Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
580442 | 2mdi RC | 19487 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HT1 GLY 1 -12.729 1.910 2.726
2 H2 GLY 1 HT2 GLY 1 -13.078 0.710 3.872
3 H3 GLY 1 HT3 GLY 1 -11.832 0.469 2.748
4 HA2 GLY 1 HA1 GLY 1 -10.957 1.034 4.938
5 HA3 GLY 1 HA2 GLY 1 -10.528 2.222 3.715
6 H SER 2 HN SER 2 -10.491 2.807 6.445
7 HA SER 2 HA SER 2 -12.875 4.033 7.343
8 HB2 SER 2 HB2 SER 2 -10.098 4.838 8.200
9 HB3 SER 2 HB1 SER 2 -11.580 4.812 9.158
10 HG SER 2 HG SER 2 -11.338 2.738 9.512
11 H ASP 3 HN ASP 3 -9.945 5.341 5.831
12 HA ASP 3 HA ASP 3 -11.109 7.993 5.703
13 HB2 ASP 3 HB2 ASP 3 -8.457 6.948 4.689
14 HB3 ASP 3 HB1 ASP 3 -8.949 8.637 4.682
15 H LEU 4 HN LEU 4 -10.048 5.469 3.465
16 HA LEU 4 HA LEU 4 -11.630 6.749 1.354
17 HB2 LEU 4 HB2 LEU 4 -8.769 5.817 1.159
18 HB3 LEU 4 HB1 LEU 4 -9.773 6.134 -0.244
19 HG LEU 4 HG LEU 4 -8.984 8.164 1.846
20 HD11 LEU 4 HD11 LEU 4 -7.648 9.136 0.026
21 HD12 LEU 4 HD12 LEU 4 -8.075 7.765 -1.001
22 HD13 LEU 4 HD13 LEU 4 -7.108 7.513 0.452
23 HD21 LEU 4 HD21 LEU 4 -9.982 9.798 0.321
24 HD22 LEU 4 HD22 LEU 4 -11.180 8.639 0.900
25 HD23 LEU 4 HD23 LEU 4 -10.522 8.488 -0.729
26 HA PRO 5 HA PRO 5 -12.908 2.555 0.393
27 HB2 PRO 5 HB2 PRO 5 -13.719 3.016 -2.159
28 HB3 PRO 5 HB1 PRO 5 -14.682 3.490 -0.756
29 HG2 PRO 5 HG2 PRO 5 -12.864 5.155 -2.455
30 HG3 PRO 5 HG1 PRO 5 -14.472 5.547 -1.817
31 HD2 PRO 5 HD2 PRO 5 -12.200 6.454 -0.671
32 HD3 PRO 5 HD1 PRO 5 -13.655 6.074 0.271
33 HA PRO 6 HA PRO 6 -9.249 0.981 -1.262
34 HB2 PRO 6 HB2 PRO 6 -10.048 -1.341 -2.464
35 HB3 PRO 6 HB1 PRO 6 -9.916 -1.135 -0.713
36 HG2 PRO 6 HG2 PRO 6 -12.338 -1.000 -2.466
37 HG3 PRO 6 HG1 PRO 6 -12.148 -1.755 -0.873
38 HD2 PRO 6 HD2 PRO 6 -13.326 0.653 -1.190
39 HD3 PRO 6 HD1 PRO 6 -12.361 0.254 0.246
40 HA PRO 7 HA PRO 7 -9.066 2.194 -5.543
41 HB2 PRO 7 HB2 PRO 7 -6.230 2.093 -5.358
42 HB3 PRO 7 HB1 PRO 7 -7.259 3.510 -5.230
43 HG2 PRO 7 HG2 PRO 7 -5.747 2.476 -3.170
44 HG3 PRO 7 HG1 PRO 7 -7.171 3.508 -2.948
45 HD2 PRO 7 HD2 PRO 7 -6.951 0.521 -2.795
46 HD3 PRO 7 HD1 PRO 7 -7.865 1.638 -1.755
47 H SER 8 HN SER 8 -8.500 1.317 -7.541
48 HA SER 8 HA SER 8 -7.195 -1.287 -7.620
49 HB2 SER 8 HB2 SER 8 -7.396 -0.780 -10.167
50 HB3 SER 8 HB1 SER 8 -8.883 -1.099 -9.274
51 HG SER 8 HG SER 8 -8.125 1.131 -10.607
52 HA PRO 9 HA PRO 9 -3.336 0.500 -7.373
53 HB2 PRO 9 HB2 PRO 9 -1.693 -1.176 -8.730
54 HB3 PRO 9 HB1 PRO 9 -2.474 -1.611 -7.204
55 HG2 PRO 9 HG2 PRO 9 -3.258 -2.321 -10.004
56 HG3 PRO 9 HG1 PRO 9 -3.247 -3.337 -8.551
57 HD2 PRO 9 HD2 PRO 9 -5.508 -2.204 -9.544
58 HD3 PRO 9 HD1 PRO 9 -5.269 -2.528 -7.815
59 HA PRO 10 HA PRO 10 -2.107 2.809 -11.042
60 HB2 PRO 10 HB2 PRO 10 -0.699 4.601 -9.386
61 HB3 PRO 10 HB1 PRO 10 -2.335 4.814 -10.007
62 HG2 PRO 10 HG2 PRO 10 -1.612 4.467 -7.319
63 HG3 PRO 10 HG1 PRO 10 -3.248 4.353 -7.988
64 HD2 PRO 10 HD2 PRO 10 -1.319 2.181 -7.309
65 HD3 PRO 10 HD1 PRO 10 -3.091 2.199 -7.187
66 H ALA 11 HN ALA 11 -0.101 3.113 -12.090
67 HA ALA 11 HA ALA 11 2.104 1.485 -11.325
68 HB1 ALA 11 HB1 ALA 11 1.637 2.066 -13.660
69 HB2 ALA 11 HB2 ALA 11 3.271 2.532 -13.189
70 HB3 ALA 11 HB3 ALA 11 2.005 3.755 -13.311
71 H ALA 12 HN ALA 12 1.207 4.806 -10.846
72 HA ALA 12 HA ALA 12 3.671 5.836 -9.965
73 HB1 ALA 12 HB1 ALA 12 1.804 7.235 -10.719
74 HB2 ALA 12 HB2 ALA 12 2.393 7.716 -9.127
75 HB3 ALA 12 HB3 ALA 12 0.902 6.785 -9.272
76 H ALA 13 HN ALA 13 1.596 3.665 -8.462
77 HA ALA 13 HA ALA 13 1.319 4.606 -5.867
78 HB1 ALA 13 HB1 ALA 13 0.753 2.339 -5.243
79 HB2 ALA 13 HB2 ALA 13 1.468 1.729 -6.735
80 HB3 ALA 13 HB3 ALA 13 0.031 2.749 -6.799
81 H THR 14 HN THR 14 4.065 3.049 -7.317
82 HA THR 14 HA THR 14 5.183 2.077 -4.888
83 HB THR 14 HB THR 14 5.718 0.963 -6.970
84 HG1 THR 14 HG1 THR 14 7.661 2.031 -5.314
85 HG21 THR 14 HG21 THR 14 7.102 3.531 -7.746
86 HG22 THR 14 HG22 THR 14 5.647 2.869 -8.489
87 HG23 THR 14 HG23 THR 14 7.183 2.014 -8.644
88 H ILE 15 HN ILE 15 5.322 5.143 -6.504
89 HA ILE 15 HA ILE 15 7.779 6.135 -6.059
90 HB ILE 15 HB ILE 15 6.040 7.360 -7.213
91 HG12 ILE 15 HG12 ILE 15 6.544 9.619 -6.360
92 HG13 ILE 15 HG11 ILE 15 7.275 8.894 -4.929
93 HG21 ILE 15 HG21 ILE 15 4.137 6.949 -5.761
94 HG22 ILE 15 HG22 ILE 15 4.350 8.674 -6.059
95 HG23 ILE 15 HG23 ILE 15 4.848 7.977 -4.517
96 HD11 ILE 15 HD11 ILE 15 8.821 9.595 -6.819
97 HD12 ILE 15 HD12 ILE 15 8.156 8.210 -7.693
98 HD13 ILE 15 HD13 ILE 15 9.017 7.963 -6.175
99 H VAL 16 HN VAL 16 5.288 7.092 -3.661
100 HA VAL 16 HA VAL 16 7.212 6.533 -1.516
101 HB VAL 16 HB VAL 16 5.484 8.992 -1.500
102 HG11 VAL 16 HG11 VAL 16 8.080 8.654 -0.063
103 HG12 VAL 16 HG12 VAL 16 6.630 7.878 0.557
104 HG13 VAL 16 HG13 VAL 16 6.676 9.633 0.372
105 HG21 VAL 16 HG21 VAL 16 7.277 10.332 -2.301
106 HG22 VAL 16 HG22 VAL 16 7.049 9.009 -3.451
107 HG23 VAL 16 HG23 VAL 16 8.384 8.957 -2.301
108 H LEU 17 HN LEU 17 6.321 5.987 0.440
109 HA LEU 17 HA LEU 17 3.408 5.600 0.471
110 HB2 LEU 17 HB2 LEU 17 4.845 3.555 0.134
111 HB3 LEU 17 HB1 LEU 17 5.490 3.817 1.719
112 HG LEU 17 HG LEU 17 2.537 3.449 1.337
113 HD11 LEU 17 HD11 LEU 17 2.846 1.058 1.758
114 HD12 LEU 17 HD12 LEU 17 4.595 1.266 1.685
115 HD13 LEU 17 HD13 LEU 17 3.614 1.540 0.246
116 HD21 LEU 17 HD21 LEU 17 2.500 3.106 3.596
117 HD22 LEU 17 HD22 LEU 17 3.868 4.215 3.456
118 HD23 LEU 17 HD23 LEU 17 4.155 2.488 3.634
119 HA PRO 18 HA PRO 18 4.028 7.863 4.284
120 HB2 PRO 18 HB2 PRO 18 1.512 8.751 4.495
121 HB3 PRO 18 HB1 PRO 18 2.592 9.336 3.227
122 HG2 PRO 18 HG2 PRO 18 0.271 7.525 3.026
123 HG3 PRO 18 HG1 PRO 18 1.009 8.548 1.784
124 HD2 PRO 18 HD2 PRO 18 1.404 5.725 2.250
125 HD3 PRO 18 HD1 PRO 18 2.090 6.736 0.962
126 HA PRO 19 HA PRO 19 2.807 5.107 7.621
127 HB2 PRO 19 HB2 PRO 19 2.723 7.737 8.984
128 HB3 PRO 19 HB1 PRO 19 3.472 6.250 9.514
129 HG2 PRO 19 HG2 PRO 19 5.002 8.101 8.588
130 HG3 PRO 19 HG1 PRO 19 5.226 6.456 7.960
131 HD2 PRO 19 HD2 PRO 19 3.764 8.761 6.718
132 HD3 PRO 19 HD1 PRO 19 4.925 7.647 5.982
133 H ASN 20 HN ASN 20 1.104 7.892 6.622
134 HA ASN 20 HA ASN 20 -1.273 7.701 8.094
135 HB2 ASN 20 HB2 ASN 20 -0.858 8.698 5.276
136 HB3 ASN 20 HB1 ASN 20 -2.315 8.943 6.225
137 HD21 ASN 20 HD21 ASN 20 -2.191 11.112 6.100
138 HD22 ASN 20 HD22 ASN 20 -0.991 12.042 6.916
139 H TRP 21 HN TRP 21 -0.055 5.451 5.901
140 HA TRP 21 HA TRP 21 -2.388 5.083 4.320
141 HB2 TRP 21 HB2 TRP 21 -1.091 3.737 3.018
142 HB3 TRP 21 HB1 TRP 21 0.206 4.546 3.882
143 HD1 TRP 21 HD1 TRP 21 -1.050 1.192 3.050
144 HE1 TRP 21 HE1 TRP 21 0.176 -0.619 4.399
145 HE3 TRP 21 HE3 TRP 21 1.253 4.162 6.527
146 HZ2 TRP 21 HZ2 TRP 21 1.879 -0.780 6.624
147 HZ3 TRP 21 HZ3 TRP 21 2.665 3.089 8.232
148 HH2 TRP 21 HH2 TRP 21 2.969 0.668 8.278
149 H LYS 22 HN LYS 22 -3.556 3.153 4.165
150 HA LYS 22 HA LYS 22 -3.869 1.781 6.749
151 HB2 LYS 22 HB2 LYS 22 -6.028 2.459 4.761
152 HB3 LYS 22 HB1 LYS 22 -6.248 1.615 6.275
153 HG2 LYS 22 HG2 LYS 22 -5.277 4.442 6.034
154 HG3 LYS 22 HG1 LYS 22 -6.933 3.957 6.405
155 HD2 LYS 22 HD2 LYS 22 -5.481 2.521 8.230
156 HD3 LYS 22 HD1 LYS 22 -4.571 4.029 8.119
157 HE2 LYS 22 HE2 LYS 22 -6.469 5.313 8.644
158 HE3 LYS 22 HE1 LYS 22 -7.528 3.914 8.523
159 HZ1 LYS 22 HZ1 LYS 22 -6.310 2.956 10.435
160 HZ2 LYS 22 HZ2 LYS 22 -7.146 4.379 10.816
161 HZ3 LYS 22 HZ3 LYS 22 -5.467 4.417 10.603
162 H THR 23 HN THR 23 -5.141 -0.291 6.426
163 HA THR 23 HA THR 23 -4.185 -1.686 4.031
164 HB THR 23 HB THR 23 -3.876 -3.681 5.621
165 HG1 THR 23 HG1 THR 23 -4.118 -3.301 7.689
166 HG21 THR 23 HG21 THR 23 -2.169 -1.321 5.266
167 HG22 THR 23 HG22 THR 23 -1.890 -2.989 4.774
168 HG23 THR 23 HG23 THR 23 -1.643 -2.505 6.455
169 H ALA 24 HN ALA 24 -5.400 -3.425 3.336
170 HA ALA 24 HA ALA 24 -7.720 -4.272 4.838
171 HB1 ALA 24 HB1 ALA 24 -9.358 -3.488 3.522
172 HB2 ALA 24 HB2 ALA 24 -8.410 -3.743 2.065
173 HB3 ALA 24 HB3 ALA 24 -8.160 -2.286 3.027
174 H ARG 25 HN ARG 25 -8.709 -6.145 3.870
175 HA ARG 25 HA ARG 25 -6.947 -7.617 2.056
176 HB2 ARG 25 HB2 ARG 25 -6.234 -8.502 4.087
177 HB3 ARG 25 HB1 ARG 25 -7.819 -8.410 4.787
178 HG2 ARG 25 HG2 ARG 25 -8.403 -10.226 3.004
179 HG3 ARG 25 HG1 ARG 25 -6.658 -10.486 3.025
180 HD2 ARG 25 HD2 ARG 25 -7.712 -11.983 4.593
181 HD3 ARG 25 HD1 ARG 25 -6.766 -10.781 5.474
182 HE ARG 25 HE ARG 25 -9.414 -9.862 5.225
183 HH11 ARG 25 HH11 ARG 25 -7.563 -12.309 6.931
184 HH12 ARG 25 HH12 ARG 25 -8.705 -12.428 8.237
185 HH21 ARG 25 HH21 ARG 25 -10.887 -10.011 6.948
186 HH22 ARG 25 HH22 ARG 25 -10.569 -11.098 8.267
187 H ASP 26 HN ASP 26 -7.959 -9.209 0.854
188 HA ASP 26 HA ASP 26 -10.784 -8.714 0.350
189 HB2 ASP 26 HB2 ASP 26 -8.992 -10.734 -1.019
190 HB3 ASP 26 HB1 ASP 26 -10.552 -10.160 -1.572
191 HA PRO 27 HA PRO 27 -12.542 -12.224 2.293
192 HB2 PRO 27 HB2 PRO 27 -14.000 -13.267 0.181
193 HB3 PRO 27 HB1 PRO 27 -14.535 -11.942 1.208
194 HG2 PRO 27 HG2 PRO 27 -13.153 -11.814 -1.416
195 HG3 PRO 27 HG1 PRO 27 -14.582 -10.914 -0.873
196 HD2 PRO 27 HD2 PRO 27 -12.227 -9.753 -0.848
197 HD3 PRO 27 HD1 PRO 27 -13.294 -9.557 0.553
198 H GLU 28 HN GLU 28 -10.813 -12.469 -0.701
199 HA GLU 28 HA GLU 28 -10.450 -15.347 -0.400
200 HB2 GLU 28 HB2 GLU 28 -9.836 -13.451 -2.661
201 HB3 GLU 28 HB1 GLU 28 -9.424 -15.164 -2.683
202 HG2 GLU 28 HG2 GLU 28 -11.662 -15.823 -2.676
203 HG3 GLU 28 HG1 GLU 28 -12.217 -14.232 -2.169
204 H GLY 29 HN GLY 29 -9.219 -13.773 1.509
205 HA2 GLY 29 HA2 GLY 29 -7.307 -13.920 2.722
206 HA3 GLY 29 HA1 GLY 29 -6.842 -15.210 1.642
207 H LYS 30 HN LYS 30 -7.212 -12.174 0.025
208 HA LYS 30 HA LYS 30 -4.294 -11.914 0.063
209 HB2 LYS 30 HB2 LYS 30 -5.359 -11.939 -2.151
210 HB3 LYS 30 HB1 LYS 30 -6.312 -10.529 -1.714
211 HG2 LYS 30 HG2 LYS 30 -4.403 -9.136 -1.650
212 HG3 LYS 30 HG1 LYS 30 -3.309 -10.513 -1.721
213 HD2 LYS 30 HD2 LYS 30 -3.238 -9.674 -3.885
214 HD3 LYS 30 HD1 LYS 30 -4.402 -10.989 -4.006
215 HE2 LYS 30 HE2 LYS 30 -5.130 -8.083 -3.648
216 HE3 LYS 30 HE1 LYS 30 -5.081 -8.916 -5.201
217 HZ1 LYS 30 HZ1 LYS 30 -6.697 -10.539 -4.030
218 HZ2 LYS 30 HZ2 LYS 30 -7.278 -9.071 -4.636
219 HZ3 LYS 30 HZ3 LYS 30 -6.979 -9.234 -2.974
220 H ILE 31 HN ILE 31 -3.257 -10.239 0.966
221 HA ILE 31 HA ILE 31 -4.900 -8.192 2.329
222 HB ILE 31 HB ILE 31 -3.695 -9.569 3.935
223 HG12 ILE 31 HG12 ILE 31 -2.399 -7.861 5.086
224 HG13 ILE 31 HG11 ILE 31 -2.294 -6.922 3.625
225 HG21 ILE 31 HG21 ILE 31 -1.846 -10.561 3.173
226 HG22 ILE 31 HG22 ILE 31 -1.059 -9.079 3.723
227 HG23 ILE 31 HG23 ILE 31 -1.505 -9.261 2.029
228 HD11 ILE 31 HD11 ILE 31 -3.926 -5.982 5.118
229 HD12 ILE 31 HD12 ILE 31 -4.762 -7.529 5.206
230 HD13 ILE 31 HD13 ILE 31 -4.737 -6.631 3.691
231 H TYR 32 HN TYR 32 -4.309 -6.027 2.029
232 HA TYR 32 HA TYR 32 -1.918 -5.433 0.492
233 HB2 TYR 32 HB2 TYR 32 -3.101 -4.199 -1.267
234 HB3 TYR 32 HB1 TYR 32 -3.516 -5.907 -1.278
235 HD1 TYR 32 HD2 TYR 32 -5.756 -6.641 -0.627
236 HD2 TYR 32 HD1 TYR 32 -4.744 -2.512 -0.769
237 HE1 TYR 32 HE2 TYR 32 -8.144 -6.063 -0.618
238 HE2 TYR 32 HE1 TYR 32 -7.131 -1.919 -0.765
239 HH TYR 32 HH TYR 32 -9.318 -3.085 -1.459
240 H TYR 33 HN TYR 33 -1.973 -2.942 -0.054
241 HA TYR 33 HA TYR 33 -2.839 -1.508 2.362
242 HB2 TYR 33 HB2 TYR 33 -0.336 -0.680 1.003
243 HB3 TYR 33 HB1 TYR 33 -0.748 -0.668 2.704
244 HD1 TYR 33 HD2 TYR 33 -0.751 -2.939 3.942
245 HD2 TYR 33 HD1 TYR 33 1.066 -2.336 0.145
246 HE1 TYR 33 HE2 TYR 33 0.607 -4.961 4.276
247 HE2 TYR 33 HE1 TYR 33 2.430 -4.353 0.471
248 HH TYR 33 HH TYR 33 3.282 -5.716 2.384
249 H TYR 34 HN TYR 34 -3.322 0.725 2.045
250 HA TYR 34 HA TYR 34 -3.149 1.713 -0.693
251 HB2 TYR 34 HB2 TYR 34 -5.479 2.701 -0.464
252 HB3 TYR 34 HB1 TYR 34 -5.373 0.976 -0.768
253 HD1 TYR 34 HD1 TYR 34 -5.916 -0.631 1.016
254 HD2 TYR 34 HD2 TYR 34 -6.430 3.555 1.573
255 HE1 TYR 34 HE1 TYR 34 -7.375 -1.072 2.940
256 HE2 TYR 34 HE2 TYR 34 -7.892 3.121 3.504
257 HH TYR 34 HH TYR 34 -8.188 -0.006 4.917
258 H HIS 35 HN HIS 35 -2.903 3.858 -0.958
259 HA HIS 35 HA HIS 35 -1.927 5.212 1.443
260 HB2 HIS 35 HB2 HIS 35 -1.570 5.944 -1.482
261 HB3 HIS 35 HB1 HIS 35 -0.716 6.640 -0.124
262 HD1 HIS 35 HD1 HIS 35 0.944 5.545 -2.377
263 HD2 HIS 35 HD2 HIS 35 -0.290 3.202 0.840
264 HE1 HIS 35 HE1 HIS 35 2.546 3.616 -2.288
265 HE2 HIS 35 HE2 HIS 35 1.878 2.304 -0.248
266 H VAL 36 HN VAL 36 -3.219 6.607 2.351
267 HA VAL 36 HA VAL 36 -5.637 7.471 1.192
268 HB VAL 36 HB VAL 36 -5.725 8.855 3.334
269 HG11 VAL 36 HG11 VAL 36 -5.151 5.954 3.836
270 HG12 VAL 36 HG12 VAL 36 -6.550 6.450 2.891
271 HG13 VAL 36 HG13 VAL 36 -6.390 6.978 4.567
272 HG21 VAL 36 HG21 VAL 36 -3.404 9.123 3.794
273 HG22 VAL 36 HG22 VAL 36 -3.120 7.379 3.686
274 HG23 VAL 36 HG23 VAL 36 -4.046 8.050 5.042
275 H ILE 37 HN ILE 37 -2.515 9.126 1.728
276 HA ILE 37 HA ILE 37 -3.386 11.698 1.032
277 HB ILE 37 HB ILE 37 -0.697 10.375 0.953
278 HG12 ILE 37 HG12 ILE 37 -0.273 12.369 2.545
279 HG13 ILE 37 HG11 ILE 37 -2.027 12.493 2.560
280 HG21 ILE 37 HG21 ILE 37 0.341 12.509 0.323
281 HG22 ILE 37 HG22 ILE 37 -1.261 13.198 0.050
282 HG23 ILE 37 HG23 ILE 37 -0.686 11.875 -0.965
283 HD11 ILE 37 HD11 ILE 37 -0.616 9.956 3.231
284 HD12 ILE 37 HD12 ILE 37 -2.285 10.422 3.551
285 HD13 ILE 37 HD13 ILE 37 -0.974 11.198 4.428
286 H THR 38 HN THR 38 -1.699 9.283 -0.891
287 HA THR 38 HA THR 38 -1.931 10.879 -3.258
288 HB THR 38 HB THR 38 -0.580 8.943 -4.239
289 HG1 THR 38 HG1 THR 38 0.469 8.037 -2.042
290 HG21 THR 38 HG21 THR 38 0.394 10.559 -1.893
291 HG22 THR 38 HG22 THR 38 0.421 11.047 -3.591
292 HG23 THR 38 HG23 THR 38 1.455 9.728 -3.034
293 H ARG 39 HN ARG 39 -3.727 8.297 -1.931
294 HA ARG 39 HA ARG 39 -5.492 7.075 -2.674
295 HB2 ARG 39 HB2 ARG 39 -5.269 9.058 -4.889
296 HB3 ARG 39 HB1 ARG 39 -6.244 7.636 -5.151
297 HG2 ARG 39 HG2 ARG 39 -7.764 9.204 -4.437
298 HG3 ARG 39 HG1 ARG 39 -7.406 8.294 -2.964
299 HD2 ARG 39 HD2 ARG 39 -5.695 9.979 -2.436
300 HD3 ARG 39 HD1 ARG 39 -6.243 10.932 -3.803
301 HE ARG 39 HE ARG 39 -8.519 10.493 -2.368
302 HH11 ARG 39 HH11 ARG 39 -5.392 11.894 -1.570
303 HH12 ARG 39 HH12 ARG 39 -6.059 12.999 -0.405
304 HH21 ARG 39 HH21 ARG 39 -9.361 11.945 -0.833
305 HH22 ARG 39 HH22 ARG 39 -8.297 13.032 0.000
306 H GLN 40 HN GLN 40 -3.028 5.919 -2.786
307 HA GLN 40 HA GLN 40 -2.977 4.471 -5.345
308 HB2 GLN 40 HB2 GLN 40 -0.761 4.920 -3.394
309 HB3 GLN 40 HB1 GLN 40 -0.605 4.152 -4.957
310 HG2 GLN 40 HG2 GLN 40 -1.109 6.235 -6.025
311 HG3 GLN 40 HG1 GLN 40 -1.385 7.008 -4.478
312 HE21 GLN 40 HE21 GLN 40 0.456 7.676 -6.607
313 HE22 GLN 40 HE22 GLN 40 2.034 7.613 -5.912
314 H THR 41 HN THR 41 -2.059 2.177 -5.071
315 HA THR 41 HA THR 41 -2.331 1.046 -2.449
316 HB THR 41 HB THR 41 -4.606 0.890 -2.911
317 HG1 THR 41 HG1 THR 41 -3.744 -1.116 -2.219
318 HG21 THR 41 HG21 THR 41 -4.518 1.490 -5.214
319 HG22 THR 41 HG22 THR 41 -5.496 0.033 -5.024
320 HG23 THR 41 HG23 THR 41 -3.847 -0.080 -5.652
321 H GLN 42 HN GLN 42 -1.319 -0.920 -2.198
322 HA GLN 42 HA GLN 42 -0.312 -2.316 -4.571
323 HB2 GLN 42 HB2 GLN 42 1.406 -1.718 -2.148
324 HB3 GLN 42 HB1 GLN 42 1.901 -2.558 -3.611
325 HG2 GLN 42 HG2 GLN 42 1.507 -0.466 -4.877
326 HG3 GLN 42 HG1 GLN 42 1.179 0.349 -3.352
327 HE21 GLN 42 HE21 GLN 42 3.216 -1.226 -1.931
328 HE22 GLN 42 HE22 GLN 42 4.739 -0.579 -2.422
329 H TRP 43 HN TRP 43 -0.759 -4.457 -4.390
330 HA TRP 43 HA TRP 43 -1.475 -5.496 -1.747
331 HB2 TRP 43 HB2 TRP 43 -1.701 -7.577 -3.599
332 HB3 TRP 43 HB1 TRP 43 -3.001 -6.633 -2.898
333 HD1 TRP 43 HD1 TRP 43 -3.856 -4.486 -4.415
334 HE1 TRP 43 HE1 TRP 43 -3.943 -4.239 -6.973
335 HE3 TRP 43 HE3 TRP 43 -0.592 -8.204 -5.696
336 HZ2 TRP 43 HZ2 TRP 43 -2.789 -5.467 -9.236
337 HZ3 TRP 43 HZ3 TRP 43 -0.146 -8.609 -8.078
338 HH2 TRP 43 HH2 TRP 43 -1.223 -7.267 -9.811
339 H ASP 44 HN ASP 44 0.766 -6.062 -4.352
340 HA ASP 44 HA ASP 44 2.026 -8.250 -2.908
341 HB2 ASP 44 HB2 ASP 44 1.497 -8.573 -5.259
342 HB3 ASP 44 HB1 ASP 44 2.482 -7.182 -5.695
343 HA PRO 45 HA PRO 45 5.810 -5.214 -3.458
344 HB2 PRO 45 HB2 PRO 45 4.476 -2.583 -3.425
345 HB3 PRO 45 HB1 PRO 45 5.803 -3.160 -4.439
346 HG2 PRO 45 HG2 PRO 45 3.351 -2.797 -5.439
347 HG3 PRO 45 HG1 PRO 45 4.380 -4.143 -5.971
348 HD2 PRO 45 HD2 PRO 45 2.092 -4.155 -4.039
349 HD3 PRO 45 HD1 PRO 45 2.490 -5.322 -5.318
350 HA PRO 46 HA PRO 46 5.599 -5.021 0.974
351 HB2 PRO 46 HB2 PRO 46 8.218 -4.034 1.148
352 HB3 PRO 46 HB1 PRO 46 7.696 -5.716 1.267
353 HG2 PRO 46 HG2 PRO 46 8.878 -4.263 -1.011
354 HG3 PRO 46 HG1 PRO 46 8.928 -5.984 -0.609
355 HD2 PRO 46 HD2 PRO 46 7.409 -4.969 -2.615
356 HD3 PRO 46 HD1 PRO 46 6.980 -6.435 -1.713
357 H THR 47 HN THR 47 5.856 -3.486 2.684
358 HA THR 47 HA THR 47 4.722 -1.051 2.304
359 HB THR 47 HB THR 47 5.980 -0.819 4.669
360 HG1 THR 47 HG1 THR 47 7.117 -2.631 4.868
361 HG21 THR 47 HG21 THR 47 3.561 -0.987 4.048
362 HG22 THR 47 HG22 THR 47 3.991 -1.630 5.627
363 HG23 THR 47 HG23 THR 47 3.701 -2.722 4.267
364 H TRP 48 HN TRP 48 5.827 0.870 3.537
365 HA TRP 48 HA TRP 48 7.871 1.907 1.863
366 HB2 TRP 48 HB2 TRP 48 6.155 3.279 3.166
367 HB3 TRP 48 HB1 TRP 48 7.148 2.968 4.577
368 HD1 TRP 48 HD1 TRP 48 7.724 4.415 1.021
369 HE1 TRP 48 HE1 TRP 48 9.404 6.359 1.212
370 HE3 TRP 48 HE3 TRP 48 8.644 4.187 6.044
371 HZ2 TRP 48 HZ2 TRP 48 10.910 7.629 3.237
372 HZ3 TRP 48 HZ3 TRP 48 10.217 5.801 7.030
373 HH2 TRP 48 HH2 TRP 48 11.327 7.486 5.653
374 H GLU 49 HN GLU 49 7.710 0.285 4.924
375 HA GLU 49 HA GLU 49 10.636 0.436 5.069
376 HB2 GLU 49 HB2 GLU 49 8.611 0.000 7.251
377 HB3 GLU 49 HB1 GLU 49 10.348 -0.226 7.467
378 HG2 GLU 49 HG2 GLU 49 10.622 2.088 6.593
379 HG3 GLU 49 HG1 GLU 49 8.884 2.288 6.794
380 H SER 50 HN SER 50 11.708 -1.190 4.591
381 HA SER 50 HA SER 50 10.729 -3.914 4.997
382 HB2 SER 50 HB2 SER 50 11.932 -2.933 2.386
383 HB3 SER 50 HB1 SER 50 11.370 -4.569 2.733
384 HG SER 50 HG SER 50 9.852 -2.209 2.402
385 HA PRO 51 HA PRO 51 14.826 -4.756 6.392
386 HB2 PRO 51 HB2 PRO 51 15.637 -6.892 4.822
387 HB3 PRO 51 HB1 PRO 51 14.680 -7.008 6.300
388 HG2 PRO 51 HG2 PRO 51 13.790 -7.074 3.455
389 HG3 PRO 51 HG1 PRO 51 13.170 -7.975 4.850
390 HD2 PRO 51 HD2 PRO 51 11.875 -5.849 3.825
391 HD3 PRO 51 HD1 PRO 51 11.861 -6.207 5.563
392 H GLY 52 HN GLY 52 17.170 -5.283 5.554
393 HA2 GLY 52 HA2 GLY 52 17.882 -3.065 3.937
394 HA3 GLY 52 HA1 GLY 52 18.979 -4.303 4.529
395 H ASP 53 HN ASP 53 17.655 -6.529 3.319
396 HA ASP 53 HA ASP 53 19.001 -6.534 0.842
397 HB2 ASP 53 HB2 ASP 53 16.899 -8.422 1.918
398 HB3 ASP 53 HB1 ASP 53 17.854 -8.718 0.470
399 H ASP 54 HN ASP 54 15.687 -5.847 1.716
400 HA ASP 54 HA ASP 54 14.688 -5.931 -0.974
401 HB2 ASP 54 HB2 ASP 54 13.384 -6.170 1.288
402 HB3 ASP 54 HB1 ASP 54 13.340 -4.410 1.242
403 H ALA 55 HN ALA 55 15.878 -3.469 1.242
404 HA ALA 55 HA ALA 55 16.700 -1.382 0.909
405 HB1 ALA 55 HB1 ALA 55 16.912 -2.277 -1.963
406 HB2 ALA 55 HB2 ALA 55 18.132 -2.508 -0.711
407 HB3 ALA 55 HB3 ALA 55 17.723 -0.881 -1.255
408 H SER 56 HN SER 56 14.395 -0.826 1.431
409 HA SER 56 HA SER 56 12.940 0.369 -0.789
