL 83 HO4 GTP 1 5.157 2.839 4.808
541 HO6 GAL 83 HO6 GTP 1 7.350 0.336 4.015
542 H1 NAG 84 H1 GCP 2 9.949 2.896 4.864
543 H2 NAG 84 H2 GCP 2 10.123 3.222 7.919
544 H3 NAG 84 H3 GCP 2 7.882 3.616 5.901
545 H4 NAG 84 H4 GCP 2 9.468 5.483 7.710
546 H5 NAG 84 H5 GCP 2 9.272 5.142 4.677
547 H61 NAG 84 H61 GCP 2 9.927 7.455 6.149
548 H62 NAG 84 H62 GCP 2 10.166 7.142 4.427
549 H81 NAG 84 HC23 GCP 2 8.088 -0.722 8.669
550 H82 NAG 84 HC21 GCP 2 8.620 -0.868 6.994
551 H83 NAG 84 HC22 GCP 2 9.697 -1.344 8.307
552 HN2 NAG 84 HN2 GCP 2 8.579 1.210 6.331
553 HO1 NAG 84 HO1 GCP 2 11.448 1.532 6.433
554 HO4 NAG 84 HO4 GCP 2 7.398 6.236 7.523
555 HO6 NAG 84 HO6 GCP 2 12.165 5.940 5.579
Start of MODEL 7
1 H CYS 10 HT1 CYS 10 -0.534 -4.917 -14.114
2 HA CYS 10 HA CYS 10 -1.272 -3.153 -12.723
3 HB2 CYS 10 HB2 CYS 10 -2.811 -5.363 -11.381
4 HB3 CYS 10 HB1 CYS 10 -2.458 -3.852 -10.551
5 H VAL 11 HN VAL 11 1.011 -4.918 -13.038
6 HA VAL 11 HA VAL 11 1.945 -5.382 -10.321
7 HB VAL 11 HB VAL 11 3.462 -5.815 -12.902
8 HG11 VAL 11 HG11 VAL 11 3.889 -6.941 -10.133
9 HG12 VAL 11 HG12 VAL 11 4.844 -5.662 -10.882
10 HG13 VAL 11 HG13 VAL 11 4.861 -7.288 -11.565
11 HG21 VAL 11 HG21 VAL 11 1.394 -7.134 -12.874
12 HG22 VAL 11 HG22 VAL 11 1.859 -7.816 -11.315
13 HG23 VAL 11 HG23 VAL 11 2.826 -8.155 -12.750
14 H HIS 12 HN HIS 12 2.137 -3.306 -9.507
15 HA HIS 12 HA HIS 12 3.575 -1.252 -10.896
16 HB2 HIS 12 HB2 HIS 12 2.142 -1.506 -8.339
17 HB3 HIS 12 HB1 HIS 12 3.511 -0.402 -8.300
18 HD1 HIS 12 HD1 HIS 12 3.023 1.910 -9.036
19 HD2 HIS 12 HD2 HIS 12 0.267 -0.808 -10.550
20 HE1 HIS 12 HE1 HIS 12 1.301 3.293 -10.239
21 HE2 HIS 12 HE2 HIS 12 -0.274 1.618 -11.267
22 H THR 13 HN THR 13 4.294 -2.581 -7.672
23 HA THR 13 HA THR 13 6.242 -3.027 -6.604
24 HB THR 13 HB THR 13 7.619 -3.513 -9.227
25 HG1 THR 13 HG1 THR 13 6.257 -5.053 -9.735
26 HG21 THR 13 HG21 THR 13 8.620 -5.368 -8.017
27 HG22 THR 13 HG22 THR 13 7.583 -5.054 -6.627
28 HG23 THR 13 HG23 THR 13 8.817 -3.881 -7.090
29 H GLY 14 HN GLY 14 8.816 -2.458 -8.492
30 HA2 GLY 14 HA2 GLY 14 10.148 -0.624 -8.979
31 HA3 GLY 14 HA1 GLY 14 8.823 0.426 -8.503
32 H ASN 15 HN ASN 15 9.019 -1.571 -6.004
33 HA ASN 15 HA ASN 15 9.735 -1.396 -3.859
34 HB2 ASN 15 HB2 ASN 15 12.272 -0.680 -5.333
35 HB3 ASN 15 HB1 ASN 15 12.210 -0.807 -3.579
36 HD21 ASN 15 HD21 ASN 15 10.306 -3.001 -3.590
37 HD22 ASN 15 HD22 ASN 15 11.187 -4.399 -4.095
38 H ILE 16 HN ILE 16 8.160 0.584 -4.412
39 HA ILE 16 HA ILE 16 9.426 2.926 -3.193
40 HB ILE 16 HB ILE 16 9.056 3.329 -5.613
41 HG12 ILE 16 HG12 ILE 16 7.262 5.318 -5.027
42 HG13 ILE 16 HG11 ILE 16 7.911 4.924 -3.438
43 HG21 ILE 16 HG21 ILE 16 6.776 3.593 -6.475
44 HG22 ILE 16 HG22 ILE 16 6.140 2.966 -4.954
45 HG23 ILE 16 HG23 ILE 16 7.121 1.932 -5.993
46 HD11 ILE 16 HD11 ILE 16 9.171 6.720 -4.465
47 HD12 ILE 16 HD12 ILE 16 9.520 5.700 -5.862
48 HD13 ILE 16 HD13 ILE 16 10.176 5.283 -4.279
49 H GLY 17 HN GLY 17 8.379 3.723 -1.482
50 HA2 GLY 17 HA2 GLY 17 5.773 2.519 -0.802
51 HA3 GLY 17 HA1 GLY 17 6.946 3.112 0.367
52 H SER 18 HN SER 18 4.927 4.242 1.126
53 HA SER 18 HA SER 18 4.966 6.938 0.066
54 HB2 SER 18 HB2 SER 18 2.446 5.269 0.121
55 HB3 SER 18 HB1 SER 18 2.454 7.024 -0.049
56 HG SER 18 HG SER 18 4.162 5.839 -1.793
57 H LYS 19 HN LYS 19 5.007 8.319 1.690
58 HA LYS 19 HA LYS 19 4.395 7.413 4.380
59 HB2 LYS 19 HB2 LYS 19 6.234 9.208 3.311
60 HB3 LYS 19 HB1 LYS 19 5.052 10.241 4.101
61 HG2 LYS 19 HG2 LYS 19 6.511 7.955 5.416
62 HG3 LYS 19 HG1 LYS 19 6.942 9.658 5.563
63 HD2 LYS 19 HD2 LYS 19 4.197 8.687 6.286
64 HD3 LYS 19 HD1 LYS 19 5.532 8.566 7.430
65 HE2 LYS 19 HE2 LYS 19 5.895 10.999 7.216
66 HE3 LYS 19 HE1 LYS 19 4.508 11.089 6.131
67 HZ1 LYS 19 HZ1 LYS 19 3.961 11.695 8.431
68 HZ2 LYS 19 HZ2 LYS 19 4.391 10.144 8.943
69 HZ3 LYS 19 HZ3 LYS 19 3.077 10.354 7.902
70 H ALA 20 HN ALA 20 2.085 7.160 3.636
71 HA ALA 20 HA ALA 20 0.634 9.688 4.061
72 HB1 ALA 20 HB1 ALA 20 -1.093 8.962 2.559
73 HB2 ALA 20 HB2 ALA 20 -0.315 7.393 2.351
74 HB3 ALA 20 HB3 ALA 20 0.456 8.849 1.720
75 H GLN 21 HN GLN 21 -1.568 9.347 4.964
76 HA GLN 21 HA GLN 21 -1.402 7.554 7.201
77 HB2 GLN 21 HB2 GLN 21 -2.354 9.798 7.461
78 HB3 GLN 21 HB1 GLN 21 -3.635 9.392 6.327
79 HG2 GLN 21 HG2 GLN 21 -4.252 7.525 7.939
80 HG3 GLN 21 HG1 GLN 21 -3.190 8.328 9.094
81 HE21 GLN 21 HE21 GLN 21 -4.877 8.801 10.487
82 HE22 GLN 21 HE22 GLN 21 -6.053 10.019 10.139
83 H THR 22 HN THR 22 -2.384 5.680 7.497
84 HA THR 22 HA THR 22 -3.627 4.355 5.290
85 HB THR 22 HB THR 22 -3.859 3.039 7.885
86 HG1 THR 22 HG1 THR 22 -1.893 3.342 8.606
87 HG21 THR 22 HG21 THR 22 -3.972 1.890 5.715
88 HG22 THR 22 HG22 THR 22 -2.670 1.256 6.722
89 HG23 THR 22 HG23 THR 22 -2.301 2.352 5.391
90 H ILE 23 HN ILE 23 -5.781 3.691 5.134
91 HA ILE 23 HA ILE 23 -7.709 5.358 6.446
92 HB ILE 23 HB ILE 23 -8.297 2.872 4.834
93 HG12 ILE 23 HG12 ILE 23 -8.186 5.653 3.698
94 HG13 ILE 23 HG11 ILE 23 -6.749 4.638 3.741
95 HG21 ILE 23 HG21 ILE 23 -10.391 4.090 4.303
96 HG22 ILE 23 HG22 ILE 23 -9.898 5.358 5.426
97 HG23 ILE 23 HG23 ILE 23 -10.211 3.728 6.022
98 HD11 ILE 23 HD11 ILE 23 -7.879 2.966 2.389
99 HD12 ILE 23 HD12 ILE 23 -7.876 4.536 1.586
100 HD13 ILE 23 HD13 ILE 23 -9.340 3.952 2.376
101 H GLY 24 HN GLY 24 -6.580 2.072 6.767
102 HA2 GLY 24 HA2 GLY 24 -8.162 1.823 9.238
103 HA3 GLY 24 HA1 GLY 24 -8.016 0.486 8.104
104 H GLU 25 HN GLU 25 -7.092 -0.803 9.745
105 HA GLU 25 HA GLU 25 -4.524 0.029 10.829
106 HB2 GLU 25 HB2 GLU 25 -6.115 -2.504 11.254
107 HB3 GLU 25 HB1 GLU 25 -4.649 -2.064 12.119
108 HG2 GLU 25 HG2 GLU 25 -5.756 -0.153 13.092
109 HG3 GLU 25 HG1 GLU 25 -7.215 -0.503 12.170
110 H VAL 26 HN VAL 26 -2.701 -1.518 10.748
111 HA VAL 26 HA VAL 26 -2.219 -2.293 8.025
112 HB VAL 26 HB VAL 26 -0.463 -2.896 10.409
113 HG11 VAL 26 HG11 VAL 26 0.151 -4.092 8.398
114 HG12 VAL 26 HG12 VAL 26 1.334 -2.823 8.713
115 HG13 VAL 26 HG13 VAL 26 0.113 -2.597 7.462
116 HG21 VAL 26 HG21 VAL 26 -0.431 -0.425 8.677
117 HG22 VAL 26 HG22 VAL 26 0.678 -0.798 9.997
118 HG23 VAL 26 HG23 VAL 26 -1.026 -0.494 10.334
119 H LYS 27 HN LYS 27 -3.310 -4.037 7.350
120 HA LYS 27 HA LYS 27 -3.496 -6.371 9.108
121 HB2 LYS 27 HB2 LYS 27 -4.897 -5.791 6.489
122 HB3 LYS 27 HB1 LYS 27 -5.184 -7.188 7.517
123 HG2 LYS 27 HG2 LYS 27 -5.969 -5.709 9.303
124 HG3 LYS 27 HG1 LYS 27 -5.696 -4.314 8.256
125 HD2 LYS 27 HD2 LYS 27 -7.286 -5.354 6.618
126 HD3 LYS 27 HD1 LYS 27 -7.656 -6.566 7.844
127 HE2 LYS 27 HE2 LYS 27 -7.971 -3.596 8.249
128 HE3 LYS 27 HE1 LYS 27 -9.275 -4.669 7.750
129 HZ1 LYS 27 HZ1 LYS 27 -9.390 -4.326 10.099
130 HZ2 LYS 27 HZ2 LYS 27 -7.776 -4.780 10.309
131 HZ3 LYS 27 HZ3 LYS 27 -8.916 -5.927 9.824
132 H ARG 28 HN ARG 28 -3.293 -8.515 8.015
133 HA ARG 28 HA ARG 28 -0.806 -8.532 6.488
134 HB2 ARG 28 HB2 ARG 28 -2.332 -10.697 7.938
135 HB3 ARG 28 HB1 ARG 28 -0.904 -11.012 6.963
136 HG2 ARG 28 HG2 ARG 28 -0.874 -9.059 9.241
137 HG3 ARG 28 HG1 ARG 28 -0.572 -10.781 9.473
138 HD2 ARG 28 HD2 ARG 28 1.322 -10.701 7.993
139 HD3 ARG 28 HD1 ARG 28 0.966 -9.029 7.559
140 HE ARG 28 HE ARG 28 1.324 -9.162 10.333
141 HH11 ARG 28 HH11 ARG 28 3.173 -9.610 7.374
142 HH12 ARG 28 HH12 ARG 28 4.718 -9.042 8.115
143 HH21 ARG 28 HH21 ARG 28 3.257 -8.460 11.315
144 HH22 ARG 28 HH22 ARG 28 4.766 -8.410 10.322
145 H ALA 29 HN ALA 29 -0.714 -9.019 4.396
146 HA ALA 29 HA ALA 29 -3.118 -10.185 3.145
147 HB1 ALA 29 HB1 ALA 29 -3.038 -7.894 2.482
148 HB2 ALA 29 HB2 ALA 29 -2.506 -8.860 1.105
149 HB3 ALA 29 HB3 ALA 29 -1.323 -8.006 2.094
150 H SER 30 HN SER 30 -2.803 -11.954 1.971
151 HA SER 30 HA SER 30 -0.409 -13.373 2.003
152 HB2 SER 30 HB2 SER 30 -2.345 -13.954 -0.163
153 HB3 SER 30 HB1 SER 30 -1.642 -15.032 1.047
154 HG SER 30 HG SER 30 -3.777 -14.776 1.582
155 H SER 31 HN SER 31 -1.837 -11.390 -0.576
156 HA SER 31 HA SER 31 0.806 -11.198 -1.794
157 HB2 SER 31 HB2 SER 31 -0.560 -13.081 -2.877
158 HB3 SER 31 HB1 SER 31 -1.602 -11.808 -3.509
159 HG SER 31 HG SER 31 0.067 -12.391 -4.977
160 H LEU 32 HN LEU 32 0.471 -9.709 -3.876
161 HA LEU 32 HA LEU 32 -0.168 -7.142 -2.904
162 HB2 LEU 32 HB2 LEU 32 1.464 -7.683 -4.729
163 HB3 LEU 32 HB1 LEU 32 0.105 -8.011 -5.785
164 HG LEU 32 HG LEU 32 -0.632 -5.625 -5.397
165 HD11 LEU 32 HD11 LEU 32 1.105 -4.058 -4.656
166 HD12 LEU 32 HD12 LEU 32 2.136 -5.424 -4.225
167 HD13 LEU 32 HD13 LEU 32 0.612 -5.167 -3.376
168 HD21 LEU 32 HD21 LEU 32 0.448 -6.325 -7.455
169 HD22 LEU 32 HD22 LEU 32 2.036 -6.105 -6.720
170 HD23 LEU 32 HD23 LEU 32 0.987 -4.712 -6.995
171 H SER 33 HN SER 33 -1.892 -9.393 -5.006
172 HA SER 33 HA SER 33 -4.018 -7.767 -5.760
173 HB2 SER 33 HB2 SER 33 -5.091 -10.324 -5.533
174 HB3 SER 33 HB1 SER 33 -4.278 -9.659 -6.951
175 HG SER 33 HG SER 33 -2.499 -10.751 -6.478
176 H GLU 34 HN GLU 34 -3.532 -9.717 -2.862
177 HA GLU 34 HA GLU 34 -6.122 -9.472 -1.792
178 HB2 GLU 34 HB2 GLU 34 -3.441 -10.195 -0.732
179 HB3 GLU 34 HB1 GLU 34 -4.646 -9.694 0.445
180 HG2 GLU 34 HG2 GLU 34 -4.607 -12.102 0.190
181 HG3 GLU 34 HG1 GLU 34 -6.150 -11.429 -0.336
182 H CYS 35 HN CYS 35 -3.249 -7.448 -1.539
183 HA CYS 35 HA CYS 35 -4.301 -5.664 0.397
184 HB2 CYS 35 HB2 CYS 35 -1.838 -5.995 -0.358
185 HB3 CYS 35 HB1 CYS 35 -2.240 -4.858 -1.642
186 H ARG 36 HN ARG 36 -4.243 -5.679 -3.140
187 HA ARG 36 HA ARG 36 -5.385 -3.132 -3.527
188 HB2 ARG 36 HB2 ARG 36 -4.269 -4.572 -5.275
189 HB3 ARG 36 HB1 ARG 36 -5.736 -5.541 -5.317
190 HG2 ARG 36 HG2 ARG 36 -7.008 -3.539 -5.986
191 HG3 ARG 36 HG1 ARG 36 -5.499 -2.621 -6.014
192 HD2 ARG 36 HD2 ARG 36 -6.174 -5.015 -7.725
193 HD3 ARG 36 HD1 ARG 36 -6.104 -3.339 -8.258
194 HE ARG 36 HE ARG 36 -3.704 -3.393 -7.805
195 HH11 ARG 36 HH11 ARG 36 -5.397 -6.476 -8.073
196 HH12 ARG 36 HH12 ARG 36 -3.905 -7.377 -8.528
197 HH21 ARG 36 HH21 ARG 36 -1.803 -4.505 -8.337
198 HH22 ARG 36 HH22 ARG 36 -1.884 -6.280 -8.654
199 H ALA 37 HN ALA 37 -6.802 -6.354 -3.219
200 HA ALA 37 HA ALA 37 -9.492 -5.627 -3.614
201 HB1 ALA 37 HB1 ALA 37 -8.832 -7.927 -3.787
202 HB2 ALA 37 HB2 ALA 37 -9.995 -7.781 -2.465
203 HB3 ALA 37 HB3 ALA 37 -8.273 -7.939 -2.112
204 H ARG 38 HN ARG 38 -7.463 -5.706 -0.739
205 HA ARG 38 HA ARG 38 -9.586 -5.197 1.103
206 HB2 ARG 38 HB2 ARG 38 -6.668 -5.484 1.209
207 HB3 ARG 38 HB1 ARG 38 -7.304 -4.318 2.361
208 HG2 ARG 38 HG2 ARG 38 -7.104 -6.542 3.340
209 HG3 ARG 38 HG1 ARG 38 -8.782 -6.004 3.287
210 HD2 ARG 38 HD2 ARG 38 -9.306 -7.443 1.512
211 HD3 ARG 38 HD1 ARG 38 -7.609 -7.716 1.122
212 HE ARG 38 HE ARG 38 -8.306 -8.606 3.754
213 HH11 ARG 38 HH11 ARG 38 -8.378 -9.455 0.340
214 HH12 ARG 38 HH12 ARG 38 -8.326 -11.228 0.664
215 HH21 ARG 38 HH21 ARG 38 -8.270 -10.841 4.206
216 HH22 ARG 38 HH22 ARG 38 -8.265 -12.007 2.826
217 H CYS 39 HN CYS 39 -7.287 -3.217 -0.667
218 HA CYS 39 HA CYS 39 -7.932 -0.786 0.662
219 HB2 CYS 39 HB2 CYS 39 -5.829 -1.338 -0.723
220 HB3 CYS 39 HB1 CYS 39 -6.815 -0.947 -2.130
221 H GLN 40 HN GLN 40 -9.030 -2.303 -2.361
222 HA GLN 40 HA GLN 40 -10.576 -0.183 -3.322
223 HB2 GLN 40 HB2 GLN 40 -11.420 -1.654 -4.886
224 HB3 GLN 40 HB1 GLN 40 -9.929 -2.459 -4.421
225 HG2 GLN 40 HG2 GLN 40 -11.212 -3.900 -2.895
226 HG3 GLN 40 HG1 GLN 40 -12.696 -3.119 -3.437
227 HE21 GLN 40 HE21 GLN 40 -11.956 -5.909 -3.615
228 HE22 GLN 40 HE22 GLN 40 -11.985 -6.314 -5.296
229 H ALA 41 HN ALA 41 -11.156 -2.318 -0.688
230 HA ALA 41 HA ALA 41 -13.948 -2.265 -0.537
231 HB1 ALA 41 HB1 ALA 41 -13.648 -2.770 1.845
232 HB2 ALA 41 HB2 ALA 41 -11.938 -2.361 1.711
233 HB3 ALA 41 HB3 ALA 41 -12.584 -3.748 0.832
234 H GLU 42 HN GLU 42 -11.525 0.082 0.333
235 HA GLU 42 HA GLU 42 -13.533 1.839 1.531
236 HB2 GLU 42 HB2 GLU 42 -10.518 2.032 1.369
237 HB3 GLU 42 HB1 GLU 42 -11.548 3.273 2.074
238 HG2 GLU 42 HG2 GLU 42 -11.314 0.429 3.031
239 HG3 GLU 42 HG1 GLU 42 -10.569 1.839 3.783
240 H LYS 43 HN LYS 43 -13.931 3.915 0.720
241 HA LYS 43 HA LYS 43 -13.622 4.116 -2.149
242 HB2 LYS 43 HB2 LYS 43 -15.738 4.689 -0.837
243 HB3 LYS 43 HB1 LYS 43 -14.907 6.155 -0.334
244 HG2 LYS 43 HG2 LYS 43 -14.986 5.580 -3.238
245 HG3 LYS 43 HG1 LYS 43 -16.501 6.053 -2.465
246 HD2 LYS 43 HD2 LYS 43 -15.599 8.114 -1.744
247 HD3 LYS 43 HD1 LYS 43 -13.950 7.605 -2.115
248 HE2 LYS 43 HE2 LYS 43 -14.508 7.562 -4.499
249 HE3 LYS 43 HE1 LYS 43 -16.149 8.085 -4.125
250 HZ1 LYS 43 HZ1 LYS 43 -14.830 9.953 -4.805
251 HZ2 LYS 43 HZ2 LYS 43 -13.656 9.617 -3.634
252 HZ3 LYS 43 HZ3 LYS 43 -15.201 10.117 -3.163
253 H GLU 44 HN GLU 44 -12.305 5.590 0.727
254 HA GLU 44 HA GLU 44 -11.086 7.816 -0.579
255 HB2 GLU 44 HB2 GLU 44 -10.793 6.537 2.114
256 HB3 GLU 44 HB1 GLU 44 -9.630 7.744 1.590
257 HG2 GLU 44 HG2 GLU 44 -11.573 9.280 1.176
258 HG3 GLU 44 HG1 GLU 44 -12.585 8.088 1.994
259 H CYS 45 HN CYS 45 -10.388 4.542 -0.624
260 HA CYS 45 HA CYS 45 -7.582 4.502 -0.538
261 HB2 CYS 45 HB2 CYS 45 -8.689 2.417 -0.369
262 HB3 CYS 45 HB1 CYS 45 -9.589 2.688 -1.858
263 H SER 46 HN SER 46 -6.165 5.338 -1.832