410 HB2 SER 56 HB2 SER 56 11.279 0.842 1.161
411 HB3 SER 56 HB1 SER 56 11.480 -0.815 0.594
412 HG SER 56 HG SER 56 12.483 0.402 2.937
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 -11.765 -2.020 4.330
2 H2 GLY 1 HT2 GLY 1 -10.998 -2.041 2.821
3 H3 GLY 1 HT3 GLY 1 -12.299 -0.990 3.093
4 HA2 GLY 1 HA1 GLY 1 -9.604 -0.853 4.326
5 HA3 GLY 1 HA2 GLY 1 -10.292 0.279 3.170
6 H SER 2 HN SER 2 -9.423 0.154 6.207
7 HA SER 2 HA SER 2 -11.712 0.958 7.670
8 HB2 SER 2 HB2 SER 2 -8.869 1.639 8.380
9 HB3 SER 2 HB1 SER 2 -10.229 1.353 9.466
10 HG SER 2 HG SER 2 -10.099 -0.795 9.115
11 H ASP 3 HN ASP 3 -9.084 2.750 6.109
12 HA ASP 3 HA ASP 3 -10.182 5.276 7.054
13 HB2 ASP 3 HB2 ASP 3 -7.684 4.678 6.919
14 HB3 ASP 3 HB1 ASP 3 -7.841 4.948 5.188
15 H LEU 4 HN LEU 4 -9.508 3.659 3.980
16 HA LEU 4 HA LEU 4 -11.508 5.360 2.685
17 HB2 LEU 4 HB2 LEU 4 -8.697 4.849 1.724
18 HB3 LEU 4 HB1 LEU 4 -9.970 5.433 0.670
19 HG LEU 4 HG LEU 4 -8.878 6.863 3.092
20 HD11 LEU 4 HD11 LEU 4 -8.618 7.427 0.144
21 HD12 LEU 4 HD12 LEU 4 -7.334 6.887 1.227
22 HD13 LEU 4 HD13 LEU 4 -8.056 8.483 1.440
23 HD21 LEU 4 HD21 LEU 4 -10.289 8.730 2.386
24 HD22 LEU 4 HD22 LEU 4 -11.253 7.313 2.805
25 HD23 LEU 4 HD23 LEU 4 -10.981 7.725 1.113
26 HA PRO 5 HA PRO 5 -12.850 1.553 0.701
27 HB2 PRO 5 HB2 PRO 5 -13.476 3.296 -1.611
28 HB3 PRO 5 HB1 PRO 5 -14.545 2.242 -0.682
29 HG2 PRO 5 HG2 PRO 5 -14.682 4.901 -0.449
30 HG3 PRO 5 HG1 PRO 5 -14.920 3.838 0.952
31 HD2 PRO 5 HD2 PRO 5 -12.513 5.439 0.171
32 HD3 PRO 5 HD1 PRO 5 -13.218 5.174 1.780
33 HA PRO 6 HA PRO 6 -9.243 0.454 -1.365
34 HB2 PRO 6 HB2 PRO 6 -10.719 -1.478 -3.026
35 HB3 PRO 6 HB1 PRO 6 -9.482 -1.764 -1.799
36 HG2 PRO 6 HG2 PRO 6 -12.058 -2.364 -1.357
37 HG3 PRO 6 HG1 PRO 6 -11.012 -1.746 -0.064
38 HD2 PRO 6 HD2 PRO 6 -13.072 -0.303 -1.690
39 HD3 PRO 6 HD1 PRO 6 -12.723 -0.186 0.050
40 HA PRO 7 HA PRO 7 -9.093 2.351 -5.408
41 HB2 PRO 7 HB2 PRO 7 -6.254 2.110 -5.269
42 HB3 PRO 7 HB1 PRO 7 -7.221 3.539 -4.947
43 HG2 PRO 7 HG2 PRO 7 -5.750 2.191 -3.055
44 HG3 PRO 7 HG1 PRO 7 -7.138 3.230 -2.689
45 HD2 PRO 7 HD2 PRO 7 -7.014 0.245 -2.933
46 HD3 PRO 7 HD1 PRO 7 -7.886 1.245 -1.748
47 H SER 8 HN SER 8 -8.520 1.741 -7.523
48 HA SER 8 HA SER 8 -7.498 -0.961 -7.936
49 HB2 SER 8 HB2 SER 8 -9.239 0.020 -9.463
50 HB3 SER 8 HB1 SER 8 -8.076 1.256 -9.941
51 HG SER 8 HG SER 8 -8.280 -0.650 -11.350
52 HA PRO 9 HA PRO 9 -3.500 0.510 -7.416
53 HB2 PRO 9 HB2 PRO 9 -1.958 -1.308 -8.685
54 HB3 PRO 9 HB1 PRO 9 -2.882 -1.686 -7.227
55 HG2 PRO 9 HG2 PRO 9 -3.512 -2.301 -10.082
56 HG3 PRO 9 HG1 PRO 9 -3.742 -3.305 -8.640
57 HD2 PRO 9 HD2 PRO 9 -5.750 -1.876 -9.854
58 HD3 PRO 9 HD1 PRO 9 -5.752 -2.328 -8.137
59 HA PRO 10 HA PRO 10 -1.853 2.661 -11.001
60 HB2 PRO 10 HB2 PRO 10 -0.473 4.405 -9.290
61 HB3 PRO 10 HB1 PRO 10 -2.051 4.696 -10.022
62 HG2 PRO 10 HG2 PRO 10 -1.502 4.350 -7.280
63 HG3 PRO 10 HG1 PRO 10 -3.100 4.384 -8.046
64 HD2 PRO 10 HD2 PRO 10 -1.449 2.055 -7.201
65 HD3 PRO 10 HD1 PRO 10 -3.216 2.235 -7.245
66 H ALA 11 HN ALA 11 0.249 2.753 -11.880
67 HA ALA 11 HA ALA 11 2.256 1.017 -10.880
68 HB1 ALA 11 HB1 ALA 11 2.476 3.288 -12.855
69 HB2 ALA 11 HB2 ALA 11 2.155 1.596 -13.238
70 HB3 ALA 11 HB3 ALA 11 3.715 2.067 -12.563
71 H ALA 12 HN ALA 12 1.515 4.376 -10.495
72 HA ALA 12 HA ALA 12 3.861 5.313 -9.314
73 HB1 ALA 12 HB1 ALA 12 1.048 6.266 -8.850
74 HB2 ALA 12 HB2 ALA 12 2.109 6.775 -10.164
75 HB3 ALA 12 HB3 ALA 12 2.523 7.163 -8.494
76 H ALA 13 HN ALA 13 1.664 3.101 -8.063
77 HA ALA 13 HA ALA 13 1.239 3.920 -5.444
78 HB1 ALA 13 HB1 ALA 13 1.468 1.082 -6.405
79 HB2 ALA 13 HB2 ALA 13 0.037 2.100 -6.573
80 HB3 ALA 13 HB3 ALA 13 0.616 1.648 -4.969
81 H THR 14 HN THR 14 4.059 2.368 -6.800
82 HA THR 14 HA THR 14 5.137 1.487 -4.306
83 HB THR 14 HB THR 14 5.768 0.367 -6.389
84 HG1 THR 14 HG1 THR 14 7.432 1.190 -4.470
85 HG21 THR 14 HG21 THR 14 7.162 2.962 -7.064
86 HG22 THR 14 HG22 THR 14 5.790 2.253 -7.918
87 HG23 THR 14 HG23 THR 14 7.357 1.445 -7.944
88 H ILE 15 HN ILE 15 5.121 4.508 -5.958
89 HA ILE 15 HA ILE 15 7.607 5.559 -5.207
90 HB ILE 15 HB ILE 15 5.866 6.363 -6.965
91 HG12 ILE 15 HG12 ILE 15 6.813 8.637 -6.922
92 HG13 ILE 15 HG11 ILE 15 7.436 8.338 -5.301
93 HG21 ILE 15 HG21 ILE 15 4.011 6.787 -5.483
94 HG22 ILE 15 HG22 ILE 15 4.526 8.294 -6.236
95 HG23 ILE 15 HG23 ILE 15 4.970 7.949 -4.566
96 HD11 ILE 15 HD11 ILE 15 9.137 8.100 -7.062
97 HD12 ILE 15 HD12 ILE 15 8.194 6.779 -7.754
98 HD13 ILE 15 HD13 ILE 15 8.890 6.614 -6.143
99 H VAL 16 HN VAL 16 7.016 8.019 -4.089
100 HA VAL 16 HA VAL 16 7.580 7.691 -1.449
101 HB VAL 16 HB VAL 16 6.017 10.013 -2.589
102 HG11 VAL 16 HG11 VAL 16 7.195 11.290 -0.793
103 HG12 VAL 16 HG12 VAL 16 7.737 9.745 -0.132
104 HG13 VAL 16 HG13 VAL 16 6.015 10.119 -0.205
105 HG21 VAL 16 HG21 VAL 16 8.194 11.049 -2.997
106 HG22 VAL 16 HG22 VAL 16 8.023 9.546 -3.903
107 HG23 VAL 16 HG23 VAL 16 8.999 9.584 -2.436
108 H LEU 17 HN LEU 17 6.551 7.654 0.451
109 HA LEU 17 HA LEU 17 3.720 6.910 0.341
110 HB2 LEU 17 HB2 LEU 17 5.161 4.932 0.154
111 HB3 LEU 17 HB1 LEU 17 5.988 5.400 1.617
112 HG LEU 17 HG LEU 17 3.039 4.862 1.697
113 HD11 LEU 17 HD11 LEU 17 3.482 2.517 2.142
114 HD12 LEU 17 HD12 LEU 17 5.205 2.772 1.861
115 HD13 LEU 17 HD13 LEU 17 4.058 2.953 0.533
116 HD21 LEU 17 HD21 LEU 17 3.520 4.228 3.977
117 HD22 LEU 17 HD22 LEU 17 4.204 5.823 3.651
118 HD23 LEU 17 HD23 LEU 17 5.252 4.404 3.694
119 HA PRO 18 HA PRO 18 3.773 9.258 4.157
120 HB2 PRO 18 HB2 PRO 18 1.125 9.681 4.254
121 HB3 PRO 18 HB1 PRO 18 2.155 10.517 3.089
122 HG2 PRO 18 HG2 PRO 18 0.219 8.328 2.656
123 HG3 PRO 18 HG1 PRO 18 0.796 9.562 1.525
124 HD2 PRO 18 HD2 PRO 18 1.678 6.846 1.775
125 HD3 PRO 18 HD1 PRO 18 2.283 8.093 0.667
126 HA PRO 19 HA PRO 19 3.144 6.079 7.212
127 HB2 PRO 19 HB2 PRO 19 2.489 8.486 8.812
128 HB3 PRO 19 HB1 PRO 19 3.561 7.163 9.205
129 HG2 PRO 19 HG2 PRO 19 4.621 9.389 8.466
130 HG3 PRO 19 HG1 PRO 19 5.196 7.902 7.685
131 HD2 PRO 19 HD2 PRO 19 3.233 9.925 6.660
132 HD3 PRO 19 HD1 PRO 19 4.601 9.174 5.826
133 H ASN 20 HN ASN 20 0.800 8.472 6.499
134 HA ASN 20 HA ASN 20 -1.366 7.738 8.090
135 HB2 ASN 20 HB2 ASN 20 -1.507 8.787 5.264
136 HB3 ASN 20 HB1 ASN 20 -2.788 8.849 6.460
137 HD21 ASN 20 HD21 ASN 20 -3.007 11.008 6.322
138 HD22 ASN 20 HD22 ASN 20 -1.814 12.130 6.853
139 H TRP 21 HN TRP 21 0.079 5.809 5.738
140 HA TRP 21 HA TRP 21 -2.251 5.027 4.306
141 HB2 TRP 21 HB2 TRP 21 -0.808 3.615 3.039
142 HB3 TRP 21 HB1 TRP 21 0.098 5.086 3.369
143 HD1 TRP 21 HD1 TRP 21 1.286 4.452 6.205
144 HE1 TRP 21 HE1 TRP 21 3.035 2.586 6.508
145 HE3 TRP 21 HE3 TRP 21 0.314 1.752 1.982
146 HZ2 TRP 21 HZ2 TRP 21 3.893 0.287 5.127
147 HZ3 TRP 21 HZ3 TRP 21 1.647 -0.267 1.546
148 HH2 TRP 21 HH2 TRP 21 3.401 -0.987 3.083
149 H LYS 22 HN LYS 22 -2.937 2.799 4.131
150 HA LYS 22 HA LYS 22 -3.006 1.561 6.802
151 HB2 LYS 22 HB2 LYS 22 -5.344 2.023 4.975
152 HB3 LYS 22 HB1 LYS 22 -5.387 1.184 6.507
153 HG2 LYS 22 HG2 LYS 22 -4.618 4.068 6.197
154 HG3 LYS 22 HG1 LYS 22 -6.226 3.497 6.646
155 HD2 LYS 22 HD2 LYS 22 -4.795 2.162 8.438
156 HD3 LYS 22 HD1 LYS 22 -3.760 3.578 8.233
157 HE2 LYS 22 HE2 LYS 22 -6.700 3.695 8.712
158 HE3 LYS 22 HE1 LYS 22 -5.475 3.812 9.954
159 HZ1 LYS 22 HZ1 LYS 22 -5.705 5.678 7.672
160 HZ2 LYS 22 HZ2 LYS 22 -4.596 5.793 8.944
161 HZ3 LYS 22 HZ3 LYS 22 -6.248 6.003 9.237
162 H THR 23 HN THR 23 -4.110 -0.572 6.711
163 HA THR 23 HA THR 23 -3.431 -2.081 4.289
164 HB THR 23 HB THR 23 -2.970 -4.014 5.768
165 HG1 THR 23 HG1 THR 23 -2.946 -3.741 7.985
166 HG21 THR 23 HG21 THR 23 -1.363 -1.909 5.210
167 HG22 THR 23 HG22 THR 23 -0.821 -3.397 5.986
168 HG23 THR 23 HG23 THR 23 -1.221 -1.983 6.965
169 H ALA 24 HN ALA 24 -4.932 -3.542 3.564
170 HA ALA 24 HA ALA 24 -7.244 -4.201 5.184
171 HB1 ALA 24 HB1 ALA 24 -8.883 -3.152 3.998
172 HB2 ALA 24 HB2 ALA 24 -7.925 -3.107 2.523
173 HB3 ALA 24 HB3 ALA 24 -7.592 -1.959 3.821
174 H ARG 25 HN ARG 25 -8.765 -5.614 3.809
175 HA ARG 25 HA ARG 25 -7.230 -7.176 1.873
176 HB2 ARG 25 HB2 ARG 25 -8.952 -8.256 4.076
177 HB3 ARG 25 HB1 ARG 25 -8.234 -9.213 2.827
178 HG2 ARG 25 HG2 ARG 25 -6.054 -8.796 3.672
179 HG3 ARG 25 HG1 ARG 25 -6.673 -7.596 4.809
180 HD2 ARG 25 HD2 ARG 25 -6.276 -9.606 6.030
181 HD3 ARG 25 HD1 ARG 25 -8.021 -9.415 5.872
182 HE ARG 25 HE ARG 25 -6.389 -11.294 4.281
183 HH11 ARG 25 HH11 ARG 25 -9.427 -10.383 5.782
184 HH12 ARG 25 HH12 ARG 25 -10.193 -11.900 5.434
185 HH21 ARG 25 HH21 ARG 25 -7.402 -13.284 3.827
186 HH22 ARG 25 HH22 ARG 25 -9.055 -13.542 4.307
187 H ASP 26 HN ASP 26 -8.558 -8.334 0.336
188 HA ASP 26 HA ASP 26 -11.191 -7.130 -0.079
189 HB2 ASP 26 HB2 ASP 26 -9.549 -8.961 -1.839
190 HB3 ASP 26 HB1 ASP 26 -11.176 -8.439 -2.227
191 HA PRO 27 HA PRO 27 -13.758 -10.415 1.181
192 HB2 PRO 27 HB2 PRO 27 -14.911 -11.251 -1.225
193 HB3 PRO 27 HB1 PRO 27 -15.504 -9.956 -0.196
194 HG2 PRO 27 HG2 PRO 27 -13.723 -9.781 -2.563
195 HG3 PRO 27 HG1 PRO 27 -15.113 -8.763 -2.139
196 HD2 PRO 27 HD2 PRO 27 -12.694 -7.871 -1.691
197 HD3 PRO 27 HD1 PRO 27 -13.916 -7.689 -0.419
198 H GLU 28 HN GLU 28 -11.734 -10.995 -1.615
199 HA GLU 28 HA GLU 28 -11.992 -13.878 -1.417
200 HB2 GLU 28 HB2 GLU 28 -10.462 -12.133 -3.349
201 HB3 GLU 28 HB1 GLU 28 -10.646 -13.879 -3.483
202 HG2 GLU 28 HG2 GLU 28 -12.803 -13.747 -4.170
203 HG3 GLU 28 HG1 GLU 28 -13.119 -12.276 -3.251
204 H GLY 29 HN GLY 29 -10.736 -12.681 0.793
205 HA2 GLY 29 HA2 GLY 29 -9.082 -13.304 2.244
206 HA3 GLY 29 HA1 GLY 29 -8.747 -14.625 1.145
207 H LYS 30 HN LYS 30 -8.385 -11.581 -0.338
208 HA LYS 30 HA LYS 30 -5.479 -11.875 -0.163
209 HB2 LYS 30 HB2 LYS 30 -7.297 -11.061 -2.231
210 HB3 LYS 30 HB1 LYS 30 -6.137 -9.773 -1.929
211 HG2 LYS 30 HG2 LYS 30 -5.257 -11.165 -3.642
212 HG3 LYS 30 HG1 LYS 30 -4.318 -11.449 -2.177
213 HD2 LYS 30 HD2 LYS 30 -5.779 -13.444 -1.742
214 HD3 LYS 30 HD1 LYS 30 -6.472 -13.199 -3.345
215 HE2 LYS 30 HE2 LYS 30 -4.756 -14.849 -3.537
216 HE3 LYS 30 HE1 LYS 30 -4.170 -13.366 -4.287
217 HZ1 LYS 30 HZ1 LYS 30 -2.452 -14.344 -2.942
218 HZ2 LYS 30 HZ2 LYS 30 -3.462 -14.362 -1.578
219 HZ3 LYS 30 HZ3 LYS 30 -2.942 -12.886 -2.228
220 H ILE 31 HN ILE 31 -4.171 -10.350 0.711
221 HA ILE 31 HA ILE 31 -5.484 -8.116 2.137
222 HB ILE 31 HB ILE 31 -4.207 -9.522 3.613
223 HG12 ILE 31 HG12 ILE 31 -2.112 -7.684 3.765
224 HG13 ILE 31 HG11 ILE 31 -3.447 -6.788 3.069
225 HG21 ILE 31 HG21 ILE 31 -2.778 -10.668 2.060
226 HG22 ILE 31 HG22 ILE 31 -1.782 -9.905 3.300
227 HG23 ILE 31 HG23 ILE 31 -1.906 -9.177 1.700
228 HD11 ILE 31 HD11 ILE 31 -3.554 -8.344 5.633
229 HD12 ILE 31 HD12 ILE 31 -4.839 -7.361 4.935
230 HD13 ILE 31 HD13 ILE 31 -3.355 -6.596 5.494
231 H TYR 32 HN TYR 32 -4.855 -6.006 1.662
232 HA TYR 32 HA TYR 32 -2.761 -5.607 -0.365
233 HB2 TYR 32 HB2 TYR 32 -5.595 -4.610 -0.381
234 HB3 TYR 32 HB1 TYR 32 -4.328 -3.715 -1.213
235 HD1 TYR 32 HD2 TYR 32 -5.765 -7.143 -0.983
236 HD2 TYR 32 HD1 TYR 32 -3.874 -4.227 -3.432
237 HE1 TYR 32 HE2 TYR 32 -6.034 -8.616 -2.932
238 HE2 TYR 32 HE1 TYR 32 -4.135 -5.692 -5.388
239 HH TYR 32 HH TYR 32 -6.121 -8.459 -5.364
240 H TYR 33 HN TYR 33 -2.448 -3.130 -0.635
241 HA TYR 33 HA TYR 33 -2.428 -1.763 1.974
242 HB2 TYR 33 HB2 TYR 33 -0.317 -1.849 -0.179
243 HB3 TYR 33 HB1 TYR 33 -0.282 -0.735 1.160
244 HD1 TYR 33 HD2 TYR 33 -0.208 -1.768 3.535
245 HD2 TYR 33 HD1 TYR 33 0.679 -3.951 -0.004
246 HE1 TYR 33 HE2 TYR 33 0.977 -3.449 4.880
247 HE2 TYR 33 HE1 TYR 33 1.861 -5.641 1.333
248 HH TYR 33 HH TYR 33 1.630 -5.790 4.729
249 H TYR 34 HN TYR 34 -2.984 0.452 1.859
250 HA TYR 34 HA TYR 34 -3.153 1.599 -0.813
251 HB2 TYR 34 HB2 TYR 34 -5.395 2.513 -0.492
252 HB3 TYR 34 HB1 TYR 34 -5.394 0.756 -0.470
253 HD1 TYR 34 HD1 TYR 34 -5.828 -0.455 1.625
254 HD2 TYR 34 HD2 TYR 34 -6.045 3.789 1.432
255 HE1 TYR 34 HE1 TYR 34 -7.020 -0.426 3.774
256 HE2 TYR 34 HE2 TYR 34 -7.244 3.831 3.578
257 HH TYR 34 HH TYR 34 -8.594 2.377 4.959
258 H HIS 35 HN HIS 35 -2.827 3.686 -1.031
259 HA HIS 35 HA HIS 35 -1.765 5.076 1.316
260 HB2 HIS 35 HB2 HIS 35 -1.545 5.613 -1.662
261 HB3 HIS 35 HB1 HIS 35 -0.833 6.626 -0.430
262 HD1 HIS 35 HD1 HIS 35 -0.597 2.865 -0.287
263 HD2 HIS 35 HD2 HIS 35 1.775 6.143 -1.233
264 HE1 HIS 35 HE1 HIS 35 1.728 1.956 -0.587
265 HE2 HIS 35 HE2 HIS 35 3.087 3.921 -1.375
266 H VAL 36 HN VAL 36 -3.070 6.456 2.272
267 HA VAL 36 HA VAL 36 -5.627 7.031 1.233
268 HB VAL 36 HB VAL 36 -5.763 8.415 3.372
269 HG11 VAL 36 HG11 VAL 36 -4.859 5.598 3.856
270 HG12 VAL 36 HG12 VAL 36 -6.333 5.922 2.952
271 HG13 VAL 36 HG13 VAL 36 -6.184 6.483 4.621
272 HG21 VAL 36 HG21 VAL 36 -3.453 8.924 3.698
273 HG22 VAL 36 HG22 VAL 36 -3.008 7.214 3.603
274 HG23 VAL 36 HG23 VAL 36 -3.928 7.821 4.993
275 H ILE 37 HN ILE 37 -2.709 9.079 1.626
276 HA ILE 37 HA ILE 37 -3.998 11.487 0.922
277 HB ILE 37 HB ILE 37 -1.119 10.644 0.902
278 HG12 ILE 37 HG12 ILE 37 -1.087 12.689 2.493
279 HG13 ILE 37 HG11 ILE 37 -2.834 12.504 2.469
280 HG21 ILE 37 HG21 ILE 37 -1.389 12.122 -1.033
281 HG22 ILE 37 HG22 ILE 37 -0.450 12.896 0.244
282 HG23 ILE 37 HG23 ILE 37 -2.141 13.336 0.001
283 HD11 ILE 37 HD11 ILE 37 -0.992 10.279 3.215
284 HD12 ILE 37 HD12 ILE 37 -2.736 10.397 3.447
285 HD13 ILE 37 HD13 ILE 37 -1.654 11.425 4.381
286 H THR 38 HN THR 38 -1.875 9.390 -0.950
287 HA THR 38 HA THR 38 -2.316 10.851 -3.353
288 HB THR 38 HB THR 38 -0.842 9.000 -4.325
289 HG1 THR 38 HG1 THR 38 0.235 7.757 -2.738
290 HG21 THR 38 HG21 THR 38 0.060 10.732 -2.033
291 HG22 THR 38 HG22 THR 38 0.063 11.154 -3.748
292 HG23 THR 38 HG23 THR 38 1.162 9.914 -3.139
293 H ARG 39 HN ARG 39 -3.891 8.220 -1.907
294 HA ARG 39 HA ARG 39 -5.425 6.699 -2.541
295 HB2 ARG 39 HB2 ARG 39 -5.776 8.801 -4.605
296 HB3 ARG 39 HB1 ARG 39 -6.475 7.231 -4.942
297 HG2 ARG 39 HG2 ARG 39 -8.176 8.485 -3.929
298 HG3 ARG 39 HG1 ARG 39 -7.586 7.380 -2.682
299 HD2 ARG 39 HD2 ARG 39 -7.662 9.384 -1.541
300 HD3 ARG 39 HD1 ARG 39 -5.989 9.309 -2.106
301 HE ARG 39 HE ARG 39 -7.305 10.644 -4.090
302 HH11 ARG 39 HH11 ARG 39 -6.865 11.124 -0.653
303 HH12 ARG 39 HH12 ARG 39 -7.059 12.846 -0.733
304 HH21 ARG 39 HH21 ARG 39 -7.563 12.887 -4.221
305 HH22 ARG 39 HH22 ARG 39 -7.444 13.865 -2.784
306 H GLN 40 HN GLN 40 -3.012 5.781 -2.794
307 HA GLN 40 HA GLN 40 -2.962 4.390 -5.378
308 HB2 GLN 40 HB2 GLN 40 -0.755 4.842 -3.414
309 HB3 GLN 40 HB1 GLN 40 -0.582 4.047 -4.962
310 HG2 GLN 40 HG2 GLN 40 -1.054 6.102 -6.073
311 HG3 GLN 40 HG1 GLN 40 -1.381 6.912 -4.556
312 HE21 GLN 40 HE21 GLN 40 0.529 7.484 -6.659
313 HE22 GLN 40 HE22 GLN 40 2.084 7.464 -5.905
314 H THR 41 HN THR 41 -2.054 2.123 -5.162
315 HA THR 41 HA THR 41 -2.302 0.946 -2.555
316 HB THR 41 HB THR 41 -4.529 0.620 -2.991
317 HG1 THR 41 HG1 THR 41 -3.605 -1.395 -2.543
318 HG21 THR 41 HG21 THR 41 -4.531 1.493 -5.218
319 HG22 THR 41 HG22 THR 41 -5.439 -0.023 -5.171
320 HG23 THR 41 HG23 THR 41 -3.805 0.012 -5.845
321 H GLN 42 HN GLN 42 -0.993 -0.801 -2.286
322 HA GLN 42 HA GLN 42 0.218 -1.895 -4.741
323 HB2 GLN 42 HB2 GLN 42 2.395 -2.011 -3.538
324 HB3 GLN 42 HB1 GLN 42 1.837 -0.366 -3.810
325 HG2 GLN 42 HG2 GLN 42 1.102 -0.199 -1.514
326 HG3 GLN 42 HG1 GLN 42 1.541 -1.880 -1.225
327 HE21 GLN 42 HE21 GLN 42 3.449 0.313 -3.160
328 HE22 GLN 42 HE22 GLN 42 4.797 0.395 -2.080
329 H TRP 43 HN TRP 43 0.027 -4.018 -4.867
330 HA TRP 43 HA TRP 43 -0.546 -5.546 -2.448
331 HB2 TRP 43 HB2 TRP 43 -2.009 -5.943 -4.337
332 HB3 TRP 43 HB1 TRP 43 -0.634 -6.283 -5.380
333 HD1 TRP 43 HD1 TRP 43 -2.174 -7.768 -2.139
334 HE1 TRP 43 HE1 TRP 43 -1.949 -10.328 -2.263
335 HE3 TRP 43 HE3 TRP 43 0.331 -8.148 -6.582
336 HZ2 TRP 43 HZ2 TRP 43 -0.860 -12.247 -4.015
337 HZ3 TRP 43 HZ3 TRP 43 0.924 -10.387 -7.410
338 HH2 TRP 43 HH2 TRP 43 0.341 -12.393 -6.152
339 H ASP 44 HN ASP 44 1.752 -5.392 -5.112
340 HA ASP 44 HA ASP 44 3.510 -7.237 -3.649
341 HB2 ASP 44 HB2 ASP 44 2.793 -8.123 -5.786
342 HB3 ASP 44 HB1 ASP 44 3.355 -6.672 -6.608
343 HA PRO 45 HA PRO 45 6.350 -3.630 -5.621
344 HB2 PRO 45 HB2 PRO 45 4.997 -1.208 -5.188
345 HB3 PRO 45 HB1 PRO 45 5.306 -1.978 -6.747
346 HG2 PRO 45 HG2 PRO 45 2.858 -2.040 -5.052
347 HG3 PRO 45 HG1 PRO 45 3.007 -2.016 -6.818
348 HD2 PRO 45 HD2 PRO 45 2.371 -4.260 -5.530
349 HD3 PRO 45 HD1 PRO 45 3.457 -4.292 -6.936
350 HA PRO 46 HA PRO 46 7.786 -3.009 -1.530
351 HB2 PRO 46 HB2 PRO 46 9.501 -0.897 -2.671
352 HB3 PRO 46 HB1 PRO 46 9.949 -2.375 -1.814
353 HG2 PRO 46 HG2 PRO 46 10.304 -2.149 -4.434
354 HG3 PRO 46 HG1 PRO 46 9.789 -3.683 -3.716
355 HD2 PRO 46 HD2 PRO 46 8.170 -1.621 -5.165
356 HD3 PRO 46 HD1 PRO 46 8.090 -3.393 -5.270
357 H THR 47 HN THR 47 8.019 -1.467 0.127
358 HA THR 47 HA THR 47 5.934 0.531 0.057
359 HB THR 47 HB THR 47 6.102 -1.057 1.934
360 HG1 THR 47 HG1 THR 47 6.394 0.830 3.610
361 HG21 THR 47 HG21 THR 47 8.618 -1.135 1.925
362 HG22 THR 47 HG22 THR 47 7.863 -1.039 3.513
363 HG23 THR 47 HG23 THR 47 8.586 0.399 2.791
364 H TRP 48 HN TRP 48 7.072 2.103 2.138
365 HA TRP 48 HA TRP 48 8.166 4.216 0.638
366 HB2 TRP 48 HB2 TRP 48 6.964 4.474 2.799
367 HB3 TRP 48 HB1 TRP 48 8.354 3.780 3.611
368 HD1 TRP 48 HD1 TRP 48 7.790 6.777 1.200
369 HE1 TRP 48 HE1 TRP 48 9.207 8.753 2.058
370 HE3 TRP 48 HE3 TRP 48 9.948 4.518 5.244
371 HZ2 TRP 48 HZ2 TRP 48 10.994 9.276 4.176
372 HZ3 TRP 48 HZ3 TRP 48 11.499 5.825 6.638
373 HH2 TRP 48 HH2 TRP 48 12.010 8.157 6.113
374 H GLU 49 HN GLU 49 9.644 1.746 2.637
375 HA GLU 49 HA GLU 49 12.309 2.747 1.998
376 HB2 GLU 49 HB2 GLU 49 11.070 1.878 4.375
377 HB3 GLU 49 HB1 GLU 49 12.247 0.646 3.953
378 HG2 GLU 49 HG2 GLU 49 12.862 3.551 4.033
379 HG3 GLU 49 HG1 GLU 49 13.029 2.511 5.446
380 H SER 50 HN SER 50 13.899 1.271 1.259
381 HA SER 50 HA SER 50 12.732 -1.104 -0.032
382 HB2 SER 50 HB2 SER 50 13.655 0.458 -1.633
383 HB3 SER 50 HB1 SER 50 15.171 0.549 -0.740
384 HG SER 50 HG SER 50 14.510 -1.142 -2.678
385 HA PRO 51 HA PRO 51 15.140 -3.624 2.772
386 HB2 PRO 51 HB2 PRO 51 14.700 -5.964 1.447
387 HB3 PRO 51 HB1 PRO 51 13.530 -5.234 2.551
388 HG2 PRO 51 HG2 PRO 51 13.649 -5.107 -0.437
389 HG3 PRO 51 HG1 PRO 51 12.244 -5.369 0.616
390 HD2 PRO 51 HD2 PRO 51 12.753 -2.970 -0.481
391 HD3 PRO 51 HD1 PRO 51 12.076 -3.123 1.155
392 H GLY 52 HN GLY 52 16.836 -5.339 2.525
393 HA2 GLY 52 HA2 GLY 52 18.866 -4.502 0.727
394 HA3 GLY 52 HA1 GLY 52 18.911 -5.949 1.729
395 H ASP 53 HN ASP 53 16.318 -6.805 0.576
396 HA ASP 53 HA ASP 53 17.202 -8.470 -1.495
397 HB2 ASP 53 HB2 ASP 53 15.274 -9.035 -0.125
398 HB3 ASP 53 HB1 ASP 53 14.399 -7.630 -0.724
399 H ASP 54 HN ASP 54 15.680 -5.305 -1.546
400 HA ASP 54 HA ASP 54 15.610 -5.342 -4.471
401 HB2 ASP 54 HB2 ASP 54 13.622 -4.472 -3.337
402 HB3 ASP 54 HB1 ASP 54 14.603 -3.276 -2.495
403 H ALA 55 HN ALA 55 16.998 -3.475 -1.793
404 HA ALA 55 HA ALA 55 18.870 -2.208 -1.616
405 HB1 ALA 55 HB1 ALA 55 20.873 -3.088 -2.663
406 HB2 ALA 55 HB2 ALA 55 19.893 -4.066 -3.756
407 HB3 ALA 55 HB3 ALA 55 19.883 -4.400 -2.024
408 H SER 56 HN SER 56 17.378 -0.548 -2.725
409 HA SER 56 HA SER 56 18.670 0.375 -5.202
410 HB2 SER 56 HB2 SER 56 15.910 1.022 -4.129
411 HB3 SER 56 HB1 SER 56 16.604 1.682 -5.612
412 HG SER 56 HG SER 56 15.581 -0.859 -5.076
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 -8.432 0.845 3.822
2 H2 GLY 1 HT2 GLY 1 -8.827 2.089 4.904
3 H3 GLY 1 HT3 GLY 1 -9.669 1.932 3.435
4 HA2 GLY 1 HA1 GLY 1 -10.607 -0.166 4.130
5 HA3 GLY 1 HA2 GLY 1 -9.707 -0.053 5.639
6 H SER 2 HN SER 2 -10.541 1.065 7.303
7 HA SER 2 HA SER 2 -13.215 1.937 7.268
8 HB2 SER 2 HB2 SER 2 -11.080 2.701 9.260
9 HB3 SER 2 HB1 SER 2 -12.823 2.670 9.532
10 HG SER 2 HG SER 2 -12.700 0.362 9.117
11 H ASP 3 HN ASP 3 -10.242 3.426 6.556
12 HA ASP 3 HA ASP 3 -11.050 6.175 6.859
13 HB2 ASP 3 HB2 ASP 3 -8.784 6.485 5.719
14 HB3 ASP 3 HB1 ASP 3 -8.756 5.600 7.247
15 H LEU 4 HN LEU 4 -10.135 4.115 4.116
16 HA LEU 4 HA LEU 4 -11.946 5.604 2.377
17 HB2 LEU 4 HB2 LEU 4 -8.996 5.180 1.995
18 HB3 LEU 4 HB1 LEU 4 -10.054 5.310 0.597
19 HG LEU 4 HG LEU 4 -9.641 7.403 2.733
20 HD11 LEU 4 HD11 LEU 4 -8.882 7.326 -0.187
21 HD12 LEU 4 HD12 LEU 4 -7.774 7.211 1.181
22 HD13 LEU 4 HD13 LEU 4 -8.670 8.702 0.894
23 HD21 LEU 4 HD21 LEU 4 -11.080 8.816 1.328
24 HD22 LEU 4 HD22 LEU 4 -11.945 7.421 1.973
25 HD23 LEU 4 HD23 LEU 4 -11.411 7.428 0.291
26 HA PRO 5 HA PRO 5 -12.953 1.495 0.826
27 HB2 PRO 5 HB2 PRO 5 -13.655 2.951 -1.649
28 HB3 PRO 5 HB1 PRO 5 -14.668 1.924 -0.632
29 HG2 PRO 5 HG2 PRO 5 -14.997 4.577 -0.686
30 HG3 PRO 5 HG1 PRO 5 -15.203 3.646 0.810
31 HD2 PRO 5 HD2 PRO 5 -12.886 5.320 -0.079
32 HD3 PRO 5 HD1 PRO 5 -13.628 5.186 1.530
33 HA PRO 6 HA PRO 6 -9.245 0.528 -1.156
34 HB2 PRO 6 HB2 PRO 6 -9.910 -1.598 -2.754
35 HB3 PRO 6 HB1 PRO 6 -9.720 -1.697 -1.000
36 HG2 PRO 6 HG2 PRO 6 -12.218 -1.451 -2.626
37 HG3 PRO 6 HG1 PRO 6 -11.906 -2.453 -1.196
38 HD2 PRO 6 HD2 PRO 6 -13.275 -0.135 -1.055
39 HD3 PRO 6 HD1 PRO 6 -12.219 -0.689 0.261
40 HA PRO 7 HA PRO 7 -9.125 2.437 -5.195
41 HB2 PRO 7 HB2 PRO 7 -6.275 2.249 -5.031
42 HB3 PRO 7 HB1 PRO 7 -7.270 3.663 -4.751
43 HG2 PRO 7 HG2 PRO 7 -5.807 2.408 -2.809
44 HG3 PRO 7 HG1 PRO 7 -7.254 3.381 -2.485
45 HD2 PRO 7 HD2 PRO 7 -6.978 0.405 -2.705
46 HD3 PRO 7 HD1 PRO 7 -7.914 1.366 -1.538
47 H SER 8 HN SER 8 -8.588 1.831 -7.318
48 HA SER 8 HA SER 8 -7.402 -0.800 -7.714
49 HB2 SER 8 HB2 SER 8 -9.263 0.167 -9.188
50 HB3 SER 8 HB1 SER 8 -8.055 1.286 -9.818
51 HG SER 8 HG SER 8 -7.095 -0.300 -10.880
52 HA PRO 9 HA PRO 9 -3.477 1.025 -7.466
53 HB2 PRO 9 HB2 PRO 9 -1.881 -0.918 -8.402
54 HB3 PRO 9 HB1 PRO 9 -2.819 -1.105 -6.917
55 HG2 PRO 9 HG2 PRO 9 -3.346 -2.194 -9.644
56 HG3 PRO 9 HG1 PRO 9 -3.620 -2.943 -8.063
57 HD2 PRO 9 HD2 PRO 9 -5.570 -1.719 -9.619
58 HD3 PRO 9 HD1 PRO 9 -5.695 -2.028 -7.878
59 HA PRO 10 HA PRO 10 -1.856 2.518 -11.403
60 HB2 PRO 10 HB2 PRO 10 -0.512 4.582 -10.347
61 HB3 PRO 10 HB1 PRO 10 -2.267 4.635 -10.547
62 HG2 PRO 10 HG2 PRO 10 -0.655 4.242 -8.087
63 HG3 PRO 10 HG1 PRO 10 -2.234 5.019 -8.286
64 HD2 PRO 10 HD2 PRO 10 -1.736 2.389 -7.384
65 HD3 PRO 10 HD1 PRO 10 -3.308 3.084 -7.819
66 H ALA 11 HN ALA 11 0.252 2.469 -12.281
67 HA ALA 11 HA ALA 11 2.129 0.692 -11.167
68 HB1 ALA 11 HB1 ALA 11 2.016 1.165 -13.565
69 HB2 ALA 11 HB2 ALA 11 3.640 1.444 -12.932
70 HB3 ALA 11 HB3 ALA 11 2.576 2.810 -13.269
71 H ALA 12 HN ALA 12 1.698 4.119 -10.868
72 HA ALA 12 HA ALA 12 4.239 4.783 -9.828
73 HB1 ALA 12 HB1 ALA 12 2.787 6.429 -10.886
74 HB2 ALA 12 HB2 ALA 12 3.250 6.924 -9.258
75 HB3 ALA 12 HB3 ALA 12 1.641 6.267 -9.556
76 H ALA 13 HN ALA 13 1.692 3.122 -8.378
77 HA ALA 13 HA ALA 13 1.271 4.434 -5.968
78 HB1 ALA 13 HB1 ALA 13 1.038 1.473 -6.458
79 HB2 ALA 13 HB2 ALA 13 -0.184 2.680 -6.856
80 HB3 ALA 13 HB3 ALA 13 0.252 2.393 -5.172
81 H THR 14 HN THR 14 3.841 2.223 -6.791
82 HA THR 14 HA THR 14 4.618 1.641 -4.115
83 HB THR 14 HB THR 14 5.175 0.079 -5.866
84 HG1 THR 14 HG1 THR 14 7.121 1.256 -4.294
85 HG21 THR 14 HG21 THR 14 5.416 1.624 -7.736
86 HG22 THR 14 HG22 THR 14 6.845 0.602 -7.590
87 HG23 THR 14 HG23 THR 14 6.896 2.273 -7.028
88 H ILE 15 HN ILE 15 5.241 4.290 -6.237
89 HA ILE 15 HA ILE 15 7.747 5.106 -5.950
90 HB ILE 15 HB ILE 15 6.076 6.312 -7.233
91 HG12 ILE 15 HG12 ILE 15 6.854 8.618 -6.750
92 HG13 ILE 15 HG11 ILE 15 7.609 8.016 -5.277
93 HG21 ILE 15 HG21 ILE 15 4.237 6.341 -5.628
94 HG22 ILE 15 HG22 ILE 15 4.575 7.952 -6.257
95 HG23 ILE 15 HG23 ILE 15 5.118 7.505 -4.639
96 HD11 ILE 15 HD11 ILE 15 9.096 8.272 -7.300
97 HD12 ILE 15 HD12 ILE 15 8.214 6.899 -7.976
98 HD13 ILE 15 HD13 ILE 15 9.133 6.707 -6.485
99 H VAL 16 HN VAL 16 5.460 6.653 -3.668
100 HA VAL 16 HA VAL 16 7.543 6.456 -1.598
101 HB VAL 16 HB VAL 16 5.677 8.810 -1.937
102 HG11 VAL 16 HG11 VAL 16 7.355 9.925 -0.452
103 HG12 VAL 16 HG12 VAL 16 8.101 8.343 -0.214
104 HG13 VAL 16 HG13 VAL 16 6.440 8.624 0.305
105 HG21 VAL 16 HG21 VAL 16 7.475 10.055 -2.920
106 HG22 VAL 16 HG22 VAL 16 7.204 8.584 -3.863
107 HG23 VAL 16 HG23 VAL 16 8.572 8.683 -2.753
108 H LEU 17 HN LEU 17 6.789 6.380 0.549
109 HA LEU 17 HA LEU 17 3.973 5.581 0.775
110 HB2 LEU 17 HB2 LEU 17 5.661 3.729 0.812
111 HB3 LEU 17 HB1 LEU 17 6.326 4.430 2.266
112 HG LEU 17 HG LEU 17 4.217 4.044 3.451
113 HD11 LEU 17 HD11 LEU 17 2.456 2.706 2.406
114 HD12 LEU 17 HD12 LEU 17 3.331 2.751 0.874
115 HD13 LEU 17 HD13 LEU 17 2.690 4.240 1.569
116 HD21 LEU 17 HD21 LEU 17 4.398 1.651 3.623
117 HD22 LEU 17 HD22 LEU 17 6.009 2.336 3.401
118 HD23 LEU 17 HD23 LEU 17 5.188 1.559 2.050
119 HA PRO 18 HA PRO 18 4.201 8.384 4.295
120 HB2 PRO 18 HB2 PRO 18 1.610 9.099 4.208
121 HB3 PRO 18 HB1 PRO 18 2.776 9.696 3.023
122 HG2 PRO 18 HG2 PRO 18 0.584 7.774 2.673
123 HG3 PRO 18 HG1 PRO 18 1.473 8.696 1.451
124 HD2 PRO 18 HD2 PRO 18 1.872 5.943 2.314
125 HD3 PRO 18 HD1 PRO 18 2.604 6.798 0.940
126 HA PRO 19 HA PRO 19 2.878 5.745 7.668
127 HB2 PRO 19 HB2 PRO 19 2.287 8.394 8.854
128 HB3 PRO 19 HB1 PRO 19 3.163 7.050 9.550
129 HG2 PRO 19 HG2 PRO 19 4.518 9.066 8.690
130 HG3 PRO 19 HG1 PRO 19 5.044 7.442 8.200
131 HD2 PRO 19 HD2 PRO 19 3.448 9.453 6.650
132 HD3 PRO 19 HD1 PRO 19 4.825 8.474 6.125
133 H ASN 20 HN ASN 20 0.976 8.246 6.348
134 HA ASN 20 HA ASN 20 -1.518 7.916 7.516
135 HB2 ASN 20 HB2 ASN 20 -0.599 8.871 4.837
136 HB3 ASN 20 HB1 ASN 20 -2.316 8.703 5.164
137 HD21 ASN 20 HD21 ASN 20 -0.606 11.043 4.655
138 HD22 ASN 20 HD22 ASN 20 -0.962 12.108 5.963
139 H TRP 21 HN TRP 21 0.110 5.575 5.721
140 HA TRP 21 HA TRP 21 -2.036 4.746 4.037
141 HB2 TRP 21 HB2 TRP 21 -0.541 2.961 3.343
142 HB3 TRP 21 HB1 TRP 21 0.366 4.465 3.427
143 HD1 TRP 21 HD1 TRP 21 1.022 4.435 6.570
144 HE1 TRP 21 HE1 TRP 21 2.732 2.744 7.476
145 HE3 TRP 21 HE3 TRP 21 0.870 1.000 2.779
146 HZ2 TRP 21 HZ2 TRP 21 3.871 0.297 6.699
147 HZ3 TRP 21 HZ3 TRP 21 2.313 -0.988 2.944
148 HH2 TRP 21 HH2 TRP 21 3.780 -1.330 4.862
149 H LYS 22 HN LYS 22 -3.181 2.899 4.134
150 HA LYS 22 HA LYS 22 -3.425 1.682 6.817
151 HB2 LYS 22 HB2 LYS 22 -5.560 2.226 4.776
152 HB3 LYS 22 HB1 LYS 22 -5.807 1.280 6.225
153 HG2 LYS 22 HG2 LYS 22 -4.819 4.106 6.303
154 HG3 LYS 22 HG1 LYS 22 -6.533 3.684 6.339
155 HD2 LYS 22 HD2 LYS 22 -5.144 2.069 8.241
156 HD3 LYS 22 HD1 LYS 22 -4.706 3.759 8.486
157 HE2 LYS 22 HE2 LYS 22 -6.999 4.388 8.658
158 HE3 LYS 22 HE1 LYS 22 -7.538 2.749 8.280
159 HZ1 LYS 22 HZ1 LYS 22 -7.627 3.210 10.658
160 HZ2 LYS 22 HZ2 LYS 22 -5.973 3.563 10.679
161 HZ3 LYS 22 HZ3 LYS 22 -6.495 1.987 10.329
162 H THR 23 HN THR 23 -4.650 -0.418 6.711
163 HA THR 23 HA THR 23 -3.697 -2.093 4.496
164 HB THR 23 HB THR 23 -3.218 -3.882 6.103
165 HG1 THR 23 HG1 THR 23 -3.181 -3.212 8.399
166 HG21 THR 23 HG21 THR 23 -1.701 -1.726 5.581
167 HG22 THR 23 HG22 THR 23 -1.144 -3.109 6.526
168 HG23 THR 23 HG23 THR 23 -1.740 -1.660 7.342
169 H ALA 24 HN ALA 24 -5.087 -3.658 3.791
170 HA ALA 24 HA ALA 24 -7.143 -4.745 5.428
171 HB1 ALA 24 HB1 ALA 24 -9.059 -3.881 4.553
172 HB2 ALA 24 HB2 ALA 24 -8.291 -3.496 3.021
173 HB3 ALA 24 HB3 ALA 24 -8.016 -2.460 4.421
174 H ARG 25 HN ARG 25 -8.482 -6.292 4.176
175 HA ARG 25 HA ARG 25 -7.048 -7.364 1.867
176 HB2 ARG 25 HB2 ARG 25 -7.898 -8.857 4.328
177 HB3 ARG 25 HB1 ARG 25 -7.452 -9.641 2.839
178 HG2 ARG 25 HG2 ARG 25 -5.232 -8.541 3.000
179 HG3 ARG 25 HG1 ARG 25 -5.711 -7.934 4.585
180 HD2 ARG 25 HD2 ARG 25 -5.998 -10.224 5.380
181 HD3 ARG 25 HD1 ARG 25 -5.540 -10.838 3.789
182 HE ARG 25 HE ARG 25 -3.641 -9.113 5.181
183 HH11 ARG 25 HH11 ARG 25 -4.571 -12.364 4.244
184 HH12 ARG 25 HH12 ARG 25 -2.973 -13.015 4.467
185 HH21 ARG 25 HH21 ARG 25 -1.539 -9.956 5.430
186 HH22 ARG 25 HH22 ARG 25 -1.247 -11.646 5.114
187 H ASP 26 HN ASP 26 -8.291 -8.648 0.465
188 HA ASP 26 HA ASP 26 -11.164 -8.111 0.540
189 HB2 ASP 26 HB2 ASP 26 -9.412 -9.320 -1.605
190 HB3 ASP 26 HB1 ASP 26 -11.156 -9.244 -1.721
191 HA PRO 27 HA PRO 27 -12.756 -11.963 1.770
192 HB2 PRO 27 HB2 PRO 27 -13.998 -12.826 -0.604
193 HB3 PRO 27 HB1 PRO 27 -14.734 -11.850 0.658
194 HG2 PRO 27 HG2 PRO 27 -13.411 -10.969 -1.845
195 HG3 PRO 27 HG1 PRO 27 -14.907 -10.366 -1.106
196 HD2 PRO 27 HD2 PRO 27 -12.707 -8.979 -0.839
197 HD3 PRO 27 HD1 PRO 27 -13.712 -9.246 0.595
198 H GLU 28 HN GLU 28 -11.269 -11.993 -1.448
199 HA GLU 28 HA GLU 28 -10.720 -14.834 -1.235
200 HB2 GLU 28 HB2 GLU 28 -10.424 -12.863 -3.489
201 HB3 GLU 28 HB1 GLU 28 -9.881 -14.534 -3.600
202 HG2 GLU 28 HG2 GLU 28 -12.683 -13.768 -2.886
203 HG3 GLU 28 HG1 GLU 28 -12.158 -14.047 -4.547
204 H GLY 29 HN GLY 29 -9.334 -13.339 0.598
205 HA2 GLY 29 HA2 GLY 29 -7.258 -13.398 1.550
206 HA3 GLY 29 HA1 GLY 29 -6.833 -14.571 0.316
207 H LYS 30 HN LYS 30 -7.844 -11.427 -0.714
208 HA LYS 30 HA LYS 30 -5.180 -10.867 -1.706
209 HB2 LYS 30 HB2 LYS 30 -7.643 -9.120 -1.798
210 HB3 LYS 30 HB1 LYS 30 -6.175 -8.907 -2.735
211 HG2 LYS 30 HG2 LYS 30 -6.635 -10.914 -3.989
212 HG3 LYS 30 HG1 LYS 30 -8.060 -11.239 -2.993
213 HD2 LYS 30 HD2 LYS 30 -8.993 -9.053 -3.731
214 HD3 LYS 30 HD1 LYS 30 -7.619 -8.882 -4.823
215 HE2 LYS 30 HE2 LYS 30 -8.288 -10.864 -6.028
216 HE3 LYS 30 HE1 LYS 30 -9.599 -11.153 -4.884
217 HZ1 LYS 30 HZ1 LYS 30 -10.464 -10.119 -6.853
218 HZ2 LYS 30 HZ2 LYS 30 -9.356 -8.846 -6.734
219 HZ3 LYS 30 HZ3 LYS 30 -10.571 -9.016 -5.568
220 H ILE 31 HN ILE 31 -3.769 -9.417 -0.802
221 HA ILE 31 HA ILE 31 -4.758 -7.839 1.489
222 HB ILE 31 HB ILE 31 -3.189 -9.426 2.368
223 HG12 ILE 31 HG12 ILE 31 -1.419 -8.017 3.234
224 HG13 ILE 31 HG11 ILE 31 -1.654 -6.869 1.947
225 HG21 ILE 31 HG21 ILE 31 -1.862 -10.373 0.829
226 HG22 ILE 31 HG22 ILE 31 -0.749 -9.092 1.324
227 HG23 ILE 31 HG23 ILE 31 -1.737 -8.888 -0.118
228 HD11 ILE 31 HD11 ILE 31 -2.574 -6.047 4.015
229 HD12 ILE 31 HD12 ILE 31 -3.559 -7.497 4.171
230 HD13 ILE 31 HD13 ILE 31 -3.876 -6.358 2.867
231 H TYR 32 HN TYR 32 -4.206 -5.657 1.499
232 HA TYR 32 HA TYR 32 -2.495 -4.677 -0.664
233 HB2 TYR 32 HB2 TYR 32 -5.338 -3.750 -0.222
234 HB3 TYR 32 HB1 TYR 32 -4.166 -2.895 -1.217
235 HD1 TYR 32 HD1 TYR 32 -3.325 -3.966 -3.311
236 HD2 TYR 32 HD2 TYR 32 -6.514 -5.617 -1.040
237 HE1 TYR 32 HE1 TYR 32 -4.008 -5.307 -5.257
238 HE2 TYR 32 HE2 TYR 32 -7.199 -6.967 -2.970
239 HH TYR 32 HH TYR 32 -7.000 -6.874 -5.423
240 H TYR 33 HN TYR 33 -2.347 -2.236 -0.492
241 HA TYR 33 HA TYR 33 -2.416 -1.273 2.273
242 HB2 TYR 33 HB2 TYR 33 -0.160 -1.118 0.290
243 HB3 TYR 33 HB1 TYR 33 -0.228 -0.145 1.730
244 HD1 TYR 33 HD2 TYR 33 -0.887 -1.782 3.892
245 HD2 TYR 33 HD1 TYR 33 1.317 -2.880 0.427
246 HE1 TYR 33 HE2 TYR 33 0.160 -3.615 5.147
247 HE2 TYR 33 HE1 TYR 33 2.369 -4.721 1.671
248 HH TYR 33 HH TYR 33 2.855 -5.359 3.949
249 H TYR 34 HN TYR 34 -3.138 0.822 2.403
250 HA TYR 34 HA TYR 34 -3.910 1.995 -0.192
251 HB2 TYR 34 HB2 TYR 34 -5.400 2.286 2.418
252 HB3 TYR 34 HB1 TYR 34 -5.924 2.841 0.832
253 HD1 TYR 34 HD1 TYR 34 -5.271 0.428 -0.811
254 HD2 TYR 34 HD2 TYR 34 -7.072 0.787 3.026
255 HE1 TYR 34 HE1 TYR 34 -6.446 -1.700 -1.170
256 HE2 TYR 34 HE2 TYR 34 -8.244 -1.344 2.680
257 HH TYR 34 HH TYR 34 -7.479 -3.483 0.149
258 H HIS 35 HN HIS 35 -3.254 3.958 -0.688
259 HA HIS 35 HA HIS 35 -2.128 5.593 1.466
260 HB2 HIS 35 HB2 HIS 35 -1.971 5.955 -1.548
261 HB3 HIS 35 HB1 HIS 35 -1.141 6.928 -0.356
262 HD1 HIS 35 HD1 HIS 35 -1.206 3.139 -0.858
263 HD2 HIS 35 HD2 HIS 35 1.447 6.327 -0.635
264 HE1 HIS 35 HE1 HIS 35 1.082 2.135 -1.138
265 HE2 HIS 35 HE2 HIS 35 2.639 4.123 -1.232
266 H VAL 36 HN VAL 36 -3.464 7.051 2.274
267 HA VAL 36 HA VAL 36 -6.024 7.447 1.138
268 HB VAL 36 HB VAL 36 -6.180 9.104 3.116
269 HG11 VAL 36 HG11 VAL 36 -5.560 6.624 4.423
270 HG12 VAL 36 HG12 VAL 36 -6.387 6.300 2.897
271 HG13 VAL 36 HG13 VAL 36 -7.137 7.346 4.108
272 HG21 VAL 36 HG21 VAL 36 -3.887 9.549 3.506
273 HG22 VAL 36 HG22 VAL 36 -3.485 7.826 3.536
274 HG23 VAL 36 HG23 VAL 36 -4.425 8.548 4.858
275 H ILE 37 HN ILE 37 -3.158 9.568 1.410
276 HA ILE 37 HA ILE 37 -4.459 11.847 0.359
277 HB ILE 37 HB ILE 37 -1.564 11.135 0.691
278 HG12 ILE 37 HG12 ILE 37 -1.799 13.330 2.058
279 HG13 ILE 37 HG11 ILE 37 -3.522 13.030 1.885
280 HG21 ILE 37 HG21 ILE 37 -2.633 13.642 -0.610
281 HG22 ILE 37 HG22 ILE 37 -1.650 12.400 -1.384
282 HG23 ILE 37 HG23 ILE 37 -0.964 13.388 -0.096
283 HD11 ILE 37 HD11 ILE 37 -1.585 11.110 3.113
284 HD12 ILE 37 HD12 ILE 37 -3.335 10.948 3.023
285 HD13 ILE 37 HD13 ILE 37 -2.622 12.221 4.005
286 H THR 38 HN THR 38 -2.171 9.598 -1.082
287 HA THR 38 HA THR 38 -2.318 10.870 -3.620
288 HB THR 38 HB THR 38 -0.778 8.955 -4.297
289 HG1 THR 38 HG1 THR 38 0.061 7.747 -2.604
290 HG21 THR 38 HG21 THR 38 -0.108 10.837 -2.045
291 HG22 THR 38 HG22 THR 38 0.082 11.136 -3.775
292 HG23 THR 38 HG23 THR 38 1.099 9.940 -2.969
293 H ARG 39 HN ARG 39 -4.119 8.373 -2.202
294 HA ARG 39 HA ARG 39 -5.722 6.961 -2.951
295 HB2 ARG 39 HB2 ARG 39 -5.388 8.530 -5.495
296 HB3 ARG 39 HB1 ARG 39 -6.483 7.178 -5.380
297 HG2 ARG 39 HG2 ARG 39 -7.896 8.915 -5.002
298 HG3 ARG 39 HG1 ARG 39 -7.426 8.509 -3.344
299 HD2 ARG 39 HD2 ARG 39 -5.654 10.157 -3.479
300 HD3 ARG 39 HD1 ARG 39 -6.190 10.620 -5.086
301 HE ARG 39 HE ARG 39 -8.321 10.803 -3.208
302 HH11 ARG 39 HH11 ARG 39 -5.431 12.476 -4.275
303 HH12 ARG 39 HH12 ARG 39 -6.041 14.048 -3.876
304 HH21 ARG 39 HH21 ARG 39 -9.117 12.869 -2.678
305 HH22 ARG 39 HH22 ARG 39 -8.134 14.274 -2.955
306 H GLN 40 HN GLN 40 -3.204 5.919 -2.758
307 HA GLN 40 HA GLN 40 -2.897 4.321 -5.200
308 HB2 GLN 40 HB2 GLN 40 -0.849 5.012 -3.147
309 HB3 GLN 40 HB1 GLN 40 -0.550 4.102 -4.607
310 HG2 GLN 40 HG2 GLN 40 -1.020 6.047 -5.912
311 HG3 GLN 40 HG1 GLN 40 -1.448 6.964 -4.485
312 HE21 GLN 40 HE21 GLN 40 0.569 7.425 -6.525
313 HE22 GLN 40 HE22 GLN 40 2.076 7.516 -5.685
314 H THR 41 HN THR 41 -2.065 2.142 -4.834
315 HA THR 41 HA THR 41 -2.467 1.071 -2.189
316 HB THR 41 HB THR 41 -4.624 0.635 -2.760
317 HG1 THR 41 HG1 THR 41 -4.301 -1.661 -3.992
318 HG21 THR 41 HG21 THR 41 -4.583 1.581 -4.930
319 HG22 THR 41 HG22 THR 41 -5.371 0.002 -5.027
320 HG23 THR 41 HG23 THR 41 -3.707 0.199 -5.588
321 H GLN 42 HN GLN 42 -1.094 -0.615 -1.748
322 HA GLN 42 HA GLN 42 0.314 -1.781 -4.067
323 HB2 GLN 42 HB2 GLN 42 2.339 -1.863 -2.421
324 HB3 GLN 42 HB1 GLN 42 1.992 -0.398 -3.328
325 HG2 GLN 42 HG2 GLN 42 1.049 0.654 -1.435
326 HG3 GLN 42 HG1 GLN 42 1.020 -0.854 -0.523
327 HE21 GLN 42 HE21 GLN 42 3.090 1.627 -1.879
328 HE22 GLN 42 HE22 GLN 42 4.436 1.335 -0.837
329 H TRP 43 HN TRP 43 0.555 -3.899 -4.085
330 HA TRP 43 HA TRP 43 -0.487 -5.468 -1.853
331 HB2 TRP 43 HB2 TRP 43 -1.361 -6.045 -4.008
332 HB3 TRP 43 HB1 TRP 43 0.244 -6.126 -4.712
333 HD1 TRP 43 HD1 TRP 43 -2.007 -8.086 -2.261
334 HE1 TRP 43 HE1 TRP 43 -1.281 -10.553 -2.305
335 HE3 TRP 43 HE3 TRP 43 2.075 -7.688 -5.314
336 HZ2 TRP 43 HZ2 TRP 43 0.745 -12.124 -3.471
337 HZ3 TRP 43 HZ3 TRP 43 3.347 -9.724 -5.851
338 HH2 TRP 43 HH2 TRP 43 2.693 -11.895 -4.946
339 H ASP 44 HN ASP 44 2.454 -4.937 -3.668
340 HA ASP 44 HA ASP 44 3.828 -7.024 -2.124
341 HB2 ASP 44 HB2 ASP 44 3.875 -7.554 -4.421
342 HB3 ASP 44 HB1 ASP 44 4.303 -5.910 -4.874
343 HA PRO 45 HA PRO 45 7.004 -3.153 -2.631
344 HB2 PRO 45 HB2 PRO 45 4.870 -1.206 -1.843
345 HB3 PRO 45 HB1 PRO 45 6.336 -0.945 -2.799
346 HG2 PRO 45 HG2 PRO 45 4.023 -1.206 -4.027
347 HG3 PRO 45 HG1 PRO 45 5.460 -2.024 -4.671
348 HD2 PRO 45 HD2 PRO 45 3.145 -3.155 -3.168
349 HD3 PRO 45 HD1 PRO 45 4.093 -3.870 -4.485
350 HA PRO 46 HA PRO 46 7.543 -3.509 1.751
351 HB2 PRO 46 HB2 PRO 46 10.057 -2.128 1.420
352 HB3 PRO 46 HB1 PRO 46 9.765 -3.830 1.779
353 HG2 PRO 46 HG2 PRO 46 10.781 -2.944 -0.571
354 HG3 PRO 46 HG1 PRO 46 9.852 -4.439 -0.418
355 HD2 PRO 46 HD2 PRO 46 8.981 -1.746 -1.392
356 HD3 PRO 46 HD1 PRO 46 8.571 -3.356 -2.023
357 H THR 47 HN THR 47 7.912 -2.179 3.596
358 HA THR 47 HA THR 47 6.600 0.156 3.826
359 HB THR 47 HB THR 47 8.210 0.342 5.874
360 HG1 THR 47 HG1 THR 47 9.823 -1.047 5.399
361 HG21 THR 47 HG21 THR 47 5.848 -0.426 5.831
362 HG22 THR 47 HG22 THR 47 6.830 -1.178 7.085
363 HG23 THR 47 HG23 THR 47 6.441 -2.068 5.611
364 H TRP 48 HN TRP 48 7.385 2.206 4.445
365 HA TRP 48 HA TRP 48 9.199 3.377 2.594
366 HB2 TRP 48 HB2 TRP 48 7.184 4.467 3.781
367 HB3 TRP 48 HB1 TRP 48 8.287 4.682 5.128
368 HD1 TRP 48 HD1 TRP 48 9.151 5.218 1.398
369 HE1 TRP 48 HE1 TRP 48 9.917 7.657 1.101
370 HE3 TRP 48 HE3 TRP 48 8.275 6.930 6.140
371 HZ2 TRP 48 HZ2 TRP 48 10.113 9.998 2.664
372 HZ3 TRP 48 HZ3 TRP 48 8.776 9.284 6.654
373 HH2 TRP 48 HH2 TRP 48 9.676 10.783 4.950
374 H GLU 49 HN GLU 49 9.434 1.969 5.681
375 HA GLU 49 HA GLU 49 12.208 2.878 5.961
376 HB2 GLU 49 HB2 GLU 49 10.307 1.626 7.949
377 HB3 GLU 49 HB1 GLU 49 12.025 1.841 8.253
378 HG2 GLU 49 HG2 GLU 49 11.060 3.672 9.263
379 HG3 GLU 49 HG1 GLU 49 11.659 4.255 7.710
380 H SER 50 HN SER 50 13.824 1.454 5.746
381 HA SER 50 HA SER 50 13.063 -1.333 5.175
382 HB2 SER 50 HB2 SER 50 13.107 -0.138 3.041
383 HB3 SER 50 HB1 SER 50 14.735 0.446 3.384
384 HG SER 50 HG SER 50 15.460 -1.699 3.319
385 HA PRO 51 HA PRO 51 16.834 -2.230 7.462
386 HB2 PRO 51 HB2 PRO 51 16.787 -4.896 6.883
387 HB3 PRO 51 HB1 PRO 51 15.846 -4.168 8.188
388 HG2 PRO 51 HG2 PRO 51 14.981 -4.911 5.421
389 HG3 PRO 51 HG1 PRO 51 14.140 -5.160 6.963
390 HD2 PRO 51 HD2 PRO 51 13.482 -3.146 5.310
391 HD3 PRO 51 HD1 PRO 51 13.429 -2.961 7.074
392 H GLY 52 HN GLY 52 18.923 -2.955 6.907
393 HA2 GLY 52 HA2 GLY 52 19.654 -2.609 4.180
394 HA3 GLY 52 HA1 GLY 52 20.715 -3.151 5.473
395 H ASP 53 HN ASP 53 18.732 -5.289 6.138
396 HA ASP 53 HA ASP 53 19.986 -7.360 4.682
397 HB2 ASP 53 HB2 ASP 53 19.179 -7.636 6.983
398 HB3 ASP 53 HB1 ASP 53 17.520 -7.452 6.426
399 H ASP 54 HN ASP 54 16.734 -5.949 4.463
400 HA ASP 54 HA ASP 54 15.972 -7.892 2.445
401 HB2 ASP 54 HB2 ASP 54 14.483 -5.675 3.837
402 HB3 ASP 54 HB1 ASP 54 13.785 -6.558 2.483
403 H ALA 55 HN ALA 55 16.528 -4.379 2.617
404 HA ALA 55 HA ALA 55 16.655 -4.385 -0.304
405 HB1 ALA 55 HB1 ALA 55 14.358 -3.769 0.284
406 HB2 ALA 55 HB2 ALA 55 15.219 -2.450 -0.509
407 HB3 ALA 55 HB3 ALA 55 14.973 -2.418 1.238