264 HA SER 46 HA SER 46 -6.812 5.636 -4.680
265 HB2 SER 46 HB2 SER 46 -5.121 7.742 -4.201
266 HB3 SER 46 HB1 SER 46 -6.881 7.868 -4.264
267 HG SER 46 HG SER 46 -6.961 7.710 -2.038
268 H HIS 47 HN HIS 47 -4.494 5.027 -2.168
269 HA HIS 47 HA HIS 47 -2.700 3.757 -4.056
270 HB2 HIS 47 HB2 HIS 47 -0.745 5.031 -2.843
271 HB3 HIS 47 HB1 HIS 47 -1.577 5.789 -4.197
272 HD1 HIS 47 HD1 HIS 47 -2.926 7.894 -3.727
273 HD2 HIS 47 HD2 HIS 47 -1.338 6.171 -0.294
274 HE1 HIS 47 HE1 HIS 47 -3.312 9.567 -1.896
275 HE2 HIS 47 HE2 HIS 47 -2.549 8.410 0.204
276 H TYR 48 HN TYR 48 -2.095 1.876 -3.188
277 HA TYR 48 HA TYR 48 -2.102 1.671 -0.249
278 HB2 TYR 48 HB2 TYR 48 -2.696 -0.674 -0.467
279 HB3 TYR 48 HB1 TYR 48 -3.868 0.313 -1.326
280 HD1 TYR 48 HD2 TYR 48 -3.963 0.273 -3.778
281 HD2 TYR 48 HD1 TYR 48 -1.243 -2.206 -1.645
282 HE1 TYR 48 HE2 TYR 48 -3.617 -1.081 -5.798
283 HE2 TYR 48 HE1 TYR 48 -0.894 -3.566 -3.662
284 HH TYR 48 HH TYR 48 -2.135 -2.601 -6.771
285 H THR 49 HN THR 49 -0.344 0.839 0.757
286 HA THR 49 HA THR 49 1.969 0.230 -0.959
287 HB THR 49 HB THR 49 2.048 0.989 1.966
288 HG1 THR 49 HG1 THR 49 2.361 2.639 -0.345
289 HG21 THR 49 HG21 THR 49 4.018 -0.199 1.128
290 HG22 THR 49 HG22 THR 49 4.399 1.480 1.507
291 HG23 THR 49 HG23 THR 49 4.182 0.982 -0.171
292 H TYR 50 HN TYR 50 2.239 -1.914 -1.181
293 HA TYR 50 HA TYR 50 1.612 -3.621 1.124
294 HB2 TYR 50 HB2 TYR 50 0.444 -4.250 -0.922
295 HB3 TYR 50 HB1 TYR 50 1.973 -4.340 -1.792
296 HD1 TYR 50 HD1 TYR 50 0.437 -5.762 1.308
297 HD2 TYR 50 HD2 TYR 50 2.857 -6.450 -2.123
298 HE1 TYR 50 HE1 TYR 50 0.663 -8.123 1.949
299 HE2 TYR 50 HE2 TYR 50 3.087 -8.816 -1.491
300 HH TYR 50 HH TYR 50 1.227 -10.208 1.114
301 H ASN 51 HN ASN 51 3.289 -4.054 2.356
302 HA ASN 51 HA ASN 51 5.984 -3.964 1.308
303 HB2 ASN 51 HB2 ASN 51 5.354 -3.152 3.624
304 HB3 ASN 51 HB1 ASN 51 5.111 -4.838 4.069
305 HD21 ASN 51 HD21 ASN 51 7.450 -2.420 3.131
306 HD22 ASN 51 HD22 ASN 51 8.847 -3.299 3.678
307 H VAL 52 HN VAL 52 6.301 -5.609 -0.072
308 HA VAL 52 HA VAL 52 5.274 -8.227 0.238
309 HB VAL 52 HB VAL 52 6.001 -7.112 -1.919
310 HG11 VAL 52 HG11 VAL 52 8.727 -8.014 -1.001
311 HG12 VAL 52 HG12 VAL 52 8.196 -6.346 -1.219
312 HG13 VAL 52 HG13 VAL 52 8.327 -7.419 -2.613
313 HG21 VAL 52 HG21 VAL 52 6.946 -9.913 -1.327
314 HG22 VAL 52 HG22 VAL 52 6.756 -9.236 -2.945
315 HG23 VAL 52 HG23 VAL 52 5.349 -9.429 -1.898
316 H LYS 53 HN LYS 53 7.902 -6.692 1.738
317 HA LYS 53 HA LYS 53 9.417 -9.136 2.141
318 HB2 LYS 53 HB2 LYS 53 9.851 -6.247 2.724
319 HB3 LYS 53 HB1 LYS 53 10.719 -7.424 3.700
320 HG2 LYS 53 HG2 LYS 53 10.771 -7.604 0.715
321 HG3 LYS 53 HG1 LYS 53 11.832 -6.482 1.573
322 HD2 LYS 53 HD2 LYS 53 12.963 -8.208 2.670
323 HD3 LYS 53 HD1 LYS 53 11.680 -9.377 2.351
324 HE2 LYS 53 HE2 LYS 53 13.268 -8.128 0.133
325 HE3 LYS 53 HE1 LYS 53 13.844 -9.556 0.988
326 HZ1 LYS 53 HZ1 LYS 53 11.659 -10.601 0.405
327 HZ2 LYS 53 HZ2 LYS 53 12.687 -10.310 -0.903
328 HZ3 LYS 53 HZ3 LYS 53 11.375 -9.286 -0.624
329 H SER 54 HN SER 54 6.649 -8.670 3.246
330 HA SER 54 HA SER 54 7.045 -9.968 5.729
331 HB2 SER 54 HB2 SER 54 7.620 -7.614 6.373
332 HB3 SER 54 HB1 SER 54 5.980 -7.141 5.934
333 HG SER 54 HG SER 54 6.904 -8.434 8.170
334 H GLY 55 HN GLY 55 4.910 -8.137 3.610
335 HA2 GLY 55 HA2 GLY 55 2.900 -9.055 2.740
336 HA3 GLY 55 HA1 GLY 55 2.805 -10.112 4.143
337 H LEU 56 HN LEU 56 3.532 -6.726 4.407
338 HA LEU 56 HA LEU 56 1.143 -6.340 6.023
339 HB2 LEU 56 HB2 LEU 56 3.521 -4.558 5.491
340 HB3 LEU 56 HB1 LEU 56 2.195 -4.153 6.562
341 HG LEU 56 HG LEU 56 3.818 -6.635 7.023
342 HD11 LEU 56 HD11 LEU 56 4.487 -3.855 7.979
343 HD12 LEU 56 HD12 LEU 56 5.427 -4.824 6.845
344 HD13 LEU 56 HD13 LEU 56 5.260 -5.346 8.520
345 HD21 LEU 56 HD21 LEU 56 3.122 -6.283 9.328
346 HD22 LEU 56 HD22 LEU 56 1.720 -6.341 8.258
347 HD23 LEU 56 HD23 LEU 56 2.302 -4.791 8.867
348 H CYS 57 HN CYS 57 -0.625 -5.410 5.264
349 HA CYS 57 HA CYS 57 -0.498 -4.051 2.671
350 HB2 CYS 57 HB2 CYS 57 -2.102 -5.926 2.943
351 HB3 CYS 57 HB1 CYS 57 -2.910 -5.025 4.220
352 H TYR 58 HN TYR 58 -0.600 -1.901 2.588
353 HA TYR 58 HA TYR 58 -1.696 -0.476 4.923
354 HB2 TYR 58 HB2 TYR 58 0.551 0.323 3.074
355 HB3 TYR 58 HB1 TYR 58 -0.182 1.406 4.242
356 HD1 TYR 58 HD2 TYR 58 1.973 -1.540 3.809
357 HD2 TYR 58 HD1 TYR 58 0.337 1.245 6.579
358 HE1 TYR 58 HE2 TYR 58 3.611 -2.263 5.492
359 HE2 TYR 58 HE1 TYR 58 1.977 0.537 8.268
360 HH TYR 58 HH TYR 58 3.375 -1.454 8.765
361 HA PRO 59 HA PRO 59 -4.326 0.831 1.334
362 HB2 PRO 59 HB2 PRO 59 -6.435 0.992 3.362
363 HB3 PRO 59 HB1 PRO 59 -6.401 0.042 1.874
364 HG2 PRO 59 HG2 PRO 59 -6.265 -1.110 4.308
365 HG3 PRO 59 HG1 PRO 59 -5.456 -1.788 2.882
366 HD2 PRO 59 HD2 PRO 59 -4.296 -0.189 5.124
367 HD3 PRO 59 HD1 PRO 59 -3.626 -1.602 4.283
368 H LYS 60 HN LYS 60 -3.362 2.868 1.207
369 HA LYS 60 HA LYS 60 -3.916 4.764 3.361
370 HB2 LYS 60 HB2 LYS 60 -1.850 4.672 1.193
371 HB3 LYS 60 HB1 LYS 60 -2.170 6.149 2.092
372 HG2 LYS 60 HG2 LYS 60 -1.274 5.339 4.020
373 HG3 LYS 60 HG1 LYS 60 -1.677 3.665 3.634
374 HD2 LYS 60 HD2 LYS 60 0.119 3.601 1.987
375 HD3 LYS 60 HD1 LYS 60 0.502 5.294 2.327
376 HE2 LYS 60 HE2 LYS 60 1.169 4.772 4.552
377 HE3 LYS 60 HE1 LYS 60 0.556 3.127 4.417
378 HZ1 LYS 60 HZ1 LYS 60 2.253 2.783 2.638
379 HZ2 LYS 60 HZ2 LYS 60 2.897 3.048 4.186
380 HZ3 LYS 60 HZ3 LYS 60 2.905 4.293 3.040
381 H ARG 61 HN ARG 61 -4.392 6.936 2.899
382 HA ARG 61 HA ARG 61 -5.931 7.389 0.430
383 HB2 ARG 61 HB2 ARG 61 -7.567 8.647 1.820
384 HB3 ARG 61 HB1 ARG 61 -7.499 6.940 2.239
385 HG2 ARG 61 HG2 ARG 61 -6.120 7.434 4.169
386 HG3 ARG 61 HG1 ARG 61 -6.089 9.140 3.731
387 HD2 ARG 61 HD2 ARG 61 -8.617 9.084 3.917
388 HD3 ARG 61 HD1 ARG 61 -8.423 7.506 4.676
389 HE ARG 61 HE ARG 61 -6.741 9.255 6.016
390 HH11 ARG 61 HH11 ARG 61 -10.202 8.877 5.444
391 HH12 ARG 61 HH12 ARG 61 -10.643 9.649 7.021
392 HH21 ARG 61 HH21 ARG 61 -7.273 10.235 8.005
393 HH22 ARG 61 HH22 ARG 61 -9.016 10.395 8.445
394 H GLY 62 HN GLY 62 -6.646 10.005 0.937
395 HA2 GLY 62 HA2 GLY 62 -5.893 12.167 0.952
396 HA3 GLY 62 HA1 GLY 62 -4.558 11.618 1.948
397 H LYS 63 HN LYS 63 -2.802 12.441 1.077
398 HA LYS 63 HA LYS 63 -2.482 12.461 -1.830
399 HB2 LYS 63 HB2 LYS 63 -0.547 13.972 -1.328
400 HB3 LYS 63 HB1 LYS 63 -2.108 14.598 -0.815
401 HG2 LYS 63 HG2 LYS 63 -1.600 13.759 1.480
402 HG3 LYS 63 HG1 LYS 63 0.026 13.374 0.915
403 HD2 LYS 63 HD2 LYS 63 -1.227 16.111 0.803
404 HD3 LYS 63 HD1 LYS 63 -0.130 15.563 2.069
405 HE2 LYS 63 HE2 LYS 63 1.599 15.166 0.364
406 HE3 LYS 63 HE1 LYS 63 0.500 15.775 -0.871
407 HZ1 LYS 63 HZ1 LYS 63 2.033 17.483 -0.179
408 HZ2 LYS 63 HZ2 LYS 63 1.554 17.313 1.434
409 HZ3 LYS 63 HZ3 LYS 63 0.462 17.901 0.287
410 HA PRO 64 HA PRO 64 0.514 9.214 -1.439
411 HB2 PRO 64 HB2 PRO 64 1.295 9.074 -3.997
412 HB3 PRO 64 HB1 PRO 64 -0.337 8.609 -3.501
413 HG2 PRO 64 HG2 PRO 64 0.567 11.046 -4.916
414 HG3 PRO 64 HG1 PRO 64 -0.977 10.180 -5.024
415 HD2 PRO 64 HD2 PRO 64 -0.458 12.516 -3.531
416 HD3 PRO 64 HD1 PRO 64 -1.910 11.500 -3.455
417 H GLN 65 HN GLN 65 2.259 9.853 -0.239
418 HA GLN 65 HA GLN 65 4.279 11.565 -1.513
419 HB2 GLN 65 HB2 GLN 65 4.193 10.639 1.367
420 HB3 GLN 65 HB1 GLN 65 5.221 11.894 0.688
421 HG2 GLN 65 HG2 GLN 65 3.063 13.122 0.124
422 HG3 GLN 65 HG1 GLN 65 2.269 11.970 1.196
423 HE21 GLN 65 HE21 GLN 65 2.822 11.967 3.406
424 HE22 GLN 65 HE22 GLN 65 3.502 13.374 4.150
425 H PHE 66 HN PHE 66 5.139 10.040 -2.902
426 HA PHE 66 HA PHE 66 5.877 7.414 -2.099
427 HB2 PHE 66 HB2 PHE 66 6.564 9.060 -4.529
428 HB3 PHE 66 HB1 PHE 66 7.062 7.385 -4.320
429 HD1 PHE 66 HD1 PHE 66 5.314 5.606 -4.157
430 HD2 PHE 66 HD2 PHE 66 4.389 9.614 -5.246
431 HE1 PHE 66 HE1 PHE 66 3.172 4.851 -5.101
432 HE2 PHE 66 HE2 PHE 66 2.243 8.866 -6.187
433 HZ PHE 66 HZ PHE 66 1.634 6.483 -6.115
434 H TYR 67 HN TYR 67 7.764 6.548 -1.538
435 HA TYR 67 HA TYR 67 10.213 8.115 -1.592
436 HB2 TYR 67 HB2 TYR 67 10.707 7.985 0.697
437 HB3 TYR 67 HB1 TYR 67 9.005 8.414 0.680
438 HD1 TYR 67 HD2 TYR 67 7.298 6.587 1.116
439 HD2 TYR 67 HD1 TYR 67 11.461 6.039 1.771
440 HE1 TYR 67 HE2 TYR 67 6.809 4.674 2.584
441 HE2 TYR 67 HE1 TYR 67 10.986 4.131 3.242
442 HH TYR 67 HH TYR 67 8.193 2.502 3.300
443 H LYS 68 HN LYS 68 12.102 6.769 -1.540
444 HA LYS 68 HA LYS 68 11.583 4.180 -2.688
445 HB2 LYS 68 HB2 LYS 68 14.142 5.661 -2.090
446 HB3 LYS 68 HB1 LYS 68 14.106 4.057 -2.808
447 HG2 LYS 68 HG2 LYS 68 12.377 5.916 -4.203
448 HG3 LYS 68 HG1 LYS 68 14.052 6.464 -4.153
449 HD2 LYS 68 HD2 LYS 68 13.804 5.153 -6.124
450 HD3 LYS 68 HD1 LYS 68 14.713 4.178 -4.972
451 HE2 LYS 68 HE2 LYS 68 12.671 2.969 -4.383
452 HE3 LYS 68 HE1 LYS 68 11.754 3.960 -5.517
453 HZ1 LYS 68 HZ1 LYS 68 12.299 1.844 -6.511
454 HZ2 LYS 68 HZ2 LYS 68 13.950 2.084 -6.214
455 HZ3 LYS 68 HZ3 LYS 68 13.135 3.076 -7.315
456 H TYR 69 HN TYR 69 11.499 2.302 -1.685
457 HA TYR 69 HA TYR 69 13.099 1.772 0.660
458 HB2 TYR 69 HB2 TYR 69 10.936 2.826 1.498
459 HB3 TYR 69 HB1 TYR 69 10.110 1.403 0.875
460 HD1 TYR 69 HD1 TYR 69 13.002 2.276 3.076
461 HD2 TYR 69 HD2 TYR 69 9.741 -0.354 2.338
462 HE1 TYR 69 HE1 TYR 69 13.482 1.099 5.183
463 HE2 TYR 69 HE2 TYR 69 10.211 -1.538 4.442
464 HH TYR 69 HH TYR 69 12.786 -0.453 6.633
465 H LEU 70 HN LEU 70 13.934 -0.162 0.323
466 HA LEU 70 HA LEU 70 12.998 -1.893 -1.720
467 HB2 LEU 70 HB2 LEU 70 14.988 -2.393 0.494
468 HB3 LEU 70 HB1 LEU 70 14.740 -3.440 -0.890
469 HG LEU 70 HG LEU 70 15.756 -0.597 -0.989
470 HD11 LEU 70 HD11 LEU 70 17.405 -2.117 -0.084
471 HD12 LEU 70 HD12 LEU 70 17.854 -1.640 -1.723
472 HD13 LEU 70 HD13 LEU 70 17.150 -3.232 -1.429
473 HD21 LEU 70 HD21 LEU 70 15.289 -2.616 -3.178
474 HD22 LEU 70 HD22 LEU 70 16.187 -1.113 -3.371
475 HD23 LEU 70 HD23 LEU 70 14.474 -1.068 -2.967
476 H GLY 71 HN GLY 71 11.131 -2.912 -1.529
477 HA2 GLY 71 HA2 GLY 71 10.293 -5.052 -0.511
478 HA3 GLY 71 HA1 GLY 71 10.520 -4.241 1.033
479 H ASP 72 HN ASP 72 9.607 -1.667 -0.151
480 HA ASP 72 HA ASP 72 6.788 -2.079 0.340
481 HB2 ASP 72 HB2 ASP 72 8.600 0.272 0.140
482 HB3 ASP 72 HB1 ASP 72 6.905 0.537 -0.250
483 H MET 73 HN MET 73 5.258 -2.266 -1.157
484 HA MET 73 HA MET 73 5.883 -1.454 -3.918
485 HB2 MET 73 HB2 MET 73 4.405 -3.913 -2.967
486 HB3 MET 73 HB1 MET 73 4.401 -3.363 -4.636
487 HG2 MET 73 HG2 MET 73 6.804 -3.658 -4.763
488 HG3 MET 73 HG1 MET 73 6.847 -4.142 -3.070
489 HE1 MET 73 HE1 MET 73 4.572 -6.646 -6.221
490 HE2 MET 73 HE2 MET 73 5.231 -5.050 -6.571
491 HE3 MET 73 HE3 MET 73 3.897 -5.220 -5.432
492 H THR 74 HN THR 74 4.796 0.465 -3.920
493 HA THR 74 HA THR 74 2.054 0.534 -2.955
494 HB THR 74 HB THR 74 3.704 2.797 -4.087
495 HG1 THR 74 HG1 THR 74 4.697 2.105 -2.221
496 HG21 THR 74 HG21 THR 74 1.170 2.791 -2.440
497 HG22 THR 74 HG22 THR 74 1.297 3.224 -4.146
498 HG23 THR 74 HG23 THR 74 2.077 4.227 -2.920
499 H GLY 75 HN GLY 75 0.296 0.611 -4.169
500 HA2 GLY 75 HA2 GLY 75 0.597 0.967 -7.084
501 HA3 GLY 75 HA1 GLY 75 -0.368 -0.348 -6.423
502 H SER 76 HN SER 76 -2.001 0.793 -7.844
503 HA SER 76 HA SER 76 -3.228 3.055 -6.403
504 HB2 SER 76 HB2 SER 76 -4.414 3.472 -8.606
505 HB3 SER 76 HB1 SER 76 -2.672 3.744 -8.626
506 HG SER 76 HG SER 76 -2.780 1.308 -9.304
507 H ARG 77 HN ARG 77 -5.651 3.105 -6.544
508 HA ARG 77 HA ARG 77 -6.749 0.874 -5.326
509 HB2 ARG 77 HB2 ARG 77 -7.657 3.234 -5.335
510 HB3 ARG 77 HB1 ARG 77 -8.347 2.879 -6.913
511 HG2 ARG 77 HG2 ARG 77 -9.586 0.986 -5.871
512 HG3 ARG 77 HG1 ARG 77 -8.992 1.528 -4.302
513 HD2 ARG 77 HD2 ARG 77 -10.039 3.762 -4.797
514 HD3 ARG 77 HD1 ARG 77 -10.797 3.011 -6.200
515 HE ARG 77 HE ARG 77 -11.234 1.907 -3.513
516 HH11 ARG 77 HH11 ARG 77 -12.473 3.446 -6.430
517 HH12 ARG 77 HH12 ARG 77 -14.192 3.106 -6.013
518 HH21 ARG 77 HH21 ARG 77 -13.390 1.444 -2.956
519 HH22 ARG 77 HH22 ARG 77 -14.707 1.967 -4.077
520 H THR 78 HN THR 78 -6.523 1.565 -8.766
521 HA THR 78 HA THR 78 -8.130 -0.843 -9.283
522 HB THR 78 HB THR 78 -8.873 1.387 -10.272
523 HG1 THR 78 HG1 THR 78 -9.142 -0.999 -11.125
524 HG21 THR 78 HG21 THR 78 -7.791 2.119 -12.317
525 HG22 THR 78 HG22 THR 78 -6.588 0.838 -12.167
526 HG23 THR 78 HG23 THR 78 -6.635 2.145 -10.983
527 H CYS 79 HN CYS 79 -5.015 -0.138 -8.898
528 HA CYS 79 HA CYS 79 -4.097 -2.362 -10.417
529 HB2 CYS 79 HB2 CYS 79 -4.110 0.146 -11.772
530 HB3 CYS 79 HB1 CYS 79 -2.436 -0.261 -11.416
531 H1 GAL 83 H1 GTP 1 5.982 2.246 8.554
532 H2 GAL 83 H2 GTP 1 5.535 4.051 6.142
533 H3 GAL 83 H3 GTP 1 3.731 2.057 7.585
534 H4 GAL 83 H4 GTP 1 3.860 0.849 5.447
535 H5 GAL 83 H5 GTP 1 5.445 0.361 7.214
536 H61 GAL 83 H61 GTP 1 5.854 -0.234 4.499
537 H62 GAL 83 H62 GTP 1 6.533 -1.063 5.905
538 HO2 GAL 83 HO2 GTP 1 5.044 4.270 8.853
539 HO3 GAL 83 HO3 GTP 1 2.848 4.073 6.694
540 HO4 GAL 83 HO4 GTP 1 5.930 2.002 4.283
541 HO6 GAL 83 HO6 GTP 1 7.711 0.441 3.980
542 H1 NAG 84 H1 GCP 2 10.477 3.087 5.402
543 H2 NAG 84 H2 GCP 2 10.006 3.659 8.386