408 H SER 56 HN SER 56 18.767 -3.983 -0.393
409 HA SER 56 HA SER 56 19.547 -1.259 0.314
410 HB2 SER 56 HB2 SER 56 21.914 -2.336 0.678
411 HB3 SER 56 HB1 SER 56 20.728 -2.372 1.981
412 HG SER 56 HG SER 56 20.857 -4.455 1.918
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 -13.015 -0.859 4.329
2 H2 GLY 1 HT2 GLY 1 -12.347 -1.070 2.784
3 H3 GLY 1 HT3 GLY 1 -13.434 0.201 3.070
4 HA2 GLY 1 HA1 GLY 1 -10.690 -0.087 4.163
5 HA3 GLY 1 HA2 GLY 1 -11.237 1.102 2.989
6 H SER 2 HN SER 2 -10.054 1.320 5.749
7 HA SER 2 HA SER 2 -12.123 2.072 7.541
8 HB2 SER 2 HB2 SER 2 -9.231 2.919 7.685
9 HB3 SER 2 HB1 SER 2 -10.360 2.688 9.020
10 HG SER 2 HG SER 2 -9.927 0.635 9.023
11 H ASP 3 HN ASP 3 -9.728 4.008 5.747
12 HA ASP 3 HA ASP 3 -11.303 6.410 6.215
13 HB2 ASP 3 HB2 ASP 3 -8.646 6.014 4.826
14 HB3 ASP 3 HB1 ASP 3 -9.438 7.574 5.028
15 H LEU 4 HN LEU 4 -10.168 4.421 3.549
16 HA LEU 4 HA LEU 4 -12.178 5.631 1.791
17 HB2 LEU 4 HB2 LEU 4 -9.242 5.215 1.231
18 HB3 LEU 4 HB1 LEU 4 -10.422 5.478 -0.039
19 HG LEU 4 HG LEU 4 -9.809 7.429 2.181
20 HD11 LEU 4 HD11 LEU 4 -9.001 7.462 -0.723
21 HD12 LEU 4 HD12 LEU 4 -7.930 7.156 0.644
22 HD13 LEU 4 HD13 LEU 4 -8.693 8.735 0.457
23 HD21 LEU 4 HD21 LEU 4 -12.091 7.630 1.360
24 HD22 LEU 4 HD22 LEU 4 -11.502 7.698 -0.301
25 HD23 LEU 4 HD23 LEU 4 -11.116 8.999 0.824
26 HA PRO 5 HA PRO 5 -12.943 1.385 0.502
27 HB2 PRO 5 HB2 PRO 5 -13.558 2.585 -2.132
28 HB3 PRO 5 HB1 PRO 5 -14.590 1.612 -1.080
29 HG2 PRO 5 HG2 PRO 5 -15.011 4.234 -1.386
30 HG3 PRO 5 HG1 PRO 5 -15.252 3.436 0.181
31 HD2 PRO 5 HD2 PRO 5 -12.954 5.112 -0.758
32 HD3 PRO 5 HD1 PRO 5 -13.766 5.097 0.822
33 HA PRO 6 HA PRO 6 -9.158 0.324 -1.323
34 HB2 PRO 6 HB2 PRO 6 -9.764 -1.890 -2.831
35 HB3 PRO 6 HB1 PRO 6 -9.600 -1.905 -1.072
36 HG2 PRO 6 HG2 PRO 6 -12.071 -1.792 -2.748
37 HG3 PRO 6 HG1 PRO 6 -11.769 -2.696 -1.252
38 HD2 PRO 6 HD2 PRO 6 -13.180 -0.393 -1.293
39 HD3 PRO 6 HD1 PRO 6 -12.160 -0.858 0.086
40 HA PRO 7 HA PRO 7 -9.105 2.155 -5.358
41 HB2 PRO 7 HB2 PRO 7 -6.262 2.151 -5.254
42 HB3 PRO 7 HB1 PRO 7 -7.342 3.484 -4.872
43 HG2 PRO 7 HG2 PRO 7 -5.729 2.185 -3.050
44 HG3 PRO 7 HG1 PRO 7 -7.177 3.116 -2.628
45 HD2 PRO 7 HD2 PRO 7 -6.850 0.158 -2.942
46 HD3 PRO 7 HD1 PRO 7 -7.791 1.068 -1.737
47 H SER 8 HN SER 8 -8.500 1.680 -7.481
48 HA SER 8 HA SER 8 -7.403 -0.965 -8.022
49 HB2 SER 8 HB2 SER 8 -9.230 0.407 -9.381
50 HB3 SER 8 HB1 SER 8 -7.813 1.146 -10.125
51 HG SER 8 HG SER 8 -8.495 -1.614 -10.062
52 HA PRO 9 HA PRO 9 -3.404 0.331 -7.507
53 HB2 PRO 9 HB2 PRO 9 -1.922 -1.202 -9.170
54 HB3 PRO 9 HB1 PRO 9 -2.781 -1.850 -7.768
55 HG2 PRO 9 HG2 PRO 9 -3.575 -1.879 -10.655
56 HG3 PRO 9 HG1 PRO 9 -3.696 -3.175 -9.452
57 HD2 PRO 9 HD2 PRO 9 -5.802 -1.630 -10.184
58 HD3 PRO 9 HD1 PRO 9 -5.638 -2.328 -8.559
59 HA PRO 10 HA PRO 10 -1.976 3.264 -10.577
60 HB2 PRO 10 HB2 PRO 10 -0.336 4.456 -8.626
61 HB3 PRO 10 HB1 PRO 10 -1.972 4.947 -9.065
62 HG2 PRO 10 HG2 PRO 10 -1.164 3.875 -6.604
63 HG3 PRO 10 HG1 PRO 10 -2.833 4.068 -7.170
64 HD2 PRO 10 HD2 PRO 10 -1.090 1.646 -7.184
65 HD3 PRO 10 HD1 PRO 10 -2.846 1.778 -6.940
66 H ALA 11 HN ALA 11 -0.048 3.623 -11.679
67 HA ALA 11 HA ALA 11 2.149 1.816 -11.305
68 HB1 ALA 11 HB1 ALA 11 1.957 4.300 -13.016
69 HB2 ALA 11 HB2 ALA 11 1.548 2.663 -13.528
70 HB3 ALA 11 HB3 ALA 11 3.215 3.064 -13.114
71 H ALA 12 HN ALA 12 1.309 5.065 -10.435
72 HA ALA 12 HA ALA 12 3.742 6.069 -9.524
73 HB1 ALA 12 HB1 ALA 12 0.967 6.659 -8.519
74 HB2 ALA 12 HB2 ALA 12 1.773 7.455 -9.872
75 HB3 ALA 12 HB3 ALA 12 2.396 7.652 -8.232
76 H ALA 13 HN ALA 13 1.911 3.558 -8.264
77 HA ALA 13 HA ALA 13 1.900 3.937 -5.518
78 HB1 ALA 13 HB1 ALA 13 0.592 2.231 -6.712
79 HB2 ALA 13 HB2 ALA 13 1.458 1.576 -5.323
80 HB3 ALA 13 HB3 ALA 13 2.068 1.296 -6.953
81 H THR 14 HN THR 14 4.513 2.913 -7.542
82 HA THR 14 HA THR 14 6.001 1.501 -5.580
83 HB THR 14 HB THR 14 6.350 1.058 -7.940
84 HG1 THR 14 HG1 THR 14 8.447 1.948 -6.317
85 HG21 THR 14 HG21 THR 14 7.459 3.865 -8.111
86 HG22 THR 14 HG22 THR 14 5.930 3.317 -8.799
87 HG23 THR 14 HG23 THR 14 7.450 2.664 -9.407
88 H ILE 15 HN ILE 15 5.620 4.849 -6.264
89 HA ILE 15 HA ILE 15 8.088 5.919 -5.566
90 HB ILE 15 HB ILE 15 6.021 7.004 -6.650
91 HG12 ILE 15 HG12 ILE 15 6.716 9.238 -5.966
92 HG13 ILE 15 HG11 ILE 15 7.553 8.571 -4.567
93 HG21 ILE 15 HG21 ILE 15 4.398 6.585 -4.942
94 HG22 ILE 15 HG22 ILE 15 4.635 8.323 -5.089
95 HG23 ILE 15 HG23 ILE 15 5.365 7.449 -3.747
96 HD11 ILE 15 HD11 ILE 15 9.070 9.134 -6.407
97 HD12 ILE 15 HD12 ILE 15 8.225 7.969 -7.430
98 HD13 ILE 15 HD13 ILE 15 9.101 7.417 -6.003
99 H VAL 16 HN VAL 16 7.592 7.780 -3.579
100 HA VAL 16 HA VAL 16 8.375 6.229 -1.300
101 HB VAL 16 HB VAL 16 7.843 9.201 -1.482
102 HG11 VAL 16 HG11 VAL 16 9.357 9.313 0.484
103 HG12 VAL 16 HG12 VAL 16 9.311 7.549 0.564
104 HG13 VAL 16 HG13 VAL 16 7.835 8.482 0.808
105 HG21 VAL 16 HG21 VAL 16 10.264 9.420 -1.761
106 HG22 VAL 16 HG22 VAL 16 9.542 8.493 -3.074
107 HG23 VAL 16 HG23 VAL 16 10.419 7.663 -1.789
108 H LEU 17 HN LEU 17 7.344 6.163 0.732
109 HA LEU 17 HA LEU 17 4.428 6.394 0.491
110 HB2 LEU 17 HB2 LEU 17 6.215 4.207 1.447
111 HB3 LEU 17 HB1 LEU 17 4.556 4.258 1.949
112 HG LEU 17 HG LEU 17 5.459 4.180 -0.926
113 HD11 LEU 17 HD11 LEU 17 4.817 1.833 -0.912
114 HD12 LEU 17 HD12 LEU 17 4.458 1.931 0.811
115 HD13 LEU 17 HD13 LEU 17 6.115 2.130 0.245
116 HD21 LEU 17 HD21 LEU 17 3.231 3.996 -1.487
117 HD22 LEU 17 HD22 LEU 17 3.208 5.133 -0.135
118 HD23 LEU 17 HD23 LEU 17 2.769 3.448 0.126
119 HA PRO 18 HA PRO 18 4.835 8.242 4.587
120 HB2 PRO 18 HB2 PRO 18 2.268 9.395 4.261
121 HB3 PRO 18 HB1 PRO 18 3.826 10.177 3.991
122 HG2 PRO 18 HG2 PRO 18 1.950 9.617 2.016
123 HG3 PRO 18 HG1 PRO 18 3.668 9.951 1.733
124 HD2 PRO 18 HD2 PRO 18 2.255 7.310 1.910
125 HD3 PRO 18 HD1 PRO 18 3.536 7.831 0.789
126 HA PRO 19 HA PRO 19 2.992 5.315 7.181
127 HB2 PRO 19 HB2 PRO 19 2.322 7.663 8.886
128 HB3 PRO 19 HB1 PRO 19 3.126 6.167 9.307
129 HG2 PRO 19 HG2 PRO 19 4.603 8.270 9.003
130 HG3 PRO 19 HG1 PRO 19 5.105 6.777 8.174
131 HD2 PRO 19 HD2 PRO 19 3.590 9.108 7.079
132 HD3 PRO 19 HD1 PRO 19 5.019 8.315 6.393
133 H ASN 20 HN ASN 20 1.021 8.033 6.396
134 HA ASN 20 HA ASN 20 -1.325 7.538 7.775
135 HB2 ASN 20 HB2 ASN 20 -1.176 8.656 4.977
136 HB3 ASN 20 HB1 ASN 20 -2.514 8.833 6.097
137 HD21 ASN 20 HD21 ASN 20 -2.537 10.965 6.184
138 HD22 ASN 20 HD22 ASN 20 -1.244 11.936 6.777
139 H TRP 21 HN TRP 21 -0.074 5.568 5.295
140 HA TRP 21 HA TRP 21 -2.606 4.938 4.111
141 HB2 TRP 21 HB2 TRP 21 -1.381 3.448 2.670
142 HB3 TRP 21 HB1 TRP 21 -0.531 4.980 2.775
143 HD1 TRP 21 HD1 TRP 21 0.942 4.101 5.657
144 HE1 TRP 21 HE1 TRP 21 2.956 2.508 5.459
145 HE3 TRP 21 HE3 TRP 21 0.022 2.216 1.006
146 HZ2 TRP 21 HZ2 TRP 21 4.014 0.704 3.574
147 HZ3 TRP 21 HZ3 TRP 21 1.585 0.565 0.073
148 HH2 TRP 21 HH2 TRP 21 3.542 -0.174 1.334
149 H LYS 22 HN LYS 22 -3.540 2.892 4.092
150 HA LYS 22 HA LYS 22 -3.215 1.507 6.673
151 HB2 LYS 22 HB2 LYS 22 -5.724 1.742 5.033
152 HB3 LYS 22 HB1 LYS 22 -5.569 1.059 6.635
153 HG2 LYS 22 HG2 LYS 22 -5.083 3.939 5.967
154 HG3 LYS 22 HG1 LYS 22 -6.578 3.287 6.644
155 HD2 LYS 22 HD2 LYS 22 -4.781 2.280 8.388
156 HD3 LYS 22 HD1 LYS 22 -3.977 3.783 7.924
157 HE2 LYS 22 HE2 LYS 22 -5.933 5.037 8.462
158 HE3 LYS 22 HE1 LYS 22 -6.800 3.560 8.869
159 HZ1 LYS 22 HZ1 LYS 22 -5.270 3.194 10.688
160 HZ2 LYS 22 HZ2 LYS 22 -5.979 4.728 10.840
161 HZ3 LYS 22 HZ3 LYS 22 -4.390 4.580 10.271
162 H THR 23 HN THR 23 -4.147 -0.738 6.595
163 HA THR 23 HA THR 23 -3.780 -1.995 3.970
164 HB THR 23 HB THR 23 -3.056 -4.062 5.187
165 HG1 THR 23 HG1 THR 23 -2.419 -3.863 7.340
166 HG21 THR 23 HG21 THR 23 -1.631 -1.708 4.588
167 HG22 THR 23 HG22 THR 23 -1.030 -3.368 4.604
168 HG23 THR 23 HG23 THR 23 -0.937 -2.377 6.063
169 H ALA 24 HN ALA 24 -5.451 -3.051 3.235
170 HA ALA 24 HA ALA 24 -7.422 -4.115 5.123
171 HB1 ALA 24 HB1 ALA 24 -9.150 -2.968 4.286
172 HB2 ALA 24 HB2 ALA 24 -8.607 -3.225 2.633
173 HB3 ALA 24 HB3 ALA 24 -7.944 -1.890 3.577
174 H ARG 25 HN ARG 25 -8.776 -5.800 4.090
175 HA ARG 25 HA ARG 25 -7.213 -7.221 2.059
176 HB2 ARG 25 HB2 ARG 25 -8.746 -8.700 4.108
177 HB3 ARG 25 HB1 ARG 25 -7.322 -9.170 3.265
178 HG2 ARG 25 HG2 ARG 25 -6.523 -8.943 5.378
179 HG3 ARG 25 HG1 ARG 25 -6.196 -7.337 4.720
180 HD2 ARG 25 HD2 ARG 25 -7.200 -7.139 6.914
181 HD3 ARG 25 HD1 ARG 25 -8.294 -6.540 5.670
182 HE ARG 25 HE ARG 25 -9.173 -9.037 5.933
183 HH11 ARG 25 HH11 ARG 25 -8.356 -6.640 8.366
184 HH12 ARG 25 HH12 ARG 25 -9.514 -7.233 9.517
185 HH21 ARG 25 HH21 ARG 25 -10.710 -9.809 7.448
186 HH22 ARG 25 HH22 ARG 25 -10.839 -9.046 9.009
187 H ASP 26 HN ASP 26 -8.423 -8.604 0.653
188 HA ASP 26 HA ASP 26 -11.139 -7.821 0.151
189 HB2 ASP 26 HB2 ASP 26 -9.442 -10.051 -0.989
190 HB3 ASP 26 HB1 ASP 26 -11.131 -9.860 -1.404
191 HA PRO 27 HA PRO 27 -13.732 -10.419 2.455
192 HB2 PRO 27 HB2 PRO 27 -14.697 -12.172 0.466
193 HB3 PRO 27 HB1 PRO 27 -15.433 -10.668 0.996
194 HG2 PRO 27 HG2 PRO 27 -13.604 -11.146 -1.283
195 HG3 PRO 27 HG1 PRO 27 -15.038 -10.103 -1.200
196 HD2 PRO 27 HD2 PRO 27 -12.659 -9.018 -1.070
197 HD3 PRO 27 HD1 PRO 27 -13.892 -8.488 0.091
198 H GLU 28 HN GLU 28 -11.743 -12.159 0.099
199 HA GLU 28 HA GLU 28 -11.780 -14.547 1.761
200 HB2 GLU 28 HB2 GLU 28 -10.501 -14.176 -0.941
201 HB3 GLU 28 HB1 GLU 28 -10.924 -15.695 -0.154
202 HG2 GLU 28 HG2 GLU 28 -13.330 -14.880 -0.239
203 HG3 GLU 28 HG1 GLU 28 -12.754 -13.632 -1.338
204 H GLY 29 HN GLY 29 -10.393 -12.385 2.849
205 HA2 GLY 29 HA2 GLY 29 -8.575 -12.208 4.211
206 HA3 GLY 29 HA1 GLY 29 -8.283 -13.899 3.876
207 H LYS 30 HN LYS 30 -8.160 -11.737 1.141
208 HA LYS 30 HA LYS 30 -5.243 -12.004 1.158
209 HB2 LYS 30 HB2 LYS 30 -7.092 -10.848 -0.940
210 HB3 LYS 30 HB1 LYS 30 -5.357 -11.047 -1.118
211 HG2 LYS 30 HG2 LYS 30 -5.623 -13.473 -0.950
212 HG3 LYS 30 HG1 LYS 30 -7.368 -13.264 -0.789
213 HD2 LYS 30 HD2 LYS 30 -7.451 -12.202 -2.986
214 HD3 LYS 30 HD1 LYS 30 -5.705 -12.386 -3.148
215 HE2 LYS 30 HE2 LYS 30 -5.951 -14.813 -3.072
216 HE3 LYS 30 HE1 LYS 30 -7.697 -14.635 -2.884
217 HZ1 LYS 30 HZ1 LYS 30 -7.696 -13.466 -5.059
218 HZ2 LYS 30 HZ2 LYS 30 -7.235 -15.090 -5.162
219 HZ3 LYS 30 HZ3 LYS 30 -6.059 -13.872 -5.247
220 H ILE 31 HN ILE 31 -3.874 -10.265 1.483
221 HA ILE 31 HA ILE 31 -5.246 -7.889 2.583
222 HB ILE 31 HB ILE 31 -4.038 -9.013 4.294
223 HG12 ILE 31 HG12 ILE 31 -2.275 -7.307 4.848
224 HG13 ILE 31 HG11 ILE 31 -2.565 -6.583 3.287
225 HG21 ILE 31 HG21 ILE 31 -2.550 -10.400 3.058
226 HG22 ILE 31 HG22 ILE 31 -1.580 -9.395 4.137
227 HG23 ILE 31 HG23 ILE 31 -1.684 -9.002 2.420
228 HD11 ILE 31 HD11 ILE 31 -4.590 -6.893 5.481
229 HD12 ILE 31 HD12 ILE 31 -4.845 -6.128 3.914
230 HD13 ILE 31 HD13 ILE 31 -3.726 -5.411 5.069
231 H TYR 32 HN TYR 32 -4.596 -5.826 1.963
232 HA TYR 32 HA TYR 32 -2.409 -5.565 0.015
233 HB2 TYR 32 HB2 TYR 32 -5.159 -4.370 -0.411
234 HB3 TYR 32 HB1 TYR 32 -3.777 -4.249 -1.499
235 HD1 TYR 32 HD1 TYR 32 -3.059 -6.207 -2.804
236 HD2 TYR 32 HD2 TYR 32 -6.517 -6.329 -0.341
237 HE1 TYR 32 HE1 TYR 32 -3.809 -8.236 -3.973
238 HE2 TYR 32 HE2 TYR 32 -7.278 -8.353 -1.498
239 HH TYR 32 HH TYR 32 -6.984 -9.536 -3.525
240 H TYR 33 HN TYR 33 -2.287 -3.073 -0.560
241 HA TYR 33 HA TYR 33 -2.350 -1.545 1.968
242 HB2 TYR 33 HB2 TYR 33 -0.396 -1.396 -0.328
243 HB3 TYR 33 HB1 TYR 33 -0.366 -0.376 1.086
244 HD1 TYR 33 HD1 TYR 33 0.244 -3.775 -0.179
245 HD2 TYR 33 HD2 TYR 33 0.583 -1.156 3.155
246 HE1 TYR 33 HE1 TYR 33 1.772 -5.362 0.907
247 HE2 TYR 33 HE2 TYR 33 2.107 -2.741 4.253
248 HH TYR 33 HH TYR 33 2.715 -5.055 4.199
249 H TYR 34 HN TYR 34 -3.200 0.551 1.846
250 HA TYR 34 HA TYR 34 -3.389 1.784 -0.785
251 HB2 TYR 34 HB2 TYR 34 -5.703 2.509 -0.493
252 HB3 TYR 34 HB1 TYR 34 -5.580 0.760 -0.542
253 HD1 TYR 34 HD1 TYR 34 -5.801 -0.533 1.613
254 HD2 TYR 34 HD2 TYR 34 -6.668 3.624 1.347
255 HE1 TYR 34 HE1 TYR 34 -7.123 -0.681 3.678
256 HE2 TYR 34 HE2 TYR 34 -7.985 3.485 3.417
257 HH TYR 34 HH TYR 34 -7.870 0.817 5.491
258 H HIS 35 HN HIS 35 -3.029 3.919 -0.860
259 HA HIS 35 HA HIS 35 -2.512 5.204 1.736
260 HB2 HIS 35 HB2 HIS 35 -0.674 5.213 -0.054
261 HB3 HIS 35 HB1 HIS 35 -1.703 6.312 -0.955
262 HD1 HIS 35 HD1 HIS 35 -0.531 8.498 -0.741
263 HD2 HIS 35 HD2 HIS 35 -0.858 6.525 2.903
264 HE1 HIS 35 HE1 HIS 35 0.211 10.156 0.996
265 HE2 HIS 35 HE2 HIS 35 0.204 8.867 3.159
266 H VAL 36 HN VAL 36 -3.768 6.654 2.471
267 HA VAL 36 HA VAL 36 -6.225 7.190 1.214
268 HB VAL 36 HB VAL 36 -6.569 8.571 3.320
269 HG11 VAL 36 HG11 VAL 36 -5.590 5.791 3.903
270 HG12 VAL 36 HG12 VAL 36 -7.018 6.054 2.910
271 HG13 VAL 36 HG13 VAL 36 -6.986 6.633 4.576
272 HG21 VAL 36 HG21 VAL 36 -4.301 9.172 3.813
273 HG22 VAL 36 HG22 VAL 36 -3.798 7.474 3.810
274 HG23 VAL 36 HG23 VAL 36 -4.853 8.090 5.095
275 H ILE 37 HN ILE 37 -3.337 9.251 1.753
276 HA ILE 37 HA ILE 37 -4.603 11.648 1.006
277 HB ILE 37 HB ILE 37 -1.714 10.846 1.061
278 HG12 ILE 37 HG12 ILE 37 -1.785 12.928 2.629
279 HG13 ILE 37 HG11 ILE 37 -3.517 12.629 2.600
280 HG21 ILE 37 HG21 ILE 37 -2.757 13.518 0.122
281 HG22 ILE 37 HG22 ILE 37 -1.918 12.325 -0.870
282 HG23 ILE 37 HG23 ILE 37 -1.070 13.129 0.451
283 HD11 ILE 37 HD11 ILE 37 -1.543 10.521 3.350
284 HD12 ILE 37 HD12 ILE 37 -3.285 10.549 3.599
285 HD13 ILE 37 HD13 ILE 37 -2.256 11.637 4.515
286 H THR 38 HN THR 38 -2.479 9.497 -0.827
287 HA THR 38 HA THR 38 -2.782 11.108 -3.191
288 HB THR 38 HB THR 38 -1.153 9.389 -4.131
289 HG1 THR 38 HG1 THR 38 -0.199 8.025 -2.654
290 HG21 THR 38 HG21 THR 38 -0.509 11.034 -1.697
291 HG22 THR 38 HG22 THR 38 -0.423 11.560 -3.383
292 HG23 THR 38 HG23 THR 38 0.711 10.351 -2.775
293 H ARG 39 HN ARG 39 -4.348 8.350 -1.992
294 HA ARG 39 HA ARG 39 -5.703 6.759 -2.860
295 HB2 ARG 39 HB2 ARG 39 -5.735 8.736 -5.105
296 HB3 ARG 39 HB1 ARG 39 -6.398 7.144 -5.369
297 HG2 ARG 39 HG2 ARG 39 -8.238 8.398 -4.789
298 HG3 ARG 39 HG1 ARG 39 -7.797 7.608 -3.269
299 HD2 ARG 39 HD2 ARG 39 -6.438 9.630 -2.760
300 HD3 ARG 39 HD1 ARG 39 -7.198 10.415 -4.138
301 HE ARG 39 HE ARG 39 -9.338 9.574 -2.743
302 HH11 ARG 39 HH11 ARG 39 -6.491 11.372 -1.797
303 HH12 ARG 39 HH12 ARG 39 -7.288 12.203 -0.496
304 HH21 ARG 39 HH21 ARG 39 -10.403 10.691 -1.061
305 HH22 ARG 39 HH22 ARG 39 -9.515 11.813 -0.076
306 H GLN 40 HN GLN 40 -3.214 5.978 -2.673
307 HA GLN 40 HA GLN 40 -2.650 4.600 -5.199
308 HB2 GLN 40 HB2 GLN 40 -0.834 5.076 -2.873
309 HB3 GLN 40 HB1 GLN 40 -0.377 4.295 -4.367
310 HG2 GLN 40 HG2 GLN 40 -0.780 6.365 -5.532
311 HG3 GLN 40 HG1 GLN 40 -1.229 7.143 -4.030
312 HE21 GLN 40 HE21 GLN 40 1.290 6.045 -6.041
313 HE22 GLN 40 HE22 GLN 40 2.587 6.702 -5.128
314 H THR 41 HN THR 41 -1.822 2.380 -4.896
315 HA THR 41 HA THR 41 -2.408 1.078 -2.424
316 HB THR 41 HB THR 41 -4.603 0.876 -3.100
317 HG1 THR 41 HG1 THR 41 -3.694 -1.200 -2.667
318 HG21 THR 41 HG21 THR 41 -4.399 1.831 -5.253
319 HG22 THR 41 HG22 THR 41 -5.279 0.305 -5.406
320 HG23 THR 41 HG23 THR 41 -3.579 0.404 -5.885
321 H GLN 42 HN GLN 42 -1.293 -0.851 -2.208
322 HA GLN 42 HA GLN 42 0.075 -1.796 -4.644
323 HB2 GLN 42 HB2 GLN 42 1.587 -2.580 -2.379
324 HB3 GLN 42 HB1 GLN 42 2.070 -1.521 -3.689
325 HG2 GLN 42 HG2 GLN 42 0.453 -0.374 -1.482
326 HG3 GLN 42 HG1 GLN 42 2.147 -0.746 -1.178
327 HE21 GLN 42 HE21 GLN 42 3.735 0.398 -2.259
328 HE22 GLN 42 HE22 GLN 42 3.413 1.887 -3.083
329 H TRP 43 HN TRP 43 -0.390 -3.777 -5.138
330 HA TRP 43 HA TRP 43 -1.574 -5.559 -3.148
331 HB2 TRP 43 HB2 TRP 43 -1.220 -5.906 -6.143
332 HB3 TRP 43 HB1 TRP 43 -2.080 -7.014 -5.081
333 HD1 TRP 43 HD1 TRP 43 -3.050 -3.742 -3.864
334 HE1 TRP 43 HE1 TRP 43 -5.282 -2.964 -4.877
335 HE3 TRP 43 HE3 TRP 43 -3.391 -7.077 -7.726
336 HZ2 TRP 43 HZ2 TRP 43 -6.969 -3.678 -7.021
337 HZ3 TRP 43 HZ3 TRP 43 -5.348 -6.958 -9.210
338 HH2 TRP 43 HH2 TRP 43 -7.100 -5.294 -8.864
339 H ASP 44 HN ASP 44 1.159 -5.204 -5.281
340 HA ASP 44 HA ASP 44 2.441 -7.585 -4.132
341 HB2 ASP 44 HB2 ASP 44 2.175 -7.749 -6.514
342 HB3 ASP 44 HB1 ASP 44 2.880 -6.157 -6.754
343 HA PRO 45 HA PRO 45 5.842 -3.942 -4.249
344 HB2 PRO 45 HB2 PRO 45 3.898 -1.790 -3.551
345 HB3 PRO 45 HB1 PRO 45 5.386 -1.699 -4.501
346 HG2 PRO 45 HG2 PRO 45 3.045 -1.684 -5.725
347 HG3 PRO 45 HG1 PRO 45 4.394 -2.627 -6.389
348 HD2 PRO 45 HD2 PRO 45 1.995 -3.558 -4.869
349 HD3 PRO 45 HD1 PRO 45 2.824 -4.313 -6.246
350 HA PRO 46 HA PRO 46 6.009 -4.351 0.142
351 HB2 PRO 46 HB2 PRO 46 8.400 -3.271 0.576
352 HB3 PRO 46 HB1 PRO 46 8.215 -4.810 -0.276
353 HG2 PRO 46 HG2 PRO 46 8.629 -2.073 -1.388
354 HG3 PRO 46 HG1 PRO 46 9.413 -3.592 -1.844
355 HD2 PRO 46 HD2 PRO 46 7.337 -2.506 -3.234
356 HD3 PRO 46 HD1 PRO 46 7.652 -4.251 -3.161
357 H THR 47 HN THR 47 6.265 -3.100 2.104
358 HA THR 47 HA THR 47 4.808 -0.701 2.124
359 HB THR 47 HB THR 47 4.935 -2.285 4.038
360 HG1 THR 47 HG1 THR 47 4.341 -0.639 5.212
361 HG21 THR 47 HG21 THR 47 7.391 -2.679 3.852
362 HG22 THR 47 HG22 THR 47 6.830 -2.360 5.490
363 HG23 THR 47 HG23 THR 47 7.644 -1.093 4.572
364 H TRP 48 HN TRP 48 6.272 0.748 4.030
365 HA TRP 48 HA TRP 48 7.344 2.741 2.412
366 HB2 TRP 48 HB2 TRP 48 6.496 2.966 4.762
367 HB3 TRP 48 HB1 TRP 48 8.028 2.300 5.304
368 HD1 TRP 48 HD1 TRP 48 9.170 4.377 2.631
369 HE1 TRP 48 HE1 TRP 48 9.804 6.743 3.433
370 HE3 TRP 48 HE3 TRP 48 6.832 4.347 7.176
371 HZ2 TRP 48 HZ2 TRP 48 9.357 8.378 5.687
372 HZ3 TRP 48 HZ3 TRP 48 6.984 6.351 8.596
373 HH2 TRP 48 HH2 TRP 48 8.220 8.323 7.866
374 H GLU 49 HN GLU 49 9.062 0.271 4.311
375 HA GLU 49 HA GLU 49 11.558 1.038 2.984
376 HB2 GLU 49 HB2 GLU 49 11.012 -0.409 5.563
377 HB3 GLU 49 HB1 GLU 49 12.579 -0.478 4.776
378 HG2 GLU 49 HG2 GLU 49 12.887 1.204 6.262
379 HG3 GLU 49 HG1 GLU 49 12.433 2.061 4.796
380 H SER 50 HN SER 50 12.876 -0.515 2.070
381 HA SER 50 HA SER 50 11.641 -3.121 1.557
382 HB2 SER 50 HB2 SER 50 13.414 -3.268 -0.256
383 HB3 SER 50 HB1 SER 50 12.199 -2.013 -0.499
384 HG SER 50 HG SER 50 14.702 -1.634 -0.629
385 HA PRO 51 HA PRO 51 14.274 -5.306 4.200
386 HB2 PRO 51 HB2 PRO 51 15.446 -7.233 2.625
387 HB3 PRO 51 HB1 PRO 51 13.808 -7.321 3.280
388 HG2 PRO 51 HG2 PRO 51 14.717 -6.461 0.564
389 HG3 PRO 51 HG1 PRO 51 13.339 -7.484 1.011
390 HD2 PRO 51 HD2 PRO 51 12.990 -4.920 0.356
391 HD3 PRO 51 HD1 PRO 51 12.048 -5.660 1.671
392 H GLY 52 HN GLY 52 16.434 -6.114 4.707
393 HA2 GLY 52 HA2 GLY 52 18.405 -4.153 4.155
394 HA3 GLY 52 HA1 GLY 52 18.654 -5.648 5.042
395 H ASP 53 HN ASP 53 17.741 -7.330 2.809
396 HA ASP 53 HA ASP 53 20.225 -7.603 1.460
397 HB2 ASP 53 HB2 ASP 53 19.224 -9.424 0.242
398 HB3 ASP 53 HB1 ASP 53 18.680 -9.513 1.912
399 H ASP 54 HN ASP 54 17.225 -6.012 0.709
400 HA ASP 54 HA ASP 54 17.894 -5.473 -2.035
401 HB2 ASP 54 HB2 ASP 54 15.557 -5.572 -1.427
402 HB3 ASP 54 HB1 ASP 54 15.775 -4.322 -0.207
403 H ALA 55 HN ALA 55 17.993 -3.700 1.016
404 HA ALA 55 HA ALA 55 18.853 -1.248 -0.159
405 HB1 ALA 55 HB1 ALA 55 19.185 -0.491 2.135
406 HB2 ALA 55 HB2 ALA 55 18.974 -2.143 2.716
407 HB3 ALA 55 HB3 ALA 55 17.627 -1.300 1.952
408 H SER 56 HN SER 56 20.760 -1.131 -1.152
409 HA SER 56 HA SER 56 23.131 -1.812 0.415
410 HB2 SER 56 HB2 SER 56 22.772 -2.512 -2.510
411 HB3 SER 56 HB1 SER 56 24.246 -2.744 -1.570
412 HG SER 56 HG SER 56 22.196 -3.869 -0.268
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 -10.224 1.304 0.844
2 H2 GLY 1 HT2 GLY 1 -9.875 -0.354 0.753
3 H3 GLY 1 HT3 GLY 1 -8.726 0.786 0.251
4 HA2 GLY 1 HA1 GLY 1 -8.196 -0.157 2.433
5 HA3 GLY 1 HA2 GLY 1 -8.429 1.586 2.477
6 H SER 2 HN SER 2 -8.702 0.739 4.851
7 HA SER 2 HA SER 2 -11.175 -0.464 5.541
8 HB2 SER 2 HB2 SER 2 -10.554 0.462 7.849
9 HB3 SER 2 HB1 SER 2 -9.414 -0.665 7.110
10 HG SER 2 HG SER 2 -9.170 2.077 7.599
11 H ASP 3 HN ASP 3 -10.002 2.871 5.611
12 HA ASP 3 HA ASP 3 -12.584 3.877 6.463
13 HB2 ASP 3 HB2 ASP 3 -9.971 5.285 5.872
14 HB3 ASP 3 HB1 ASP 3 -11.411 6.072 6.513
15 H LEU 4 HN LEU 4 -10.505 3.996 3.648
16 HA LEU 4 HA LEU 4 -12.597 5.450 2.181
17 HB2 LEU 4 HB2 LEU 4 -9.601 5.424 1.815
18 HB3 LEU 4 HB1 LEU 4 -10.711 6.137 0.658
19 HG LEU 4 HG LEU 4 -10.359 7.012 3.527
20 HD11 LEU 4 HD11 LEU 4 -8.455 7.609 2.151
21 HD12 LEU 4 HD12 LEU 4 -9.411 9.039 2.540
22 HD13 LEU 4 HD13 LEU 4 -9.530 8.308 0.940
23 HD21 LEU 4 HD21 LEU 4 -11.813 8.877 2.915
24 HD22 LEU 4 HD22 LEU 4 -12.648 7.330 2.756
25 HD23 LEU 4 HD23 LEU 4 -12.056 8.165 1.320
26 HA PRO 5 HA PRO 5 -13.334 2.020 -0.401
27 HB2 PRO 5 HB2 PRO 5 -13.675 3.239 -2.839
28 HB3 PRO 5 HB1 PRO 5 -14.894 3.233 -1.562
29 HG2 PRO 5 HG2 PRO 5 -12.910 5.355 -2.280
30 HG3 PRO 5 HG1 PRO 5 -14.625 5.524 -1.859
31 HD2 PRO 5 HD2 PRO 5 -12.699 6.049 -0.076
32 HD3 PRO 5 HD1 PRO 5 -14.221 5.274 0.414
33 HA PRO 6 HA PRO 6 -9.549 0.731 -2.107
34 HB2 PRO 6 HB2 PRO 6 -10.356 -1.170 -3.887
35 HB3 PRO 6 HB1 PRO 6 -10.368 -1.402 -2.136
36 HG2 PRO 6 HG2 PRO 6 -12.621 -0.686 -3.967
37 HG3 PRO 6 HG1 PRO 6 -12.603 -1.817 -2.602
38 HD2 PRO 6 HD2 PRO 6 -13.628 0.679 -2.410
39 HD3 PRO 6 HD1 PRO 6 -12.837 -0.138 -1.046
40 HA PRO 7 HA PRO 7 -8.900 2.917 -5.945
41 HB2 PRO 7 HB2 PRO 7 -6.112 2.286 -5.618
42 HB3 PRO 7 HB1 PRO 7 -6.916 3.817 -5.315
43 HG2 PRO 7 HG2 PRO 7 -5.823 2.293 -3.337
44 HG3 PRO 7 HG1 PRO 7 -7.205 3.377 -3.081
45 HD2 PRO 7 HD2 PRO 7 -7.199 0.412 -3.565
46 HD3 PRO 7 HD1 PRO 7 -8.101 1.351 -2.352
47 H SER 8 HN SER 8 -8.267 2.478 -8.062
48 HA SER 8 HA SER 8 -7.696 -0.273 -8.792
49 HB2 SER 8 HB2 SER 8 -7.633 0.776 -11.121
50 HB3 SER 8 HB1 SER 8 -9.178 0.903 -10.281
51 HG SER 8 HG SER 8 -7.232 2.885 -10.778
52 HA PRO 9 HA PRO 9 -3.464 -0.017 -8.385
53 HB2 PRO 9 HB2 PRO 9 -2.320 -0.997 -10.679
54 HB3 PRO 9 HB1 PRO 9 -3.098 -2.007 -9.455
55 HG2 PRO 9 HG2 PRO 9 -4.187 -0.994 -12.048
56 HG3 PRO 9 HG1 PRO 9 -4.366 -2.595 -11.310
57 HD2 PRO 9 HD2 PRO 9 -6.329 -0.745 -11.210
58 HD3 PRO 9 HD1 PRO 9 -6.044 -1.884 -9.878
59 HA PRO 10 HA PRO 10 -2.027 3.707 -10.368
60 HB2 PRO 10 HB2 PRO 10 -0.403 4.418 -8.331
61 HB3 PRO 10 HB1 PRO 10 -2.159 4.588 -8.263
62 HG2 PRO 10 HG2 PRO 10 -0.415 2.717 -6.839
63 HG3 PRO 10 HG1 PRO 10 -2.088 3.178 -6.491
64 HD2 PRO 10 HD2 PRO 10 -1.093 0.821 -7.858
65 HD3 PRO 10 HD1 PRO 10 -2.753 1.197 -7.358
66 H ALA 11 HN ALA 11 -0.188 4.364 -11.477
67 HA ALA 11 HA ALA 11 2.155 2.760 -11.649
68 HB1 ALA 11 HB1 ALA 11 1.746 5.691 -12.281
69 HB2 ALA 11 HB2 ALA 11 1.576 4.345 -13.411
70 HB3 ALA 11 HB3 ALA 11 3.160 4.736 -12.735
71 H ALA 12 HN ALA 12 1.021 5.290 -9.620
72 HA ALA 12 HA ALA 12 3.331 6.154 -8.356
73 HB1 ALA 12 HB1 ALA 12 0.544 6.015 -7.243
74 HB2 ALA 12 HB2 ALA 12 1.201 7.321 -8.227
75 HB3 ALA 12 HB3 ALA 12 1.860 7.008 -6.621
76 H ALA 13 HN ALA 13 1.826 3.142 -8.084
77 HA ALA 13 HA ALA 13 2.028 2.533 -5.379
78 HB1 ALA 13 HB1 ALA 13 2.324 0.639 -7.701
79 HB2 ALA 13 HB2 ALA 13 0.798 1.171 -6.992
80 HB3 ALA 13 HB3 ALA 13 1.923 0.199 -6.041
81 H THR 14 HN THR 14 4.495 2.545 -7.846
82 HA THR 14 HA THR 14 6.390 1.021 -6.340
83 HB THR 14 HB THR 14 6.485 1.082 -8.795
84 HG1 THR 14 HG1 THR 14 8.680 1.888 -7.222
85 HG21 THR 14 HG21 THR 14 7.317 3.961 -8.425
86 HG22 THR 14 HG22 THR 14 5.843 3.384 -9.204
87 HG23 THR 14 HG23 THR 14 7.413 3.057 -9.938
88 H ILE 15 HN ILE 15 5.452 4.351 -6.329
89 HA ILE 15 HA ILE 15 7.980 5.491 -5.750
90 HB ILE 15 HB ILE 15 5.810 6.583 -6.727
91 HG12 ILE 15 HG12 ILE 15 6.600 8.804 -6.030
92 HG13 ILE 15 HG11 ILE 15 7.587 8.058 -4.774
93 HG21 ILE 15 HG21 ILE 15 4.303 6.205 -4.917
94 HG22 ILE 15 HG22 ILE 15 4.602 7.938 -5.032
95 HG23 ILE 15 HG23 ILE 15 5.393 6.990 -3.775
96 HD11 ILE 15 HD11 ILE 15 8.855 8.688 -6.788
97 HD12 ILE 15 HD12 ILE 15 7.880 7.546 -7.718
98 HD13 ILE 15 HD13 ILE 15 8.935 6.964 -6.431
99 H VAL 16 HN VAL 16 7.545 7.199 -3.681
100 HA VAL 16 HA VAL 16 8.312 5.644 -1.434
101 HB VAL 16 HB VAL 16 7.469 8.544 -1.435
102 HG11 VAL 16 HG11 VAL 16 9.097 8.728 0.410
103 HG12 VAL 16 HG12 VAL 16 9.334 6.981 0.341
104 HG13 VAL 16 HG13 VAL 16 7.759 7.642 0.783
105 HG21 VAL 16 HG21 VAL 16 9.757 9.129 -1.932
106 HG22 VAL 16 HG22 VAL 16 9.115 8.103 -3.214
107 HG23 VAL 16 HG23 VAL 16 10.208 7.428 -2.009
108 H LEU 17 HN LEU 17 7.230 5.758 0.689
109 HA LEU 17 HA LEU 17 4.303 5.601 0.336
110 HB2 LEU 17 HB2 LEU 17 5.811 3.479 0.693
111 HB3 LEU 17 HB1 LEU 17 5.793 3.970 2.360
112 HG LEU 17 HG LEU 17 3.294 3.424 0.765
113 HD11 LEU 17 HD11 LEU 17 3.212 1.276 1.908
114 HD12 LEU 17 HD12 LEU 17 4.776 1.594 2.656
115 HD13 LEU 17 HD13 LEU 17 4.659 1.391 0.908
116 HD21 LEU 17 HD21 LEU 17 2.163 3.634 2.749
117 HD22 LEU 17 HD22 LEU 17 3.419 4.871 2.888
118 HD23 LEU 17 HD23 LEU 17 3.605 3.330 3.723
119 HA PRO 18 HA PRO 18 4.376 8.383 3.855
120 HB2 PRO 18 HB2 PRO 18 1.891 9.312 3.540
121 HB3 PRO 18 HB1 PRO 18 3.178 9.738 2.406
122 HG2 PRO 18 HG2 PRO 18 0.912 7.851 2.071
123 HG3 PRO 18 HG1 PRO 18 1.750 8.833 0.860
124 HD2 PRO 18 HD2 PRO 18 2.166 6.083 1.437
125 HD3 PRO 18 HD1 PRO 18 3.117 7.107 0.346
126 HA PRO 19 HA PRO 19 2.840 5.885 7.182
127 HB2 PRO 19 HB2 PRO 19 2.390 8.591 8.315
128 HB3 PRO 19 HB1 PRO 19 3.161 7.202 9.048
129 HG2 PRO 19 HG2 PRO 19 4.680 9.083 8.175
130 HG3 PRO 19 HG1 PRO 19 5.072 7.422 7.681
131 HD2 PRO 19 HD2 PRO 19 3.610 9.545 6.140
132 HD3 PRO 19 HD1 PRO 19 4.926 8.485 5.608
133 H ASN 20 HN ASN 20 0.939 8.384 5.793
134 HA ASN 20 HA ASN 20 -1.454 8.249 7.192
135 HB2 ASN 20 HB2 ASN 20 -1.074 8.681 4.231
136 HB3 ASN 20 HB1 ASN 20 -2.553 9.009 5.117
137 HD21 ASN 20 HD21 ASN 20 -0.965 10.775 3.559
138 HD22 ASN 20 HD22 ASN 20 -0.544 12.078 4.597
139 H TRP 21 HN TRP 21 -0.059 5.740 5.433
140 HA TRP 21 HA TRP 21 -2.376 4.816 4.041
141 HB2 TRP 21 HB2 TRP 21 -0.945 3.037 3.280
142 HB3 TRP 21 HB1 TRP 21 0.013 4.516 3.279
143 HD1 TRP 21 HD1 TRP 21 1.143 4.725 6.095
144 HE1 TRP 21 HE1 TRP 21 2.700 2.954 7.107
145 HE3 TRP 21 HE3 TRP 21 -0.089 0.783 3.086
146 HZ2 TRP 21 HZ2 TRP 21 3.326 0.237 6.676
147 HZ3 TRP 21 HZ3 TRP 21 1.040 -1.369 3.455
148 HH2 TRP 21 HH2 TRP 21 2.714 -1.637 5.211
149 H LYS 22 HN LYS 22 -3.217 2.722 4.284
150 HA LYS 22 HA LYS 22 -3.150 1.650 7.021
151 HB2 LYS 22 HB2 LYS 22 -5.516 1.960 5.191
152 HB3 LYS 22 HB1 LYS 22 -5.523 0.944 6.610
153 HG2 LYS 22 HG2 LYS 22 -4.908 3.875 6.706
154 HG3 LYS 22 HG1 LYS 22 -6.527 3.202 6.931
155 HD2 LYS 22 HD2 LYS 22 -4.150 2.319 8.542
156 HD3 LYS 22 HD1 LYS 22 -5.203 3.626 9.044
157 HE2 LYS 22 HE2 LYS 22 -7.116 1.944 8.758
158 HE3 LYS 22 HE1 LYS 22 -5.841 0.731 8.678
159 HZ1 LYS 22 HZ1 LYS 22 -6.608 0.855 10.908
160 HZ2 LYS 22 HZ2 LYS 22 -6.436 2.539 10.949
161 HZ3 LYS 22 HZ3 LYS 22 -5.060 1.547 10.870
162 H THR 23 HN THR 23 -4.045 -0.576 7.017
163 HA THR 23 HA THR 23 -3.370 -2.022 4.556
164 HB THR 23 HB THR 23 -2.765 -3.966 6.067
165 HG1 THR 23 HG1 THR 23 -2.449 -3.609 8.183
166 HG21 THR 23 HG21 THR 23 -1.286 -1.594 5.391
167 HG22 THR 23 HG22 THR 23 -0.799 -3.286 5.279
168 HG23 THR 23 HG23 THR 23 -0.603 -2.405 6.798
169 H ALA 24 HN ALA 24 -4.925 -3.219 3.774
170 HA ALA 24 HA ALA 24 -7.092 -4.096 5.528
171 HB1 ALA 24 HB1 ALA 24 -8.772 -3.003 4.489
172 HB2 ALA 24 HB2 ALA 24 -7.968 -3.043 2.926
173 HB3 ALA 24 HB3 ALA 24 -7.493 -1.839 4.128
174 H ARG 25 HN ARG 25 -8.565 -5.577 4.313
175 HA ARG 25 HA ARG 25 -7.012 -7.155 2.404
176 HB2 ARG 25 HB2 ARG 25 -6.572 -8.458 4.213
177 HB3 ARG 25 HB1 ARG 25 -7.997 -7.934 5.059
178 HG2 ARG 25 HG2 ARG 25 -9.381 -9.455 3.832
179 HG3 ARG 25 HG1 ARG 25 -8.024 -9.881 2.796
180 HD2 ARG 25 HD2 ARG 25 -7.986 -10.276 5.744
181 HD3 ARG 25 HD1 ARG 25 -8.540 -11.519 4.630
182 HE ARG 25 HE ARG 25 -6.127 -10.915 3.645
183 HH11 ARG 25 HH11 ARG 25 -7.151 -11.648 6.908
184 HH12 ARG 25 HH12 ARG 25 -5.626 -12.342 7.368
185 HH21 ARG 25 HH21 ARG 25 -4.127 -11.833 4.239
186 HH22 ARG 25 HH22 ARG 25 -3.891 -12.423 5.856
187 H ASP 26 HN ASP 26 -8.140 -8.292 0.977
188 HA ASP 26 HA ASP 26 -10.775 -7.169 0.448
189 HB2 ASP 26 HB2 ASP 26 -8.751 -8.554 -1.307
190 HB3 ASP 26 HB1 ASP 26 -10.390 -8.229 -1.843
191 HA PRO 27 HA PRO 27 -13.538 -10.377 1.025
192 HB2 PRO 27 HB2 PRO 27 -13.925 -11.299 -1.638
193 HB3 PRO 27 HB1 PRO 27 -14.912 -10.158 -0.740
194 HG2 PRO 27 HG2 PRO 27 -12.704 -9.627 -2.626
195 HG3 PRO 27 HG1 PRO 27 -14.207 -8.720 -2.377
196 HD2 PRO 27 HD2 PRO 27 -11.971 -7.763 -1.417
197 HD3 PRO 27 HD1 PRO 27 -13.405 -7.765 -0.374
198 H GLU 28 HN GLU 28 -11.012 -11.284 -1.314
199 HA GLU 28 HA GLU 28 -11.451 -14.079 -0.672
200 HB2 GLU 28 HB2 GLU 28 -9.671 -12.819 -2.748
201 HB3 GLU 28 HB1 GLU 28 -9.979 -14.546 -2.570
202 HG2 GLU 28 HG2 GLU 28 -12.146 -12.539 -2.995
203 HG3 GLU 28 HG1 GLU 28 -11.329 -13.344 -4.334
204 H GLY 29 HN GLY 29 -10.371 -12.565 1.403
205 HA2 GLY 29 HA2 GLY 29 -8.938 -12.992 3.133
206 HA3 GLY 29 HA1 GLY 29 -8.560 -14.493 2.319
207 H LYS 30 HN LYS 30 -7.817 -11.750 0.428
208 HA LYS 30 HA LYS 30 -4.984 -12.130 1.064
209 HB2 LYS 30 HB2 LYS 30 -6.287 -10.732 -1.278
210 HB3 LYS 30 HB1 LYS 30 -4.555 -10.936 -1.056
211 HG2 LYS 30 HG2 LYS 30 -6.575 -13.138 -1.437
212 HG3 LYS 30 HG1 LYS 30 -5.408 -12.563 -2.629
213 HD2 LYS 30 HD2 LYS 30 -3.578 -13.245 -1.111
214 HD3 LYS 30 HD1 LYS 30 -4.776 -13.890 0.009
215 HE2 LYS 30 HE2 LYS 30 -4.308 -14.818 -2.823
216 HE3 LYS 30 HE1 LYS 30 -3.799 -15.658 -1.360
217 HZ1 LYS 30 HZ1 LYS 30 -6.172 -15.827 -0.743
218 HZ2 LYS 30 HZ2 LYS 30 -5.797 -16.646 -2.180
219 HZ3 LYS 30 HZ3 LYS 30 -6.591 -15.152 -2.244
220 H ILE 31 HN ILE 31 -3.650 -10.490 1.738
221 HA ILE 31 HA ILE 31 -5.061 -8.128 2.819
222 HB ILE 31 HB ILE 31 -3.872 -9.555 4.471
223 HG12 ILE 31 HG12 ILE 31 -2.566 -7.766 5.545
224 HG13 ILE 31 HG11 ILE 31 -2.633 -6.845 4.065
225 HG21 ILE 31 HG21 ILE 31 -1.948 -10.471 3.864
226 HG22 ILE 31 HG22 ILE 31 -1.242 -8.887 4.186
227 HG23 ILE 31 HG23 ILE 31 -1.730 -9.314 2.549
228 HD11 ILE 31 HD11 ILE 31 -4.229 -6.049 5.710
229 HD12 ILE 31 HD12 ILE 31 -4.971 -7.645 5.751
230 HD13 ILE 31 HD13 ILE 31 -5.043 -6.680 4.278
231 H TYR 32 HN TYR 32 -4.281 -6.049 2.367
232 HA TYR 32 HA TYR 32 -2.146 -5.811 0.363
233 HB2 TYR 32 HB2 TYR 32 -4.995 -4.893 -0.059
234 HB3 TYR 32 HB1 TYR 32 -3.638 -4.416 -1.075
235 HD1 TYR 32 HD1 TYR 32 -2.151 -6.759 -1.616
236 HD2 TYR 32 HD2 TYR 32 -6.365 -6.387 -1.159
237 HE1 TYR 32 HE1 TYR 32 -2.471 -8.753 -3.014
238 HE2 TYR 32 HE2 TYR 32 -6.696 -8.387 -2.553
239 HH TYR 32 HH TYR 32 -5.565 -9.697 -4.202
240 H TYR 33 HN TYR 33 -2.152 -3.315 -0.336
241 HA TYR 33 HA TYR 33 -1.979 -1.784 2.179
242 HB2 TYR 33 HB2 TYR 33 -0.206 -1.684 -0.256
243 HB3 TYR 33 HB1 TYR 33 -0.009 -0.707 1.171
244 HD1 TYR 33 HD2 TYR 33 -0.543 -2.847 3.244
245 HD2 TYR 33 HD1 TYR 33 1.844 -2.871 -0.275
246 HE1 TYR 33 HE2 TYR 33 0.883 -4.584 4.233
247 HE2 TYR 33 HE1 TYR 33 3.278 -4.611 0.707
248 HH TYR 33 HH TYR 33 3.896 -5.429 2.967
249 H TYR 34 HN TYR 34 -2.870 0.255 2.173
250 HA TYR 34 HA TYR 34 -3.699 1.391 -0.396
251 HB2 TYR 34 HB2 TYR 34 -5.592 0.982 1.928
252 HB3 TYR 34 HB1 TYR 34 -5.972 1.830 0.430
253 HD1 TYR 34 HD2 TYR 34 -5.975 0.514 -1.747
254 HD2 TYR 34 HD1 TYR 34 -5.769 -1.359 2.064
255 HE1 TYR 34 HE2 TYR 34 -6.706 -1.612 -2.755
256 HE2 TYR 34 HE1 TYR 34 -6.504 -3.480 1.073
257 HH TYR 34 HH TYR 34 -6.737 -3.965 -2.350
258 H HIS 35 HN HIS 35 -3.539 3.525 -0.574
259 HA HIS 35 HA HIS 35 -2.620 4.972 1.815
260 HB2 HIS 35 HB2 HIS 35 -2.136 5.607 -1.106
261 HB3 HIS 35 HB1 HIS 35 -1.361 6.354 0.273
262 HD1 HIS 35 HD1 HIS 35 -1.607 2.864 -1.223
263 HD2 HIS 35 HD2 HIS 35 1.117 5.323 0.722
264 HE1 HIS 35 HE1 HIS 35 0.546 1.577 -1.181
265 HE2 HIS 35 HE2 HIS 35 2.224 3.174 -0.211
266 H VAL 36 HN VAL 36 -3.833 6.639 2.488
267 HA VAL 36 HA VAL 36 -6.413 6.843 1.236
268 HB VAL 36 HB VAL 36 -6.884 8.180 3.358
269 HG11 VAL 36 HG11 VAL 36 -5.839 5.569 4.226
270 HG12 VAL 36 HG12 VAL 36 -6.899 5.517 2.825
271 HG13 VAL 36 HG13 VAL 36 -7.475 6.221 4.339
272 HG21 VAL 36 HG21 VAL 36 -4.683 8.901 3.923
273 HG22 VAL 36 HG22 VAL 36 -4.063 7.242 3.863
274 HG23 VAL 36 HG23 VAL 36 -5.175 7.734 5.157
275 H ILE 37 HN ILE 37 -3.859 9.243 2.125
276 HA ILE 37 HA ILE 37 -5.300 11.404 1.027
277 HB ILE 37 HB ILE 37 -2.431 11.092 1.809
278 HG12 ILE 37 HG12 ILE 37 -3.261 13.197 3.140
279 HG13 ILE 37 HG11 ILE 37 -4.842 12.592 2.669
280 HG21 ILE 37 HG21 ILE 37 -1.988 13.413 1.163
281 HG22 ILE 37 HG22 ILE 37 -3.582 13.509 0.411
282 HG23 ILE 37 HG23 ILE 37 -2.362 12.418 -0.246
283 HD11 ILE 37 HD11 ILE 37 -2.865 11.387 4.507
284 HD12 ILE 37 HD12 ILE 37 -4.012 10.385 3.634
285 HD13 ILE 37 HD13 ILE 37 -4.602 11.641 4.716
286 H THR 38 HN THR 38 -2.603 9.529 -0.156
287 HA THR 38 HA THR 38 -2.483 10.894 -2.634
288 HB THR 38 HB THR 38 -0.815 9.028 -3.182
289 HG1 THR 38 HG1 THR 38 -0.189 7.747 -1.480
290 HG21 THR 38 HG21 THR 38 -0.475 10.844 -0.805
291 HG22 THR 38 HG22 THR 38 -0.090 11.212 -2.487
292 HG23 THR 38 HG23 THR 38 0.855 10.009 -1.610
293 H ARG 39 HN ARG 39 -4.295 8.244 -1.514
294 HA ARG 39 HA ARG 39 -5.809 6.858 -2.488
295 HB2 ARG 39 HB2 ARG 39 -5.681 9.129 -4.253
296 HB3 ARG 39 HB1 ARG 39 -5.984 7.662 -5.149
297 HG2 ARG 39 HG2 ARG 39 -8.090 8.469 -4.681
298 HG3 ARG 39 HG1 ARG 39 -7.833 7.236 -3.442
299 HD2 ARG 39 HD2 ARG 39 -7.009 9.019 -1.958
300 HD3 ARG 39 HD1 ARG 39 -7.489 10.205 -3.158
301 HE ARG 39 HE ARG 39 -9.727 8.653 -2.678
302 HH11 ARG 39 HH11 ARG 39 -7.656 10.732 -0.769
303 HH12 ARG 39 HH12 ARG 39 -8.941 11.295 0.260
304 HH21 ARG 39 HH21 ARG 39 -11.423 9.385 -1.338
305 HH22 ARG 39 HH22 ARG 39 -11.080 10.525 -0.072
306 H GLN 40 HN GLN 40 -3.350 5.800 -2.320
307 HA GLN 40 HA GLN 40 -2.824 4.608 -4.952
308 HB2 GLN 40 HB2 GLN 40 -0.973 4.913 -2.630
309 HB3 GLN 40 HB1 GLN 40 -0.536 4.309 -4.208
310 HG2 GLN 40 HG2 GLN 40 -0.841 6.462 -5.143
311 HG3 GLN 40 HG1 GLN 40 -1.507 7.092 -3.650
312 HE21 GLN 40 HE21 GLN 40 0.773 7.972 -5.218
313 HE22 GLN 40 HE22 GLN 40 2.146 7.861 -4.178
314 H THR 41 HN THR 41 -2.020 2.394 -4.839
315 HA THR 41 HA THR 41 -2.504 0.940 -2.404
316 HB THR 41 HB THR 41 -4.660 0.635 -3.191
317 HG1 THR 41 HG1 THR 41 -3.775 -1.583 -4.578
318 HG21 THR 41 HG21 THR 41 -4.300 1.701 -5.337
319 HG22 THR 41 HG22 THR 41 -5.256 0.224 -5.507
320 HG23 THR 41 HG23 THR 41 -3.546 0.232 -5.958
321 H GLN 42 HN GLN 42 -1.149 -0.825 -2.231
322 HA GLN 42 HA GLN 42 0.098 -1.734 -4.729
323 HB2 GLN 42 HB2 GLN 42 2.300 -1.891 -3.583
324 HB3 GLN 42 HB1 GLN 42 1.737 -0.241 -3.786
325 HG2 GLN 42 HG2 GLN 42 0.897 -0.393 -1.406
326 HG3 GLN 42 HG1 GLN 42 1.825 -1.881 -1.280
327 HE21 GLN 42 HE21 GLN 42 4.078 -1.763 -1.355
328 HE22 GLN 42 HE22 GLN 42 4.901 -0.270 -1.085
329 H TRP 43 HN TRP 43 -0.075 -3.813 -4.960
330 HA TRP 43 HA TRP 43 -0.784 -5.464 -2.657
331 HB2 TRP 43 HB2 TRP 43 -0.698 -6.261 -5.577
332 HB3 TRP 43 HB1 TRP 43 -1.531 -7.088 -4.264
333 HD1 TRP 43 HD1 TRP 43 -3.266 -4.921 -2.980
334 HE1 TRP 43 HE1 TRP 43 -5.139 -3.721 -4.261
335 HE3 TRP 43 HE3 TRP 43 -1.649 -5.777 -7.760
336 HZ2 TRP 43 HZ2 TRP 43 -5.835 -3.198 -6.944
337 HZ3 TRP 43 HZ3 TRP 43 -2.983 -4.886 -9.622
338 HH2 TRP 43 HH2 TRP 43 -5.032 -3.626 -9.221
339 H ASP 44 HN ASP 44 1.611 -5.132 -5.197
340 HA ASP 44 HA ASP 44 3.182 -7.333 -4.102
341 HB2 ASP 44 HB2 ASP 44 3.190 -5.919 -6.761
342 HB3 ASP 44 HB1 ASP 44 4.370 -7.126 -6.300
343 HA PRO 45 HA PRO 45 6.348 -3.534 -4.832
344 HB2 PRO 45 HB2 PRO 45 4.425 -1.478 -3.823
345 HB3 PRO 45 HB1 PRO 45 5.747 -1.310 -4.986
346 HG2 PRO 45 HG2 PRO 45 3.254 -1.433 -5.842
347 HG3 PRO 45 HG1 PRO 45 4.534 -2.315 -6.700
348 HD2 PRO 45 HD2 PRO 45 2.439 -3.345 -4.836
349 HD3 PRO 45 HD1 PRO 45 3.100 -4.083 -6.309
350 HA PRO 46 HA PRO 46 7.343 -4.110 -0.534
351 HB2 PRO 46 HB2 PRO 46 9.559 -2.262 -1.176
352 HB3 PRO 46 HB1 PRO 46 9.610 -3.903 -0.521
353 HG2 PRO 46 HG2 PRO 46 10.306 -3.419 -3.037
354 HG3 PRO 46 HG1 PRO 46 9.415 -4.888 -2.604
355 HD2 PRO 46 HD2 PRO 46 8.405 -2.364 -3.870
356 HD3 PRO 46 HD1 PRO 46 7.996 -4.055 -4.241
357 H THR 47 HN THR 47 7.741 -2.819 1.359
358 HA THR 47 HA THR 47 5.853 -0.732 1.584
359 HB THR 47 HB THR 47 6.454 -2.367 3.364
360 HG1 THR 47 HG1 THR 47 5.793 -0.994 4.846
361 HG21 THR 47 HG21 THR 47 8.908 -2.240 3.095
362 HG22 THR 47 HG22 THR 47 8.390 -2.012 4.765
363 HG23 THR 47 HG23 THR 47 8.873 -0.622 3.790
364 H TRP 48 HN TRP 48 7.237 0.895 3.474
365 HA TRP 48 HA TRP 48 7.695 3.119 1.898
366 HB2 TRP 48 HB2 TRP 48 9.225 3.052 4.413
367 HB3 TRP 48 HB1 TRP 48 8.090 4.230 3.809
368 HD1 TRP 48 HD1 TRP 48 5.464 3.797 4.323
369 HE1 TRP 48 HE1 TRP 48 4.341 2.501 6.240
370 HE3 TRP 48 HE3 TRP 48 9.473 1.067 5.916
371 HZ2 TRP 48 HZ2 TRP 48 5.056 0.575 8.174
372 HZ3 TRP 48 HZ3 TRP 48 9.173 -0.477 7.808
373 HH2 TRP 48 HH2 TRP 48 7.012 -0.716 8.913
374 H GLU 49 HN GLU 49 10.004 0.842 3.199
375 HA GLU 49 HA GLU 49 12.179 2.222 1.828
376 HB2 GLU 49 HB2 GLU 49 11.850 1.014 4.399
377 HB3 GLU 49 HB1 GLU 49 13.150 0.217 3.532
378 HG2 GLU 49 HG2 GLU 49 14.322 2.248 3.269
379 HG3 GLU 49 HG1 GLU 49 12.917 3.172 3.790
380 H SER 50 HN SER 50 13.749 0.907 0.719
381 HA SER 50 HA SER 50 12.408 -1.384 -0.550
382 HB2 SER 50 HB2 SER 50 14.634 0.366 -1.636
383 HB3 SER 50 HB1 SER 50 13.763 -0.888 -2.520
384 HG SER 50 HG SER 50 11.892 0.635 -1.609
385 HA PRO 51 HA PRO 51 15.491 -4.029 1.270
386 HB2 PRO 51 HB2 PRO 51 14.997 -6.183 -0.345
387 HB3 PRO 51 HB1 PRO 51 14.024 -5.765 1.068
388 HG2 PRO 51 HG2 PRO 51 13.512 -5.196 -1.822
389 HG3 PRO 51 HG1 PRO 51 12.380 -5.736 -0.567
390 HD2 PRO 51 HD2 PRO 51 12.490 -3.169 -1.362
391 HD3 PRO 51 HD1 PRO 51 12.162 -3.614 0.326
392 H GLY 52 HN GLY 52 17.322 -5.347 0.569
393 HA2 GLY 52 HA2 GLY 52 18.886 -4.090 -1.418
394 HA3 GLY 52 HA1 GLY 52 19.278 -5.605 -0.614
395 H ASP 53 HN ASP 53 16.630 -6.676 -1.428
396 HA ASP 53 HA ASP 53 17.297 -8.034 -3.765
397 HB2 ASP 53 HB2 ASP 53 15.597 -8.831 -2.200
398 HB3 ASP 53 HB1 ASP 53 14.566 -7.461 -2.599
399 H ASP 54 HN ASP 54 15.457 -5.051 -3.313
400 HA ASP 54 HA ASP 54 15.082 -4.828 -6.206
401 HB2 ASP 54 HB2 ASP 54 13.952 -3.231 -3.906
402 HB3 ASP 54 HB1 ASP 54 13.700 -2.812 -5.596
403 H ALA 55 HN ALA 55 16.566 -3.114 -3.488
404 HA ALA 55 HA ALA 55 17.431 -0.892 -5.049
405 HB1 ALA 55 HB1 ALA 55 17.076 -0.678 -2.657