544 H3 NAG 84 H3 GCP 2 8.113 3.501 6.011
545 H4 NAG 84 H4 GCP 2 9.033 5.752 7.853
546 H5 NAG 84 H5 GCP 2 9.450 5.190 4.884
547 H61 NAG 84 H61 GCP 2 9.617 7.652 6.410
548 H62 NAG 84 H62 GCP 2 9.832 7.369 4.684
549 H81 NAG 84 HC23 GCP 2 9.803 -0.742 9.607
550 H82 NAG 84 HC21 GCP 2 8.584 -0.521 8.353
551 H83 NAG 84 HC22 GCP 2 10.256 -0.850 7.907
552 HN2 NAG 84 HN2 GCP 2 9.012 1.320 6.821
553 HO1 NAG 84 HO1 GCP 2 11.858 2.517 7.670
554 HO4 NAG 84 HO4 GCP 2 6.913 6.092 7.238
555 HO6 NAG 84 HO6 GCP 2 11.870 6.631 6.510
Start of MODEL 8
1 H CYS 10 HT1 CYS 10 0.332 -0.078 -15.411
2 HA CYS 10 HA CYS 10 -0.850 2.263 -14.041
3 HB2 CYS 10 HB2 CYS 10 -1.903 0.425 -12.636
4 HB3 CYS 10 HB1 CYS 10 -2.513 0.573 -14.279
5 H VAL 11 HN VAL 11 -0.209 2.596 -11.890
6 HA VAL 11 HA VAL 11 2.514 2.017 -11.334
7 HB VAL 11 HB VAL 11 0.366 3.157 -9.536
8 HG11 VAL 11 HG11 VAL 11 2.176 2.227 -8.204
9 HG12 VAL 11 HG12 VAL 11 2.224 3.992 -8.158
10 HG13 VAL 11 HG13 VAL 11 3.362 3.103 -9.172
11 HG21 VAL 11 HG21 VAL 11 2.533 4.511 -11.140
12 HG22 VAL 11 HG22 VAL 11 1.387 5.312 -10.065
13 HG23 VAL 11 HG23 VAL 11 0.812 4.508 -11.525
14 H HIS 12 HN HIS 12 3.390 0.321 -10.379
15 HA HIS 12 HA HIS 12 2.302 -1.079 -8.195
16 HB2 HIS 12 HB2 HIS 12 1.632 -3.165 -9.118
17 HB3 HIS 12 HB1 HIS 12 0.824 -1.947 -10.094
18 HD1 HIS 12 HD1 HIS 12 2.906 -4.896 -10.357
19 HD2 HIS 12 HD2 HIS 12 2.230 -1.507 -12.665
20 HE1 HIS 12 HE1 HIS 12 3.770 -5.457 -12.645
21 HE2 HIS 12 HE2 HIS 12 3.226 -3.446 -14.058
22 H THR 13 HN THR 13 3.856 -2.344 -7.233
23 HA THR 13 HA THR 13 5.923 -3.132 -6.736
24 HB THR 13 HB THR 13 6.634 -3.489 -9.620
25 HG1 THR 13 HG1 THR 13 5.198 -5.590 -8.981
26 HG21 THR 13 HG21 THR 13 7.629 -5.508 -8.865
27 HG22 THR 13 HG22 THR 13 6.751 -5.457 -7.338
28 HG23 THR 13 HG23 THR 13 8.035 -4.292 -7.654
29 H GLY 14 HN GLY 14 8.334 -2.839 -8.486
30 HA2 GLY 14 HA2 GLY 14 9.931 -1.268 -9.047
31 HA3 GLY 14 HA1 GLY 14 8.691 -0.028 -8.935
32 H ASN 15 HN ASN 15 9.062 -2.138 -6.289
33 HA ASN 15 HA ASN 15 9.327 -1.655 -4.089
34 HB2 ASN 15 HB2 ASN 15 11.692 -1.317 -3.463
35 HB3 ASN 15 HB1 ASN 15 11.456 -2.603 -4.637
36 HD21 ASN 15 HD21 ASN 15 13.070 0.271 -3.899
37 HD22 ASN 15 HD22 ASN 15 13.910 0.466 -5.396
38 H ILE 16 HN ILE 16 7.818 0.206 -4.643
39 HA ILE 16 HA ILE 16 9.012 2.706 -3.650
40 HB ILE 16 HB ILE 16 6.885 2.241 -5.718
41 HG12 ILE 16 HG12 ILE 16 9.296 2.655 -6.320
42 HG13 ILE 16 HG11 ILE 16 8.148 3.777 -7.041
43 HG21 ILE 16 HG21 ILE 16 5.820 3.695 -4.093
44 HG22 ILE 16 HG22 ILE 16 6.200 4.588 -5.566
45 HG23 ILE 16 HG23 ILE 16 7.208 4.784 -4.131
46 HD11 ILE 16 HD11 ILE 16 10.084 4.979 -6.297
47 HD12 ILE 16 HD12 ILE 16 9.934 4.296 -4.678
48 HD13 ILE 16 HD13 ILE 16 8.710 5.415 -5.279
49 H GLY 17 HN GLY 17 8.233 3.376 -1.735
50 HA2 GLY 17 HA2 GLY 17 5.827 2.021 -0.701
51 HA3 GLY 17 HA1 GLY 17 7.096 2.734 0.288
52 H SER 18 HN SER 18 5.024 3.627 1.274
53 HA SER 18 HA SER 18 4.697 6.329 0.268
54 HB2 SER 18 HB2 SER 18 2.382 4.413 0.589
55 HB3 SER 18 HB1 SER 18 2.190 6.163 0.484
56 HG SER 18 HG SER 18 3.738 4.981 -1.493
57 H LYS 19 HN LYS 19 4.991 7.623 1.937
58 HA LYS 19 HA LYS 19 4.625 6.616 4.645
59 HB2 LYS 19 HB2 LYS 19 6.613 8.047 3.767
60 HB3 LYS 19 HB1 LYS 19 5.512 9.407 3.949
61 HG2 LYS 19 HG2 LYS 19 5.208 8.729 6.337
62 HG3 LYS 19 HG1 LYS 19 6.493 7.546 6.096
63 HD2 LYS 19 HD2 LYS 19 7.498 9.470 7.058
64 HD3 LYS 19 HD1 LYS 19 7.961 9.450 5.355
65 HE2 LYS 19 HE2 LYS 19 7.274 11.693 6.232
66 HE3 LYS 19 HE1 LYS 19 6.372 11.143 4.822
67 HZ1 LYS 19 HZ1 LYS 19 4.568 10.475 6.273
68 HZ2 LYS 19 HZ2 LYS 19 4.924 12.110 6.499
69 HZ3 LYS 19 HZ3 LYS 19 5.436 10.972 7.639
70 H ALA 20 HN ALA 20 2.377 7.301 2.754
71 HA ALA 20 HA ALA 20 1.069 9.605 3.838
72 HB1 ALA 20 HB1 ALA 20 -0.769 9.024 2.414
73 HB2 ALA 20 HB2 ALA 20 -0.140 7.394 2.184
74 HB3 ALA 20 HB3 ALA 20 0.727 8.778 1.516
75 H GLN 21 HN GLN 21 -1.169 9.410 4.765
76 HA GLN 21 HA GLN 21 -1.061 7.777 7.106
77 HB2 GLN 21 HB2 GLN 21 -2.080 10.143 6.814
78 HB3 GLN 21 HB1 GLN 21 -3.490 9.298 6.189
79 HG2 GLN 21 HG2 GLN 21 -2.786 8.021 8.596
80 HG3 GLN 21 HG1 GLN 21 -2.713 9.757 8.897
81 HE21 GLN 21 HE21 GLN 21 -4.574 7.857 9.966
82 HE22 GLN 21 HE22 GLN 21 -6.150 8.361 9.461
83 H THR 22 HN THR 22 -2.151 5.965 7.593
84 HA THR 22 HA THR 22 -3.386 4.497 5.426
85 HB THR 22 HB THR 22 -3.141 3.572 8.290
86 HG1 THR 22 HG1 THR 22 -1.059 3.861 7.993
87 HG21 THR 22 HG21 THR 22 -2.979 1.359 7.265
88 HG22 THR 22 HG22 THR 22 -3.071 2.084 5.660
89 HG23 THR 22 HG23 THR 22 -4.455 2.174 6.749
90 H ILE 23 HN ILE 23 -5.542 3.937 5.295
91 HA ILE 23 HA ILE 23 -7.393 5.703 6.536
92 HB ILE 23 HB ILE 23 -8.089 3.151 5.081
93 HG12 ILE 23 HG12 ILE 23 -7.764 5.896 3.864
94 HG13 ILE 23 HG11 ILE 23 -6.496 4.677 3.819
95 HG21 ILE 23 HG21 ILE 23 -10.137 4.442 4.502
96 HG22 ILE 23 HG22 ILE 23 -9.581 5.730 5.569
97 HG23 ILE 23 HG23 ILE 23 -9.962 4.140 6.229
98 HD11 ILE 23 HD11 ILE 23 -8.070 3.174 2.630
99 HD12 ILE 23 HD12 ILE 23 -7.672 4.647 1.745
100 HD13 ILE 23 HD13 ILE 23 -9.225 4.508 2.572
101 H GLY 24 HN GLY 24 -6.901 2.180 6.887
102 HA2 GLY 24 HA2 GLY 24 -8.327 2.418 9.460
103 HA3 GLY 24 HA1 GLY 24 -8.508 1.031 8.404
104 H GLU 25 HN GLU 25 -7.878 -0.426 9.921
105 HA GLU 25 HA GLU 25 -5.376 -0.203 11.317
106 HB2 GLU 25 HB2 GLU 25 -7.020 -1.308 12.550
107 HB3 GLU 25 HB1 GLU 25 -7.587 -2.222 11.162
108 HG2 GLU 25 HG2 GLU 25 -4.880 -2.940 11.703
109 HG3 GLU 25 HG1 GLU 25 -5.819 -3.039 13.192
110 H VAL 26 HN VAL 26 -3.477 -1.154 10.841
111 HA VAL 26 HA VAL 26 -3.061 -2.132 8.175
112 HB VAL 26 HB VAL 26 -1.139 -2.098 10.514
113 HG11 VAL 26 HG11 VAL 26 -0.373 -3.616 8.826
114 HG12 VAL 26 HG12 VAL 26 0.592 -2.142 8.725
115 HG13 VAL 26 HG13 VAL 26 -0.692 -2.439 7.552
116 HG21 VAL 26 HG21 VAL 26 -1.513 -0.072 8.309
117 HG22 VAL 26 HG22 VAL 26 -0.276 -0.024 9.564
118 HG23 VAL 26 HG23 VAL 26 -1.978 0.142 9.995
119 H LYS 27 HN LYS 27 -3.379 -4.183 7.563
120 HA LYS 27 HA LYS 27 -3.098 -6.282 9.605
121 HB2 LYS 27 HB2 LYS 27 -4.812 -7.396 7.789
122 HB3 LYS 27 HB1 LYS 27 -5.287 -6.657 9.308
123 HG2 LYS 27 HG2 LYS 27 -5.593 -4.503 8.076
124 HG3 LYS 27 HG1 LYS 27 -5.310 -5.389 6.576
125 HD2 LYS 27 HD2 LYS 27 -7.278 -6.606 6.777
126 HD3 LYS 27 HD1 LYS 27 -7.387 -6.328 8.516
127 HE2 LYS 27 HE2 LYS 27 -7.784 -4.242 6.371
128 HE3 LYS 27 HE1 LYS 27 -9.069 -5.038 7.279
129 HZ1 LYS 27 HZ1 LYS 27 -7.895 -4.123 9.329
130 HZ2 LYS 27 HZ2 LYS 27 -8.739 -3.019 8.361
131 HZ3 LYS 27 HZ3 LYS 27 -7.051 -3.112 8.264
132 H ARG 28 HN ARG 28 -2.641 -8.427 8.731
133 HA ARG 28 HA ARG 28 -0.469 -8.269 6.860
134 HB2 ARG 28 HB2 ARG 28 -0.267 -9.702 8.804
135 HB3 ARG 28 HB1 ARG 28 -1.705 -10.596 8.343
136 HG2 ARG 28 HG2 ARG 28 -0.558 -11.464 6.379
137 HG3 ARG 28 HG1 ARG 28 0.884 -10.538 6.799
138 HD2 ARG 28 HD2 ARG 28 0.997 -12.932 7.472
139 HD3 ARG 28 HD1 ARG 28 1.182 -11.803 8.815
140 HE ARG 28 HE ARG 28 -1.499 -12.824 8.328
141 HH11 ARG 28 HH11 ARG 28 1.489 -13.048 10.172
142 HH12 ARG 28 HH12 ARG 28 0.711 -13.932 11.532
143 HH21 ARG 28 HH21 ARG 28 -2.523 -13.930 10.032
144 HH22 ARG 28 HH22 ARG 28 -1.537 -14.427 11.462
145 H ALA 29 HN ALA 29 -0.412 -8.925 4.804
146 HA ALA 29 HA ALA 29 -2.893 -10.020 3.646
147 HB1 ALA 29 HB1 ALA 29 -0.945 -8.032 2.490
148 HB2 ALA 29 HB2 ALA 29 -2.658 -7.794 2.836
149 HB3 ALA 29 HB3 ALA 29 -2.163 -8.867 1.528
150 H SER 30 HN SER 30 -2.681 -11.702 2.197
151 HA SER 30 HA SER 30 -0.326 -13.282 2.443
152 HB2 SER 30 HB2 SER 30 -2.196 -14.069 0.339
153 HB3 SER 30 HB1 SER 30 -1.685 -14.951 1.777
154 HG SER 30 HG SER 30 -3.983 -13.664 1.343
155 H SER 31 HN SER 31 -1.414 -10.933 0.145
156 HA SER 31 HA SER 31 1.047 -11.049 -1.291
157 HB2 SER 31 HB2 SER 31 0.052 -11.611 -3.504
158 HB3 SER 31 HB1 SER 31 -0.048 -12.952 -2.364
159 HG SER 31 HG SER 31 -2.045 -12.782 -3.275
160 H LEU 32 HN LEU 32 0.674 -9.665 -3.456
161 HA LEU 32 HA LEU 32 -0.070 -7.068 -2.611
162 HB2 LEU 32 HB2 LEU 32 1.648 -7.504 -4.334
163 HB3 LEU 32 HB1 LEU 32 0.406 -8.123 -5.405
164 HG LEU 32 HG LEU 32 -0.669 -5.806 -5.229
165 HD11 LEU 32 HD11 LEU 32 2.061 -5.215 -4.104
166 HD12 LEU 32 HD12 LEU 32 0.497 -4.924 -3.342
167 HD13 LEU 32 HD13 LEU 32 0.973 -3.990 -4.762
168 HD21 LEU 32 HD21 LEU 32 0.806 -4.905 -6.969
169 HD22 LEU 32 HD22 LEU 32 0.428 -6.609 -7.235
170 HD23 LEU 32 HD23 LEU 32 2.000 -6.145 -6.584
171 H SER 33 HN SER 33 -1.595 -9.506 -4.669
172 HA SER 33 HA SER 33 -3.832 -8.004 -5.463
173 HB2 SER 33 HB2 SER 33 -4.191 -10.921 -5.029
174 HB3 SER 33 HB1 SER 33 -4.520 -9.945 -6.463
175 HG SER 33 HG SER 33 -2.699 -11.473 -6.591
176 H GLU 34 HN GLU 34 -3.182 -10.024 -2.657
177 HA GLU 34 HA GLU 34 -5.747 -10.027 -1.523
178 HB2 GLU 34 HB2 GLU 34 -3.548 -11.312 -0.887
179 HB3 GLU 34 HB1 GLU 34 -3.272 -9.931 0.163
180 HG2 GLU 34 HG2 GLU 34 -4.306 -11.450 1.552
181 HG3 GLU 34 HG1 GLU 34 -5.633 -10.402 1.054
182 H CYS 35 HN CYS 35 -3.049 -7.777 -1.281
183 HA CYS 35 HA CYS 35 -4.246 -6.070 0.661
184 HB2 CYS 35 HB2 CYS 35 -1.795 -6.177 0.245
185 HB3 CYS 35 HB1 CYS 35 -2.056 -5.437 -1.331
186 H ARG 36 HN ARG 36 -4.158 -6.173 -2.849
187 HA ARG 36 HA ARG 36 -5.232 -3.660 -3.426
188 HB2 ARG 36 HB2 ARG 36 -4.255 -5.205 -5.109
189 HB3 ARG 36 HB1 ARG 36 -5.662 -6.245 -4.946
190 HG2 ARG 36 HG2 ARG 36 -7.087 -4.402 -5.735
191 HG3 ARG 36 HG1 ARG 36 -5.645 -3.412 -5.962
192 HD2 ARG 36 HD2 ARG 36 -6.228 -4.330 -8.077
193 HD3 ARG 36 HD1 ARG 36 -4.787 -5.172 -7.514
194 HE ARG 36 HE ARG 36 -7.003 -6.655 -6.699
195 HH11 ARG 36 HH11 ARG 36 -5.437 -5.645 -9.679
196 HH12 ARG 36 HH12 ARG 36 -5.971 -7.103 -10.596
197 HH21 ARG 36 HH21 ARG 36 -7.721 -8.506 -7.824
198 HH22 ARG 36 HH22 ARG 36 -7.262 -8.692 -9.559
199 H ALA 37 HN ALA 37 -6.856 -6.783 -2.953
200 HA ALA 37 HA ALA 37 -9.485 -5.909 -3.317
201 HB1 ALA 37 HB1 ALA 37 -8.834 -8.269 -3.276
202 HB2 ALA 37 HB2 ALA 37 -10.153 -7.940 -2.150
203 HB3 ALA 37 HB3 ALA 37 -8.509 -8.147 -1.547
204 H ARG 38 HN ARG 38 -7.413 -5.801 -0.487
205 HA ARG 38 HA ARG 38 -9.466 -5.149 1.377
206 HB2 ARG 38 HB2 ARG 38 -6.521 -5.315 1.391
207 HB3 ARG 38 HB1 ARG 38 -7.204 -4.160 2.527
208 HG2 ARG 38 HG2 ARG 38 -6.818 -6.410 3.486
209 HG3 ARG 38 HG1 ARG 38 -8.495 -5.873 3.586
210 HD2 ARG 38 HD2 ARG 38 -9.071 -7.235 1.662
211 HD3 ARG 38 HD1 ARG 38 -7.385 -7.714 1.472
212 HE ARG 38 HE ARG 38 -8.660 -8.339 4.013
213 HH11 ARG 38 HH11 ARG 38 -7.680 -9.419 0.824
214 HH12 ARG 38 HH12 ARG 38 -7.676 -11.168 1.270
215 HH21 ARG 38 HH21 ARG 38 -8.696 -10.526 4.644
216 HH22 ARG 38 HH22 ARG 38 -8.239 -11.785 3.434
217 H CYS 39 HN CYS 39 -7.306 -3.273 -0.661
218 HA CYS 39 HA CYS 39 -8.085 -0.769 0.514
219 HB2 CYS 39 HB2 CYS 39 -5.891 -1.449 -0.810
220 HB3 CYS 39 HB1 CYS 39 -6.835 -0.896 -2.189
221 H GLN 40 HN GLN 40 -9.058 -2.708 -2.247
222 HA GLN 40 HA GLN 40 -10.602 -0.713 -3.540
223 HB2 GLN 40 HB2 GLN 40 -10.713 -3.725 -3.655
224 HB3 GLN 40 HB1 GLN 40 -11.733 -2.690 -4.643
225 HG2 GLN 40 HG2 GLN 40 -9.750 -1.700 -5.659
226 HG3 GLN 40 HG1 GLN 40 -8.724 -2.736 -4.667
227 HE21 GLN 40 HE21 GLN 40 -10.770 -2.544 -7.434
228 HE22 GLN 40 HE22 GLN 40 -10.456 -4.134 -8.039
229 H ALA 41 HN ALA 41 -11.092 -2.393 -0.659
230 HA ALA 41 HA ALA 41 -13.972 -2.416 -0.746
231 HB1 ALA 41 HB1 ALA 41 -12.063 -2.885 1.542
232 HB2 ALA 41 HB2 ALA 41 -12.801 -4.122 0.524
233 HB3 ALA 41 HB3 ALA 41 -13.807 -3.148 1.595
234 H GLU 42 HN GLU 42 -11.642 -0.075 -0.258
235 HA GLU 42 HA GLU 42 -13.384 1.548 1.463
236 HB2 GLU 42 HB2 GLU 42 -10.576 1.122 1.454
237 HB3 GLU 42 HB1 GLU 42 -10.855 2.799 1.000
238 HG2 GLU 42 HG2 GLU 42 -11.604 1.386 3.531
239 HG3 GLU 42 HG1 GLU 42 -10.651 2.854 3.318
240 H LYS 43 HN LYS 43 -13.387 3.909 0.947
241 HA LYS 43 HA LYS 43 -13.654 4.240 -1.967
242 HB2 LYS 43 HB2 LYS 43 -15.182 6.116 -1.412
243 HB3 LYS 43 HB1 LYS 43 -15.739 4.566 -0.802
244 HG2 LYS 43 HG2 LYS 43 -14.676 5.234 1.413
245 HG3 LYS 43 HG1 LYS 43 -14.557 6.858 0.733
246 HD2 LYS 43 HD2 LYS 43 -16.582 6.790 1.978
247 HD3 LYS 43 HD1 LYS 43 -17.037 6.726 0.276
248 HE2 LYS 43 HE2 LYS 43 -17.239 4.269 0.459
249 HE3 LYS 43 HE1 LYS 43 -16.871 4.389 2.177
250 HZ1 LYS 43 HZ1 LYS 43 -19.232 4.240 1.848
251 HZ2 LYS 43 HZ2 LYS 43 -19.220 5.564 0.794
252 HZ3 LYS 43 HZ3 LYS 43 -18.854 5.785 2.428
253 H GLU 44 HN GLU 44 -12.009 5.348 0.845
254 HA GLU 44 HA GLU 44 -11.006 7.729 -0.495
255 HB2 GLU 44 HB2 GLU 44 -10.574 6.624 2.281
256 HB3 GLU 44 HB1 GLU 44 -9.756 8.057 1.675
257 HG2 GLU 44 HG2 GLU 44 -12.015 9.046 1.239
258 HG3 GLU 44 HG1 GLU 44 -12.701 7.673 2.103
259 H CYS 45 HN CYS 45 -10.301 4.597 -0.735
260 HA CYS 45 HA CYS 45 -7.476 4.545 -0.395
261 HB2 CYS 45 HB2 CYS 45 -8.577 2.453 -0.300
262 HB3 CYS 45 HB1 CYS 45 -9.419 2.740 -1.818
263 H SER 46 HN SER 46 -6.245 5.889 -1.544
264 HA SER 46 HA SER 46 -6.806 6.254 -4.396
265 HB2 SER 46 HB2 SER 46 -5.090 8.096 -4.192
266 HB3 SER 46 HB1 SER 46 -6.533 8.327 -3.206
267 HG SER 46 HG SER 46 -4.739 8.754 -1.943