406 HB2 ALA 55 HB2 ALA 55 18.745 -0.278 -3.069
407 HB3 ALA 55 HB3 ALA 55 18.367 -1.839 -2.344
408 H SER 56 HN SER 56 18.849 -1.086 -6.619
409 HA SER 56 HA SER 56 20.909 -3.103 -6.589
410 HB2 SER 56 HB2 SER 56 20.454 -0.872 -8.586
411 HB3 SER 56 HB1 SER 56 21.404 -2.342 -8.829
412 HG SER 56 HG SER 56 19.036 -3.160 -8.081
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 -8.354 7.507 5.127
2 H2 GLY 1 HT2 GLY 1 -7.860 8.303 6.538
3 H3 GLY 1 HT3 GLY 1 -9.474 7.798 6.365
4 HA2 GLY 1 HA1 GLY 1 -7.116 6.000 6.525
5 HA3 GLY 1 HA2 GLY 1 -8.224 6.336 7.847
6 H SER 2 HN SER 2 -9.490 4.651 8.187
7 HA SER 2 HA SER 2 -9.997 2.566 6.382
8 HB2 SER 2 HB2 SER 2 -11.801 3.235 8.694
9 HB3 SER 2 HB1 SER 2 -11.298 1.648 8.102
10 HG SER 2 HG SER 2 -9.845 1.785 9.614
11 H ASP 3 HN ASP 3 -11.494 5.584 6.880
12 HA ASP 3 HA ASP 3 -14.085 5.134 5.896
13 HB2 ASP 3 HB2 ASP 3 -14.128 7.598 5.589
14 HB3 ASP 3 HB1 ASP 3 -13.631 7.095 7.199
15 H LEU 4 HN LEU 4 -11.118 5.259 4.254
16 HA LEU 4 HA LEU 4 -12.383 6.163 1.761
17 HB2 LEU 4 HB2 LEU 4 -9.474 6.024 2.566
18 HB3 LEU 4 HB1 LEU 4 -10.035 6.491 0.973
19 HG LEU 4 HG LEU 4 -10.674 7.974 3.523
20 HD11 LEU 4 HD11 LEU 4 -9.126 9.667 2.695
21 HD12 LEU 4 HD12 LEU 4 -8.727 8.636 1.318
22 HD13 LEU 4 HD13 LEU 4 -8.307 8.125 2.955
23 HD21 LEU 4 HD21 LEU 4 -11.481 9.722 2.003
24 HD22 LEU 4 HD22 LEU 4 -12.403 8.227 1.837
25 HD23 LEU 4 HD23 LEU 4 -11.187 8.653 0.632
26 HA PRO 5 HA PRO 5 -12.395 1.980 0.374
27 HB2 PRO 5 HB2 PRO 5 -12.777 3.136 -2.299
28 HB3 PRO 5 HB1 PRO 5 -13.878 2.146 -1.339
29 HG2 PRO 5 HG2 PRO 5 -14.339 4.753 -1.764
30 HG3 PRO 5 HG1 PRO 5 -14.762 3.969 -0.230
31 HD2 PRO 5 HD2 PRO 5 -12.387 5.675 -0.891
32 HD3 PRO 5 HD1 PRO 5 -13.425 5.703 0.552
33 HA PRO 6 HA PRO 6 -8.468 0.975 -1.359
34 HB2 PRO 6 HB2 PRO 6 -9.824 -1.171 -2.870
35 HB3 PRO 6 HB1 PRO 6 -8.560 -1.287 -1.641
36 HG2 PRO 6 HG2 PRO 6 -11.080 -2.021 -1.118
37 HG3 PRO 6 HG1 PRO 6 -10.076 -1.223 0.108
38 HD2 PRO 6 HD2 PRO 6 -12.239 -0.070 -1.617
39 HD3 PRO 6 HD1 PRO 6 -11.900 0.212 0.104
40 HA PRO 7 HA PRO 7 -8.437 2.595 -5.532
41 HB2 PRO 7 HB2 PRO 7 -5.596 2.183 -5.524
42 HB3 PRO 7 HB1 PRO 7 -6.464 3.691 -5.314
43 HG2 PRO 7 HG2 PRO 7 -4.996 2.518 -3.341
44 HG3 PRO 7 HG1 PRO 7 -6.397 3.562 -3.024
45 HD2 PRO 7 HD2 PRO 7 -6.248 0.561 -3.097
46 HD3 PRO 7 HD1 PRO 7 -7.047 1.617 -1.908
47 H SER 8 HN SER 8 -8.116 1.840 -7.649
48 HA SER 8 HA SER 8 -7.048 -0.849 -8.019
49 HB2 SER 8 HB2 SER 8 -8.964 0.097 -9.424
50 HB3 SER 8 HB1 SER 8 -7.792 1.201 -10.139
51 HG SER 8 HG SER 8 -6.818 -0.451 -11.152
52 HA PRO 9 HA PRO 9 -3.070 0.534 -7.740
53 HB2 PRO 9 HB2 PRO 9 -2.092 -1.091 -9.994
54 HB3 PRO 9 HB1 PRO 9 -1.722 -1.214 -8.273
55 HG2 PRO 9 HG2 PRO 9 -3.263 -3.024 -9.523
56 HG3 PRO 9 HG1 PRO 9 -3.548 -2.550 -7.839
57 HD2 PRO 9 HD2 PRO 9 -4.998 -1.715 -10.317
58 HD3 PRO 9 HD1 PRO 9 -5.640 -2.079 -8.701
59 HA PRO 10 HA PRO 10 -2.012 3.497 -10.943
60 HB2 PRO 10 HB2 PRO 10 -0.500 4.933 -9.052
61 HB3 PRO 10 HB1 PRO 10 -2.168 5.259 -9.521
62 HG2 PRO 10 HG2 PRO 10 -1.286 4.391 -7.005
63 HG3 PRO 10 HG1 PRO 10 -2.962 4.412 -7.579
64 HD2 PRO 10 HD2 PRO 10 -1.023 2.152 -7.461
65 HD3 PRO 10 HD1 PRO 10 -2.786 2.144 -7.234
66 H ALA 11 HN ALA 11 -0.089 3.963 -12.037
67 HA ALA 11 HA ALA 11 2.165 2.252 -11.661
68 HB1 ALA 11 HB1 ALA 11 1.907 4.785 -13.288
69 HB2 ALA 11 HB2 ALA 11 1.598 3.146 -13.859
70 HB3 ALA 11 HB3 ALA 11 3.229 3.622 -13.396
71 H ALA 12 HN ALA 12 1.268 5.454 -10.649
72 HA ALA 12 HA ALA 12 3.749 6.401 -9.742
73 HB1 ALA 12 HB1 ALA 12 1.833 7.858 -10.110
74 HB2 ALA 12 HB2 ALA 12 2.465 8.040 -8.473
75 HB3 ALA 12 HB3 ALA 12 0.995 7.105 -8.753
76 H ALA 13 HN ALA 13 1.808 3.962 -8.495
77 HA ALA 13 HA ALA 13 1.797 4.380 -5.753
78 HB1 ALA 13 HB1 ALA 13 1.838 1.716 -7.147
79 HB2 ALA 13 HB2 ALA 13 0.409 2.725 -6.916
80 HB3 ALA 13 HB3 ALA 13 1.246 2.046 -5.519
81 H THR 14 HN THR 14 4.376 3.161 -7.737
82 HA THR 14 HA THR 14 5.783 1.802 -5.666
83 HB THR 14 HB THR 14 6.082 1.151 -7.995
84 HG1 THR 14 HG1 THR 14 8.178 1.881 -6.339
85 HG21 THR 14 HG21 THR 14 7.458 3.816 -8.351
86 HG22 THR 14 HG22 THR 14 5.902 3.361 -9.043
87 HG23 THR 14 HG23 THR 14 7.369 2.527 -9.551
88 H ILE 15 HN ILE 15 5.593 5.108 -6.581
89 HA ILE 15 HA ILE 15 8.135 6.079 -5.959
90 HB ILE 15 HB ILE 15 6.143 7.221 -7.126
91 HG12 ILE 15 HG12 ILE 15 6.929 9.465 -6.530
92 HG13 ILE 15 HG11 ILE 15 7.761 8.810 -5.123
93 HG21 ILE 15 HG21 ILE 15 4.483 6.978 -5.409
94 HG22 ILE 15 HG22 ILE 15 4.790 8.692 -5.678
95 HG23 ILE 15 HG23 ILE 15 5.473 7.888 -4.270
96 HD11 ILE 15 HD11 ILE 15 9.239 9.252 -7.052
97 HD12 ILE 15 HD12 ILE 15 8.340 8.033 -7.959
98 HD13 ILE 15 HD13 ILE 15 9.248 7.569 -6.522
99 H VAL 16 HN VAL 16 7.643 8.122 -4.076
100 HA VAL 16 HA VAL 16 8.336 6.839 -1.646
101 HB VAL 16 HB VAL 16 7.343 9.678 -2.001
102 HG11 VAL 16 HG11 VAL 16 8.738 10.108 0.011
103 HG12 VAL 16 HG12 VAL 16 8.994 8.368 0.155
104 HG13 VAL 16 HG13 VAL 16 7.371 9.037 0.315
105 HG21 VAL 16 HG21 VAL 16 9.682 10.319 -2.232
106 HG22 VAL 16 HG22 VAL 16 9.212 9.195 -3.509
107 HG23 VAL 16 HG23 VAL 16 10.166 8.625 -2.140
108 H LEU 17 HN LEU 17 7.161 6.711 0.295
109 HA LEU 17 HA LEU 17 4.316 6.317 -0.261
110 HB2 LEU 17 HB2 LEU 17 6.290 4.602 1.194
111 HB3 LEU 17 HB1 LEU 17 4.583 4.279 1.149
112 HG LEU 17 HG LEU 17 6.513 4.240 -1.164
113 HD11 LEU 17 HD11 LEU 17 5.771 1.859 -1.278
114 HD12 LEU 17 HD12 LEU 17 4.956 2.102 0.268
115 HD13 LEU 17 HD13 LEU 17 6.708 2.268 0.159
116 HD21 LEU 17 HD21 LEU 17 4.581 5.073 -2.111
117 HD22 LEU 17 HD22 LEU 17 3.557 4.164 -1.010
118 HD23 LEU 17 HD23 LEU 17 4.394 3.327 -2.319
119 HA PRO 18 HA PRO 18 3.848 8.494 3.612
120 HB2 PRO 18 HB2 PRO 18 1.210 8.952 3.354
121 HB3 PRO 18 HB1 PRO 18 2.411 9.816 2.389
122 HG2 PRO 18 HG2 PRO 18 0.538 7.677 1.591
123 HG3 PRO 18 HG1 PRO 18 1.283 8.947 0.609
124 HD2 PRO 18 HD2 PRO 18 2.084 6.217 0.841
125 HD3 PRO 18 HD1 PRO 18 2.881 7.507 -0.078
126 HA PRO 19 HA PRO 19 2.986 4.840 6.088
127 HB2 PRO 19 HB2 PRO 19 3.070 7.009 8.097
128 HB3 PRO 19 HB1 PRO 19 3.845 5.443 8.134
129 HG2 PRO 19 HG2 PRO 19 5.304 7.491 7.587
130 HG3 PRO 19 HG1 PRO 19 5.432 6.079 6.519
131 HD2 PRO 19 HD2 PRO 19 3.887 8.616 6.105
132 HD3 PRO 19 HD1 PRO 19 4.950 7.757 4.979
133 H ASN 20 HN ASN 20 1.107 7.661 5.943
134 HA ASN 20 HA ASN 20 -0.910 7.310 7.791
135 HB2 ASN 20 HB2 ASN 20 -1.033 8.495 5.028
136 HB3 ASN 20 HB1 ASN 20 -2.370 8.563 6.162
137 HD21 ASN 20 HD21 ASN 20 -2.407 10.722 6.270
138 HD22 ASN 20 HD22 ASN 20 -1.150 11.666 6.983
139 H TRP 21 HN TRP 21 -0.282 5.089 5.335
140 HA TRP 21 HA TRP 21 -2.911 4.866 4.282
141 HB2 TRP 21 HB2 TRP 21 -2.054 3.051 2.948
142 HB3 TRP 21 HB1 TRP 21 -0.877 4.353 2.953
143 HD1 TRP 21 HD1 TRP 21 -1.377 1.163 5.163
144 HE1 TRP 21 HE1 TRP 21 0.919 0.031 5.421
145 HE3 TRP 21 HE3 TRP 21 1.444 4.408 2.402
146 HZ2 TRP 21 HZ2 TRP 21 3.563 0.447 4.547
147 HZ3 TRP 21 HZ3 TRP 21 3.842 3.960 2.153
148 HH2 TRP 21 HH2 TRP 21 4.879 2.021 3.203
149 H LYS 22 HN LYS 22 -4.105 2.918 4.261
150 HA LYS 22 HA LYS 22 -4.021 1.504 6.841
151 HB2 LYS 22 HB2 LYS 22 -6.366 2.362 5.180
152 HB3 LYS 22 HB1 LYS 22 -6.499 1.107 6.390
153 HG2 LYS 22 HG2 LYS 22 -5.470 3.861 6.994
154 HG3 LYS 22 HG1 LYS 22 -7.166 3.386 7.160
155 HD2 LYS 22 HD2 LYS 22 -4.901 1.928 8.492
156 HD3 LYS 22 HD1 LYS 22 -5.809 3.216 9.276
157 HE2 LYS 22 HE2 LYS 22 -7.858 1.915 8.996
158 HE3 LYS 22 HE1 LYS 22 -6.935 0.665 8.168
159 HZ1 LYS 22 HZ1 LYS 22 -5.620 0.421 10.240
160 HZ2 LYS 22 HZ2 LYS 22 -7.243 -0.031 10.388
161 HZ3 LYS 22 HZ3 LYS 22 -6.722 1.455 11.014
162 H THR 23 HN THR 23 -5.320 -0.564 6.661
163 HA THR 23 HA THR 23 -4.522 -2.021 4.245
164 HB THR 23 HB THR 23 -4.102 -3.968 5.858
165 HG1 THR 23 HG1 THR 23 -4.406 -3.508 7.901
166 HG21 THR 23 HG21 THR 23 -2.455 -1.623 5.282
167 HG22 THR 23 HG22 THR 23 -2.162 -3.319 4.911
168 HG23 THR 23 HG23 THR 23 -1.835 -2.697 6.531
169 H ALA 24 HN ALA 24 -5.858 -3.635 3.581
170 HA ALA 24 HA ALA 24 -8.002 -4.527 5.306
171 HB1 ALA 24 HB1 ALA 24 -9.721 -3.622 4.226
172 HB2 ALA 24 HB2 ALA 24 -9.023 -4.038 2.667
173 HB3 ALA 24 HB3 ALA 24 -8.548 -2.540 3.466
174 H ARG 25 HN ARG 25 -8.980 -6.428 4.561
175 HA ARG 25 HA ARG 25 -7.590 -7.835 2.411
176 HB2 ARG 25 HB2 ARG 25 -6.449 -8.830 4.134
177 HB3 ARG 25 HB1 ARG 25 -7.770 -8.634 5.246
178 HG2 ARG 25 HG2 ARG 25 -8.975 -10.469 4.145
179 HG3 ARG 25 HG1 ARG 25 -7.594 -10.684 3.065
180 HD2 ARG 25 HD2 ARG 25 -6.167 -11.206 4.951
181 HD3 ARG 25 HD1 ARG 25 -7.494 -10.898 6.069
182 HE ARG 25 HE ARG 25 -8.491 -12.844 4.485
183 HH11 ARG 25 HH11 ARG 25 -5.537 -12.527 6.333
184 HH12 ARG 25 HH12 ARG 25 -5.358 -14.235 6.585
185 HH21 ARG 25 HH21 ARG 25 -8.280 -15.087 4.837
186 HH22 ARG 25 HH22 ARG 25 -6.908 -15.692 5.722
187 H ASP 26 HN ASP 26 -8.796 -9.273 1.315
188 HA ASP 26 HA ASP 26 -11.681 -8.939 1.657
189 HB2 ASP 26 HB2 ASP 26 -10.072 -9.929 -0.698
190 HB3 ASP 26 HB1 ASP 26 -11.823 -9.991 -0.629
191 HA PRO 27 HA PRO 27 -12.858 -12.885 2.958
192 HB2 PRO 27 HB2 PRO 27 -14.213 -13.876 0.710
193 HB3 PRO 27 HB1 PRO 27 -14.915 -12.927 2.012
194 HG2 PRO 27 HG2 PRO 27 -13.855 -12.008 -0.601
195 HG3 PRO 27 HG1 PRO 27 -15.336 -11.510 0.238
196 HD2 PRO 27 HD2 PRO 27 -13.240 -9.948 0.321
197 HD3 PRO 27 HD1 PRO 27 -14.116 -10.268 1.830
198 H GLU 28 HN GLU 28 -11.340 -12.708 -0.220
199 HA GLU 28 HA GLU 28 -10.735 -15.542 -0.183
200 HB2 GLU 28 HB2 GLU 28 -10.196 -13.421 -2.250
201 HB3 GLU 28 HB1 GLU 28 -9.789 -15.125 -2.440
202 HG2 GLU 28 HG2 GLU 28 -12.553 -14.137 -1.877
203 HG3 GLU 28 HG1 GLU 28 -11.936 -14.400 -3.508
204 H GLY 29 HN GLY 29 -9.505 -14.050 1.848
205 HA2 GLY 29 HA2 GLY 29 -7.540 -14.210 2.985
206 HA3 GLY 29 HA1 GLY 29 -7.029 -15.354 1.766
207 H LYS 30 HN LYS 30 -7.657 -12.405 0.240
208 HA LYS 30 HA LYS 30 -4.791 -11.896 0.132
209 HB2 LYS 30 HB2 LYS 30 -7.110 -11.138 -1.553
210 HB3 LYS 30 HB1 LYS 30 -5.784 -9.988 -1.482
211 HG2 LYS 30 HG2 LYS 30 -5.399 -11.360 -3.359
212 HG3 LYS 30 HG1 LYS 30 -4.249 -11.866 -2.121
213 HD2 LYS 30 HD2 LYS 30 -5.804 -13.709 -1.520
214 HD3 LYS 30 HD1 LYS 30 -6.823 -13.241 -2.883
215 HE2 LYS 30 HE2 LYS 30 -3.967 -14.203 -2.999
216 HE3 LYS 30 HE1 LYS 30 -5.399 -15.086 -3.521
217 HZ1 LYS 30 HZ1 LYS 30 -4.367 -14.191 -5.435
218 HZ2 LYS 30 HZ2 LYS 30 -4.231 -12.654 -4.752
219 HZ3 LYS 30 HZ3 LYS 30 -5.760 -13.258 -5.169
220 H ILE 31 HN ILE 31 -3.780 -10.222 0.986
221 HA ILE 31 HA ILE 31 -5.351 -8.192 2.455
222 HB ILE 31 HB ILE 31 -4.122 -9.578 4.027
223 HG12 ILE 31 HG12 ILE 31 -2.671 -7.863 5.065
224 HG13 ILE 31 HG11 ILE 31 -2.786 -6.920 3.600
225 HG21 ILE 31 HG21 ILE 31 -1.859 -10.053 3.958
226 HG22 ILE 31 HG22 ILE 31 -1.585 -8.804 2.761
227 HG23 ILE 31 HG23 ILE 31 -2.414 -10.281 2.295
228 HD11 ILE 31 HD11 ILE 31 -4.255 -6.104 5.361
229 HD12 ILE 31 HD12 ILE 31 -5.067 -7.666 5.385
230 HD13 ILE 31 HD13 ILE 31 -5.162 -6.650 3.951
231 H TYR 32 HN TYR 32 -4.709 -6.029 2.141
232 HA TYR 32 HA TYR 32 -2.417 -5.517 0.426
233 HB2 TYR 32 HB2 TYR 32 -3.797 -4.187 -1.193
234 HB3 TYR 32 HB1 TYR 32 -4.062 -5.928 -1.259
235 HD1 TYR 32 HD1 TYR 32 -5.512 -2.694 -0.318
236 HD2 TYR 32 HD2 TYR 32 -6.188 -6.885 -0.610
237 HE1 TYR 32 HE1 TYR 32 -7.921 -2.320 -0.033
238 HE2 TYR 32 HE2 TYR 32 -8.601 -6.520 -0.328
239 HH TYR 32 HH TYR 32 -10.051 -3.465 -0.558
240 H TYR 33 HN TYR 33 -2.512 -3.035 -0.198
241 HA TYR 33 HA TYR 33 -2.946 -1.540 2.305
242 HB2 TYR 33 HB2 TYR 33 -0.643 -1.364 0.349
243 HB3 TYR 33 HB1 TYR 33 -0.842 -0.361 1.764
244 HD1 TYR 33 HD1 TYR 33 -0.235 -3.828 0.635
245 HD2 TYR 33 HD2 TYR 33 -0.101 -1.103 3.896
246 HE1 TYR 33 HE1 TYR 33 1.004 -5.485 1.955
247 HE2 TYR 33 HE2 TYR 33 1.140 -2.755 5.227
248 HH TYR 33 HH TYR 33 2.419 -5.654 3.827
249 H TYR 34 HN TYR 34 -3.720 0.566 2.067
250 HA TYR 34 HA TYR 34 -3.732 1.687 -0.625
251 HB2 TYR 34 HB2 TYR 34 -6.078 2.579 -0.217
252 HB3 TYR 34 HB1 TYR 34 -5.924 0.881 -0.629
253 HD1 TYR 34 HD1 TYR 34 -6.408 -0.847 1.042
254 HD2 TYR 34 HD2 TYR 34 -6.848 3.286 1.943
255 HE1 TYR 34 HE1 TYR 34 -7.691 -1.428 3.056
256 HE2 TYR 34 HE2 TYR 34 -8.140 2.717 3.950
257 HH TYR 34 HH TYR 34 -9.414 0.942 4.874
258 H HIS 35 HN HIS 35 -3.252 3.725 -0.789
259 HA HIS 35 HA HIS 35 -2.423 5.049 1.672
260 HB2 HIS 35 HB2 HIS 35 -1.835 5.756 -1.220
261 HB3 HIS 35 HB1 HIS 35 -1.059 6.438 0.196
262 HD1 HIS 35 HD1 HIS 35 0.866 5.324 -1.729
263 HD2 HIS 35 HD2 HIS 35 -1.014 2.897 1.078
264 HE1 HIS 35 HE1 HIS 35 2.300 3.276 -1.527
265 HE2 HIS 35 HE2 HIS 35 1.243 1.904 0.297
266 H VAL 36 HN VAL 36 -3.586 6.569 2.496
267 HA VAL 36 HA VAL 36 -6.053 7.294 1.350
268 HB VAL 36 HB VAL 36 -6.170 8.710 3.472
269 HG11 VAL 36 HG11 VAL 36 -5.490 5.841 4.008
270 HG12 VAL 36 HG12 VAL 36 -6.900 6.266 3.052
271 HG13 VAL 36 HG13 VAL 36 -6.770 6.826 4.720
272 HG21 VAL 36 HG21 VAL 36 -3.830 9.051 3.877
273 HG22 VAL 36 HG22 VAL 36 -3.522 7.309 3.841
274 HG23 VAL 36 HG23 VAL 36 -4.450 8.020 5.172
275 H ILE 37 HN ILE 37 -3.021 9.134 1.825
276 HA ILE 37 HA ILE 37 -4.106 11.610 1.023
277 HB ILE 37 HB ILE 37 -1.291 10.582 1.152
278 HG12 ILE 37 HG12 ILE 37 -1.218 12.669 2.699
279 HG13 ILE 37 HG11 ILE 37 -2.968 12.540 2.626
280 HG21 ILE 37 HG21 ILE 37 -1.332 12.044 -0.800
281 HG22 ILE 37 HG22 ILE 37 -0.465 12.807 0.533
282 HG23 ILE 37 HG23 ILE 37 -2.112 13.309 0.152
283 HD11 ILE 37 HD11 ILE 37 -1.217 10.273 3.460
284 HD12 ILE 37 HD12 ILE 37 -2.961 10.445 3.637
285 HD13 ILE 37 HD13 ILE 37 -1.879 11.458 4.585
286 H THR 38 HN THR 38 -2.072 9.311 -0.686
287 HA THR 38 HA THR 38 -2.270 10.806 -3.123
288 HB THR 38 HB THR 38 -0.660 9.018 -3.937
289 HG1 THR 38 HG1 THR 38 0.294 7.795 -2.231
290 HG21 THR 38 HG21 THR 38 -0.052 10.734 -1.542
291 HG22 THR 38 HG22 THR 38 0.135 11.176 -3.243
292 HG23 THR 38 HG23 THR 38 1.187 9.952 -2.525
293 H ARG 39 HN ARG 39 -3.940 8.143 -1.821
294 HA ARG 39 HA ARG 39 -5.379 6.618 -2.627
295 HB2 ARG 39 HB2 ARG 39 -6.228 8.699 -3.822
296 HB3 ARG 39 HB1 ARG 39 -5.425 8.043 -5.226
297 HG2 ARG 39 HG2 ARG 39 -7.716 7.419 -5.325
298 HG3 ARG 39 HG1 ARG 39 -6.762 5.974 -4.957
299 HD2 ARG 39 HD2 ARG 39 -7.164 6.582 -2.526
300 HD3 ARG 39 HD1 ARG 39 -8.446 7.632 -3.124
301 HE ARG 39 HE ARG 39 -8.406 4.695 -3.340
302 HH11 ARG 39 HH11 ARG 39 -10.102 7.742 -3.524
303 HH12 ARG 39 HH12 ARG 39 -11.655 7.014 -3.834
304 HH21 ARG 39 HH21 ARG 39 -10.451 3.714 -3.721
305 HH22 ARG 39 HH22 ARG 39 -11.844 4.717 -3.969
306 H GLN 40 HN GLN 40 -2.891 5.765 -2.599
307 HA GLN 40 HA GLN 40 -2.509 4.333 -5.134
308 HB2 GLN 40 HB2 GLN 40 -0.540 4.903 -2.955
309 HB3 GLN 40 HB1 GLN 40 -0.175 4.110 -4.469
310 HG2 GLN 40 HG2 GLN 40 -0.598 6.137 -5.640
311 HG3 GLN 40 HG1 GLN 40 -1.150 6.930 -4.180
312 HE21 GLN 40 HE21 GLN 40 0.979 7.595 -6.039
313 HE22 GLN 40 HE22 GLN 40 2.432 7.656 -5.108
314 H THR 41 HN THR 41 -1.407 2.116 -4.674
315 HA THR 41 HA THR 41 -2.290 0.966 -2.179
316 HB THR 41 HB THR 41 -4.274 0.494 -3.186
317 HG1 THR 41 HG1 THR 41 -3.621 -1.517 -2.635
318 HG21 THR 41 HG21 THR 41 -3.807 1.497 -5.287
319 HG22 THR 41 HG22 THR 41 -4.539 -0.089 -5.561
320 HG23 THR 41 HG23 THR 41 -2.799 0.132 -5.782
321 H GLN 42 HN GLN 42 -1.265 -0.994 -1.623
322 HA GLN 42 HA GLN 42 0.793 -1.940 -3.526
323 HB2 GLN 42 HB2 GLN 42 0.978 -1.828 -0.500
324 HB3 GLN 42 HB1 GLN 42 2.175 -2.523 -1.567
325 HG2 GLN 42 HG2 GLN 42 2.858 -0.467 -2.372
326 HG3 GLN 42 HG1 GLN 42 1.395 0.321 -1.803
327 HE21 GLN 42 HE21 GLN 42 4.488 -0.967 -0.864
328 HE22 GLN 42 HE22 GLN 42 4.554 -0.214 0.692
329 H TRP 43 HN TRP 43 0.487 -3.998 -4.088
330 HA TRP 43 HA TRP 43 -1.305 -5.658 -2.476
331 HB2 TRP 43 HB2 TRP 43 -1.480 -5.368 -5.035
332 HB3 TRP 43 HB1 TRP 43 -0.077 -6.428 -5.120
333 HD1 TRP 43 HD1 TRP 43 -0.440 -8.977 -4.160
334 HE1 TRP 43 HE1 TRP 43 -2.562 -10.435 -4.120
335 HE3 TRP 43 HE3 TRP 43 -3.940 -5.319 -4.837
336 HZ2 TRP 43 HZ2 TRP 43 -5.351 -10.074 -4.361
337 HZ3 TRP 43 HZ3 TRP 43 -6.313 -5.959 -4.928
338 HH2 TRP 43 HH2 TRP 43 -7.003 -8.291 -4.693
339 H ASP 44 HN ASP 44 1.978 -5.541 -3.694
340 HA ASP 44 HA ASP 44 2.588 -8.066 -2.322
341 HB2 ASP 44 HB2 ASP 44 2.914 -8.144 -4.732
342 HB3 ASP 44 HB1 ASP 44 3.981 -6.746 -4.656
343 HA PRO 45 HA PRO 45 6.303 -5.225 -1.195
344 HB2 PRO 45 HB2 PRO 45 5.506 -2.461 -1.586
345 HB3 PRO 45 HB1 PRO 45 6.884 -3.324 -2.271
346 HG2 PRO 45 HG2 PRO 45 4.769 -2.495 -3.757
347 HG3 PRO 45 HG1 PRO 45 5.735 -3.925 -4.160
348 HD2 PRO 45 HD2 PRO 45 3.076 -3.753 -2.796
349 HD3 PRO 45 HD1 PRO 45 3.625 -4.890 -4.044
350 HA PRO 46 HA PRO 46 4.213 -4.241 2.688
351 HB2 PRO 46 HB2 PRO 46 6.121 -5.157 4.300
352 HB3 PRO 46 HB1 PRO 46 5.027 -6.250 3.441
353 HG2 PRO 46 HG2 PRO 46 7.822 -5.457 2.775
354 HG3 PRO 46 HG1 PRO 46 7.068 -7.055 2.717
355 HD2 PRO 46 HD2 PRO 46 7.435 -5.449 0.523
356 HD3 PRO 46 HD1 PRO 46 6.168 -6.682 0.646
357 H THR 47 HN THR 47 4.697 -2.847 4.435
358 HA THR 47 HA THR 47 5.115 -0.778 5.158
359 HB THR 47 HB THR 47 6.863 -2.181 6.192
360 HG1 THR 47 HG1 THR 47 7.405 -0.445 7.220
361 HG21 THR 47 HG21 THR 47 8.120 -2.602 4.070
362 HG22 THR 47 HG22 THR 47 9.114 -2.183 5.465
363 HG23 THR 47 HG23 THR 47 8.779 -0.974 4.224
364 H TRP 48 HN TRP 48 7.322 0.825 4.861
365 HA TRP 48 HA TRP 48 6.475 2.275 2.513
366 HB2 TRP 48 HB2 TRP 48 8.688 3.324 4.153
367 HB3 TRP 48 HB1 TRP 48 7.245 4.111 3.569
368 HD1 TRP 48 HD1 TRP 48 4.908 3.482 5.034
369 HE1 TRP 48 HE1 TRP 48 4.680 3.216 7.586
370 HE3 TRP 48 HE3 TRP 48 9.828 2.709 6.218
371 HZ2 TRP 48 HZ2 TRP 48 6.366 2.770 9.804
372 HZ3 TRP 48 HZ3 TRP 48 10.432 2.380 8.579
373 HH2 TRP 48 HH2 TRP 48 8.736 2.409 10.333
374 H GLU 49 HN GLU 49 9.515 1.013 3.816
375 HA GLU 49 HA GLU 49 10.745 1.489 1.201
376 HB2 GLU 49 HB2 GLU 49 11.975 1.371 3.950
377 HB3 GLU 49 HB1 GLU 49 12.902 1.470 2.453
378 HG2 GLU 49 HG2 GLU 49 11.711 3.511 1.883
379 HG3 GLU 49 HG1 GLU 49 10.887 3.456 3.435
380 H SER 50 HN SER 50 12.030 -0.081 0.275
381 HA SER 50 HA SER 50 11.384 -2.790 1.208
382 HB2 SER 50 HB2 SER 50 12.228 -1.876 -1.551
383 HB3 SER 50 HB1 SER 50 11.664 -3.485 -1.107
384 HG SER 50 HG SER 50 9.878 -1.638 -0.317
385 HA PRO 51 HA PRO 51 15.636 -3.371 2.293
386 HB2 PRO 51 HB2 PRO 51 15.595 -6.101 2.329
387 HB3 PRO 51 HB1 PRO 51 14.982 -5.086 3.639
388 HG2 PRO 51 HG2 PRO 51 13.486 -6.425 1.420
389 HG3 PRO 51 HG1 PRO 51 13.066 -6.309 3.140
390 HD2 PRO 51 HD2 PRO 51 11.917 -4.729 1.305
391 HD3 PRO 51 HD1 PRO 51 12.307 -4.132 2.933
392 H GLY 52 HN GLY 52 17.479 -4.881 1.621
393 HA2 GLY 52 HA2 GLY 52 17.920 -4.550 -1.159
394 HA3 GLY 52 HA1 GLY 52 18.963 -5.426 -0.050
395 H ASP 53 HN ASP 53 17.133 -7.369 0.826
396 HA ASP 53 HA ASP 53 17.546 -9.340 -1.108
397 HB2 ASP 53 HB2 ASP 53 17.267 -9.832 1.287
398 HB3 ASP 53 HB1 ASP 53 15.571 -9.372 1.184
399 H ASP 54 HN ASP 54 14.630 -7.492 -0.331
400 HA ASP 54 HA ASP 54 13.107 -8.894 -2.357
401 HB2 ASP 54 HB2 ASP 54 12.352 -6.614 -0.524
402 HB3 ASP 54 HB1 ASP 54 11.244 -7.392 -1.651
403 H ALA 55 HN ALA 55 14.929 -6.022 -2.038
404 HA ALA 55 HA ALA 55 15.580 -4.414 -3.476