268 H HIS 47 HN HIS 47 -4.795 4.604 -2.234
269 HA HIS 47 HA HIS 47 -3.382 3.207 -4.232
270 HB2 HIS 47 HB2 HIS 47 -1.112 4.037 -3.813
271 HB3 HIS 47 HB1 HIS 47 -2.135 5.332 -4.421
272 HD1 HIS 47 HD1 HIS 47 -3.199 6.875 -2.330
273 HD2 HIS 47 HD2 HIS 47 0.311 4.749 -1.639
274 HE1 HIS 47 HE1 HIS 47 -2.142 7.952 -0.319
275 HE2 HIS 47 HE2 HIS 47 -0.109 6.547 0.166
276 H TYR 48 HN TYR 48 -2.369 1.397 -3.361
277 HA TYR 48 HA TYR 48 -2.494 1.202 -0.422
278 HB2 TYR 48 HB2 TYR 48 -2.920 -1.220 -0.690
279 HB3 TYR 48 HB1 TYR 48 -4.185 -0.235 -1.413
280 HD1 TYR 48 HD2 TYR 48 -4.327 -0.049 -3.897
281 HD2 TYR 48 HD1 TYR 48 -1.606 -2.715 -2.003
282 HE1 TYR 48 HE2 TYR 48 -4.059 -1.273 -6.013
283 HE2 TYR 48 HE1 TYR 48 -1.335 -3.946 -4.112
284 HH TYR 48 HH TYR 48 -2.242 -4.268 -6.178
285 H THR 49 HN THR 49 -0.718 0.564 0.633
286 HA THR 49 HA THR 49 1.633 -0.069 -1.012
287 HB THR 49 HB THR 49 1.541 1.086 1.783
288 HG1 THR 49 HG1 THR 49 2.315 2.349 -0.656
289 HG21 THR 49 HG21 THR 49 3.961 1.530 1.370
290 HG22 THR 49 HG22 THR 49 3.843 0.559 -0.099
291 HG23 THR 49 HG23 THR 49 3.565 -0.186 1.475
292 H TYR 50 HN TYR 50 1.995 -2.187 -1.066
293 HA TYR 50 HA TYR 50 1.467 -3.758 1.359
294 HB2 TYR 50 HB2 TYR 50 0.290 -4.642 -0.539
295 HB3 TYR 50 HB1 TYR 50 1.737 -4.573 -1.542
296 HD1 TYR 50 HD1 TYR 50 0.672 -6.093 1.713
297 HD2 TYR 50 HD2 TYR 50 2.789 -6.582 -1.947
298 HE1 TYR 50 HE1 TYR 50 1.214 -8.406 2.343
299 HE2 TYR 50 HE2 TYR 50 3.331 -8.899 -1.327
300 HH TYR 50 HH TYR 50 3.563 -10.217 0.838
301 H ASN 51 HN ASN 51 3.143 -4.278 2.563
302 HA ASN 51 HA ASN 51 5.833 -4.060 1.450
303 HB2 ASN 51 HB2 ASN 51 5.253 -2.964 3.628
304 HB3 ASN 51 HB1 ASN 51 5.002 -4.566 4.314
305 HD21 ASN 51 HD21 ASN 51 7.305 -2.272 3.129
306 HD22 ASN 51 HD22 ASN 51 8.717 -3.076 3.747
307 H VAL 52 HN VAL 52 6.862 -5.804 0.722
308 HA VAL 52 HA VAL 52 5.746 -8.435 1.209
309 HB VAL 52 HB VAL 52 7.395 -9.268 -0.379
310 HG11 VAL 52 HG11 VAL 52 5.350 -8.383 -1.281
311 HG12 VAL 52 HG12 VAL 52 6.680 -7.948 -2.354
312 HG13 VAL 52 HG13 VAL 52 5.997 -6.744 -1.259
313 HG21 VAL 52 HG21 VAL 52 8.448 -6.439 -0.427
314 HG22 VAL 52 HG22 VAL 52 8.944 -7.743 -1.510
315 HG23 VAL 52 HG23 VAL 52 9.283 -7.854 0.218
316 H LYS 53 HN LYS 53 7.986 -6.554 2.832
317 HA LYS 53 HA LYS 53 9.747 -8.719 3.596
318 HB2 LYS 53 HB2 LYS 53 9.524 -5.886 4.627
319 HB3 LYS 53 HB1 LYS 53 10.757 -7.035 5.120
320 HG2 LYS 53 HG2 LYS 53 10.347 -5.998 2.322
321 HG3 LYS 53 HG1 LYS 53 11.584 -5.450 3.454
322 HD2 LYS 53 HD2 LYS 53 12.344 -7.893 3.530
323 HD3 LYS 53 HD1 LYS 53 11.327 -8.130 2.110
324 HE2 LYS 53 HE2 LYS 53 13.657 -7.702 1.493
325 HE3 LYS 53 HE1 LYS 53 12.581 -6.438 0.900
326 HZ1 LYS 53 HZ1 LYS 53 13.332 -4.949 2.530
327 HZ2 LYS 53 HZ2 LYS 53 14.732 -5.694 1.954
328 HZ3 LYS 53 HZ3 LYS 53 14.081 -6.164 3.439
329 H SER 54 HN SER 54 7.180 -6.800 5.085
330 HA SER 54 HA SER 54 7.174 -8.612 7.390
331 HB2 SER 54 HB2 SER 54 5.456 -6.163 7.162
332 HB3 SER 54 HB1 SER 54 6.133 -6.914 8.608
333 HG SER 54 HG SER 54 8.157 -6.140 8.028
334 H GLY 55 HN GLY 55 5.400 -7.853 4.530
335 HA2 GLY 55 HA2 GLY 55 3.611 -8.993 3.599
336 HA3 GLY 55 HA1 GLY 55 3.546 -9.998 5.042
337 H LEU 56 HN LEU 56 3.467 -6.512 5.140
338 HA LEU 56 HA LEU 56 0.747 -6.673 6.225
339 HB2 LEU 56 HB2 LEU 56 2.863 -4.555 6.580
340 HB3 LEU 56 HB1 LEU 56 1.250 -4.481 7.259
341 HG LEU 56 HG LEU 56 3.262 -6.632 7.927
342 HD11 LEU 56 HD11 LEU 56 2.501 -4.174 9.494
343 HD12 LEU 56 HD12 LEU 56 4.037 -4.431 8.667
344 HD13 LEU 56 HD13 LEU 56 3.585 -5.457 10.027
345 HD21 LEU 56 HD21 LEU 56 0.995 -7.370 8.268
346 HD22 LEU 56 HD22 LEU 56 0.598 -5.879 9.122
347 HD23 LEU 56 HD23 LEU 56 1.729 -7.027 9.835
348 H CYS 57 HN CYS 57 -0.880 -5.478 5.435
349 HA CYS 57 HA CYS 57 -0.383 -4.089 2.896
350 HB2 CYS 57 HB2 CYS 57 -2.004 -5.865 2.712
351 HB3 CYS 57 HB1 CYS 57 -2.894 -5.265 4.106
352 H TYR 58 HN TYR 58 -0.617 -1.934 2.772
353 HA TYR 58 HA TYR 58 -1.841 -0.571 5.080
354 HB2 TYR 58 HB2 TYR 58 0.446 0.328 3.328
355 HB3 TYR 58 HB1 TYR 58 -0.336 1.337 4.534
356 HD1 TYR 58 HD2 TYR 58 1.709 -1.724 4.080
357 HD2 TYR 58 HD1 TYR 58 0.280 1.216 6.804
358 HE1 TYR 58 HE2 TYR 58 3.293 -2.536 5.778
359 HE2 TYR 58 HE1 TYR 58 1.865 0.417 8.503
360 HH TYR 58 HH TYR 58 4.404 -1.758 7.779
361 HA PRO 59 HA PRO 59 -4.434 0.767 1.520
362 HB2 PRO 59 HB2 PRO 59 -6.514 1.019 3.569
363 HB3 PRO 59 HB1 PRO 59 -6.517 0.023 2.108
364 HG2 PRO 59 HG2 PRO 59 -6.368 -1.053 4.579
365 HG3 PRO 59 HG1 PRO 59 -5.599 -1.792 3.160
366 HD2 PRO 59 HD2 PRO 59 -4.360 -0.156 5.332
367 HD3 PRO 59 HD1 PRO 59 -3.740 -1.608 4.518
368 H LYS 60 HN LYS 60 -3.534 2.789 1.263
369 HA LYS 60 HA LYS 60 -3.962 4.713 3.437
370 HB2 LYS 60 HB2 LYS 60 -1.889 4.684 1.250
371 HB3 LYS 60 HB1 LYS 60 -2.091 5.989 2.414
372 HG2 LYS 60 HG2 LYS 60 -1.547 4.534 4.234
373 HG3 LYS 60 HG1 LYS 60 -1.520 3.132 3.163
374 HD2 LYS 60 HD2 LYS 60 0.393 4.041 1.982
375 HD3 LYS 60 HD1 LYS 60 0.341 5.498 2.976
376 HE2 LYS 60 HE2 LYS 60 0.886 2.688 3.921
377 HE3 LYS 60 HE1 LYS 60 2.059 3.995 3.789
378 HZ1 LYS 60 HZ1 LYS 60 0.536 5.220 5.400
379 HZ2 LYS 60 HZ2 LYS 60 1.489 3.967 6.021
380 HZ3 LYS 60 HZ3 LYS 60 -0.162 3.707 5.719
381 H ARG 61 HN ARG 61 -4.192 6.967 2.836
382 HA ARG 61 HA ARG 61 -5.728 7.354 0.358
383 HB2 ARG 61 HB2 ARG 61 -7.307 8.766 1.622
384 HB3 ARG 61 HB1 ARG 61 -7.318 7.107 2.200
385 HG2 ARG 61 HG2 ARG 61 -6.054 7.686 4.132
386 HG3 ARG 61 HG1 ARG 61 -5.742 9.308 3.510
387 HD2 ARG 61 HD2 ARG 61 -8.142 9.798 3.629
388 HD3 ARG 61 HD1 ARG 61 -8.433 8.185 4.278
389 HE ARG 61 HE ARG 61 -6.544 9.431 5.912
390 HH11 ARG 61 HH11 ARG 61 -9.924 9.836 4.967
391 HH12 ARG 61 HH12 ARG 61 -10.386 10.544 6.568
392 HH21 ARG 61 HH21 ARG 61 -7.091 10.342 7.920
393 HH22 ARG 61 HH22 ARG 61 -8.807 10.828 8.217
394 H GLY 62 HN GLY 62 -6.236 9.927 0.381
395 HA2 GLY 62 HA2 GLY 62 -5.388 12.031 0.120
396 HA3 GLY 62 HA1 GLY 62 -4.309 11.665 1.455
397 H LYS 63 HN LYS 63 -2.692 12.856 0.474
398 HA LYS 63 HA LYS 63 -1.696 12.396 -2.126
399 HB2 LYS 63 HB2 LYS 63 -1.341 14.463 -0.773
400 HB3 LYS 63 HB1 LYS 63 -0.242 13.553 0.252
401 HG2 LYS 63 HG2 LYS 63 1.228 13.164 -1.659
402 HG3 LYS 63 HG1 LYS 63 0.127 14.083 -2.689
403 HD2 LYS 63 HD2 LYS 63 0.482 15.914 -0.818
404 HD3 LYS 63 HD1 LYS 63 1.983 15.021 -0.565
405 HE2 LYS 63 HE2 LYS 63 1.078 16.055 -3.243
406 HE3 LYS 63 HE1 LYS 63 2.150 16.942 -2.163
407 HZ1 LYS 63 HZ1 LYS 63 3.701 15.065 -2.276
408 HZ2 LYS 63 HZ2 LYS 63 3.425 15.753 -3.795
409 HZ3 LYS 63 HZ3 LYS 63 2.688 14.291 -3.384
410 HA PRO 64 HA PRO 64 0.516 8.635 -1.194
411 HB2 PRO 64 HB2 PRO 64 1.427 8.171 -3.690
412 HB3 PRO 64 HB1 PRO 64 -0.264 7.905 -3.238
413 HG2 PRO 64 HG2 PRO 64 0.943 10.184 -4.725
414 HG3 PRO 64 HG1 PRO 64 -0.607 9.364 -4.990
415 HD2 PRO 64 HD2 PRO 64 -0.347 11.758 -3.682
416 HD3 PRO 64 HD1 PRO 64 -1.689 10.624 -3.434
417 H GLN 65 HN GLN 65 2.091 9.685 0.126
418 HA GLN 65 HA GLN 65 4.343 11.036 -0.979
419 HB2 GLN 65 HB2 GLN 65 4.042 9.726 1.733
420 HB3 GLN 65 HB1 GLN 65 5.279 10.891 1.281
421 HG2 GLN 65 HG2 GLN 65 3.796 12.659 1.252
422 HG3 GLN 65 HG1 GLN 65 2.394 11.611 1.042
423 HE21 GLN 65 HE21 GLN 65 1.255 12.415 2.744
424 HE22 GLN 65 HE22 GLN 65 1.720 12.186 4.393
425 H PHE 66 HN PHE 66 5.006 9.608 -2.607
426 HA PHE 66 HA PHE 66 5.808 6.927 -2.133
427 HB2 PHE 66 HB2 PHE 66 6.172 8.872 -4.393
428 HB3 PHE 66 HB1 PHE 66 7.025 7.335 -4.401
429 HD1 PHE 66 HD1 PHE 66 3.896 7.004 -2.774
430 HD2 PHE 66 HD2 PHE 66 5.717 7.227 -6.614
431 HE1 PHE 66 HE1 PHE 66 1.932 5.903 -3.768
432 HE2 PHE 66 HE2 PHE 66 3.760 6.130 -7.612
433 HZ PHE 66 HZ PHE 66 1.862 5.465 -6.193
434 H TYR 67 HN TYR 67 7.816 6.022 -1.986
435 HA TYR 67 HA TYR 67 10.201 7.607 -2.006
436 HB2 TYR 67 HB2 TYR 67 10.913 7.292 0.241
437 HB3 TYR 67 HB1 TYR 67 9.287 7.949 0.323
438 HD1 TYR 67 HD2 TYR 67 7.412 6.507 1.058
439 HD2 TYR 67 HD1 TYR 67 11.427 5.109 1.085
440 HE1 TYR 67 HE2 TYR 67 6.763 4.676 2.571
441 HE2 TYR 67 HE1 TYR 67 10.789 3.283 2.597
442 HH TYR 67 HH TYR 67 7.867 2.181 3.035
443 H LYS 68 HN LYS 68 12.018 6.378 -2.351
444 HA LYS 68 HA LYS 68 11.545 3.734 -3.365
445 HB2 LYS 68 HB2 LYS 68 13.078 5.366 -4.439
446 HB3 LYS 68 HB1 LYS 68 14.148 5.242 -3.051
447 HG2 LYS 68 HG2 LYS 68 15.201 3.634 -4.159
448 HG3 LYS 68 HG1 LYS 68 13.791 2.616 -3.861
449 HD2 LYS 68 HD2 LYS 68 13.940 4.475 -6.221
450 HD3 LYS 68 HD1 LYS 68 14.608 2.844 -6.277
451 HE2 LYS 68 HE2 LYS 68 12.292 2.098 -5.442
452 HE3 LYS 68 HE1 LYS 68 11.755 3.703 -5.939
453 HZ1 LYS 68 HZ1 LYS 68 13.202 1.875 -7.769
454 HZ2 LYS 68 HZ2 LYS 68 12.296 3.248 -8.165
455 HZ3 LYS 68 HZ3 LYS 68 11.518 1.850 -7.616
456 H TYR 69 HN TYR 69 11.679 1.892 -2.277
457 HA TYR 69 HA TYR 69 13.734 1.389 -0.348
458 HB2 TYR 69 HB2 TYR 69 12.485 2.367 1.326
459 HB3 TYR 69 HB1 TYR 69 10.953 2.007 0.545
460 HD1 TYR 69 HD1 TYR 69 13.805 0.208 2.192
461 HD2 TYR 69 HD2 TYR 69 9.619 0.400 1.486
462 HE1 TYR 69 HE1 TYR 69 13.464 -1.697 3.711
463 HE2 TYR 69 HE2 TYR 69 9.267 -1.501 2.994
464 HH TYR 69 HH TYR 69 11.876 -2.844 4.908
465 H LEU 70 HN LEU 70 14.298 -0.650 -0.598
466 HA LEU 70 HA LEU 70 12.847 -2.441 -2.245
467 HB2 LEU 70 HB2 LEU 70 15.338 -2.562 -0.626
468 HB3 LEU 70 HB1 LEU 70 14.612 -4.078 -1.125
469 HG LEU 70 HG LEU 70 15.356 -1.880 -3.055
470 HD11 LEU 70 HD11 LEU 70 17.381 -2.641 -1.995
471 HD12 LEU 70 HD12 LEU 70 17.290 -3.323 -3.617
472 HD13 LEU 70 HD13 LEU 70 16.908 -4.324 -2.218
473 HD21 LEU 70 HD21 LEU 70 15.278 -3.844 -4.650
474 HD22 LEU 70 HD22 LEU 70 13.726 -3.294 -4.020
475 HD23 LEU 70 HD23 LEU 70 14.483 -4.742 -3.358
476 H GLY 71 HN GLY 71 10.882 -3.028 -1.490
477 HA2 GLY 71 HA2 GLY 71 10.344 -5.161 -0.034
478 HA3 GLY 71 HA1 GLY 71 10.629 -3.999 1.253
479 H ASP 72 HN ASP 72 9.499 -1.798 -0.375
480 HA ASP 72 HA ASP 72 6.707 -2.353 0.264
481 HB2 ASP 72 HB2 ASP 72 8.347 0.107 -0.040
482 HB3 ASP 72 HB1 ASP 72 6.642 0.225 -0.450
483 H MET 73 HN MET 73 5.124 -2.489 -1.187
484 HA MET 73 HA MET 73 5.747 -1.854 -3.990
485 HB2 MET 73 HB2 MET 73 4.443 -4.333 -2.870
486 HB3 MET 73 HB1 MET 73 4.186 -3.828 -4.535
487 HG2 MET 73 HG2 MET 73 6.551 -4.001 -4.992
488 HG3 MET 73 HG1 MET 73 6.873 -4.398 -3.308
489 HE1 MET 73 HE1 MET 73 4.854 -5.520 -6.485
490 HE2 MET 73 HE2 MET 73 3.698 -5.793 -5.181
491 HE3 MET 73 HE3 MET 73 4.385 -7.163 -6.050
492 H THR 74 HN THR 74 4.670 0.116 -3.800
493 HA THR 74 HA THR 74 1.914 0.149 -2.934
494 HB THR 74 HB THR 74 3.551 2.383 -4.153
495 HG1 THR 74 HG1 THR 74 4.516 1.791 -2.230
496 HG21 THR 74 HG21 THR 74 1.139 2.769 -4.278
497 HG22 THR 74 HG22 THR 74 1.893 3.850 -3.104
498 HG23 THR 74 HG23 THR 74 0.992 2.438 -2.551
499 H GLY 75 HN GLY 75 0.178 0.023 -4.175
500 HA2 GLY 75 HA2 GLY 75 0.544 0.205 -7.102
501 HA3 GLY 75 HA1 GLY 75 -0.545 -0.952 -6.339
502 H SER 76 HN SER 76 -1.411 0.885 -8.272
503 HA SER 76 HA SER 76 -2.529 3.216 -7.112
504 HB2 SER 76 HB2 SER 76 -4.044 3.036 -9.225
505 HB3 SER 76 HB1 SER 76 -2.315 3.310 -9.440
506 HG SER 76 HG SER 76 -3.144 1.637 -10.799
507 H ARG 77 HN ARG 77 -4.349 0.487 -8.464
508 HA ARG 77 HA ARG 77 -5.769 -0.181 -6.140
509 HB2 ARG 77 HB2 ARG 77 -6.654 2.210 -6.759
510 HB3 ARG 77 HB1 ARG 77 -7.556 1.350 -7.999
511 HG2 ARG 77 HG2 ARG 77 -8.816 0.167 -6.436
512 HG3 ARG 77 HG1 ARG 77 -7.681 0.507 -5.127
513 HD2 ARG 77 HD2 ARG 77 -9.718 1.837 -4.898
514 HD3 ARG 77 HD1 ARG 77 -8.312 2.862 -5.180
515 HE ARG 77 HE ARG 77 -10.003 2.118 -7.456
516 HH11 ARG 77 HH11 ARG 77 -8.841 4.568 -5.199
517 HH12 ARG 77 HH12 ARG 77 -9.440 5.933 -6.218
518 HH21 ARG 77 HH21 ARG 77 -10.777 3.822 -8.751
519 HH22 ARG 77 HH22 ARG 77 -10.516 5.521 -8.196
520 H THR 78 HN THR 78 -5.743 0.089 -9.629
521 HA THR 78 HA THR 78 -6.036 -2.685 -10.025
522 HB THR 78 HB THR 78 -8.412 -2.038 -9.410
523 HG1 THR 78 HG1 THR 78 -9.160 -3.528 -10.809
524 HG21 THR 78 HG21 THR 78 -8.350 -0.722 -12.129
525 HG22 THR 78 HG22 THR 78 -8.484 0.122 -10.585
526 HG23 THR 78 HG23 THR 78 -9.776 -0.956 -11.117
527 H CYS 79 HN CYS 79 -6.265 -3.177 -12.414
528 HA CYS 79 HA CYS 79 -5.236 -0.964 -14.052
529 HB2 CYS 79 HB2 CYS 79 -4.249 -3.823 -14.160
530 HB3 CYS 79 HB1 CYS 79 -3.667 -2.483 -15.139
531 H1 GAL 83 H1 GTP 1 6.057 2.143 8.450
532 H2 GAL 83 H2 GTP 1 5.711 4.311 6.326
533 H3 GAL 83 H3 GTP 1 3.715 2.566 7.819
534 H4 GAL 83 H4 GTP 1 3.277 1.689 5.568
535 H5 GAL 83 H5 GTP 1 4.934 0.608 7.013
536 H61 GAL 83 H61 GTP 1 5.203 0.652 4.070
537 H62 GAL 83 H62 GTP 1 5.062 -0.720 5.167
538 HO2 GAL 83 HO2 GTP 1 6.000 4.565 8.906
539 HO3 GAL 83 HO3 GTP 1 3.351 4.911 7.181
540 HO4 GAL 83 HO4 GTP 1 4.192 3.819 4.611
541 HO6 GAL 83 HO6 GTP 1 7.164 0.153 3.861
542 H1 NAG 84 H1 GCP 2 9.908 3.018 4.454
543 H2 NAG 84 H2 GCP 2 10.289 3.006 7.502
544 H3 NAG 84 H3 GCP 2 7.874 3.465 5.702
545 H4 NAG 84 H4 GCP 2 9.468 5.275 7.582
546 H5 NAG 84 H5 GCP 2 9.070 5.221 4.552
547 H61 NAG 84 H61 GCP 2 10.291 7.239 6.410