405 HB1 ALA 55 HB1 ALA 55 15.310 -4.701 -5.871
406 HB2 ALA 55 HB2 ALA 55 14.139 -5.992 -5.602
407 HB3 ALA 55 HB3 ALA 55 15.821 -6.214 -5.122
408 H SER 56 HN SER 56 14.664 -2.726 -5.065
409 HA SER 56 HA SER 56 11.914 -2.108 -4.230
410 HB2 SER 56 HB2 SER 56 12.731 0.352 -4.383
411 HB3 SER 56 HB1 SER 56 13.167 -0.596 -2.964
412 HG SER 56 HG SER 56 15.095 -1.076 -4.592
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 -5.572 4.122 4.446
2 H2 GLY 1 HT2 GLY 1 -7.020 3.887 3.600
3 H3 GLY 1 HT3 GLY 1 -6.321 2.604 4.448
4 HA2 GLY 1 HA1 GLY 1 -6.696 3.728 6.536
5 HA3 GLY 1 HA2 GLY 1 -7.402 5.081 5.661
6 H SER 2 HN SER 2 -8.423 3.070 7.665
7 HA SER 2 HA SER 2 -10.230 1.297 6.446
8 HB2 SER 2 HB2 SER 2 -9.491 1.180 8.810
9 HB3 SER 2 HB1 SER 2 -10.428 2.633 9.160
10 HG SER 2 HG SER 2 -11.696 0.406 7.988
11 H ASP 3 HN ASP 3 -10.345 4.694 7.035
12 HA ASP 3 HA ASP 3 -13.146 5.110 6.913
13 HB2 ASP 3 HB2 ASP 3 -10.944 7.048 6.181
14 HB3 ASP 3 HB1 ASP 3 -12.592 7.455 6.643
15 H LEU 4 HN LEU 4 -10.738 4.602 4.459
16 HA LEU 4 HA LEU 4 -12.590 5.589 2.405
17 HB2 LEU 4 HB2 LEU 4 -9.569 5.417 2.337
18 HB3 LEU 4 HB1 LEU 4 -10.574 5.863 0.968
19 HG LEU 4 HG LEU 4 -11.452 7.723 2.582
20 HD11 LEU 4 HD11 LEU 4 -9.743 8.552 4.112
21 HD12 LEU 4 HD12 LEU 4 -8.757 7.128 3.774
22 HD13 LEU 4 HD13 LEU 4 -10.318 6.952 4.577
23 HD21 LEU 4 HD21 LEU 4 -10.258 8.109 0.485
24 HD22 LEU 4 HD22 LEU 4 -8.721 7.853 1.312
25 HD23 LEU 4 HD23 LEU 4 -9.733 9.233 1.738
26 HA PRO 5 HA PRO 5 -12.915 1.433 0.833
27 HB2 PRO 5 HB2 PRO 5 -13.590 2.803 -1.703
28 HB3 PRO 5 HB1 PRO 5 -14.547 1.659 -0.756
29 HG2 PRO 5 HG2 PRO 5 -15.179 4.256 -0.838
30 HG3 PRO 5 HG1 PRO 5 -15.368 3.305 0.649
31 HD2 PRO 5 HD2 PRO 5 -13.202 5.231 -0.107
32 HD3 PRO 5 HD1 PRO 5 -14.028 5.022 1.451
33 HA PRO 6 HA PRO 6 -9.033 0.726 -1.021
34 HB2 PRO 6 HB2 PRO 6 -10.243 -1.495 -2.550
35 HB3 PRO 6 HB1 PRO 6 -8.949 -1.532 -1.349
36 HG2 PRO 6 HG2 PRO 6 -11.383 -2.457 -0.770
37 HG3 PRO 6 HG1 PRO 6 -10.433 -1.567 0.435
38 HD2 PRO 6 HD2 PRO 6 -12.704 -0.607 -1.269
39 HD3 PRO 6 HD1 PRO 6 -12.377 -0.293 0.449
40 HA PRO 7 HA PRO 7 -9.046 2.455 -5.138
41 HB2 PRO 7 HB2 PRO 7 -6.185 2.305 -5.052
42 HB3 PRO 7 HB1 PRO 7 -7.192 3.718 -4.802
43 HG2 PRO 7 HG2 PRO 7 -5.668 2.569 -2.851
44 HG3 PRO 7 HG1 PRO 7 -7.138 3.512 -2.527
45 HD2 PRO 7 HD2 PRO 7 -6.785 0.532 -2.672
46 HD3 PRO 7 HD1 PRO 7 -7.703 1.499 -1.495
47 H SER 8 HN SER 8 -8.459 1.894 -7.256
48 HA SER 8 HA SER 8 -7.464 -0.810 -7.718
49 HB2 SER 8 HB2 SER 8 -9.259 0.282 -9.148
50 HB3 SER 8 HB1 SER 8 -8.036 1.418 -9.712
51 HG SER 8 HG SER 8 -8.370 -0.387 -11.122
52 HA PRO 9 HA PRO 9 -3.435 0.555 -7.289
53 HB2 PRO 9 HB2 PRO 9 -1.963 -1.223 -8.705
54 HB3 PRO 9 HB1 PRO 9 -2.815 -1.647 -7.219
55 HG2 PRO 9 HG2 PRO 9 -3.593 -2.150 -10.058
56 HG3 PRO 9 HG1 PRO 9 -3.763 -3.205 -8.644
57 HD2 PRO 9 HD2 PRO 9 -5.817 -1.733 -9.700
58 HD3 PRO 9 HD1 PRO 9 -5.727 -2.217 -7.995
59 HA PRO 10 HA PRO 10 -2.002 2.925 -10.819
60 HB2 PRO 10 HB2 PRO 10 -0.536 4.588 -9.126
61 HB3 PRO 10 HB1 PRO 10 -2.195 4.863 -9.654
62 HG2 PRO 10 HG2 PRO 10 -1.305 4.300 -7.024
63 HG3 PRO 10 HG1 PRO 10 -2.980 4.408 -7.591
64 HD2 PRO 10 HD2 PRO 10 -1.285 2.015 -7.124
65 HD3 PRO 10 HD1 PRO 10 -3.048 2.193 -7.006
66 H ALA 11 HN ALA 11 0.026 3.165 -11.829
67 HA ALA 11 HA ALA 11 2.122 1.379 -11.164
68 HB1 ALA 11 HB1 ALA 11 1.757 2.233 -13.438
69 HB2 ALA 11 HB2 ALA 11 3.400 2.542 -12.878
70 HB3 ALA 11 HB3 ALA 11 2.217 3.849 -12.898
71 H ALA 12 HN ALA 12 1.384 4.677 -10.388
72 HA ALA 12 HA ALA 12 3.837 5.547 -9.381
73 HB1 ALA 12 HB1 ALA 12 1.955 7.019 -9.942
74 HB2 ALA 12 HB2 ALA 12 2.604 7.331 -8.332
75 HB3 ALA 12 HB3 ALA 12 1.098 6.431 -8.517
76 H ALA 13 HN ALA 13 1.735 3.258 -8.084
77 HA ALA 13 HA ALA 13 1.646 3.833 -5.363
78 HB1 ALA 13 HB1 ALA 13 1.618 1.116 -6.657
79 HB2 ALA 13 HB2 ALA 13 0.223 2.173 -6.442
80 HB3 ALA 13 HB3 ALA 13 1.046 1.501 -5.035
81 H THR 14 HN THR 14 4.212 2.418 -7.215
82 HA THR 14 HA THR 14 5.551 1.156 -5.041
83 HB THR 14 HB THR 14 5.869 0.360 -7.329
84 HG1 THR 14 HG1 THR 14 7.840 0.936 -5.567
85 HG21 THR 14 HG21 THR 14 7.314 2.975 -7.791
86 HG22 THR 14 HG22 THR 14 5.783 2.491 -8.523
87 HG23 THR 14 HG23 THR 14 7.264 1.616 -8.916
88 H ILE 15 HN ILE 15 5.429 4.401 -6.147
89 HA ILE 15 HA ILE 15 7.985 5.358 -5.603
90 HB ILE 15 HB ILE 15 5.958 6.463 -6.781
91 HG12 ILE 15 HG12 ILE 15 6.875 8.726 -6.343
92 HG13 ILE 15 HG11 ILE 15 7.790 8.071 -4.988
93 HG21 ILE 15 HG21 ILE 15 4.373 6.438 -4.995
94 HG22 ILE 15 HG22 ILE 15 4.777 8.114 -5.356
95 HG23 ILE 15 HG23 ILE 15 5.470 7.329 -3.941
96 HD11 ILE 15 HD11 ILE 15 9.138 8.357 -7.012
97 HD12 ILE 15 HD12 ILE 15 8.090 7.210 -7.847
98 HD13 ILE 15 HD13 ILE 15 9.064 6.678 -6.477
99 H VAL 16 HN VAL 16 7.693 7.466 -3.850
100 HA VAL 16 HA VAL 16 8.260 6.161 -1.358
101 HB VAL 16 HB VAL 16 7.977 9.130 -1.793
102 HG11 VAL 16 HG11 VAL 16 9.894 7.822 0.074
103 HG12 VAL 16 HG12 VAL 16 8.192 7.914 0.515
104 HG13 VAL 16 HG13 VAL 16 9.100 9.396 0.194
105 HG21 VAL 16 HG21 VAL 16 10.321 9.219 -2.347
106 HG22 VAL 16 HG22 VAL 16 9.515 8.117 -3.462
107 HG23 VAL 16 HG23 VAL 16 10.477 7.476 -2.133
108 H LEU 17 HN LEU 17 6.993 6.007 0.440
109 HA LEU 17 HA LEU 17 4.256 7.036 0.131
110 HB2 LEU 17 HB2 LEU 17 4.707 4.542 -0.313
111 HB3 LEU 17 HB1 LEU 17 4.936 4.406 1.427
112 HG LEU 17 HG LEU 17 2.639 5.175 1.804
113 HD11 LEU 17 HD11 LEU 17 1.107 5.509 -0.066
114 HD12 LEU 17 HD12 LEU 17 2.432 5.270 -1.205
115 HD13 LEU 17 HD13 LEU 17 2.438 6.664 -0.124
116 HD21 LEU 17 HD21 LEU 17 1.474 3.247 0.959
117 HD22 LEU 17 HD22 LEU 17 3.105 2.777 1.439
118 HD23 LEU 17 HD23 LEU 17 2.717 2.990 -0.267
119 HA PRO 18 HA PRO 18 4.895 8.383 4.380
120 HB2 PRO 18 HB2 PRO 18 2.351 9.717 4.194
121 HB3 PRO 18 HB1 PRO 18 3.965 10.432 4.161
122 HG2 PRO 18 HG2 PRO 18 2.243 10.403 2.022
123 HG3 PRO 18 HG1 PRO 18 4.004 10.526 1.879
124 HD2 PRO 18 HD2 PRO 18 2.242 8.123 1.563
125 HD3 PRO 18 HD1 PRO 18 3.655 8.619 0.603
126 HA PRO 19 HA PRO 19 2.893 5.501 6.924
127 HB2 PRO 19 HB2 PRO 19 2.208 7.825 8.623
128 HB3 PRO 19 HB1 PRO 19 2.968 6.318 9.063
129 HG2 PRO 19 HG2 PRO 19 4.472 8.386 8.843
130 HG3 PRO 19 HG1 PRO 19 4.989 6.909 8.002
131 HD2 PRO 19 HD2 PRO 19 3.581 9.314 6.885
132 HD3 PRO 19 HD1 PRO 19 4.992 8.450 6.254
133 H ASN 20 HN ASN 20 0.947 8.029 5.782
134 HA ASN 20 HA ASN 20 -1.473 7.735 7.122
135 HB2 ASN 20 HB2 ASN 20 -1.406 8.272 4.171
136 HB3 ASN 20 HB1 ASN 20 -2.528 8.877 5.368
137 HD21 ASN 20 HD21 ASN 20 -2.133 10.730 6.317
138 HD22 ASN 20 HD22 ASN 20 -0.775 11.714 5.917
139 H TRP 21 HN TRP 21 -0.031 5.408 5.112
140 HA TRP 21 HA TRP 21 -2.441 4.474 3.867
141 HB2 TRP 21 HB2 TRP 21 -1.021 2.697 2.944
142 HB3 TRP 21 HB1 TRP 21 -0.263 4.270 2.727
143 HD1 TRP 21 HD1 TRP 21 2.024 4.714 3.958
144 HE1 TRP 21 HE1 TRP 21 3.674 3.190 5.209
145 HE3 TRP 21 HE3 TRP 21 -0.921 0.574 4.478
146 HZ2 TRP 21 HZ2 TRP 21 3.726 0.579 6.273
147 HZ3 TRP 21 HZ3 TRP 21 0.002 -1.396 5.621
148 HH2 TRP 21 HH2 TRP 21 2.280 -1.393 6.501
149 H LYS 22 HN LYS 22 -3.452 2.575 4.263
150 HA LYS 22 HA LYS 22 -2.807 1.171 6.757
151 HB2 LYS 22 HB2 LYS 22 -5.495 2.132 5.856
152 HB3 LYS 22 HB1 LYS 22 -5.311 0.830 7.009
153 HG2 LYS 22 HG2 LYS 22 -4.089 3.536 7.358
154 HG3 LYS 22 HG1 LYS 22 -5.658 3.067 8.034
155 HD2 LYS 22 HD2 LYS 22 -3.074 1.609 8.551
156 HD3 LYS 22 HD1 LYS 22 -3.747 2.822 9.631
157 HE2 LYS 22 HE2 LYS 22 -5.738 1.435 9.927
158 HE3 LYS 22 HE1 LYS 22 -5.076 0.263 8.792
159 HZ1 LYS 22 HZ1 LYS 22 -3.126 0.112 10.390
160 HZ2 LYS 22 HZ2 LYS 22 -4.579 -0.607 10.880
161 HZ3 LYS 22 HZ3 LYS 22 -4.124 0.895 11.521
162 H THR 23 HN THR 23 -4.181 -0.833 6.911
163 HA THR 23 HA THR 23 -3.732 -2.371 4.467
164 HB THR 23 HB THR 23 -3.602 -4.327 6.023
165 HG1 THR 23 HG1 THR 23 -3.200 -3.563 8.313
166 HG21 THR 23 HG21 THR 23 -1.698 -2.557 5.365
167 HG22 THR 23 HG22 THR 23 -1.386 -3.992 6.344
168 HG23 THR 23 HG23 THR 23 -1.631 -2.426 7.122
169 H ALA 24 HN ALA 24 -5.374 -3.332 3.484
170 HA ALA 24 HA ALA 24 -7.605 -4.367 5.016
171 HB1 ALA 24 HB1 ALA 24 -9.286 -3.186 4.082
172 HB2 ALA 24 HB2 ALA 24 -8.453 -3.055 2.539
173 HB3 ALA 24 HB3 ALA 24 -8.032 -1.961 3.858
174 H ARG 25 HN ARG 25 -8.937 -5.817 3.571
175 HA ARG 25 HA ARG 25 -7.216 -7.001 1.531
176 HB2 ARG 25 HB2 ARG 25 -8.797 -8.918 2.901
177 HB3 ARG 25 HB1 ARG 25 -7.068 -8.876 2.721
178 HG2 ARG 25 HG2 ARG 25 -6.928 -7.451 4.701
179 HG3 ARG 25 HG1 ARG 25 -8.684 -7.541 4.873
180 HD2 ARG 25 HD2 ARG 25 -8.475 -10.015 5.027
181 HD3 ARG 25 HD1 ARG 25 -6.725 -9.823 5.017
182 HE ARG 25 HE ARG 25 -7.764 -8.222 7.063
183 HH11 ARG 25 HH11 ARG 25 -7.372 -11.617 6.259
184 HH12 ARG 25 HH12 ARG 25 -7.410 -12.132 7.916
185 HH21 ARG 25 HH21 ARG 25 -7.781 -8.906 9.232
186 HH22 ARG 25 HH22 ARG 25 -7.638 -10.590 9.607
187 H ASP 26 HN ASP 26 -8.396 -8.406 0.023
188 HA ASP 26 HA ASP 26 -11.116 -7.534 -0.510
189 HB2 ASP 26 HB2 ASP 26 -9.357 -9.583 -1.887
190 HB3 ASP 26 HB1 ASP 26 -11.040 -9.352 -2.303
191 HA PRO 27 HA PRO 27 -13.508 -10.628 1.425
192 HB2 PRO 27 HB2 PRO 27 -14.618 -11.875 -0.833
193 HB3 PRO 27 HB1 PRO 27 -15.294 -10.505 0.034
194 HG2 PRO 27 HG2 PRO 27 -13.563 -10.512 -2.374
195 HG3 PRO 27 HG1 PRO 27 -15.002 -9.528 -2.040
196 HD2 PRO 27 HD2 PRO 27 -12.633 -8.453 -1.768
197 HD3 PRO 27 HD1 PRO 27 -13.830 -8.192 -0.485
198 H GLU 28 HN GLU 28 -11.526 -11.559 -1.322
199 HA GLU 28 HA GLU 28 -11.506 -14.346 -0.517
200 HB2 GLU 28 HB2 GLU 28 -10.071 -13.076 -2.842
201 HB3 GLU 28 HB1 GLU 28 -10.483 -14.776 -2.632
202 HG2 GLU 28 HG2 GLU 28 -12.904 -14.043 -2.641
203 HG3 GLU 28 HG1 GLU 28 -12.327 -12.471 -3.183
204 H GLY 29 HN GLY 29 -10.312 -12.615 1.312
205 HA2 GLY 29 HA2 GLY 29 -8.606 -12.828 2.806
206 HA3 GLY 29 HA1 GLY 29 -8.208 -14.321 1.986
207 H LYS 30 HN LYS 30 -7.948 -11.652 -0.138
208 HA LYS 30 HA LYS 30 -5.041 -11.768 0.174
209 HB2 LYS 30 HB2 LYS 30 -6.746 -10.458 -1.956
210 HB3 LYS 30 HB1 LYS 30 -4.989 -10.459 -1.942
211 HG2 LYS 30 HG2 LYS 30 -5.029 -12.929 -2.061
212 HG3 LYS 30 HG1 LYS 30 -6.788 -12.858 -2.204
213 HD2 LYS 30 HD2 LYS 30 -6.589 -11.571 -4.257
214 HD3 LYS 30 HD1 LYS 30 -4.832 -11.546 -4.094
215 HE2 LYS 30 HE2 LYS 30 -5.387 -13.230 -5.684
216 HE3 LYS 30 HE1 LYS 30 -4.865 -14.038 -4.207
217 HZ1 LYS 30 HZ1 LYS 30 -7.158 -14.478 -3.649
218 HZ2 LYS 30 HZ2 LYS 30 -6.838 -15.057 -5.208
219 HZ3 LYS 30 HZ3 LYS 30 -7.698 -13.610 -5.005
220 H ILE 31 HN ILE 31 -3.815 -10.069 0.848
221 HA ILE 31 HA ILE 31 -5.322 -7.839 2.049
222 HB ILE 31 HB ILE 31 -4.254 -9.200 3.719
223 HG12 ILE 31 HG12 ILE 31 -2.577 -7.456 4.613
224 HG13 ILE 31 HG11 ILE 31 -3.013 -6.515 3.207
225 HG21 ILE 31 HG21 ILE 31 -2.541 -10.272 2.415
226 HG22 ILE 31 HG22 ILE 31 -1.810 -9.475 3.809
227 HG23 ILE 31 HG23 ILE 31 -1.692 -8.740 2.210
228 HD11 ILE 31 HD11 ILE 31 -4.919 -7.487 5.310
229 HD12 ILE 31 HD12 ILE 31 -5.306 -6.481 3.916
230 HD13 ILE 31 HD13 ILE 31 -4.260 -5.855 5.187
231 H TYR 32 HN TYR 32 -4.643 -5.717 1.706
232 HA TYR 32 HA TYR 32 -2.268 -5.312 0.000
233 HB2 TYR 32 HB2 TYR 32 -4.847 -3.792 -0.408
234 HB3 TYR 32 HB1 TYR 32 -3.415 -3.777 -1.432
235 HD1 TYR 32 HD2 TYR 32 -6.362 -5.716 -0.415
236 HD2 TYR 32 HD1 TYR 32 -3.061 -5.484 -3.082
237 HE1 TYR 32 HE2 TYR 32 -7.363 -7.484 -1.794
238 HE2 TYR 32 HE1 TYR 32 -4.055 -7.248 -4.476
239 HH TYR 32 HH TYR 32 -7.302 -8.345 -3.991
240 H TYR 33 HN TYR 33 -1.823 -2.834 -0.133
241 HA TYR 33 HA TYR 33 -2.611 -1.435 2.321
242 HB2 TYR 33 HB2 TYR 33 0.014 -0.906 1.006
243 HB3 TYR 33 HB1 TYR 33 -0.475 -0.616 2.653
244 HD1 TYR 33 HD2 TYR 33 -0.781 -2.632 4.194
245 HD2 TYR 33 HD1 TYR 33 1.255 -2.831 0.470
246 HE1 TYR 33 HE2 TYR 33 0.327 -4.698 4.923
247 HE2 TYR 33 HE1 TYR 33 2.377 -4.900 1.189
248 HH TYR 33 HH TYR 33 2.959 -6.076 3.201
249 H TYR 34 HN TYR 34 -3.107 0.719 2.020
250 HA TYR 34 HA TYR 34 -2.764 1.873 -0.619
251 HB2 TYR 34 HB2 TYR 34 -5.184 2.564 -0.717
252 HB3 TYR 34 HB1 TYR 34 -4.858 0.861 -0.996
253 HD1 TYR 34 HD1 TYR 34 -5.267 -0.762 0.922
254 HD2 TYR 34 HD2 TYR 34 -6.684 3.250 0.937
255 HE1 TYR 34 HE1 TYR 34 -6.926 -1.358 2.630
256 HE2 TYR 34 HE2 TYR 34 -8.346 2.662 2.648
257 HH TYR 34 HH TYR 34 -8.306 -0.424 4.260
258 H HIS 35 HN HIS 35 -2.626 4.018 -0.756
259 HA HIS 35 HA HIS 35 -2.385 5.411 1.824
260 HB2 HIS 35 HB2 HIS 35 -0.558 5.494 -0.013
261 HB3 HIS 35 HB1 HIS 35 -1.659 6.522 -0.901
262 HD1 HIS 35 HD1 HIS 35 -0.696 8.789 -0.754
263 HD2 HIS 35 HD2 HIS 35 -0.561 6.810 2.898
264 HE1 HIS 35 HE1 HIS 35 0.110 10.496 0.907
265 HE2 HIS 35 HE2 HIS 35 0.301 9.248 3.089
266 H VAL 36 HN VAL 36 -3.691 6.956 2.450
267 HA VAL 36 HA VAL 36 -6.231 7.151 1.201
268 HB VAL 36 HB VAL 36 -6.638 8.731 3.163
269 HG11 VAL 36 HG11 VAL 36 -5.555 6.164 4.183
270 HG12 VAL 36 HG12 VAL 36 -6.811 6.081 2.952
271 HG13 VAL 36 HG13 VAL 36 -7.125 6.918 4.474
272 HG21 VAL 36 HG21 VAL 36 -4.413 9.479 3.593
273 HG22 VAL 36 HG22 VAL 36 -3.820 7.813 3.709
274 HG23 VAL 36 HG23 VAL 36 -4.892 8.468 4.963
275 H ILE 37 HN ILE 37 -3.512 9.452 1.564
276 HA ILE 37 HA ILE 37 -4.960 11.682 0.649
277 HB ILE 37 HB ILE 37 -2.016 11.146 0.821
278 HG12 ILE 37 HG12 ILE 37 -2.351 13.293 2.285
279 HG13 ILE 37 HG11 ILE 37 -4.041 12.811 2.223
280 HG21 ILE 37 HG21 ILE 37 -2.305 12.504 -1.190
281 HG22 ILE 37 HG22 ILE 37 -1.564 13.443 0.107
282 HG23 ILE 37 HG23 ILE 37 -3.272 13.662 -0.277
283 HD11 ILE 37 HD11 ILE 37 -1.776 11.177 3.292
284 HD12 ILE 37 HD12 ILE 37 -3.451 10.656 3.172
285 HD13 ILE 37 HD13 ILE 37 -3.023 11.996 4.230
286 H THR 38 HN THR 38 -2.603 9.635 -0.988
287 HA THR 38 HA THR 38 -2.978 11.025 -3.467
288 HB THR 38 HB THR 38 -1.231 9.340 -4.253
289 HG1 THR 38 HG1 THR 38 -0.248 8.139 -2.668
290 HG21 THR 38 HG21 THR 38 -0.717 11.192 -1.933
291 HG22 THR 38 HG22 THR 38 -0.667 11.619 -3.646
292 HG23 THR 38 HG23 THR 38 0.546 10.527 -2.972
293 H ARG 39 HN ARG 39 -4.374 8.275 -2.059
294 HA ARG 39 HA ARG 39 -5.692 6.611 -2.802
295 HB2 ARG 39 HB2 ARG 39 -5.842 8.357 -5.193
296 HB3 ARG 39 HB1 ARG 39 -6.700 6.843 -5.102
297 HG2 ARG 39 HG2 ARG 39 -7.014 9.054 -3.109
298 HG3 ARG 39 HG1 ARG 39 -8.054 8.843 -4.525
299 HD2 ARG 39 HD2 ARG 39 -7.517 6.665 -2.578
300 HD3 ARG 39 HD1 ARG 39 -8.853 7.796 -2.344
301 HE ARG 39 HE ARG 39 -9.040 6.749 -4.937
302 HH11 ARG 39 HH11 ARG 39 -9.309 5.661 -1.632
303 HH12 ARG 39 HH12 ARG 39 -10.376 4.344 -1.993
304 HH21 ARG 39 HH21 ARG 39 -10.482 5.031 -5.444
305 HH22 ARG 39 HH22 ARG 39 -11.059 3.999 -4.172
306 H GLN 40 HN GLN 40 -3.161 5.898 -2.729
307 HA GLN 40 HA GLN 40 -2.686 4.467 -5.252
308 HB2 GLN 40 HB2 GLN 40 -0.748 5.012 -3.053
309 HB3 GLN 40 HB1 GLN 40 -0.363 4.341 -4.620
310 HG2 GLN 40 HG2 GLN 40 -0.905 6.429 -5.642
311 HG3 GLN 40 HG1 GLN 40 -1.370 7.110 -4.094
312 HE21 GLN 40 HE21 GLN 40 1.153 6.333 -6.224
313 HE22 GLN 40 HE22 GLN 40 2.432 7.003 -5.297
314 H THR 41 HN THR 41 -1.928 2.258 -4.980
315 HA THR 41 HA THR 41 -2.120 1.082 -2.384
316 HB THR 41 HB THR 41 -4.398 0.916 -2.729
317 HG1 THR 41 HG1 THR 41 -3.365 -1.150 -2.273
318 HG21 THR 41 HG21 THR 41 -4.481 1.657 -4.977
319 HG22 THR 41 HG22 THR 41 -5.412 0.161 -4.844
320 HG23 THR 41 HG23 THR 41 -3.800 0.142 -5.570
321 H GLN 42 HN GLN 42 -0.932 -0.769 -2.224
322 HA GLN 42 HA GLN 42 -0.104 -2.158 -4.643
323 HB2 GLN 42 HB2 GLN 42 2.343 -1.941 -3.586
324 HB3 GLN 42 HB1 GLN 42 1.716 -0.794 -4.757
325 HG2 GLN 42 HG2 GLN 42 2.667 0.530 -3.093
326 HG3 GLN 42 HG1 GLN 42 0.948 0.582 -2.772
327 HE21 GLN 42 HE21 GLN 42 3.115 -2.059 -1.959
328 HE22 GLN 42 HE22 GLN 42 2.904 -1.896 -0.261
329 H TRP 43 HN TRP 43 -0.181 -4.289 -4.266
330 HA TRP 43 HA TRP 43 0.295 -5.272 -1.550
331 HB2 TRP 43 HB2 TRP 43 -1.653 -6.161 -2.802
332 HB3 TRP 43 HB1 TRP 43 -0.557 -6.804 -4.018
333 HD1 TRP 43 HD1 TRP 43 0.694 -7.224 -0.497
334 HE1 TRP 43 HE1 TRP 43 0.438 -9.679 0.241
335 HE3 TRP 43 HE3 TRP 43 -2.231 -8.922 -4.337
336 HZ2 TRP 43 HZ2 TRP 43 -0.841 -12.011 -0.681
337 HZ3 TRP 43 HZ3 TRP 43 -2.928 -11.282 -4.324
338 HH2 TRP 43 HH2 TRP 43 -2.246 -12.792 -2.534
339 H ASP 44 HN ASP 44 1.610 -5.415 -4.811
340 HA ASP 44 HA ASP 44 3.741 -7.193 -3.878
341 HB2 ASP 44 HB2 ASP 44 2.399 -7.771 -5.920
342 HB3 ASP 44 HB1 ASP 44 3.131 -6.385 -6.722
343 HA PRO 45 HA PRO 45 6.178 -3.316 -5.670
344 HB2 PRO 45 HB2 PRO 45 4.081 -1.274 -5.141
345 HB3 PRO 45 HB1 PRO 45 5.257 -1.360 -6.457
346 HG2 PRO 45 HG2 PRO 45 2.695 -1.911 -6.896
347 HG3 PRO 45 HG1 PRO 45 3.974 -2.862 -7.678
348 HD2 PRO 45 HD2 PRO 45 2.277 -3.552 -5.307
349 HD3 PRO 45 HD1 PRO 45 2.793 -4.581 -6.659
350 HA PRO 46 HA PRO 46 7.103 -2.956 -1.348
351 HB2 PRO 46 HB2 PRO 46 8.992 -0.849 -2.222
352 HB3 PRO 46 HB1 PRO 46 9.300 -2.328 -1.304
353 HG2 PRO 46 HG2 PRO 46 10.020 -2.125 -3.843
354 HG3 PRO 46 HG1 PRO 46 9.379 -3.646 -3.208
355 HD2 PRO 46 HD2 PRO 46 8.031 -1.572 -4.897
356 HD3 PRO 46 HD1 PRO 46 7.917 -3.344 -4.980
357 H THR 47 HN THR 47 7.042 -1.458 0.374
358 HA THR 47 HA THR 47 5.499 0.969 -0.256
359 HB THR 47 HB THR 47 3.995 -0.867 0.444
360 HG1 THR 47 HG1 THR 47 2.929 0.817 1.088
361 HG21 THR 47 HG21 THR 47 5.679 -1.915 2.000
362 HG22 THR 47 HG22 THR 47 4.024 -1.825 2.593
363 HG23 THR 47 HG23 THR 47 5.234 -0.676 3.167
364 H TRP 48 HN TRP 48 5.044 1.644 2.407
365 HA TRP 48 HA TRP 48 7.471 3.066 2.933
366 HB2 TRP 48 HB2 TRP 48 5.374 4.144 3.388
367 HB3 TRP 48 HB1 TRP 48 4.914 2.859 4.491
368 HD1 TRP 48 HD1 TRP 48 7.850 5.404 4.277
369 HE1 TRP 48 HE1 TRP 48 8.345 6.229 6.664
370 HE3 TRP 48 HE3 TRP 48 4.380 2.647 6.826
371 HZ2 TRP 48 HZ2 TRP 48 7.388 5.773 9.279
372 HZ3 TRP 48 HZ3 TRP 48 4.238 2.902 9.269
373 HH2 TRP 48 HH2 TRP 48 5.712 4.432 10.466
374 H GLU 49 HN GLU 49 5.771 0.401 4.416
375 HA GLU 49 HA GLU 49 7.765 0.196 6.535
376 HB2 GLU 49 HB2 GLU 49 4.970 0.188 6.491
377 HB3 GLU 49 HB1 GLU 49 5.427 -1.476 6.818
378 HG2 GLU 49 HG2 GLU 49 6.532 0.853 8.287
379 HG3 GLU 49 HG1 GLU 49 5.068 0.018 8.803
380 H SER 50 HN SER 50 8.508 -1.916 7.169
381 HA SER 50 HA SER 50 8.481 -3.827 4.928
382 HB2 SER 50 HB2 SER 50 10.427 -3.673 7.245
383 HB3 SER 50 HB1 SER 50 10.584 -4.663 5.791
384 HG SER 50 HG SER 50 10.271 -1.909 5.463
385 HA PRO 51 HA PRO 51 5.953 -6.449 7.521
386 HB2 PRO 51 HB2 PRO 51 6.181 -8.667 5.939
387 HB3 PRO 51 HB1 PRO 51 5.053 -7.343 5.621
388 HG2 PRO 51 HG2 PRO 51 7.744 -7.875 4.418
389 HG3 PRO 51 HG1 PRO 51 6.250 -7.327 3.632
390 HD2 PRO 51 HD2 PRO 51 8.241 -5.620 4.242
391 HD3 PRO 51 HD1 PRO 51 6.532 -5.142 4.325
392 H GLY 52 HN GLY 52 6.140 -8.601 8.531
393 HA2 GLY 52 HA2 GLY 52 8.679 -9.077 9.667
394 HA3 GLY 52 HA1 GLY 52 7.317 -10.192 9.715
395 H ASP 53 HN ASP 53 7.128 -10.118 6.784
396 HA ASP 53 HA ASP 53 8.646 -12.318 6.013
397 HB2 ASP 53 HB2 ASP 53 6.712 -11.788 4.759
398 HB3 ASP 53 HB1 ASP 53 7.239 -10.131 4.492
399 H ASP 54 HN ASP 54 9.369 -8.876 5.836
400 HA ASP 54 HA ASP 54 11.704 -9.347 4.174
401 HB2 ASP 54 HB2 ASP 54 10.308 -7.364 3.754
402 HB3 ASP 54 HB1 ASP 54 10.658 -6.775 5.375
403 H ALA 55 HN ALA 55 10.988 -8.277 7.479