548 H62 NAG 84 H62 GCP 2 9.346 7.445 4.932
549 H81 NAG 84 HC23 GCP 2 10.026 -1.522 7.121
550 H82 NAG 84 HC21 GCP 2 8.572 -1.193 8.062
551 H83 NAG 84 HC22 GCP 2 8.573 -0.920 6.321
552 HN2 NAG 84 HN2 GCP 2 8.852 1.104 5.690
553 HO1 NAG 84 HO1 GCP 2 11.516 1.547 5.360
554 HO4 NAG 84 HO4 GCP 2 7.263 5.776 7.570
555 HO6 NAG 84 HO6 GCP 2 11.853 6.156 4.780
Start of MODEL 9
1 H CYS 10 HT1 CYS 10 0.010 -3.783 -14.463
2 HA CYS 10 HA CYS 10 -0.803 -2.759 -12.533
3 HB2 CYS 10 HB2 CYS 10 -1.790 -5.518 -11.789
4 HB3 CYS 10 HB1 CYS 10 -1.804 -4.133 -10.702
5 H VAL 11 HN VAL 11 1.568 -4.495 -13.512
6 HA VAL 11 HA VAL 11 2.806 -5.368 -11.061
7 HB VAL 11 HB VAL 11 4.193 -4.937 -13.707
8 HG11 VAL 11 HG11 VAL 11 4.769 -6.761 -11.372
9 HG12 VAL 11 HG12 VAL 11 5.692 -5.336 -11.854
10 HG13 VAL 11 HG13 VAL 11 5.655 -6.759 -12.897
11 HG21 VAL 11 HG21 VAL 11 2.173 -6.317 -14.038
12 HG22 VAL 11 HG22 VAL 11 2.767 -7.437 -12.812
13 HG23 VAL 11 HG23 VAL 11 3.666 -7.215 -14.313
14 H HIS 12 HN HIS 12 2.899 -3.526 -9.757
15 HA HIS 12 HA HIS 12 4.211 -1.139 -10.747
16 HB2 HIS 12 HB2 HIS 12 2.938 -1.866 -8.117
17 HB3 HIS 12 HB1 HIS 12 3.894 -0.401 -8.295
18 HD1 HIS 12 HD1 HIS 12 2.745 1.595 -9.300
19 HD2 HIS 12 HD2 HIS 12 0.569 -1.913 -9.758
20 HE1 HIS 12 HE1 HIS 12 0.501 2.301 -10.194
21 HE2 HIS 12 HE2 HIS 12 -0.870 0.181 -10.229
22 H THR 13 HN THR 13 4.758 -2.710 -7.635
23 HA THR 13 HA THR 13 6.638 -3.102 -6.436
24 HB THR 13 HB THR 13 8.111 -3.767 -8.963
25 HG1 THR 13 HG1 THR 13 6.698 -5.258 -9.480
26 HG21 THR 13 HG21 THR 13 8.894 -5.656 -7.599
27 HG22 THR 13 HG22 THR 13 7.877 -5.110 -6.266
28 HG23 THR 13 HG23 THR 13 9.226 -4.113 -6.811
29 H GLY 14 HN GLY 14 9.274 -2.703 -8.330
30 HA2 GLY 14 HA2 GLY 14 10.772 -1.007 -8.723
31 HA3 GLY 14 HA1 GLY 14 9.458 0.138 -8.502
32 H ASN 15 HN ASN 15 9.381 -1.699 -5.836
33 HA ASN 15 HA ASN 15 9.905 -1.369 -3.664
34 HB2 ASN 15 HB2 ASN 15 12.552 -0.612 -4.910
35 HB3 ASN 15 HB1 ASN 15 12.307 -0.747 -3.171
36 HD21 ASN 15 HD21 ASN 15 10.445 -2.979 -3.416
37 HD22 ASN 15 HD22 ASN 15 11.399 -4.365 -3.815
38 H ILE 16 HN ILE 16 8.350 0.514 -4.570
39 HA ILE 16 HA ILE 16 9.449 3.051 -3.558
40 HB ILE 16 HB ILE 16 7.025 2.793 -5.341
41 HG12 ILE 16 HG12 ILE 16 9.779 3.620 -6.260
42 HG13 ILE 16 HG11 ILE 16 9.199 1.963 -6.400
43 HG21 ILE 16 HG21 ILE 16 7.363 5.183 -5.708
44 HG22 ILE 16 HG22 ILE 16 8.794 5.151 -4.681
45 HG23 ILE 16 HG23 ILE 16 7.206 4.840 -3.985
46 HD11 ILE 16 HD11 ILE 16 7.354 2.726 -7.797
47 HD12 ILE 16 HD12 ILE 16 8.918 3.171 -8.482
48 HD13 ILE 16 HD13 ILE 16 7.937 4.386 -7.660
49 H GLY 17 HN GLY 17 8.671 3.643 -1.643
50 HA2 GLY 17 HA2 GLY 17 6.204 2.372 -0.679
51 HA3 GLY 17 HA1 GLY 17 7.437 3.117 0.331
52 H SER 18 HN SER 18 4.862 3.763 0.784
53 HA SER 18 HA SER 18 4.648 6.475 -0.333
54 HB2 SER 18 HB2 SER 18 2.842 4.792 -1.017
55 HB3 SER 18 HB1 SER 18 2.298 4.859 0.659
56 HG SER 18 HG SER 18 2.664 7.217 -0.844
57 H LYS 19 HN LYS 19 4.731 8.075 1.096
58 HA LYS 19 HA LYS 19 4.833 7.426 3.938
59 HB2 LYS 19 HB2 LYS 19 6.102 9.345 2.251
60 HB3 LYS 19 HB1 LYS 19 5.180 10.222 3.464
61 HG2 LYS 19 HG2 LYS 19 7.060 7.996 4.187
62 HG3 LYS 19 HG1 LYS 19 7.598 9.663 4.002
63 HD2 LYS 19 HD2 LYS 19 5.283 9.027 5.787
64 HD3 LYS 19 HD1 LYS 19 6.932 8.774 6.357
65 HE2 LYS 19 HE2 LYS 19 6.680 10.920 7.046
66 HE3 LYS 19 HE1 LYS 19 7.197 11.252 5.394
67 HZ1 LYS 19 HZ1 LYS 19 5.141 12.445 6.278
68 HZ2 LYS 19 HZ2 LYS 19 4.335 10.970 6.067
69 HZ3 LYS 19 HZ3 LYS 19 5.038 11.748 4.737
70 H ALA 20 HN ALA 20 2.316 7.447 2.378
71 HA ALA 20 HA ALA 20 0.836 9.726 3.401
72 HB1 ALA 20 HB1 ALA 20 -1.066 8.756 2.190
73 HB2 ALA 20 HB2 ALA 20 -0.084 7.348 1.785
74 HB3 ALA 20 HB3 ALA 20 0.347 8.938 1.151
75 H GLN 21 HN GLN 21 -1.287 9.281 4.523
76 HA GLN 21 HA GLN 21 -0.766 7.520 6.767
77 HB2 GLN 21 HB2 GLN 21 -1.607 9.816 7.132
78 HB3 GLN 21 HB1 GLN 21 -3.084 9.400 6.275
79 HG2 GLN 21 HG2 GLN 21 -3.419 7.588 8.014
80 HG3 GLN 21 HG1 GLN 21 -2.114 8.356 8.919
81 HE21 GLN 21 HE21 GLN 21 -2.470 10.342 9.888
82 HE22 GLN 21 HE22 GLN 21 -4.053 11.011 10.071
83 H THR 22 HN THR 22 -1.903 5.746 7.325
84 HA THR 22 HA THR 22 -3.335 4.360 5.279
85 HB THR 22 HB THR 22 -3.674 3.006 7.714
86 HG1 THR 22 HG1 THR 22 -1.852 3.298 8.825
87 HG21 THR 22 HG21 THR 22 -3.113 2.032 5.512
88 HG22 THR 22 HG22 THR 22 -2.051 1.450 6.795
89 HG23 THR 22 HG23 THR 22 -1.477 2.677 5.666
90 H ILE 23 HN ILE 23 -5.494 3.543 5.457
91 HA ILE 23 HA ILE 23 -7.341 5.442 6.601
92 HB ILE 23 HB ILE 23 -8.095 2.811 5.335
93 HG12 ILE 23 HG12 ILE 23 -7.719 5.401 3.827
94 HG13 ILE 23 HG11 ILE 23 -6.463 4.173 3.921
95 HG21 ILE 23 HG21 ILE 23 -10.105 4.101 4.673
96 HG22 ILE 23 HG22 ILE 23 -9.478 5.481 5.572
97 HG23 ILE 23 HG23 ILE 23 -9.895 3.993 6.420
98 HD11 ILE 23 HD11 ILE 23 -7.985 2.561 2.879
99 HD12 ILE 23 HD12 ILE 23 -7.697 3.971 1.860
100 HD13 ILE 23 HD13 ILE 23 -9.211 3.821 2.752
101 H GLY 24 HN GLY 24 -6.275 2.167 7.205
102 HA2 GLY 24 HA2 GLY 24 -7.567 2.259 9.835
103 HA3 GLY 24 HA1 GLY 24 -7.848 0.865 8.798
104 H GLU 25 HN GLU 25 -6.879 -0.429 10.486
105 HA GLU 25 HA GLU 25 -4.133 -0.014 11.196
106 HB2 GLU 25 HB2 GLU 25 -5.343 -2.706 11.529
107 HB3 GLU 25 HB1 GLU 25 -4.378 -1.761 12.654
108 HG2 GLU 25 HG2 GLU 25 -6.323 -1.543 13.739
109 HG3 GLU 25 HG1 GLU 25 -6.615 -0.266 12.559
110 H VAL 26 HN VAL 26 -2.441 -1.618 10.795
111 HA VAL 26 HA VAL 26 -2.331 -2.266 7.984
112 HB VAL 26 HB VAL 26 -0.257 -2.918 10.075
113 HG11 VAL 26 HG11 VAL 26 -0.024 -3.997 7.876
114 HG12 VAL 26 HG12 VAL 26 1.288 -2.865 8.212
115 HG13 VAL 26 HG13 VAL 26 -0.015 -2.405 7.114
116 HG21 VAL 26 HG21 VAL 26 -0.548 -0.365 8.494
117 HG22 VAL 26 HG22 VAL 26 0.806 -0.779 9.543
118 HG23 VAL 26 HG23 VAL 26 -0.801 -0.540 10.228
119 H LYS 27 HN LYS 27 -3.535 -3.988 7.460
120 HA LYS 27 HA LYS 27 -3.429 -6.373 9.150
121 HB2 LYS 27 HB2 LYS 27 -5.344 -5.374 7.079
122 HB3 LYS 27 HB1 LYS 27 -5.251 -7.101 7.391
123 HG2 LYS 27 HG2 LYS 27 -6.925 -6.504 8.826
124 HG3 LYS 27 HG1 LYS 27 -5.526 -6.351 9.889
125 HD2 LYS 27 HD2 LYS 27 -6.693 -4.387 10.284
126 HD3 LYS 27 HD1 LYS 27 -5.491 -3.891 9.094
127 HE2 LYS 27 HE2 LYS 27 -7.162 -4.167 7.316
128 HE3 LYS 27 HE1 LYS 27 -8.357 -4.635 8.528
129 HZ1 LYS 27 HZ1 LYS 27 -8.645 -2.340 7.993
130 HZ2 LYS 27 HZ2 LYS 27 -7.013 -1.999 8.281
131 HZ3 LYS 27 HZ3 LYS 27 -8.029 -2.432 9.568
132 H ARG 28 HN ARG 28 -3.129 -8.453 8.177
133 HA ARG 28 HA ARG 28 -1.020 -8.407 6.202
134 HB2 ARG 28 HB2 ARG 28 -2.311 -10.751 7.614
135 HB3 ARG 28 HB1 ARG 28 -0.858 -10.818 6.629
136 HG2 ARG 28 HG2 ARG 28 -0.128 -8.932 8.395
137 HG3 ARG 28 HG1 ARG 28 -1.229 -9.878 9.392
138 HD2 ARG 28 HD2 ARG 28 0.022 -11.898 8.897
139 HD3 ARG 28 HD1 ARG 28 1.091 -10.993 7.827
140 HE ARG 28 HE ARG 28 0.949 -10.143 10.611
141 HH11 ARG 28 HH11 ARG 28 2.665 -11.872 8.075
142 HH12 ARG 28 HH12 ARG 28 4.228 -11.853 8.972
143 HH21 ARG 28 HH21 ARG 28 2.918 -10.109 11.783
144 HH22 ARG 28 HH22 ARG 28 4.363 -10.905 11.048
145 H ALA 29 HN ALA 29 -1.146 -9.127 4.126
146 HA ALA 29 HA ALA 29 -3.811 -9.988 3.199
147 HB1 ALA 29 HB1 ALA 29 -3.360 -7.696 2.493
148 HB2 ALA 29 HB2 ALA 29 -3.405 -8.786 1.109
149 HB3 ALA 29 HB3 ALA 29 -1.855 -8.218 1.732
150 H SER 30 HN SER 30 -3.838 -11.402 1.373
151 HA SER 30 HA SER 30 -1.972 -13.479 1.487
152 HB2 SER 30 HB2 SER 30 -4.199 -13.903 0.667
153 HB3 SER 30 HB1 SER 30 -3.992 -12.739 -0.639
154 HG SER 30 HG SER 30 -2.642 -15.218 -0.320
155 H SER 31 HN SER 31 -2.283 -10.770 -0.766
156 HA SER 31 HA SER 31 0.488 -10.672 -1.306
157 HB2 SER 31 HB2 SER 31 -0.402 -12.711 -2.684
158 HB3 SER 31 HB1 SER 31 -1.094 -11.478 -3.740
159 HG SER 31 HG SER 31 1.053 -12.200 -4.336
160 H LEU 32 HN LEU 32 0.433 -9.419 -3.797
161 HA LEU 32 HA LEU 32 -0.398 -6.817 -3.120
162 HB2 LEU 32 HB2 LEU 32 1.388 -7.418 -4.772
163 HB3 LEU 32 HB1 LEU 32 0.125 -7.905 -5.887
164 HG LEU 32 HG LEU 32 -0.755 -5.519 -5.713
165 HD11 LEU 32 HD11 LEU 32 0.899 -3.828 -5.045
166 HD12 LEU 32 HD12 LEU 32 1.960 -5.114 -4.477
167 HD13 LEU 32 HD13 LEU 32 0.402 -4.853 -3.699
168 HD21 LEU 32 HD21 LEU 32 0.435 -6.368 -7.670
169 HD22 LEU 32 HD22 LEU 32 1.977 -5.969 -6.912
170 HD23 LEU 32 HD23 LEU 32 0.852 -4.684 -7.351
171 H SER 33 HN SER 33 -1.848 -9.316 -5.155
172 HA SER 33 HA SER 33 -4.003 -7.885 -6.196
173 HB2 SER 33 HB2 SER 33 -5.078 -10.258 -6.187
174 HB3 SER 33 HB1 SER 33 -3.618 -9.995 -7.143
175 HG SER 33 HG SER 33 -3.818 -11.884 -5.539
176 H GLU 34 HN GLU 34 -3.665 -9.685 -3.190
177 HA GLU 34 HA GLU 34 -6.345 -9.316 -2.325
178 HB2 GLU 34 HB2 GLU 34 -4.590 -11.064 -1.587
179 HB3 GLU 34 HB1 GLU 34 -4.030 -9.817 -0.482
180 HG2 GLU 34 HG2 GLU 34 -5.622 -11.437 0.514
181 HG3 GLU 34 HG1 GLU 34 -6.133 -9.752 0.632
182 H CYS 35 HN CYS 35 -3.352 -7.530 -1.911
183 HA CYS 35 HA CYS 35 -4.217 -5.806 0.145
184 HB2 CYS 35 HB2 CYS 35 -1.831 -6.156 -0.754
185 HB3 CYS 35 HB1 CYS 35 -2.268 -5.015 -2.020
186 H ARG 36 HN ARG 36 -4.469 -5.678 -3.371
187 HA ARG 36 HA ARG 36 -5.582 -3.076 -3.514
188 HB2 ARG 36 HB2 ARG 36 -4.588 -4.257 -5.462
189 HB3 ARG 36 HB1 ARG 36 -5.946 -5.374 -5.450
190 HG2 ARG 36 HG2 ARG 36 -7.462 -3.424 -5.800
191 HG3 ARG 36 HG1 ARG 36 -6.028 -2.418 -6.003
192 HD2 ARG 36 HD2 ARG 36 -6.838 -4.775 -7.697
193 HD3 ARG 36 HD1 ARG 36 -6.881 -3.080 -8.165
194 HE ARG 36 HE ARG 36 -4.455 -3.081 -8.081
195 HH11 ARG 36 HH11 ARG 36 -6.064 -6.213 -8.109
196 HH12 ARG 36 HH12 ARG 36 -4.612 -7.071 -8.739
197 HH21 ARG 36 HH21 ARG 36 -2.610 -4.114 -8.844
198 HH22 ARG 36 HH22 ARG 36 -2.668 -5.900 -9.151
199 H ALA 37 HN ALA 37 -7.009 -6.318 -3.403
200 HA ALA 37 HA ALA 37 -9.703 -5.521 -3.608
201 HB1 ALA 37 HB1 ALA 37 -8.577 -7.966 -2.242
202 HB2 ALA 37 HB2 ALA 37 -8.946 -7.829 -3.962
203 HB3 ALA 37 HB3 ALA 37 -10.247 -7.740 -2.773
204 H ARG 38 HN ARG 38 -7.539 -5.891 -0.860
205 HA ARG 38 HA ARG 38 -9.494 -5.510 1.159
206 HB2 ARG 38 HB2 ARG 38 -6.635 -5.852 0.993
207 HB3 ARG 38 HB1 ARG 38 -7.020 -4.546 2.106
208 HG2 ARG 38 HG2 ARG 38 -6.884 -6.544 3.369
209 HG3 ARG 38 HG1 ARG 38 -8.589 -6.106 3.265
210 HD2 ARG 38 HD2 ARG 38 -8.913 -7.745 1.486
211 HD3 ARG 38 HD1 ARG 38 -7.198 -8.157 1.539
212 HE ARG 38 HE ARG 38 -8.037 -8.561 4.087
213 HH11 ARG 38 HH11 ARG 38 -9.020 -9.778 0.923
214 HH12 ARG 38 HH12 ARG 38 -9.715 -11.297 1.615
215 HH21 ARG 38 HH21 ARG 38 -8.885 -10.493 4.973
216 HH22 ARG 38 HH22 ARG 38 -9.633 -11.694 3.855
217 H CYS 39 HN CYS 39 -7.410 -3.357 -0.670
218 HA CYS 39 HA CYS 39 -8.098 -1.015 0.817
219 HB2 CYS 39 HB2 CYS 39 -6.002 -1.519 -0.662
220 HB3 CYS 39 HB1 CYS 39 -7.017 -0.938 -1.978
221 H GLN 40 HN GLN 40 -9.250 -2.537 -2.149
222 HA GLN 40 HA GLN 40 -10.831 -0.399 -3.079
223 HB2 GLN 40 HB2 GLN 40 -11.513 -1.807 -4.736
224 HB3 GLN 40 HB1 GLN 40 -10.123 -2.721 -4.176
225 HG2 GLN 40 HG2 GLN 40 -11.584 -4.128 -2.827
226 HG3 GLN 40 HG1 GLN 40 -12.981 -3.200 -3.372
227 HE21 GLN 40 HE21 GLN 40 -12.463 -6.016 -3.668
228 HE22 GLN 40 HE22 GLN 40 -12.478 -6.345 -5.368
229 H ALA 41 HN ALA 41 -11.288 -2.511 -0.435
230 HA ALA 41 HA ALA 41 -14.115 -2.526 -0.309
231 HB1 ALA 41 HB1 ALA 41 -13.801 -3.156 2.047
232 HB2 ALA 41 HB2 ALA 41 -12.083 -2.778 1.910
233 HB3 ALA 41 HB3 ALA 41 -12.774 -4.103 0.970
234 H GLU 42 HN GLU 42 -11.737 -0.157 0.338
235 HA GLU 42 HA GLU 42 -13.615 1.504 1.851
236 HB2 GLU 42 HB2 GLU 42 -10.758 1.151 1.879
237 HB3 GLU 42 HB1 GLU 42 -11.149 2.835 1.560
238 HG2 GLU 42 HG2 GLU 42 -12.345 1.295 3.839
239 HG3 GLU 42 HG1 GLU 42 -10.827 2.176 3.973
240 H LYS 43 HN LYS 43 -13.625 3.838 1.256
241 HA LYS 43 HA LYS 43 -13.764 4.071 -1.672
242 HB2 LYS 43 HB2 LYS 43 -15.660 4.636 0.236
243 HB3 LYS 43 HB1 LYS 43 -14.956 6.219 -0.063
244 HG2 LYS 43 HG2 LYS 43 -15.926 4.444 -2.283
245 HG3 LYS 43 HG1 LYS 43 -16.974 5.592 -1.449
246 HD2 LYS 43 HD2 LYS 43 -15.647 7.435 -2.158
247 HD3 LYS 43 HD1 LYS 43 -14.378 6.368 -2.757
248 HE2 LYS 43 HE2 LYS 43 -15.933 5.498 -4.447
249 HE3 LYS 43 HE1 LYS 43 -17.172 6.604 -3.859
250 HZ1 LYS 43 HZ1 LYS 43 -15.770 8.461 -4.476
251 HZ2 LYS 43 HZ2 LYS 43 -16.044 7.469 -5.815
252 HZ3 LYS 43 HZ3 LYS 43 -14.558 7.410 -5.009
253 H GLU 44 HN GLU 44 -12.287 5.331 1.196
254 HA GLU 44 HA GLU 44 -11.239 7.711 -0.040
255 HB2 GLU 44 HB2 GLU 44 -10.460 6.328 2.531
256 HB3 GLU 44 HB1 GLU 44 -9.917 7.924 2.032
257 HG2 GLU 44 HG2 GLU 44 -12.470 8.440 1.910
258 HG3 GLU 44 HG1 GLU 44 -12.601 7.046 2.984
259 H CYS 45 HN CYS 45 -10.408 4.442 -0.041
260 HA CYS 45 HA CYS 45 -7.613 4.524 -0.160
261 HB2 CYS 45 HB2 CYS 45 -8.637 2.398 0.111
262 HB3 CYS 45 HB1 CYS 45 -9.618 2.607 -1.337
263 H SER 46 HN SER 46 -6.377 5.521 -1.541
264 HA SER 46 HA SER 46 -7.229 5.701 -4.354
265 HB2 SER 46 HB2 SER 46 -5.480 7.834 -3.887
266 HB3 SER 46 HB1 SER 46 -7.234 7.936 -4.060
267 HG SER 46 HG SER 46 -7.367 7.574 -1.766
268 H HIS 47 HN HIS 47 -4.886 4.792 -2.080
269 HA HIS 47 HA HIS 47 -3.185 3.619 -4.050
270 HB2 HIS 47 HB2 HIS 47 -1.121 4.890 -3.031
271 HB3 HIS 47 HB1 HIS 47 -2.047 5.635 -4.329
272 HD1 HIS 47 HD1 HIS 47 -3.060 7.865 -3.869
273 HD2 HIS 47 HD2 HIS 47 -1.738 6.003 -0.401
274 HE1 HIS 47 HE1 HIS 47 -3.303 9.582 -2.052
275 HE2 HIS 47 HE2 HIS 47 -2.684 8.370 0.068
276 H TYR 48 HN TYR 48 -2.207 1.859 -3.169
277 HA TYR 48 HA TYR 48 -2.169 1.707 -0.225
278 HB2 TYR 48 HB2 TYR 48 -2.580 -0.727 -0.425
279 HB3 TYR 48 HB1 TYR 48 -3.909 0.230 -1.066
280 HD1 TYR 48 HD1 TYR 48 -1.108 -1.989 -1.942
281 HD2 TYR 48 HD2 TYR 48 -4.464 0.177 -3.404
282 HE1 TYR 48 HE1 TYR 48 -0.982 -3.235 -4.060
283 HE2 TYR 48 HE2 TYR 48 -4.345 -1.059 -5.522
284 HH TYR 48 HH TYR 48 -2.653 -2.300 -6.853
285 H THR 49 HN THR 49 -0.493 0.437 0.708
286 HA THR 49 HA THR 49 1.821 0.068 -1.081
287 HB THR 49 HB THR 49 2.164 0.671 1.841
288 HG1 THR 49 HG1 THR 49 1.528 2.461 -0.246
289 HG21 THR 49 HG21 THR 49 4.122 -0.088 0.646
290 HG22 THR 49 HG22 THR 49 4.301 1.629 1.012
291 HG23 THR 49 HG23 THR 49 3.858 1.117 -0.616
292 H TYR 50 HN TYR 50 2.091 -2.075 -1.334
293 HA TYR 50 HA TYR 50 1.475 -3.835 0.922
294 HB2 TYR 50 HB2 TYR 50 0.517 -4.487 -1.234
295 HB3 TYR 50 HB1 TYR 50 2.117 -4.484 -1.969
296 HD1 TYR 50 HD1 TYR 50 0.246 -6.093 0.841
297 HD2 TYR 50 HD2 TYR 50 3.266 -6.474 -2.131
298 HE1 TYR 50 HE1 TYR 50 0.530 -8.462 1.444
299 HE2 TYR 50 HE2 TYR 50 3.561 -8.839 -1.540
300 HH TYR 50 HH TYR 50 1.410 -10.480 0.666
301 H ASN 51 HN ASN 51 3.081 -4.188 2.284
302 HA ASN 51 HA ASN 51 5.831 -3.904 1.413
303 HB2 ASN 51 HB2 ASN 51 5.010 -3.041 3.626
304 HB3 ASN 51 HB1 ASN 51 4.805 -4.712 4.142
305 HD21 ASN 51 HD21 ASN 51 7.128 -2.285 3.138
306 HD22 ASN 51 HD22 ASN 51 8.504 -3.048 3.878
307 H VAL 52 HN VAL 52 6.353 -5.575 0.115
308 HA VAL 52 HA VAL 52 5.531 -8.259 0.528
309 HB VAL 52 HB VAL 52 6.230 -7.201 -1.664
310 HG11 VAL 52 HG11 VAL 52 9.011 -7.860 -0.706
311 HG12 VAL 52 HG12 VAL 52 8.347 -6.229 -0.821
312 HG13 VAL 52 HG13 VAL 52 8.554 -7.201 -2.279
313 HG21 VAL 52 HG21 VAL 52 7.466 -9.848 -0.921
314 HG22 VAL 52 HG22 VAL 52 7.143 -9.287 -2.561
315 HG23 VAL 52 HG23 VAL 52 5.806 -9.583 -1.450
316 H LYS 53 HN LYS 53 7.818 -6.402 2.119
317 HA LYS 53 HA LYS 53 9.739 -8.476 2.617
318 HB2 LYS 53 HB2 LYS 53 9.673 -5.690 2.921
319 HB3 LYS 53 HB1 LYS 53 9.805 -6.331 4.555
320 HG2 LYS 53 HG2 LYS 53 11.620 -7.154 2.301
321 HG3 LYS 53 HG1 LYS 53 11.980 -5.836 3.417
322 HD2 LYS 53 HD2 LYS 53 12.329 -7.243 5.186
323 HD3 LYS 53 HD1 LYS 53 11.227 -8.470 4.564
324 HE2 LYS 53 HE2 LYS 53 13.919 -7.848 3.366
325 HE3 LYS 53 HE1 LYS 53 13.635 -9.127 4.542
326 HZ1 LYS 53 HZ1 LYS 53 11.981 -10.052 2.945
327 HZ2 LYS 53 HZ2 LYS 53 13.582 -10.096 2.400
328 HZ3 LYS 53 HZ3 LYS 53 12.521 -8.922 1.805
329 H SER 54 HN SER 54 6.659 -7.832 3.782
330 HA SER 54 HA SER 54 7.088 -9.681 6.009
331 HB2 SER 54 HB2 SER 54 5.569 -8.196 7.428
332 HB3 SER 54 HB1 SER 54 7.211 -7.610 7.159
333 HG SER 54 HG SER 54 6.468 -6.114 5.744
334 H GLY 55 HN GLY 55 4.860 -8.033 3.843
335 HA2 GLY 55 HA2 GLY 55 3.152 -9.288 2.703
336 HA3 GLY 55 HA1 GLY 55 3.011 -10.312 4.127
337 H LEU 56 HN LEU 56 3.404 -7.035 4.806
338 HA LEU 56 HA LEU 56 0.707 -6.856 5.834
339 HB2 LEU 56 HB2 LEU 56 3.007 -4.901 5.945
340 HB3 LEU 56 HB1 LEU 56 1.479 -4.707 6.780
341 HG LEU 56 HG LEU 56 3.411 -6.969 7.280
342 HD11 LEU 56 HD11 LEU 56 2.946 -4.445 8.858
343 HD12 LEU 56 HD12 LEU 56 4.394 -4.838 7.929
344 HD13 LEU 56 HD13 LEU 56 3.968 -5.797 9.349
345 HD21 LEU 56 HD21 LEU 56 2.061 -7.402 9.247
346 HD22 LEU 56 HD22 LEU 56 1.061 -7.477 7.796
347 HD23 LEU 56 HD23 LEU 56 0.995 -6.057 8.838
348 H CYS 57 HN CYS 57 -0.891 -5.570 5.098
349 HA CYS 57 HA CYS 57 -0.411 -4.207 2.539
350 HB2 CYS 57 HB2 CYS 57 -2.113 -5.991 2.493
351 HB3 CYS 57 HB1 CYS 57 -3.007 -5.178 3.770
352 H TYR 58 HN TYR 58 -0.497 -2.043 2.488
353 HA TYR 58 HA TYR 58 -1.577 -0.664 4.858
354 HB2 TYR 58 HB2 TYR 58 0.572 0.142 2.905
355 HB3 TYR 58 HB1 TYR 58 -0.127 1.252 4.070
356 HD1 TYR 58 HD2 TYR 58 1.970 -1.759 3.670
357 HD2 TYR 58 HD1 TYR 58 0.515 1.195 6.368
358 HE1 TYR 58 HE2 TYR 58 3.658 -2.442 5.323
359 HE2 TYR 58 HE1 TYR 58 2.207 0.524 8.021
360 HH TYR 58 HH TYR 58 4.833 -1.513 7.236
361 HA PRO 59 HA PRO 59 -4.465 0.698 1.527
362 HB2 PRO 59 HB2 PRO 59 -6.372 0.912 3.746
363 HB3 PRO 59 HB1 PRO 59 -6.490 -0.061 2.273
364 HG2 PRO 59 HG2 PRO 59 -6.145 -1.185 4.688
365 HG3 PRO 59 HG1 PRO 59 -5.456 -1.878 3.208
366 HD2 PRO 59 HD2 PRO 59 -4.113 -0.235 5.316
367 HD3 PRO 59 HD1 PRO 59 -3.526 -1.685 4.473
368 H LYS 60 HN LYS 60 -3.699 2.759 1.182
369 HA LYS 60 HA LYS 60 -3.953 4.659 3.402
370 HB2 LYS 60 HB2 LYS 60 -2.018 4.470 1.131
371 HB3 LYS 60 HB1 LYS 60 -2.282 6.006 1.954
372 HG2 LYS 60 HG2 LYS 60 -1.360 5.270 3.919
373 HG3 LYS 60 HG1 LYS 60 -1.718 3.577 3.581
374 HD2 LYS 60 HD2 LYS 60 0.044 3.541 1.885
375 HD3 LYS 60 HD1 LYS 60 0.393 5.242 2.206
376 HE2 LYS 60 HE2 LYS 60 1.086 4.741 4.444
377 HE3 LYS 60 HE1 LYS 60 0.553 3.072 4.290
378 HZ1 LYS 60 HZ1 LYS 60 2.253 2.819 2.511
379 HZ2 LYS 60 HZ2 LYS 60 2.899 3.139 4.047
380 HZ3 LYS 60 HZ3 LYS 60 2.823 4.369 2.896
381 H ARG 61 HN ARG 61 -4.364 6.870 2.908
382 HA ARG 61 HA ARG 61 -6.086 7.318 0.563
383 HB2 ARG 61 HB2 ARG 61 -7.616 8.610 2.082
384 HB3 ARG 61 HB1 ARG 61 -7.595 6.881 2.404
385 HG2 ARG 61 HG2 ARG 61 -5.986 7.299 4.250
386 HG3 ARG 61 HG1 ARG 61 -6.168 9.029 3.964
387 HD2 ARG 61 HD2 ARG 61 -8.572 8.843 4.466
388 HD3 ARG 61 HD1 ARG 61 -8.367 7.118 4.773
389 HE ARG 61 HE ARG 61 -6.574 8.250 6.449
390 HH11 ARG 61 HH11 ARG 61 -10.031 8.709 5.901
391 HH12 ARG 61 HH12 ARG 61 -10.313 9.317 7.577
392 HH21 ARG 61 HH21 ARG 61 -6.891 9.011 8.557
393 HH22 ARG 61 HH22 ARG 61 -8.555 9.487 9.070
394 H GLY 62 HN GLY 62 -6.785 9.946 1.247
395 HA2 GLY 62 HA2 GLY 62 -6.039 12.102 1.208
396 HA3 GLY 62 HA1 GLY 62 -4.643 11.551 2.113
397 H LYS 63 HN LYS 63 -3.185 12.832 1.058
398 HA LYS 63 HA LYS 63 -2.989 12.732 -1.824
399 HB2 LYS 63 HB2 LYS 63 -1.377 14.449 -1.648
400 HB3 LYS 63 HB1 LYS 63 -2.584 14.811 -0.429
401 HG2 LYS 63 HG2 LYS 63 -1.111 13.832 1.287
402 HG3 LYS 63 HG1 LYS 63 0.109 13.559 0.043
403 HD2 LYS 63 HD2 LYS 63 -0.997 16.220 0.936
404 HD3 LYS 63 HD1 LYS 63 0.626 15.593 1.234
405 HE2 LYS 63 HE2 LYS 63 1.050 15.583 -1.183
406 HE3 LYS 63 HE1 LYS 63 -0.559 16.243 -1.464
407 HZ1 LYS 63 HZ1 LYS 63 0.117 18.166 -0.072
408 HZ2 LYS 63 HZ2 LYS 63 0.984 18.022 -1.517
409 HZ3 LYS 63 HZ3 LYS 63 1.693 17.551 -0.057
410 HA PRO 64 HA PRO 64 0.103 9.594 -1.878
411 HB2 PRO 64 HB2 PRO 64 1.134 10.264 -4.409
412 HB3 PRO 64 HB1 PRO 64 -0.222 9.187 -4.073
413 HG2 PRO 64 HG2 PRO 64 -0.366 11.656 -5.385
414 HG3 PRO 64 HG1 PRO 64 -1.730 10.709 -4.761
415 HD2 PRO 64 HD2 PRO 64 -0.363 13.062 -3.565
416 HD3 PRO 64 HD1 PRO 64 -2.063 12.558 -3.460
417 H GLN 65 HN GLN 65 1.828 9.675 -0.651
418 HA GLN 65 HA GLN 65 4.016 11.532 -1.315
419 HB2 GLN 65 HB2 GLN 65 2.867 10.598 1.228
420 HB3 GLN 65 HB1 GLN 65 4.618 10.484 1.160
421 HG2 GLN 65 HG2 GLN 65 4.865 12.795 0.845
422 HG3 GLN 65 HG1 GLN 65 3.157 13.009 0.464
423 HE21 GLN 65 HE21 GLN 65 1.688 13.212 2.103
424 HE22 GLN 65 HE22 GLN 65 2.135 13.348 3.765
425 H PHE 66 HN PHE 66 6.055 10.604 -1.740
426 HA PHE 66 HA PHE 66 6.097 7.655 -1.658
427 HB2 PHE 66 HB2 PHE 66 7.106 9.431 -3.884
428 HB3 PHE 66 HB1 PHE 66 7.381 7.696 -3.787
429 HD1 PHE 66 HD1 PHE 66 5.345 6.168 -3.763
430 HD2 PHE 66 HD2 PHE 66 5.167 10.280 -4.844
431 HE1 PHE 66 HE1 PHE 66 3.215 5.765 -4.925
432 HE2 PHE 66 HE2 PHE 66 3.036 9.885 -6.007
433 HZ PHE 66 HZ PHE 66 2.058 7.624 -6.050
434 H TYR 67 HN TYR 67 8.088 6.636 -1.496
435 HA TYR 67 HA TYR 67 10.527 8.097 -1.139
436 HB2 TYR 67 HB2 TYR 67 10.971 7.572 1.150
437 HB3 TYR 67 HB1 TYR 67 9.386 8.327 1.107
438 HD1 TYR 67 HD2 TYR 67 7.351 6.944 1.472
439 HD2 TYR 67 HD1 TYR 67 11.260 5.320 1.902
440 HE1 TYR 67 HE2 TYR 67 6.422 5.046 2.732
441 HE2 TYR 67 HE1 TYR 67 10.338 3.424 3.165
442 HH TYR 67 HH TYR 67 7.488 2.378 3.103
443 H LYS 68 HN LYS 68 12.359 6.668 -1.115
444 HA LYS 68 HA LYS 68 11.780 4.191 -2.485
445 HB2 LYS 68 HB2 LYS 68 14.326 5.642 -1.800
446 HB3 LYS 68 HB1 LYS 68 14.343 4.019 -2.476
447 HG2 LYS 68 HG2 LYS 68 12.639 5.818 -3.985
448 HG3 LYS 68 HG1 LYS 68 14.306 6.383 -3.892
449 HD2 LYS 68 HD2 LYS 68 14.233 5.032 -5.810
450 HD3 LYS 68 HD1 LYS 68 14.975 4.018 -4.573
451 HE2 LYS 68 HE2 LYS 68 12.688 3.059 -4.146
452 HE3 LYS 68 HE1 LYS 68 12.136 3.932 -5.577
453 HZ1 LYS 68 HZ1 LYS 68 12.660 1.767 -6.289
454 HZ2 LYS 68 HZ2 LYS 68 14.121 1.738 -5.437
455 HZ3 LYS 68 HZ3 LYS 68 13.960 2.725 -6.800
456 H TYR 69 HN TYR 69 11.746 2.207 -1.640
457 HA TYR 69 HA TYR 69 13.266 1.562 0.725
458 HB2 TYR 69 HB2 TYR 69 11.210 2.533 1.687
459 HB3 TYR 69 HB1 TYR 69 10.249 1.355 0.803
460 HD1 TYR 69 HD1 TYR 69 12.742 1.762 3.504
461 HD2 TYR 69 HD2 TYR 69 9.971 -0.866 1.627
462 HE1 TYR 69 HE1 TYR 69 12.985 0.176 5.368
463 HE2 TYR 69 HE2 TYR 69 10.208 -2.455 3.484
464 HH TYR 69 HH TYR 69 11.930 -1.648 6.394
465 H LEU 70 HN LEU 70 14.134 -0.331 0.310
466 HA LEU 70 HA LEU 70 13.198 -2.036 -1.765
467 HB2 LEU 70 HB2 LEU 70 15.595 -1.700 -0.705
468 HB3 LEU 70 HB1 LEU 70 15.077 -3.009 0.337
469 HG LEU 70 HG LEU 70 14.469 -3.950 -2.186
470 HD11 LEU 70 HD11 LEU 70 15.690 -2.078 -3.192
471 HD12 LEU 70 HD12 LEU 70 16.467 -3.625 -3.525
472 HD13 LEU 70 HD13 LEU 70 17.135 -2.547 -2.298
473 HD21 LEU 70 HD21 LEU 70 16.942 -4.384 -0.515
474 HD22 LEU 70 HD22 LEU 70 16.404 -5.429 -1.830
475 HD23 LEU 70 HD23 LEU 70 15.415 -5.256 -0.381
476 H GLY 71 HN GLY 71 11.111 -2.674 -1.298
477 HA2 GLY 71 HA2 GLY 71 10.404 -4.998 -0.343
478 HA3 GLY 71 HA1 GLY 71 10.642 -4.161 1.183
479 H ASP 72 HN ASP 72 9.673 -1.643 -0.293
480 HA ASP 72 HA ASP 72 6.860 -2.083 0.327
481 HB2 ASP 72 HB2 ASP 72 8.673 0.205 0.301
482 HB3 ASP 72 HB1 ASP 72 7.120 0.561 -0.441
483 H MET 73 HN MET 73 5.245 -2.108 -1.125
484 HA MET 73 HA MET 73 5.894 -1.471 -3.929
485 HB2 MET 73 HB2 MET 73 4.172 -3.761 -2.953
486 HB3 MET 73 HB1 MET 73 4.448 -3.332 -4.633
487 HG2 MET 73 HG2 MET 73 6.768 -3.913 -4.457
488 HG3 MET 73 HG1 MET 73 6.607 -4.191 -2.724
489 HE1 MET 73 HE1 MET 73 3.979 -5.273 -5.513
490 HE2 MET 73 HE2 MET 73 4.648 -6.841 -5.963
491 HE3 MET 73 HE3 MET 73 5.557 -5.367 -6.292
492 H THR 74 HN THR 74 4.878 0.531 -3.913
493 HA THR 74 HA THR 74 2.171 0.784 -2.937
494 HB THR 74 HB THR 74 3.789 2.798 -4.514
495 HG1 THR 74 HG1 THR 74 4.881 2.419 -2.613
496 HG21 THR 74 HG21 THR 74 2.258 4.432 -3.440
497 HG22 THR 74 HG22 THR 74 1.320 3.085 -2.796
498 HG23 THR 74 HG23 THR 74 1.431 3.329 -4.540
499 H GLY 75 HN GLY 75 0.341 0.613 -4.086
500 HA2 GLY 75 HA2 GLY 75 0.545 0.536 -7.031
501 HA3 GLY 75 HA1 GLY 75 -0.331 -0.715 -6.160
502 H SER 76 HN SER 76 -1.685 0.587 -8.052
503 HA SER 76 HA SER 76 -3.148 2.785 -6.819
504 HB2 SER 76 HB2 SER 76 -3.556 1.614 -9.573
505 HB3 SER 76 HB1 SER 76 -4.014 3.216 -8.999
506 HG SER 76 HG SER 76 -2.125 3.866 -9.609
507 H ARG 77 HN ARG 77 -5.409 2.745 -6.551
508 HA ARG 77 HA ARG 77 -6.483 0.451 -5.403
509 HB2 ARG 77 HB2 ARG 77 -7.237 2.799 -5.020
510 HB3 ARG 77 HB1 ARG 77 -8.028 2.761 -6.589
511 HG2 ARG 77 HG2 ARG 77 -9.307 0.735 -5.693
512 HG3 ARG 77 HG1 ARG 77 -8.727 1.241 -4.103
513 HD2 ARG 77 HD2 ARG 77 -9.688 3.509 -4.585
514 HD3 ARG 77 HD1 ARG 77 -10.426 2.819 -6.027
515 HE ARG 77 HE ARG 77 -11.024 1.801 -3.323
516 HH11 ARG 77 HH11 ARG 77 -12.047 2.960 -6.488
517 HH12 ARG 77 HH12 ARG 77 -13.798 2.700 -6.145
518 HH21 ARG 77 HH21 ARG 77 -13.239 1.454 -2.845
519 HH22 ARG 77 HH22 ARG 77 -14.462 1.850 -4.115
520 H THR 78 HN THR 78 -6.555 1.496 -8.749
521 HA THR 78 HA THR 78 -8.401 -0.709 -9.349
522 HB THR 78 HB THR 78 -9.036 1.611 -10.088
523 HG1 THR 78 HG1 THR 78 -8.784 0.178 -12.460
524 HG21 THR 78 HG21 THR 78 -7.968 2.494 -12.118
525 HG22 THR 78 HG22 THR 78 -6.768 1.205 -12.040
526 HG23 THR 78 HG23 THR 78 -6.841 2.419 -10.764
527 H CYS 79 HN CYS 79 -5.200 -0.337 -9.154
528 HA CYS 79 HA CYS 79 -4.568 -2.572 -10.724
529 HB2 CYS 79 HB2 CYS 79 -4.947 -0.674 -12.483
530 HB3 CYS 79 HB1 CYS 79 -3.378 -0.091 -11.939
531 H1 GAL 83 H1 GTP 1 5.970 2.696 8.402
532 H2 GAL 83 H2 GTP 1 5.557 4.539 5.997
533 H3 GAL 83 H3 GTP 1 3.704 2.681 7.530
534 H4 GAL 83 H4 GTP 1 3.647 1.466 5.398
535 H5 GAL 83 H5 GTP 1 5.275 0.867 7.097
536 H61 GAL 83 H61 GTP 1 7.138 0.623 4.900
537 H62 GAL 83 H62 GTP 1 5.498 0.246 4.373
538 HO2 GAL 83 HO2 GTP 1 5.527 5.097 8.559
539 HO3 GAL 83 HO3 GTP 1 3.047 4.858 6.510
540 HO4 GAL 83 HO4 GTP 1 5.850 2.763 4.320
541 HO6 GAL 83 HO6 GTP 1 6.644 -1.583 5.247
542 H1 NAG 84 H1 GCP 2 10.302 3.449 4.962
543 H2 NAG 84 H2 GCP 2 10.131 3.915 7.982
544 H3 NAG 84 H3 GCP 2 8.044 3.907 5.772
545 H4 NAG 84 H4 GCP 2 9.177 6.058 7.620
546 H5 NAG 84 H5 GCP 2 9.334 5.588 4.597
547 H61 NAG 84 H61 GCP 2 10.060 7.894 6.343
548 H62 NAG 84 H62 GCP 2 9.452 7.856 4.684
549 H81 NAG 84 HC23 GCP 2 8.695 -0.158 8.130
550 H82 NAG 84 HC21 GCP 2 10.031 -0.677 7.100
551 H83 NAG 84 HC22 GCP 2 10.249 -0.588 8.847
552 HN2 NAG 84 HN2 GCP 2 8.670 1.723 6.684
553 HO1 NAG 84 HO1 GCP 2 11.911 2.707 7.039
554 HO4 NAG 84 HO4 GCP 2 7.071 6.507 7.201
555 HO6 NAG 84 HO6 GCP 2 11.991 6.746 5.251
Start of MODEL 10
1 H CYS 10 HT1 CYS 10 0.427 0.362 -15.333
2 HA CYS 10 HA CYS 10 -1.007 2.419 -13.788
3 HB2 CYS 10 HB2 CYS 10 -1.948 0.578 -12.481
4 HB3 CYS 10 HB1 CYS 10 -2.423 0.443 -14.169
5 H VAL 11 HN VAL 11 -0.415 2.400 -11.525
6 HA VAL 11 HA VAL 11 2.443 2.099 -11.221
7 HB VAL 11 HB VAL 11 0.451 2.954 -9.110
8 HG11 VAL 11 HG11 VAL 11 2.647 2.373 -8.246
9 HG12 VAL 11 HG12 VAL 11 2.386 4.117 -8.140
10 HG13 VAL 11 HG13 VAL 11 3.413 3.452 -9.413
11 HG21 VAL 11 HG21 VAL 11 1.954 4.722 -11.036
12 HG22 VAL 11 HG22 VAL 11 0.842 5.240 -9.771
13 HG23 VAL 11 HG23 VAL 11 0.240 4.329 -11.155
14 H HIS 12 HN HIS 12 3.390 0.336 -10.460
15 HA HIS 12 HA HIS 12 2.363 -1.148 -8.260
16 HB2 HIS 12 HB2 HIS 12 1.936 -3.271 -9.325
17 HB3 HIS 12 HB1 HIS 12 0.944 -2.058 -10.123
18 HD1 HIS 12 HD1 HIS 12 3.446 -4.642 -10.781
19 HD2 HIS 12 HD2 HIS 12 1.980 -1.282 -12.739
20 HE1 HIS 12 HE1 HIS 12 4.173 -4.885 -13.174
21 HE2 HIS 12 HE2 HIS 12 3.438 -2.749 -14.291
22 H THR 13 HN THR 13 3.948 -2.313 -7.286
23 HA THR 13 HA THR 13 6.033 -3.018 -6.747
24 HB THR 13 HB THR 13 6.893 -3.436 -9.554
25 HG1 THR 13 HG1 THR 13 5.156 -5.410 -8.866
26 HG21 THR 13 HG21 THR 13 7.342 -5.726 -8.616
27 HG22 THR 13 HG22 THR 13 6.783 -5.123 -7.057
28 HG23 THR 13 HG23 THR 13 8.206 -4.415 -7.818
29 H GLY 14 HN GLY 14 8.510 -2.764 -8.167
30 HA2 GLY 14 HA2 GLY 14 10.063 -1.187 -8.903
31 HA3 GLY 14 HA1 GLY 14 8.818 0.048 -8.820
32 H ASN 15 HN ASN 15 9.316 -2.065 -6.155
33 HA ASN 15 HA ASN 15 9.582 -1.541 -3.950
34 HB2 ASN 15 HB2 ASN 15 11.966 -1.080 -3.405
35 HB3 ASN 15 HB1 ASN 15 11.728 -2.423 -4.508
36 HD21 ASN 15 HD21 ASN 15 13.215 0.580 -3.984
37 HD22 ASN 15 HD22 ASN 15 14.024 0.714 -5.509
38 H ILE 16 HN ILE 16 8.011 0.283 -4.528
39 HA ILE 16 HA ILE 16 9.145 2.809 -3.546
40 HB ILE 16 HB ILE 16 7.269 2.281 -5.793
41 HG12 ILE 16 HG12 ILE 16 9.636 3.068 -6.058
42 HG13 ILE 16 HG11 ILE 16 8.439 4.100 -6.832
43 HG21 ILE 16 HG21 ILE 16 5.751 3.446 -4.357
44 HG22 ILE 16 HG22 ILE 16 6.294 4.566 -5.606
45 HG23 ILE 16 HG23 ILE 16 6.965 4.666 -3.979
46 HD11 ILE 16 HD11 ILE 16 10.025 5.512 -5.790
47 HD12 ILE 16 HD12 ILE 16 9.934 4.613 -4.276
48 HD13 ILE 16 HD13 ILE 16 8.561 5.582 -4.810
49 H GLY 17 HN GLY 17 8.348 3.442 -1.660
50 HA2 GLY 17 HA2 GLY 17 5.859 2.187 -0.701
51 HA3 GLY 17 HA1 GLY 17 7.131 2.837 0.328
52 H SER 18 HN SER 18 4.570 3.610 0.810
53 HA SER 18 HA SER 18 4.586 6.388 -0.160
54 HB2 SER 18 HB2 SER 18 2.193 4.593 0.292
55 HB3 SER 18 HB1 SER 18 2.084 6.334 0.034
56 HG SER 18 HG SER 18 3.247 4.466 -1.765
57 H LYS 19 HN LYS 19 5.230 7.578 1.512
58 HA LYS 19 HA LYS 19 4.655 6.807 4.240
59 HB2 LYS 19 HB2 LYS 19 6.807 7.907 3.443
60 HB3 LYS 19 HB1 LYS 19 5.886 9.394 3.276
61 HG2 LYS 19 HG2 LYS 19 5.260 9.043 5.743
62 HG3 LYS 19 HG1 LYS 19 6.602 7.898 5.769
63 HD2 LYS 19 HD2 LYS 19 7.392 10.049 6.518
64 HD3 LYS 19 HD1 LYS 19 8.093 9.701 4.937
65 HE2 LYS 19 HE2 LYS 19 7.308 12.040 5.160
66 HE3 LYS 19 HE1 LYS 19 6.504 11.167 3.858
67 HZ1 LYS 19 HZ1 LYS 19 5.393 11.722 6.557
68 HZ2 LYS 19 HZ2 LYS 19 4.621 10.799 5.367
69 HZ3 LYS 19 HZ3 LYS 19 4.915 12.442 5.103
70 H ALA 20 HN ALA 20 2.286 7.049 3.080
71 HA ALA 20 HA ALA 20 1.249 9.713 3.768
72 HB1 ALA 20 HB1 ALA 20 -0.697 9.145 2.391
73 HB2 ALA 20 HB2 ALA 20 0.007 7.563 2.053
74 HB3 ALA 20 HB3 ALA 20 0.804 9.024 1.470
75 H GLN 21 HN GLN 21 -1.162 9.520 4.491
76 HA GLN 21 HA GLN 21 -1.147 8.083 6.964
77 HB2 GLN 21 HB2 GLN 21 -2.247 10.385 6.292
78 HB3 GLN 21 HB1 GLN 21 -3.611 9.363 5.872
79 HG2 GLN 21 HG2 GLN 21 -2.728 8.558 8.425
80 HG3 GLN 21 HG1 GLN 21 -2.807 10.319 8.425
81 HE21 GLN 21 HE21 GLN 21 -4.457 8.516 9.890
82 HE22 GLN 21 HE22 GLN 21 -6.087 8.777 9.373
83 H THR 22 HN THR 22 -2.030 6.182 7.446
84 HA THR 22 HA THR 22 -3.241 4.602 5.362
85 HB THR 22 HB THR 22 -3.009 3.822 8.268
86 HG1 THR 22 HG1 THR 22 -0.929 4.123 7.991
87 HG21 THR 22 HG21 THR 22 -2.768 1.567 7.348
88 HG22 THR 22 HG22 THR 22 -2.881 2.213 5.712
89 HG23 THR 22 HG23 THR 22 -4.267 2.312 6.798
90 H ILE 23 HN ILE 23 -5.393 3.953 5.254
91 HA ILE 23 HA ILE 23 -7.305 5.748 6.310
92 HB ILE 23 HB ILE 23 -7.864 3.006 5.171
93 HG12 ILE 23 HG12 ILE 23 -7.773 5.640 3.695
94 HG13 ILE 23 HG11 ILE 23 -6.436 4.496 3.708
95 HG21 ILE 23 HG21 ILE 23 -9.523 5.455 5.678
96 HG22 ILE 23 HG22 ILE 23 -9.839 3.783 6.149
97 HG23 ILE 23 HG23 ILE 23 -9.988 4.270 4.461
98 HD11 ILE 23 HD11 ILE 23 -7.913 2.812 2.691
99 HD12 ILE 23 HD12 ILE 23 -7.716 4.250 1.688
100 HD13 ILE 23 HD13 ILE 23 -9.196 4.018 2.617
101 H GLY 24 HN GLY 24 -6.695 2.317 7.091
102 HA2 GLY 24 HA2 GLY 24 -7.866 2.864 9.732
103 HA3 GLY 24 HA1 GLY 24 -8.382 1.459 8.814
104 H GLU 25 HN GLU 25 -7.743 0.070 10.402
105 HA GLU 25 HA GLU 25 -5.164 -0.007 11.552
106 HB2 GLU 25 HB2 GLU 25 -6.766 -1.068 12.832
107 HB3 GLU 25 HB1 GLU 25 -7.535 -1.820 11.446
108 HG2 GLU 25 HG2 GLU 25 -5.090 -3.018 11.446
109 HG3 GLU 25 HG1 GLU 25 -5.394 -2.792 13.170
110 H VAL 26 HN VAL 26 -3.362 -1.121 11.033
111 HA VAL 26 HA VAL 26 -3.045 -2.006 8.324
112 HB VAL 26 HB VAL 26 -1.074 -2.261 10.602
113 HG11 VAL 26 HG11 VAL 26 -0.568 -3.621 8.624
114 HG12 VAL 26 HG12 VAL 26 0.612 -2.332 8.858
115 HG13 VAL 26 HG13 VAL 26 -0.636 -2.170 7.623
116 HG21 VAL 26 HG21 VAL 26 -1.768 0.057 10.386
117 HG22 VAL 26 HG22 VAL 26 -1.436 0.010 8.654
118 HG23 VAL 26 HG23 VAL 26 -0.113 -0.148 9.810
119 H LYS 27 HN LYS 27 -3.219 -4.041 7.585
120 HA LYS 27 HA LYS 27 -3.230 -6.240 9.543
121 HB2 LYS 27 HB2 LYS 27 -4.861 -6.958 7.329
122 HB3 LYS 27 HB1 LYS 27 -5.337 -6.756 9.010
123 HG2 LYS 27 HG2 LYS 27 -5.621 -4.309 8.536
124 HG3 LYS 27 HG1 LYS 27 -5.377 -4.685 6.826
125 HD2 LYS 27 HD2 LYS 27 -7.327 -6.046 6.768
126 HD3 LYS 27 HD1 LYS 27 -7.480 -6.012 8.527
127 HE2 LYS 27 HE2 LYS 27 -7.825 -3.678 6.647
128 HE3 LYS 27 HE1 LYS 27 -9.102 -4.524 7.517
129 HZ1 LYS 27 HZ1 LYS 27 -7.049 -2.689 8.560
130 HZ2 LYS 27 HZ2 LYS 27 -7.736 -3.852 9.586
131 HZ3 LYS 27 HZ3 LYS 27 -8.721 -2.697 8.832
132 H ARG 28 HN ARG 28 -2.735 -8.353 8.563
133 HA ARG 28 HA ARG 28 -0.621 -8.042 6.587
134 HB2 ARG 28 HB2 ARG 28 -1.240 -9.958 8.712
135 HB3 ARG 28 HB1 ARG 28 -0.716 -10.728 7.220
136 HG2 ARG 28 HG2 ARG 28 1.314 -9.395 7.223
137 HG3 ARG 28 HG1 ARG 28 0.779 -8.569 8.687
138 HD2 ARG 28 HD2 ARG 28 2.393 -10.304 9.217
139 HD3 ARG 28 HD1 ARG 28 0.815 -10.683 9.905
140 HE ARG 28 HE ARG 28 0.778 -12.005 7.552
141 HH11 ARG 28 HH11 ARG 28 3.138 -11.850 10.152
142 HH12 ARG 28 HH12 ARG 28 3.662 -13.562 9.942
143 HH21 ARG 28 HH21 ARG 28 1.412 -14.163 7.226
144 HH22 ARG 28 HH22 ARG 28 2.679 -14.866 8.304
145 H ALA 29 HN ALA 29 -0.481 -9.374 4.722
146 HA ALA 29 HA ALA 29 -3.052 -10.476 3.798
147 HB1 ALA 29 HB1 ALA 29 -1.233 -8.547 2.391
148 HB2 ALA 29 HB2 ALA 29 -2.969 -8.423 2.674
149 HB3 ALA 29 HB3 ALA 29 -2.346 -9.585 1.503
150 H SER 30 HN SER 30 -2.760 -11.974 1.941
151 HA SER 30 HA SER 30 -0.397 -13.612 2.376
152 HB2 SER 30 HB2 SER 30 -2.060 -14.913 0.564
153 HB3 SER 30 HB1 SER 30 -2.000 -15.186 2.305
154 HG SER 30 HG SER 30 -4.011 -14.211 0.883
155 H SER 31 HN SER 31 -1.685 -11.411 0.095
156 HA SER 31 HA SER 31 0.623 -11.627 -1.586
157 HB2 SER 31 HB2 SER 31 -0.758 -12.057 -3.669
158 HB3 SER 31 HB1 SER 31 -0.578 -13.441 -2.591
159 HG SER 31 HG SER 31 -2.689 -13.458 -2.829
160 H LEU 32 HN LEU 32 0.384 -10.101 -3.519
161 HA LEU 32 HA LEU 32 -0.315 -7.531 -2.625
162 HB2 LEU 32 HB2 LEU 32 1.349 -7.956 -4.387
163 HB3 LEU 32 HB1 LEU 32 0.085 -8.540 -5.451
164 HG LEU 32 HG LEU 32 -0.944 -6.213 -5.267
165 HD11 LEU 32 HD11 LEU 32 1.769 -5.658 -4.084
166 HD12 LEU 32 HD12 LEU 32 0.199 -5.383 -3.336
167 HD13 LEU 32 HD13 LEU 32 0.693 -4.417 -4.726
168 HD21 LEU 32 HD21 LEU 32 0.560 -5.296 -6.966
169 HD22 LEU 32 HD22 LEU 32 0.211 -7.000 -7.257
170 HD23 LEU 32 HD23 LEU 32 1.759 -6.524 -6.563
171 H SER 33 HN SER 33 -1.978 -9.883 -4.644
172 HA SER 33 HA SER 33 -4.160 -8.320 -5.441
173 HB2 SER 33 HB2 SER 33 -4.848 -11.107 -5.008
174 HB3 SER 33 HB1 SER 33 -4.674 -10.223 -6.526
175 HG SER 33 HG SER 33 -3.143 -12.060 -5.976
176 H GLU 34 HN GLU 34 -3.542 -10.210 -2.542
177 HA GLU 34 HA GLU 34 -6.150 -10.041 -1.445
178 HB2 GLU 34 HB2 GLU 34 -3.811 -11.345 -0.781
179 HB3 GLU 34 HB1 GLU 34 -3.950 -10.142 0.491
180 HG2 GLU 34 HG2 GLU 34 -4.995 -12.108 1.274
181 HG3 GLU 34 HG1 GLU 34 -6.273 -10.954 0.898
182 H CYS 35 HN CYS 35 -3.243 -8.067 -1.196
183 HA CYS 35 HA CYS 35 -4.214 -6.283 0.775
184 HB2 CYS 35 HB2 CYS 35 -1.808 -6.538 0.199
185 HB3 CYS 35 HB1 CYS 35 -2.120 -5.780 -1.358
186 H ARG 36 HN ARG 36 -4.297 -6.295 -2.753
187 HA ARG 36 HA ARG 36 -5.328 -3.720 -3.136
188 HB2 ARG 36 HB2 ARG 36 -4.439 -5.375 -4.885
189 HB3 ARG 36 HB1 ARG 36 -6.050 -6.081 -4.862
190 HG2 ARG 36 HG2 ARG 36 -6.992 -3.897 -5.496
191 HG3 ARG 36 HG1 ARG 36 -5.357 -3.242 -5.585
192 HD2 ARG 36 HD2 ARG 36 -5.553 -3.804 -7.762
193 HD3 ARG 36 HD1 ARG 36 -5.078 -5.395 -7.170
194 HE ARG 36 HE ARG 36 -7.912 -5.010 -7.088
195 HH11 ARG 36 HH11 ARG 36 -5.198 -5.805 -9.179
196 HH12 ARG 36 HH12 ARG 36 -6.217 -6.706 -10.362
197 HH21 ARG 36 HH21 ARG 36 -9.245 -6.134 -8.565
198 HH22 ARG 36 HH22 ARG 36 -8.487 -6.906 -10.007
199 H ALA 37 HN ALA 37 -6.931 -6.821 -2.561
200 HA ALA 37 HA ALA 37 -9.585 -5.943 -2.887
201 HB1 ALA 37 HB1 ALA 37 -8.944 -8.309 -2.842
202 HB2 ALA 37 HB2 ALA 37 -10.216 -7.954 -1.673
203 HB3 ALA 37 HB3 ALA 37 -8.550 -8.165 -1.130
204 H ARG 38 HN ARG 38 -7.453 -6.044 -0.074
205 HA ARG 38 HA ARG 38 -9.332 -5.265 1.866
206 HB2 ARG 38 HB2 ARG 38 -6.392 -5.389 1.663
207 HB3 ARG 38 HB1 ARG 38 -7.005 -4.223 2.824
208 HG2 ARG 38 HG2 ARG 38 -6.565 -6.308 3.928
209 HG3 ARG 38 HG1 ARG 38 -8.305 -6.015 3.899
210 HD2 ARG 38 HD2 ARG 38 -8.629 -7.594 2.158
211 HD3 ARG 38 HD1 ARG 38 -6.894 -7.719 1.859
212 HE ARG 38 HE ARG 38 -7.313 -8.473 4.487
213 HH11 ARG 38 HH11 ARG 38 -8.277 -9.563 1.287
214 HH12 ARG 38 HH12 ARG 38 -8.419 -11.286 1.797
215 HH21 ARG 38 HH21 ARG 38 -7.482 -10.628 5.171
216 HH22 ARG 38 HH22 ARG 38 -7.961 -11.886 3.969
217 H CYS 39 HN CYS 39 -7.272 -3.429 -0.309
218 HA CYS 39 HA CYS 39 -7.971 -0.888 0.819
219 HB2 CYS 39 HB2 CYS 39 -5.841 -1.572 -0.529
220 HB3 CYS 39 HB1 CYS 39 -6.837 -1.221 -1.937
221 H GLN 40 HN GLN 40 -9.021 -2.814 -1.956
222 HA GLN 40 HA GLN 40 -10.687 -0.827 -3.099
223 HB2 GLN 40 HB2 GLN 40 -10.557 -3.814 -3.389
224 HB3 GLN 40 HB1 GLN 40 -11.788 -2.866 -4.211
225 HG2 GLN 40 HG2 GLN 40 -9.945 -1.511 -5.223
226 HG3 GLN 40 HG1 GLN 40 -8.807 -2.673 -4.542
227 HE21 GLN 40 HE21 GLN 40 -11.263 -2.118 -6.915
228 HE22 GLN 40 HE22 GLN 40 -10.978 -3.543 -7.847
229 H ALA 41 HN ALA 41 -11.009 -2.506 -0.243
230 HA ALA 41 HA ALA 41 -13.882 -2.701 -0.217
231 HB1 ALA 41 HB1 ALA 41 -11.886 -2.922 2.042
232 HB2 ALA 41 HB2 ALA 41 -12.521 -4.263 1.086
233 HB3 ALA 41 HB3 ALA 41 -13.599 -3.337 2.129
234 H GLU 42 HN GLU 42 -11.698 -0.220 -0.022
235 HA GLU 42 HA GLU 42 -13.459 1.422 1.666
236 HB2 GLU 42 HB2 GLU 42 -10.624 1.106 1.631
237 HB3 GLU 42 HB1 GLU 42 -11.001 2.754 1.149
238 HG2 GLU 42 HG2 GLU 42 -11.742 1.355 3.698
239 HG3 GLU 42 HG1 GLU 42 -10.739 2.789 3.489
240 H LYS 43 HN LYS 43 -13.337 3.807 1.039
241 HA LYS 43 HA LYS 43 -13.800 3.985 -1.866
242 HB2 LYS 43 HB2 LYS 43 -15.349 5.770 -1.395
243 HB3 LYS 43 HB1 LYS 43 -15.740 4.408 -0.357
244 HG2 LYS 43 HG2 LYS 43 -14.124 5.731 1.300
245 HG3 LYS 43 HG1 LYS 43 -14.706 7.089 0.336
246 HD2 LYS 43 HD2 LYS 43 -16.326 7.043 1.944
247 HD3 LYS 43 HD1 LYS 43 -17.043 5.926 0.781
248 HE2 LYS 43 HE2 LYS 43 -17.215 4.931 2.938
249 HE3 LYS 43 HE1 LYS 43 -15.985 4.052 2.037
250 HZ1 LYS 43 HZ1 LYS 43 -15.233 6.253 3.856
251 HZ2 LYS 43 HZ2 LYS 43 -14.280 4.965 3.300
252 HZ3 LYS 43 HZ3 LYS 43 -15.494 4.692 4.447
253 H GLU 44 HN GLU 44 -11.946 5.208 0.778
254 HA GLU 44 HA GLU 44 -10.961 7.485 -0.755
255 HB2 GLU 44 HB2 GLU 44 -10.386 6.558 2.062
256 HB3 GLU 44 HB1 GLU 44 -9.659 7.978 1.327
257 HG2 GLU 44 HG2 GLU 44 -11.985 8.862 0.991
258 HG3 GLU 44 HG1 GLU 44 -12.552 7.525 1.992
259 H CYS 45 HN CYS 45 -10.374 4.421 -1.057
260 HA CYS 45 HA CYS 45 -7.525 4.299 -0.700
261 HB2 CYS 45 HB2 CYS 45 -8.691 2.242 -0.431
262 HB3 CYS 45 HB1 CYS 45 -9.525 2.432 -1.969
263 H SER 46 HN SER 46 -6.392 5.647 -1.954
264 HA SER 46 HA SER 46 -6.947 5.644 -4.843
265 HB2 SER 46 HB2 SER 46 -5.530 7.755 -4.815
266 HB3 SER 46 HB1 SER 46 -7.075 7.872 -3.970
267 HG SER 46 HG SER 46 -5.537 8.735 -2.628
268 H HIS 47 HN HIS 47 -4.899 4.439 -2.495
269 HA HIS 47 HA HIS 47 -3.103 3.266 -4.344
270 HB2 HIS 47 HB2 HIS 47 -1.018 4.363 -3.522
271 HB3 HIS 47 HB1 HIS 47 -2.064 5.462 -4.416
272 HD1 HIS 47 HD1 HIS 47 -3.475 7.188 -2.906
273 HD2 HIS 47 HD2 HIS 47 -0.403 5.157 -0.972
274 HE1 HIS 47 HE1 HIS 47 -3.042 8.473 -0.796
275 HE2 HIS 47 HE2 HIS 47 -1.336 7.108 0.448
276 H TYR 48 HN TYR 48 -2.180 1.493 -3.428
277 HA TYR 48 HA TYR 48 -2.365 1.269 -0.500
278 HB2 TYR 48 HB2 TYR 48 -2.858 -1.136 -0.766
279 HB3 TYR 48 HB1 TYR 48 -4.101 -0.122 -1.484
280 HD1 TYR 48 HD2 TYR 48 -4.160 0.131 -4.001
281 HD2 TYR 48 HD1 TYR 48 -1.684 -2.731 -2.052
282 HE1 TYR 48 HE2 TYR 48 -3.947 -1.117 -6.107
283 HE2 TYR 48 HE1 TYR 48 -1.470 -3.983 -4.156
284 HH TYR 48 HH TYR 48 -2.261 -2.734 -7.124
285 H THR 49 HN THR 49 -0.597 0.583 0.545
286 HA THR 49 HA THR 49 1.732 -0.103 -1.109
287 HB THR 49 HB THR 49 1.671 1.037 1.692
288 HG1 THR 49 HG1 THR 49 2.429 2.257 -0.782
289 HG21 THR 49 HG21 THR 49 4.087 1.337 1.397
290 HG22 THR 49 HG22 THR 49 3.992 0.559 -0.184
291 HG23 THR 49 HG23 THR 49 3.644 -0.366 1.277
292 H TYR 50 HN TYR 50 2.103 -2.214 -1.168
293 HA TYR 50 HA TYR 50 1.475 -3.814 1.211
294 HB2 TYR 50 HB2 TYR 50 0.412 -4.556 -0.879
295 HB3 TYR 50 HB1 TYR 50 1.993 -4.686 -1.641
296 HD1 TYR 50 HD1 TYR 50 0.600 -5.857 1.634
297 HD2 TYR 50 HD2 TYR 50 2.551 -6.881 -2.003
298 HE1 TYR 50 HE1 TYR 50 0.775 -8.188 2.393
299 HE2 TYR 50 HE2 TYR 50 2.729 -9.217 -1.256
300 HH TYR 50 HH TYR 50 2.730 -10.495 0.810
301 H ASN 51 HN ASN 51 3.131 -4.071 2.520
302 HA ASN 51 HA ASN 51 5.860 -3.982 1.523
303 HB2 ASN 51 HB2 ASN 51 5.302 -2.809 3.618
304 HB3 ASN 51 HB1 ASN 51 4.792 -4.331 4.341
305 HD21 ASN 51 HD21 ASN 51 7.481 -2.414 3.273
306 HD22 ASN 51 HD22 ASN 51 8.707 -3.336 4.087
307 H VAL 52 HN VAL 52 6.457 -5.818 0.517
308 HA VAL 52 HA VAL 52 5.415 -8.385 1.205
309 HB VAL 52 HB VAL 52 7.026 -9.290 -0.413
310 HG11 VAL 52 HG11 VAL 52 4.885 -8.464 -1.191
311 HG12 VAL 52 HG12 VAL 52 6.136 -8.145 -2.392
312 HG13 VAL 52 HG13 VAL 52 5.548 -6.839 -1.360
313 HG21 VAL 52 HG21 VAL 52 8.913 -7.818 -0.003
314 HG22 VAL 52 HG22 VAL 52 8.005 -6.444 -0.630
315 HG23 VAL 52 HG23 VAL 52 8.457 -7.766 -1.706
316 H LYS 53 HN LYS 53 7.992 -6.551 2.466
317 HA LYS 53 HA LYS 53 9.712 -8.678 3.238
318 HB2 LYS 53 HB2 LYS 53 9.397 -5.835 4.179
319 HB3 LYS 53 HB1 LYS 53 10.565 -6.929 4.905
320 HG2 LYS 53 HG2 LYS 53 10.508 -6.382 1.956
321 HG3 LYS 53 HG1 LYS 53 11.411 -5.375 3.086
322 HD2 LYS 53 HD2 LYS 53 12.537 -7.497 3.874
323 HD3 LYS 53 HD1 LYS 53 11.801 -8.299 2.487
324 HE2 LYS 53 HE2 LYS 53 14.056 -7.638 1.935
325 HE3 LYS 53 HE1 LYS 53 12.912 -6.681 0.996
326 HZ1 LYS 53 HZ1 LYS 53 13.394 -4.788 2.173
327 HZ2 LYS 53 HZ2 LYS 53 14.905 -5.541 2.171
328 HZ3 LYS 53 HZ3 LYS 53 13.924 -5.622 3.547
329 H SER 54 HN SER 54 6.919 -7.158 4.707
330 HA SER 54 HA SER 54 7.157 -9.032 6.967
331 HB2 SER 54 HB2 SER 54 5.620 -6.430 6.928
332 HB3 SER 54 HB1 SER 54 5.972 -7.440 8.330
333 HG SER 54 HG SER 54 7.868 -6.037 6.736
334 H GLY 55 HN GLY 55 5.197 -7.940 4.340
335 HA2 GLY 55 HA2 GLY 55 3.406 -9.114 3.403
336 HA3 GLY 55 HA1 GLY 55 3.299 -10.083 4.869
337 H LEU 56 HN LEU 56 3.538 -6.693 5.202
338 HA LEU 56 HA LEU 56 0.846 -6.590 6.303
339 HB2 LEU 56 HB2 LEU 56 3.166 -4.667 6.398
340 HB3 LEU 56 HB1 LEU 56 1.585 -4.297 7.056
341 HG LEU 56 HG LEU 56 3.183 -6.682 7.969
342 HD11 LEU 56 HD11 LEU 56 3.144 -3.900 9.144
343 HD12 LEU 56 HD12 LEU 56 4.517 -4.669 8.346
344 HD13 LEU 56 HD13 LEU 56 3.904 -5.319 9.867
345 HD21 LEU 56 HD21 LEU 56 0.717 -6.565 8.401
346 HD22 LEU 56 HD22 LEU 56 1.016 -5.114 9.354
347 HD23 LEU 56 HD23 LEU 56 1.716 -6.654 9.852
348 H CYS 57 HN CYS 57 -0.791 -5.489 5.452
349 HA CYS 57 HA CYS 57 -0.375 -4.180 2.859
350 HB2 CYS 57 HB2 CYS 57 -2.023 -6.006 2.899
351 HB3 CYS 57 HB1 CYS 57 -2.906 -5.190 4.187
352 H TYR 58 HN TYR 58 -0.560 -2.007 2.707
353 HA TYR 58 HA TYR 58 -1.720 -0.593 5.015
354 HB2 TYR 58 HB2 TYR 58 0.551 0.201 3.200
355 HB3 TYR 58 HB1 TYR 58 -0.216 1.303 4.331
356 HD1 TYR 58 HD2 TYR 58 1.934 -1.661 4.016
357 HD2 TYR 58 HD1 TYR 58 0.206 1.163 6.693
358 HE1 TYR 58 HE2 TYR 58 3.485 -2.390 5.777
359 HE2 TYR 58 HE1 TYR 58 1.763 0.444 8.459
360 HH TYR 58 HH TYR 58 4.387 -1.778 7.800
361 HA PRO 59 HA PRO 59 -4.365 0.763 1.511
362 HB2 PRO 59 HB2 PRO 59 -6.460 0.980 3.517
363 HB3 PRO 59 HB1 PRO 59 -6.402 -0.080 2.105
364 HG2 PRO 59 HG2 PRO 59 -6.255 -1.016 4.644
365 HG3 PRO 59 HG1 PRO 59 -5.496 -1.823 3.259
366 HD2 PRO 59 HD2 PRO 59 -4.245 -0.072 5.337
367 HD3 PRO 59 HD1 PRO 59 -3.624 -1.561 4.589
368 H LYS 60 HN LYS 60 -3.511 2.810 1.271
369 HA LYS 60 HA LYS 60 -3.975 4.704 3.470
370 HB2 LYS 60 HB2 LYS 60 -1.917 4.756 1.265
371 HB3 LYS 60 HB1 LYS 60 -2.140 6.034 2.452
372 HG2 LYS 60 HG2 LYS 60 -1.579 4.514 4.247
373 HG3 LYS 60 HG1 LYS 60 -1.432 3.184 3.100
374 HD2 LYS 60 HD2 LYS 60 0.432 4.292 2.015
375 HD3 LYS 60 HD1 LYS 60 0.253 5.681 3.087
376 HE2 LYS 60 HE2 LYS 60 0.915 2.875 3.966
377 HE3 LYS 60 HE1 LYS 60 2.076 4.186 3.793
378 HZ1 LYS 60 HZ1 LYS 60 0.703 5.427 5.461
379 HZ2 LYS 60 HZ2 LYS 60 1.508 4.064 6.063
380 HZ3 LYS 60 HZ3 LYS 60 -0.155 3.990 5.741
381 H ARG 61 HN ARG 61 -4.443 6.891 2.981
382 HA ARG 61 HA ARG 61 -5.946 7.257 0.473
383 HB2 ARG 61 HB2 ARG 61 -7.551 8.630 1.753
384 HB3 ARG 61 HB1 ARG 61 -7.515 6.963 2.308
385 HG2 ARG 61 HG2 ARG 61 -6.129 7.608 4.205
386 HG3 ARG 61 HG1 ARG 61 -6.118 9.279 3.638
387 HD2 ARG 61 HD2 ARG 61 -8.639 9.213 3.802
388 HD3 ARG 61 HD1 ARG 61 -8.455 7.678 4.651
389 HE ARG 61 HE ARG 61 -6.827 9.410 6.005
390 HH11 ARG 61 HH11 ARG 61 -10.245 9.315 5.137
391 HH12 ARG 61 HH12 ARG 61 -10.741 10.295 6.573
392 HH21 ARG 61 HH21 ARG 61 -7.427 10.654 7.827
393 HH22 ARG 61 HH22 ARG 61 -9.170 11.062 8.063
394 H GLY 62 HN GLY 62 -6.553 9.840 0.558
395 HA2 GLY 62 HA2 GLY 62 -5.771 11.985 0.356
396 HA3 GLY 62 HA1 GLY 62 -4.540 11.576 1.542
397 H LYS 63 HN LYS 63 -2.965 12.726 0.454
398 HA LYS 63 HA LYS 63 -2.295 11.945 -2.269
399 HB2 LYS 63 HB2 LYS 63 -0.488 13.720 -1.971
400 HB3 LYS 63 HB1 LYS 63 -2.156 14.275 -1.977
401 HG2 LYS 63 HG2 LYS 63 -2.129 14.390 0.463
402 HG3 LYS 63 HG1 LYS 63 -0.453 13.834 0.473
403 HD2 LYS 63 HD2 LYS 63 -1.339 16.301 -1.001
404 HD3 LYS 63 HD1 LYS 63 -0.832 16.334 0.687
405 HE2 LYS 63 HE2 LYS 63 1.342 15.479 0.090
406 HE3 LYS 63 HE1 LYS 63 0.843 15.288 -1.588
407 HZ1 LYS 63 HZ1 LYS 63 2.114 17.438 -0.620
408 HZ2 LYS 63 HZ2 LYS 63 0.506 17.951 -0.525
409 HZ3 LYS 63 HZ3 LYS 63 1.145 17.451 -2.004
410 HA PRO 64 HA PRO 64 0.641 9.007 -0.733
411 HB2 PRO 64 HB2 PRO 64 1.659 8.231 -3.104
412 HB3 PRO 64 HB1 PRO 64 0.034 7.765 -2.579
413 HG2 PRO 64 HG2 PRO 64 0.846 9.910 -4.484
414 HG3 PRO 64 HG1 PRO 64 -0.511 8.773 -4.585
415 HD2 PRO 64 HD2 PRO 64 -0.771 11.365 -3.759
416 HD3 PRO 64 HD1 PRO 64 -1.857 10.053 -3.257
417 H GLN 65 HN GLN 65 2.753 8.982 -0.201
418 HA GLN 65 HA GLN 65 4.506 11.013 -1.401
419 HB2 GLN 65 HB2 GLN 65 4.225 10.119 1.465
420 HB3 GLN 65 HB1 GLN 65 5.704 10.871 0.885
421 HG2 GLN 65 HG2 GLN 65 4.819 12.898 0.988
422 HG3 GLN 65 HG1 GLN 65 3.374 12.391 0.115
423 HE21 GLN 65 HE21 GLN 65 1.533 11.883 1.241
424 HE22 GLN 65 HE22 GLN 65 1.373 12.129 2.946
425 H PHE 66 HN PHE 66 5.227 9.565 -2.918
426 HA PHE 66 HA PHE 66 6.078 6.934 -2.391
427 HB2 PHE 66 HB2 PHE 66 6.884 8.720 -4.684
428 HB3 PHE 66 HB1 PHE 66 6.974 6.964 -4.643
429 HD1 PHE 66 HD1 PHE 66 4.635 5.803 -4.055
430 HD2 PHE 66 HD2 PHE 66 5.123 9.662 -5.789
431 HE1 PHE 66 HE1 PHE 66 2.367 5.663 -4.991
432 HE2 PHE 66 HE2 PHE 66 2.852 9.527 -6.727
433 HZ PHE 66 HZ PHE 66 1.470 7.526 -6.329
434 H TYR 67 HN TYR 67 7.857 6.156 -1.571
435 HA TYR 67 HA TYR 67 10.344 7.666 -1.814
436 HB2 TYR 67 HB2 TYR 67 10.970 7.381 0.468
437 HB3 TYR 67 HB1 TYR 67 9.354 8.067 0.471
438 HD1 TYR 67 HD2 TYR 67 7.425 6.684 1.161
439 HD2 TYR 67 HD1 TYR 67 11.412 5.209 1.361
440 HE1 TYR 67 HE2 TYR 67 6.680 4.897 2.680
441 HE2 TYR 67 HE1 TYR 67 10.680 3.423 2.882
442 HH TYR 67 HH TYR 67 7.928 2.285 3.210
443 H LYS 68 HN LYS 68 12.117 6.428 -2.164
444 HA LYS 68 HA LYS 68 11.693 3.820 -3.199
445 HB2 LYS 68 HB2 LYS 68 13.405 5.542 -3.955
446 HB3 LYS 68 HB1 LYS 68 14.356 5.069 -2.555
447 HG2 LYS 68 HG2 LYS 68 15.303 3.630 -3.979
448 HG3 LYS 68 HG1 LYS 68 13.866 2.657 -3.670
449 HD2 LYS 68 HD2 LYS 68 13.977 4.692 -5.881
450 HD3 LYS 68 HD1 LYS 68 14.513 3.025 -6.107
451 HE2 LYS 68 HE2 LYS 68 12.240 2.331 -5.225
452 HE3 LYS 68 HE1 LYS 68 11.763 4.016 -5.415
453 HZ1 LYS 68 HZ1 LYS 68 12.969 2.582 -7.676
454 HZ2 LYS 68 HZ2 LYS 68 11.906 3.895 -7.690
455 HZ3 LYS 68 HZ3 LYS 68 11.334 2.347 -7.316
456 H TYR 69 HN TYR 69 11.628 1.941 -2.153
457 HA TYR 69 HA TYR 69 13.461 1.385 0.005
458 HB2 TYR 69 HB2 TYR 69 11.670 2.491 1.250
459 HB3 TYR 69 HB1 TYR 69 10.481 1.415 0.527
460 HD1 TYR 69 HD1 TYR 69 13.490 1.426 2.717
461 HD2 TYR 69 HD2 TYR 69 9.942 -0.606 1.564
462 HE1 TYR 69 HE1 TYR 69 13.802 -0.160 4.573
463 HE2 TYR 69 HE2 TYR 69 10.241 -2.199 3.407
464 HH TYR 69 HH TYR 69 12.645 -1.724 5.877
465 H LEU 70 HN LEU 70 14.152 -0.623 -0.318
466 HA LEU 70 HA LEU 70 12.868 -2.408 -2.125
467 HB2 LEU 70 HB2 LEU 70 15.177 -2.739 -0.221
468 HB3 LEU 70 HB1 LEU 70 14.600 -4.048 -1.231
469 HG LEU 70 HG LEU 70 15.703 -1.422 -2.233
470 HD11 LEU 70 HD11 LEU 70 17.574 -2.824 -3.030
471 HD12 LEU 70 HD12 LEU 70 16.878 -4.198 -2.173
472 HD13 LEU 70 HD13 LEU 70 17.448 -2.793 -1.273
473 HD21 LEU 70 HD21 LEU 70 15.689 -2.633 -4.431
474 HD22 LEU 70 HD22 LEU 70 14.095 -2.213 -3.804
475 HD23 LEU 70 HD23 LEU 70 14.691 -3.868 -3.668
476 H GLY 71 HN GLY 71 10.914 -3.153 -1.539
477 HA2 GLY 71 HA2 GLY 71 10.226 -5.261 -0.232
478 HA3 GLY 71 HA1 GLY 71 10.590 -4.262 1.166
479 H ASP 72 HN ASP 72 9.575 -1.875 -0.358
480 HA ASP 72 HA ASP 72 6.774 -2.256 0.356
481 HB2 ASP 72 HB2 ASP 72 8.565 0.103 0.024
482 HB3 ASP 72 HB1 ASP 72 6.846 0.332 -0.274
483 H MET 73 HN MET 73 5.280 -2.630 -1.133
484 HA MET 73 HA MET 73 5.868 -1.854 -3.916
485 HB2 MET 73 HB2 MET 73 4.530 -4.299 -2.792
486 HB3 MET 73 HB1 MET 73 4.220 -3.776 -4.442
487 HG2 MET 73 HG2 MET 73 6.561 -3.998 -4.992
488 HG3 MET 73 HG1 MET 73 6.941 -4.405 -3.322
489 HE1 MET 73 HE1 MET 73 4.764 -5.523 -6.423
490 HE2 MET 73 HE2 MET 73 3.671 -5.667 -5.047
491 HE3 MET 73 HE3 MET 73 4.227 -7.116 -5.888
492 H THR 74 HN THR 74 4.822 0.115 -3.860
493 HA THR 74 HA THR 74 2.066 0.245 -2.974
494 HB THR 74 HB THR 74 3.789 2.379 -4.254
495 HG1 THR 74 HG1 THR 74 4.627 1.920 -2.247
496 HG21 THR 74 HG21 THR 74 1.449 2.886 -4.587
497 HG22 THR 74 HG22 THR 74 2.086 3.936 -3.321
498 HG23 THR 74 HG23 THR 74 1.093 2.540 -2.894
499 H GLY 75 HN GLY 75 0.329 0.152 -4.214
500 HA2 GLY 75 HA2 GLY 75 0.696 0.195 -7.148
501 HA3 GLY 75 HA1 GLY 75 -0.394 -0.927 -6.338
502 H SER 76 HN SER 76 -1.181 0.914 -8.357
503 HA SER 76 HA SER 76 -2.343 3.237 -7.231
504 HB2 SER 76 HB2 SER 76 -3.792 2.989 -9.426
505 HB3 SER 76 HB1 SER 76 -2.086 3.423 -9.521
506 HG SER 76 HG SER 76 -3.220 1.426 -10.722
507 H ARG 77 HN ARG 77 -4.238 0.701 -8.785
508 HA ARG 77 HA ARG 77 -5.722 -0.178 -6.593
509 HB2 ARG 77 HB2 ARG 77 -6.519 2.221 -6.625
510 HB3 ARG 77 HB1 ARG 77 -7.207 1.904 -8.212
511 HG2 ARG 77 HG2 ARG 77 -8.738 0.315 -7.318
512 HG3 ARG 77 HG1 ARG 77 -7.938 0.350 -5.745
513 HD2 ARG 77 HD2 ARG 77 -9.946 1.654 -5.612
514 HD3 ARG 77 HD1 ARG 77 -8.560 2.739 -5.536
515 HE ARG 77 HE ARG 77 -9.864 2.327 -8.125
516 HH11 ARG 77 HH11 ARG 77 -9.188 4.383 -5.345
517 HH12 ARG 77 HH12 ARG 77 -9.756 5.877 -6.181
518 HH21 ARG 77 HH21 ARG 77 -10.572 4.229 -9.221
519 HH22 ARG 77 HH22 ARG 77 -10.541 5.794 -8.324
520 H THR 78 HN THR 78 -5.983 0.805 -9.965
521 HA THR 78 HA THR 78 -6.715 -1.939 -10.676
522 HB THR 78 HB THR 78 -8.724 -0.299 -10.599
523 HG1 THR 78 HG1 THR 78 -8.550 -1.404 -13.161
524 HG21 THR 78 HG21 THR 78 -7.434 0.601 -13.175
525 HG22 THR 78 HG22 THR 78 -7.681 1.586 -11.732
526 HG23 THR 78 HG23 THR 78 -9.068 1.004 -12.654
527 H CYS 79 HN CYS 79 -6.316 -2.337 -13.043
528 HA CYS 79 HA CYS 79 -4.206 -0.573 -14.071
529 HB2 CYS 79 HB2 CYS 79 -4.169 -3.584 -13.869
530 HB3 CYS 79 HB1 CYS 79 -3.109 -2.701 -14.962
531 H1 GAL 83 H1 GTP 1 6.127 2.160 8.601
532 H2 GAL 83 H2 GTP 1 5.483 4.329 6.541
533 H3 GAL 83 H3 GTP 1 3.762 2.313 8.031
534 H4 GAL 83 H4 GTP 1 3.378 1.443 5.765
535 H5 GAL 83 H5 GTP 1 5.161 0.537 7.152
536 H61 GAL 83 H61 GTP 1 5.356 0.605 4.211
537 H62 GAL 83 H62 GTP 1 5.436 -0.758 5.330
538 HO2 GAL 83 HO2 GTP 1 5.917 4.818 8.890
539 HO3 GAL 83 HO3 GTP 1 3.123 4.657 7.392
540 HO4 GAL 83 HO4 GTP 1 5.506 2.744 4.623
541 HO6 GAL 83 HO6 GTP 1 7.371 0.208 3.939
542 H1 NAG 84 H1 GCP 2 9.872 3.355 4.641
543 H2 NAG 84 H2 GCP 2 10.231 3.233 7.673
544 H3 NAG 84 H3 GCP 2 7.835 3.741 5.876
545 H4 NAG 84 H4 GCP 2 9.422 5.465 7.847
546 H5 NAG 84 H5 GCP 2 9.060 5.558 4.815
547 H61 NAG 84 H61 GCP 2 9.958 7.561 6.774
548 H62 NAG 84 H62 GCP 2 9.513 7.727 5.073
549 H81 NAG 84 HC23 GCP 2 10.162 -1.320 6.972
550 H82 NAG 84 HC21 GCP 2 8.888 -1.038 8.159
551 H83 NAG 84 HC22 GCP 2 8.594 -0.703 6.453
552 HN2 NAG 84 HN2 GCP 2 8.651 1.373 5.947
553 HO1 NAG 84 HO1 GCP 2 11.641 2.049 6.135
554 HO4 NAG 84 HO4 GCP 2 7.411 6.308 7.931
555 HO6 NAG 84 HO6 GCP 2 11.666 7.972 4.864