404 HA ALA 55 HA ALA 55 13.879 -8.303 8.019
405 HB1 ALA 55 HB1 ALA 55 11.718 -6.855 9.540
406 HB2 ALA 55 HB2 ALA 55 12.795 -6.126 8.348
407 HB3 ALA 55 HB3 ALA 55 13.451 -6.774 9.852
408 H SER 56 HN SER 56 11.252 -8.402 10.363
409 HA SER 56 HA SER 56 11.825 -11.152 11.064
410 HB2 SER 56 HB2 SER 56 13.537 -9.768 12.281
411 HB3 SER 56 HB1 SER 56 12.214 -8.945 13.103
412 HG SER 56 HG SER 56 12.523 -10.515 14.496
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 -11.949 -1.227 2.416
2 H2 GLY 1 HT2 GLY 1 -13.130 -0.066 2.785
3 H3 GLY 1 HT3 GLY 1 -12.650 -1.192 3.959
4 HA2 GLY 1 HA1 GLY 1 -10.409 -0.244 3.958
5 HA3 GLY 1 HA2 GLY 1 -10.968 0.963 2.807
6 H SER 2 HN SER 2 -9.952 1.087 5.671
7 HA SER 2 HA SER 2 -12.165 1.737 7.334
8 HB2 SER 2 HB2 SER 2 -9.870 0.976 8.078
9 HB3 SER 2 HB1 SER 2 -9.305 2.608 7.732
10 HG SER 2 HG SER 2 -10.787 3.395 9.270
11 H ASP 3 HN ASP 3 -9.737 3.776 5.704
12 HA ASP 3 HA ASP 3 -11.335 6.148 6.273
13 HB2 ASP 3 HB2 ASP 3 -8.828 6.161 6.468
14 HB3 ASP 3 HB1 ASP 3 -8.741 5.943 4.726
15 H LEU 4 HN LEU 4 -10.119 4.322 3.515
16 HA LEU 4 HA LEU 4 -12.158 5.553 1.805
17 HB2 LEU 4 HB2 LEU 4 -9.195 5.339 1.289
18 HB3 LEU 4 HB1 LEU 4 -10.356 5.541 -0.014
19 HG LEU 4 HG LEU 4 -9.922 7.477 2.264
20 HD11 LEU 4 HD11 LEU 4 -8.963 8.927 0.562
21 HD12 LEU 4 HD12 LEU 4 -9.191 7.669 -0.652
22 HD13 LEU 4 HD13 LEU 4 -8.060 7.415 0.677
23 HD21 LEU 4 HD21 LEU 4 -11.687 7.641 -0.178
24 HD22 LEU 4 HD22 LEU 4 -11.389 8.956 0.959
25 HD23 LEU 4 HD23 LEU 4 -12.227 7.500 1.497
26 HA PRO 5 HA PRO 5 -12.831 1.386 0.324
27 HB2 PRO 5 HB2 PRO 5 -13.619 2.006 -2.232
28 HB3 PRO 5 HB1 PRO 5 -14.683 2.115 -0.826
29 HG2 PRO 5 HG2 PRO 5 -13.158 4.275 -2.223
30 HG3 PRO 5 HG1 PRO 5 -14.813 4.304 -1.588
31 HD2 PRO 5 HD2 PRO 5 -12.768 5.442 -0.268
32 HD3 PRO 5 HD1 PRO 5 -14.106 4.644 0.589
33 HA PRO 6 HA PRO 6 -9.000 0.385 -1.437
34 HB2 PRO 6 HB2 PRO 6 -9.561 -1.874 -2.884
35 HB3 PRO 6 HB1 PRO 6 -9.406 -1.841 -1.123
36 HG2 PRO 6 HG2 PRO 6 -11.871 -1.813 -2.814
37 HG3 PRO 6 HG1 PRO 6 -11.561 -2.675 -1.296
38 HD2 PRO 6 HD2 PRO 6 -13.010 -0.399 -1.393
39 HD3 PRO 6 HD1 PRO 6 -11.986 -0.815 -0.003
40 HA PRO 7 HA PRO 7 -8.960 2.005 -5.596
41 HB2 PRO 7 HB2 PRO 7 -6.103 2.028 -5.412
42 HB3 PRO 7 HB1 PRO 7 -7.204 3.385 -5.236
43 HG2 PRO 7 HG2 PRO 7 -5.679 2.382 -3.192
44 HG3 PRO 7 HG1 PRO 7 -7.210 3.243 -2.951
45 HD2 PRO 7 HD2 PRO 7 -6.690 0.285 -3.001
46 HD3 PRO 7 HD1 PRO 7 -7.696 1.231 -1.877
47 H SER 8 HN SER 8 -8.406 1.306 -7.666
48 HA SER 8 HA SER 8 -7.022 -1.238 -7.937
49 HB2 SER 8 HB2 SER 8 -7.290 -0.557 -10.451
50 HB3 SER 8 HB1 SER 8 -8.732 -1.014 -9.548
51 HG SER 8 HG SER 8 -7.941 1.472 -10.529
52 HA PRO 9 HA PRO 9 -3.214 0.592 -7.600
53 HB2 PRO 9 HB2 PRO 9 -1.954 -1.163 -9.577
54 HB3 PRO 9 HB1 PRO 9 -1.749 -1.119 -7.825
55 HG2 PRO 9 HG2 PRO 9 -3.039 -3.133 -9.073
56 HG3 PRO 9 HG1 PRO 9 -3.496 -2.575 -7.453
57 HD2 PRO 9 HD2 PRO 9 -4.781 -1.988 -10.095
58 HD3 PRO 9 HD1 PRO 9 -5.540 -2.331 -8.524
59 HA PRO 10 HA PRO 10 -2.088 3.196 -11.092
60 HB2 PRO 10 HB2 PRO 10 -0.795 4.976 -9.380
61 HB3 PRO 10 HB1 PRO 10 -2.480 5.083 -9.890
62 HG2 PRO 10 HG2 PRO 10 -1.496 4.562 -7.276
63 HG3 PRO 10 HG1 PRO 10 -3.182 4.539 -7.817
64 HD2 PRO 10 HD2 PRO 10 -1.299 2.286 -7.396
65 HD3 PRO 10 HD1 PRO 10 -3.073 2.316 -7.295
66 H ALA 11 HN ALA 11 -0.067 3.631 -12.102
67 HA ALA 11 HA ALA 11 2.179 2.059 -11.441
68 HB1 ALA 11 HB1 ALA 11 1.817 2.996 -13.681
69 HB2 ALA 11 HB2 ALA 11 3.403 3.424 -13.042
70 HB3 ALA 11 HB3 ALA 11 2.103 4.616 -13.045
71 H ALA 12 HN ALA 12 1.126 5.240 -10.499
72 HA ALA 12 HA ALA 12 3.411 6.288 -9.324
73 HB1 ALA 12 HB1 ALA 12 1.307 7.519 -9.736
74 HB2 ALA 12 HB2 ALA 12 1.959 7.767 -8.117
75 HB3 ALA 12 HB3 ALA 12 0.591 6.681 -8.358
76 H ALA 13 HN ALA 13 1.547 3.662 -8.312
77 HA ALA 13 HA ALA 13 1.666 3.756 -5.531
78 HB1 ALA 13 HB1 ALA 13 1.228 1.384 -5.558
79 HB2 ALA 13 HB2 ALA 13 1.722 1.285 -7.250
80 HB3 ALA 13 HB3 ALA 13 0.274 2.188 -6.804
81 H THR 14 HN THR 14 4.146 3.020 -7.804
82 HA THR 14 HA THR 14 5.744 1.362 -6.140
83 HB THR 14 HB THR 14 5.928 1.254 -8.578
84 HG1 THR 14 HG1 THR 14 8.120 1.776 -6.929
85 HG21 THR 14 HG21 THR 14 7.130 4.017 -8.372
86 HG22 THR 14 HG22 THR 14 5.585 3.607 -9.117
87 HG23 THR 14 HG23 THR 14 7.089 3.019 -9.827
88 H ILE 15 HN ILE 15 5.342 4.779 -6.343
89 HA ILE 15 HA ILE 15 7.901 5.662 -5.622
90 HB ILE 15 HB ILE 15 5.844 6.963 -6.529
91 HG12 ILE 15 HG12 ILE 15 6.734 9.076 -5.642
92 HG13 ILE 15 HG11 ILE 15 7.631 8.185 -4.416
93 HG21 ILE 15 HG21 ILE 15 4.240 6.548 -4.839
94 HG22 ILE 15 HG22 ILE 15 4.685 8.251 -4.729
95 HG23 ILE 15 HG23 ILE 15 5.338 7.098 -3.572
96 HD11 ILE 15 HD11 ILE 15 9.011 8.888 -6.325
97 HD12 ILE 15 HD12 ILE 15 8.007 7.889 -7.377
98 HD13 ILE 15 HD13 ILE 15 8.973 7.137 -6.109
99 H VAL 16 HN VAL 16 7.619 7.257 -3.432
100 HA VAL 16 HA VAL 16 7.958 5.262 -1.321
101 HB VAL 16 HB VAL 16 8.668 8.207 -1.313
102 HG11 VAL 16 HG11 VAL 16 10.156 7.509 0.588
103 HG12 VAL 16 HG12 VAL 16 9.293 5.968 0.595
104 HG13 VAL 16 HG13 VAL 16 8.425 7.467 0.927
105 HG21 VAL 16 HG21 VAL 16 10.969 7.487 -1.679
106 HG22 VAL 16 HG22 VAL 16 9.928 6.968 -3.006
107 HG23 VAL 16 HG23 VAL 16 10.436 5.808 -1.779
108 H LEU 17 HN LEU 17 6.889 5.361 0.673
109 HA LEU 17 HA LEU 17 4.396 6.912 0.529
110 HB2 LEU 17 HB2 LEU 17 4.926 4.037 1.120
111 HB3 LEU 17 HB1 LEU 17 3.469 4.800 1.681
112 HG LEU 17 HG LEU 17 4.288 4.775 -1.213
113 HD11 LEU 17 HD11 LEU 17 2.719 2.931 -1.515
114 HD12 LEU 17 HD12 LEU 17 2.455 2.860 0.228
115 HD13 LEU 17 HD13 LEU 17 4.039 2.467 -0.441
116 HD21 LEU 17 HD21 LEU 17 2.729 6.470 -0.778
117 HD22 LEU 17 HD22 LEU 17 1.826 5.440 0.327
118 HD23 LEU 17 HD23 LEU 17 1.778 5.118 -1.408
119 HA PRO 18 HA PRO 18 5.349 7.999 4.814
120 HB2 PRO 18 HB2 PRO 18 2.996 9.698 4.588
121 HB3 PRO 18 HB1 PRO 18 4.688 10.168 4.762
122 HG2 PRO 18 HG2 PRO 18 3.272 10.596 2.491
123 HG3 PRO 18 HG1 PRO 18 5.022 10.301 2.496
124 HD2 PRO 18 HD2 PRO 18 2.784 8.388 1.914
125 HD3 PRO 18 HD1 PRO 18 4.322 8.617 1.054
126 HA PRO 19 HA PRO 19 2.891 5.611 7.474
127 HB2 PRO 19 HB2 PRO 19 2.215 8.108 8.907
128 HB3 PRO 19 HB1 PRO 19 2.829 6.601 9.539
129 HG2 PRO 19 HG2 PRO 19 4.479 8.558 9.298
130 HG3 PRO 19 HG1 PRO 19 4.972 6.981 8.643
131 HD2 PRO 19 HD2 PRO 19 3.853 9.359 7.192
132 HD3 PRO 19 HD1 PRO 19 5.246 8.347 6.775
133 H ASN 20 HN ASN 20 1.251 8.112 5.946
134 HA ASN 20 HA ASN 20 -1.255 8.206 7.097
135 HB2 ASN 20 HB2 ASN 20 -0.581 8.550 4.189
136 HB3 ASN 20 HB1 ASN 20 -2.080 9.037 4.936
137 HD21 ASN 20 HD21 ASN 20 -2.186 10.844 5.991
138 HD22 ASN 20 HD22 ASN 20 -0.903 11.981 6.042
139 H TRP 21 HN TRP 21 -0.060 5.406 5.632
140 HA TRP 21 HA TRP 21 -2.336 4.779 4.003
141 HB2 TRP 21 HB2 TRP 21 -1.174 2.771 3.452
142 HB3 TRP 21 HB1 TRP 21 0.076 3.998 3.619
143 HD1 TRP 21 HD1 TRP 21 -1.361 0.935 5.468
144 HE1 TRP 21 HE1 TRP 21 0.403 0.077 7.136
145 HE3 TRP 21 HE3 TRP 21 2.148 4.621 4.921
146 HZ2 TRP 21 HZ2 TRP 21 2.935 0.846 8.074
147 HZ3 TRP 21 HZ3 TRP 21 4.216 4.473 6.240
148 HH2 TRP 21 HH2 TRP 21 4.601 2.623 7.784
149 H LYS 22 HN LYS 22 -3.503 2.795 4.264
150 HA LYS 22 HA LYS 22 -3.761 1.822 7.019
151 HB2 LYS 22 HB2 LYS 22 -6.003 2.217 5.047
152 HB3 LYS 22 HB1 LYS 22 -6.144 1.400 6.580
153 HG2 LYS 22 HG2 LYS 22 -5.447 4.285 6.212
154 HG3 LYS 22 HG1 LYS 22 -7.001 3.636 6.753
155 HD2 LYS 22 HD2 LYS 22 -5.555 2.448 8.568
156 HD3 LYS 22 HD1 LYS 22 -4.373 3.694 8.162
157 HE2 LYS 22 HE2 LYS 22 -6.026 5.391 8.583
158 HE3 LYS 22 HE1 LYS 22 -7.191 4.153 9.050
159 HZ1 LYS 22 HZ1 LYS 22 -6.090 5.167 10.981
160 HZ2 LYS 22 HZ2 LYS 22 -4.584 4.654 10.394
161 HZ3 LYS 22 HZ3 LYS 22 -5.744 3.513 10.862
162 H THR 23 HN THR 23 -4.845 -0.344 6.986
163 HA THR 23 HA THR 23 -3.939 -1.929 4.686
164 HB THR 23 HB THR 23 -3.469 -3.776 6.246
165 HG1 THR 23 HG1 THR 23 -4.869 -3.247 7.958
166 HG21 THR 23 HG21 THR 23 -1.937 -1.618 5.752
167 HG22 THR 23 HG22 THR 23 -1.383 -3.026 6.662
168 HG23 THR 23 HG23 THR 23 -1.962 -1.592 7.514
169 H ALA 24 HN ALA 24 -5.285 -3.578 4.005
170 HA ALA 24 HA ALA 24 -7.511 -4.419 5.600
171 HB1 ALA 24 HB1 ALA 24 -9.265 -3.548 4.476
172 HB2 ALA 24 HB2 ALA 24 -8.384 -3.511 2.955
173 HB3 ALA 24 HB3 ALA 24 -8.107 -2.249 4.156
174 H ARG 25 HN ARG 25 -8.756 -6.079 4.496
175 HA ARG 25 HA ARG 25 -7.278 -7.461 2.391
176 HB2 ARG 25 HB2 ARG 25 -8.417 -8.642 4.915
177 HB3 ARG 25 HB1 ARG 25 -7.911 -9.591 3.546
178 HG2 ARG 25 HG2 ARG 25 -5.627 -8.688 3.822
179 HG3 ARG 25 HG1 ARG 25 -6.180 -7.864 5.283
180 HD2 ARG 25 HD2 ARG 25 -6.741 -9.978 6.310
181 HD3 ARG 25 HD1 ARG 25 -6.333 -10.840 4.828
182 HE ARG 25 HE ARG 25 -4.394 -9.466 6.578
183 HH11 ARG 25 HH11 ARG 25 -5.179 -11.870 4.164
184 HH12 ARG 25 HH12 ARG 25 -3.613 -12.624 4.206
185 HH21 ARG 25 HH21 ARG 25 -2.325 -10.438 6.636
186 HH22 ARG 25 HH22 ARG 25 -1.988 -11.798 5.610
187 H ASP 26 HN ASP 26 -8.596 -8.818 1.063
188 HA ASP 26 HA ASP 26 -11.410 -8.022 0.993
189 HB2 ASP 26 HB2 ASP 26 -9.734 -9.622 -0.950
190 HB3 ASP 26 HB1 ASP 26 -11.467 -9.427 -1.118
191 HA PRO 27 HA PRO 27 -13.365 -11.527 2.643
192 HB2 PRO 27 HB2 PRO 27 -14.625 -12.570 0.356
193 HB3 PRO 27 HB1 PRO 27 -15.293 -11.387 1.468
194 HG2 PRO 27 HG2 PRO 27 -13.851 -10.931 -1.083
195 HG3 PRO 27 HG1 PRO 27 -15.302 -10.116 -0.465
196 HD2 PRO 27 HD2 PRO 27 -12.989 -8.902 -0.295
197 HD3 PRO 27 HD1 PRO 27 -14.042 -8.911 1.133
198 H GLU 28 HN GLU 28 -11.746 -12.044 -0.449
199 HA GLU 28 HA GLU 28 -11.457 -14.893 -0.001
200 HB2 GLU 28 HB2 GLU 28 -10.355 -13.247 -2.268
201 HB3 GLU 28 HB1 GLU 28 -10.711 -14.971 -2.259
202 HG2 GLU 28 HG2 GLU 28 -13.092 -14.465 -2.055
203 HG3 GLU 28 HG1 GLU 28 -12.723 -12.746 -2.104
204 H GLY 29 HN GLY 29 -10.107 -13.312 1.877
205 HA2 GLY 29 HA2 GLY 29 -8.134 -13.405 3.033
206 HA3 GLY 29 HA1 GLY 29 -7.703 -14.746 1.990
207 H LYS 30 HN LYS 30 -8.318 -11.856 0.284
208 HA LYS 30 HA LYS 30 -5.552 -11.677 -0.499
209 HB2 LYS 30 HB2 LYS 30 -7.828 -9.784 -1.144
210 HB3 LYS 30 HB1 LYS 30 -6.288 -9.894 -1.981
211 HG2 LYS 30 HG2 LYS 30 -6.859 -12.090 -2.816
212 HG3 LYS 30 HG1 LYS 30 -8.368 -12.067 -1.902
213 HD2 LYS 30 HD2 LYS 30 -9.099 -10.104 -3.195
214 HD3 LYS 30 HD1 LYS 30 -7.604 -10.181 -4.129
215 HE2 LYS 30 HE2 LYS 30 -9.707 -12.341 -3.994
216 HE3 LYS 30 HE1 LYS 30 -9.498 -11.198 -5.319
217 HZ1 LYS 30 HZ1 LYS 30 -7.558 -13.270 -4.445
218 HZ2 LYS 30 HZ2 LYS 30 -7.244 -12.106 -5.640
219 HZ3 LYS 30 HZ3 LYS 30 -8.458 -13.265 -5.882
220 H ILE 31 HN ILE 31 -4.052 -10.229 0.218
221 HA ILE 31 HA ILE 31 -4.990 -8.208 2.166
222 HB ILE 31 HB ILE 31 -3.545 -9.786 3.292
223 HG12 ILE 31 HG12 ILE 31 -1.776 -8.340 4.090
224 HG13 ILE 31 HG11 ILE 31 -1.916 -7.326 2.680
225 HG21 ILE 31 HG21 ILE 31 -2.160 -10.932 1.970
226 HG22 ILE 31 HG22 ILE 31 -1.045 -9.612 2.337
227 HG23 ILE 31 HG23 ILE 31 -1.970 -9.589 0.839
228 HD11 ILE 31 HD11 ILE 31 -2.920 -6.267 4.591
229 HD12 ILE 31 HD12 ILE 31 -3.938 -7.678 4.859
230 HD13 ILE 31 HD13 ILE 31 -4.172 -6.689 3.422
231 H TYR 32 HN TYR 32 -4.289 -6.099 1.889
232 HA TYR 32 HA TYR 32 -2.382 -5.473 -0.190
233 HB2 TYR 32 HB2 TYR 32 -4.012 -3.935 -1.370
234 HB3 TYR 32 HB1 TYR 32 -4.270 -5.661 -1.623
235 HD1 TYR 32 HD1 TYR 32 -5.552 -2.644 0.070
236 HD2 TYR 32 HD2 TYR 32 -6.265 -6.736 -0.861
237 HE1 TYR 32 HE1 TYR 32 -7.886 -2.401 0.809
238 HE2 TYR 32 HE2 TYR 32 -8.593 -6.504 -0.122
239 HH TYR 32 HH TYR 32 -9.979 -5.163 1.179
240 H TYR 33 HN TYR 33 -2.470 -2.948 -0.529
241 HA TYR 33 HA TYR 33 -2.682 -1.632 2.085
242 HB2 TYR 33 HB2 TYR 33 -0.348 -1.640 0.181
243 HB3 TYR 33 HB1 TYR 33 -0.481 -0.578 1.557
244 HD1 TYR 33 HD2 TYR 33 -0.987 -1.892 3.853
245 HD2 TYR 33 HD1 TYR 33 0.900 -3.570 0.426
246 HE1 TYR 33 HE2 TYR 33 0.048 -3.609 5.271
247 HE2 TYR 33 HE1 TYR 33 1.939 -5.297 1.840
248 HH TYR 33 HH TYR 33 0.948 -5.937 4.977
249 H TYR 34 HN TYR 34 -3.275 0.550 1.965
250 HA TYR 34 HA TYR 34 -3.349 1.780 -0.676
251 HB2 TYR 34 HB2 TYR 34 -5.686 2.580 -0.336
252 HB3 TYR 34 HB1 TYR 34 -5.541 0.849 -0.582
253 HD1 TYR 34 HD1 TYR 34 -5.861 -0.697 1.339
254 HD2 TYR 34 HD2 TYR 34 -6.594 3.481 1.666
255 HE1 TYR 34 HE1 TYR 34 -7.189 -1.095 3.366
256 HE2 TYR 34 HE2 TYR 34 -7.919 3.094 3.698
257 HH TYR 34 HH TYR 34 -7.951 0.057 5.316
258 H HIS 35 HN HIS 35 -3.125 3.938 -0.783
259 HA HIS 35 HA HIS 35 -2.523 5.254 1.786
260 HB2 HIS 35 HB2 HIS 35 -0.878 5.057 -0.362
261 HB3 HIS 35 HB1 HIS 35 -1.720 6.544 -0.759
262 HD1 HIS 35 HD1 HIS 35 -0.324 8.447 -0.086
263 HD2 HIS 35 HD2 HIS 35 -0.133 5.330 2.654
264 HE1 HIS 35 HE1 HIS 35 1.114 9.291 1.798
265 HE2 HIS 35 HE2 HIS 35 1.397 7.298 3.326
266 H VAL 36 HN VAL 36 -3.683 6.892 2.427
267 HA VAL 36 HA VAL 36 -6.196 7.240 1.145
268 HB VAL 36 HB VAL 36 -6.621 8.640 3.216
269 HG11 VAL 36 HG11 VAL 36 -5.502 5.996 4.025
270 HG12 VAL 36 HG12 VAL 36 -6.807 6.021 2.845
271 HG13 VAL 36 HG13 VAL 36 -7.051 6.729 4.445
272 HG21 VAL 36 HG21 VAL 36 -4.393 9.381 3.693
273 HG22 VAL 36 HG22 VAL 36 -3.793 7.714 3.728
274 HG23 VAL 36 HG23 VAL 36 -4.879 8.302 5.003
275 H ILE 37 HN ILE 37 -3.449 9.471 1.809
276 HA ILE 37 HA ILE 37 -4.765 11.693 0.680
277 HB ILE 37 HB ILE 37 -1.892 11.160 1.307
278 HG12 ILE 37 HG12 ILE 37 -2.440 13.403 2.553
279 HG13 ILE 37 HG11 ILE 37 -4.097 12.913 2.234
280 HG21 ILE 37 HG21 ILE 37 -1.809 12.378 -0.801
281 HG22 ILE 37 HG22 ILE 37 -1.312 13.421 0.532
282 HG23 ILE 37 HG23 ILE 37 -2.925 13.585 -0.163
283 HD11 ILE 37 HD11 ILE 37 -2.064 11.389 3.805
284 HD12 ILE 37 HD12 ILE 37 -3.672 10.811 3.399
285 HD13 ILE 37 HD13 ILE 37 -3.486 12.224 4.430
286 H THR 38 HN THR 38 -2.294 9.537 -0.610
287 HA THR 38 HA THR 38 -2.236 10.934 -3.093
288 HB THR 38 HB THR 38 -0.610 9.097 -3.744
289 HG1 THR 38 HG1 THR 38 -0.080 7.611 -2.269
290 HG21 THR 38 HG21 THR 38 -0.177 10.823 -1.316
291 HG22 THR 38 HG22 THR 38 0.208 11.218 -2.994
292 HG23 THR 38 HG23 THR 38 1.125 9.970 -2.147
293 H ARG 39 HN ARG 39 -4.098 8.362 -1.915
294 HA ARG 39 HA ARG 39 -5.648 7.003 -2.823
295 HB2 ARG 39 HB2 ARG 39 -6.117 9.181 -4.114
296 HB3 ARG 39 HB1 ARG 39 -5.352 8.347 -5.443
297 HG2 ARG 39 HG2 ARG 39 -7.700 8.060 -5.651
298 HG3 ARG 39 HG1 ARG 39 -6.994 6.509 -5.165
299 HD2 ARG 39 HD2 ARG 39 -7.416 7.307 -2.788
300 HD3 ARG 39 HD1 ARG 39 -8.492 8.499 -3.508
301 HE ARG 39 HE ARG 39 -8.905 5.634 -4.049
302 HH11 ARG 39 HH11 ARG 39 -10.055 8.705 -2.831
303 HH12 ARG 39 HH12 ARG 39 -11.685 8.142 -2.594
304 HH21 ARG 39 HH21 ARG 39 -11.048 4.893 -3.754
305 HH22 ARG 39 HH22 ARG 39 -12.249 5.990 -3.130
306 H GLN 40 HN GLN 40 -3.166 5.978 -2.659
307 HA GLN 40 HA GLN 40 -2.757 4.555 -5.189
308 HB2 GLN 40 HB2 GLN 40 -0.806 5.119 -2.994
309 HB3 GLN 40 HB1 GLN 40 -0.429 4.312 -4.499
310 HG2 GLN 40 HG2 GLN 40 -0.841 6.328 -5.693
311 HG3 GLN 40 HG1 GLN 40 -1.393 7.139 -4.244
312 HE21 GLN 40 HE21 GLN 40 0.761 7.745 -6.123
313 HE22 GLN 40 HE22 GLN 40 2.191 7.833 -5.174
314 H THR 41 HN THR 41 -1.828 2.360 -4.857
315 HA THR 41 HA THR 41 -2.270 1.133 -2.307
316 HB THR 41 HB THR 41 -4.465 0.805 -2.954
317 HG1 THR 41 HG1 THR 41 -3.481 -1.187 -2.390
318 HG21 THR 41 HG21 THR 41 -4.270 1.640 -5.190
319 HG22 THR 41 HG22 THR 41 -5.152 0.110 -5.208
320 HG23 THR 41 HG23 THR 41 -3.460 0.166 -5.718
321 H GLN 42 HN GLN 42 -0.930 -0.657 -2.025
322 HA GLN 42 HA GLN 42 0.198 -1.711 -4.537
323 HB2 GLN 42 HB2 GLN 42 2.380 -2.026 -3.413
324 HB3 GLN 42 HB1 GLN 42 1.926 -0.340 -3.583
325 HG2 GLN 42 HG2 GLN 42 2.469 -0.136 -1.449
326 HG3 GLN 42 HG1 GLN 42 0.974 -0.995 -1.090
327 HE21 GLN 42 HE21 GLN 42 3.527 -0.905 0.336
328 HE22 GLN 42 HE22 GLN 42 4.047 -2.543 0.484
329 H TRP 43 HN TRP 43 -0.365 -3.687 -4.807
330 HA TRP 43 HA TRP 43 -0.471 -5.556 -2.566
331 HB2 TRP 43 HB2 TRP 43 -2.290 -5.591 -4.240
332 HB3 TRP 43 HB1 TRP 43 -1.115 -5.930 -5.503
333 HD1 TRP 43 HD1 TRP 43 -1.469 -7.686 -2.058
334 HE1 TRP 43 HE1 TRP 43 -1.812 -10.198 -2.490
335 HE3 TRP 43 HE3 TRP 43 -1.647 -7.614 -7.167
336 HZ2 TRP 43 HZ2 TRP 43 -2.121 -11.920 -4.700
337 HZ3 TRP 43 HZ3 TRP 43 -1.972 -9.741 -8.363
338 HH2 TRP 43 HH2 TRP 43 -2.203 -11.845 -7.151
339 H ASP 44 HN ASP 44 1.196 -4.855 -5.548
340 HA ASP 44 HA ASP 44 3.262 -6.854 -4.960
341 HB2 ASP 44 HB2 ASP 44 2.035 -7.226 -7.051
342 HB3 ASP 44 HB1 ASP 44 2.480 -5.618 -7.606
343 HA PRO 45 HA PRO 45 5.468 -2.630 -6.537
344 HB2 PRO 45 HB2 PRO 45 3.587 -0.882 -5.006
345 HB3 PRO 45 HB1 PRO 45 4.487 -0.537 -6.489
346 HG2 PRO 45 HG2 PRO 45 1.910 -1.095 -6.616
347 HG3 PRO 45 HG1 PRO 45 3.028 -1.787 -7.808
348 HD2 PRO 45 HD2 PRO 45 1.741 -3.078 -5.443
349 HD3 PRO 45 HD1 PRO 45 2.070 -3.747 -7.053
350 HA PRO 46 HA PRO 46 8.025 -2.314 -2.961
351 HB2 PRO 46 HB2 PRO 46 8.072 0.631 -3.394
352 HB3 PRO 46 HB1 PRO 46 9.413 -0.508 -3.215
353 HG2 PRO 46 HG2 PRO 46 8.780 0.444 -5.594
354 HG3 PRO 46 HG1 PRO 46 9.239 -1.256 -5.400
355 HD2 PRO 46 HD2 PRO 46 6.532 -0.054 -5.793
356 HD3 PRO 46 HD1 PRO 46 7.198 -1.569 -6.436
357 H THR 47 HN THR 47 8.255 -1.463 -0.850
358 HA THR 47 HA THR 47 5.699 -0.924 0.367
359 HB THR 47 HB THR 47 7.220 -2.616 1.299
360 HG1 THR 47 HG1 THR 47 7.121 -1.860 3.494
361 HG21 THR 47 HG21 THR 47 9.251 -1.983 2.442
362 HG22 THR 47 HG22 THR 47 9.002 -0.297 2.004
363 HG23 THR 47 HG23 THR 47 9.336 -1.495 0.753
364 H TRP 48 HN TRP 48 6.615 0.411 2.629
365 HA TRP 48 HA TRP 48 5.981 3.024 1.850
366 HB2 TRP 48 HB2 TRP 48 7.267 2.457 4.474
367 HB3 TRP 48 HB1 TRP 48 5.880 3.460 4.096
368 HD1 TRP 48 HD1 TRP 48 6.577 0.382 5.800
369 HE1 TRP 48 HE1 TRP 48 4.532 -1.191 5.857
370 HE3 TRP 48 HE3 TRP 48 3.720 2.638 2.211
371 HZ2 TRP 48 HZ2 TRP 48 2.050 -1.430 4.551
372 HZ3 TRP 48 HZ3 TRP 48 1.525 1.670 1.673
373 HH2 TRP 48 HH2 TRP 48 0.711 -0.324 2.821
374 H GLU 49 HN GLU 49 9.079 1.691 3.035
375 HA GLU 49 HA GLU 49 10.378 4.068 1.927
376 HB2 GLU 49 HB2 GLU 49 11.223 2.201 4.128
377 HB3 GLU 49 HB1 GLU 49 12.374 3.238 3.301
378 HG2 GLU 49 HG2 GLU 49 11.844 4.544 5.070
379 HG3 GLU 49 HG1 GLU 49 10.705 5.093 3.850
380 H SER 50 HN SER 50 11.503 3.891 0.183
381 HA SER 50 HA SER 50 12.415 1.234 -0.691
382 HB2 SER 50 HB2 SER 50 10.812 2.253 -2.241
383 HB3 SER 50 HB1 SER 50 11.789 3.720 -2.319
384 HG SER 50 HG SER 50 12.060 1.383 -3.690
385 HA PRO 51 HA PRO 51 16.518 2.650 0.159
386 HB2 PRO 51 HB2 PRO 51 17.847 0.857 -1.419
387 HB3 PRO 51 HB1 PRO 51 17.199 0.470 0.179
388 HG2 PRO 51 HG2 PRO 51 16.016 -0.052 -2.521
389 HG3 PRO 51 HG1 PRO 51 16.090 -1.120 -1.107
390 HD2 PRO 51 HD2 PRO 51 13.850 0.211 -1.736
391 HD3 PRO 51 HD1 PRO 51 14.336 -0.039 -0.046
392 H GLY 52 HN GLY 52 18.517 3.294 -1.009
393 HA2 GLY 52 HA2 GLY 52 17.983 5.133 -3.042
394 HA3 GLY 52 HA1 GLY 52 19.581 4.533 -2.624
395 H ASP 53 HN ASP 53 18.996 1.771 -3.205
396 HA ASP 53 HA ASP 53 19.688 1.773 -5.954
397 HB2 ASP 53 HB2 ASP 53 18.883 -0.501 -4.138
398 HB3 ASP 53 HB1 ASP 53 19.480 -0.721 -5.777
399 H ASP 54 HN ASP 54 16.637 1.340 -4.282
400 HA ASP 54 HA ASP 54 15.402 0.338 -6.739
401 HB2 ASP 54 HB2 ASP 54 14.979 -0.928 -4.680
402 HB3 ASP 54 HB1 ASP 54 14.268 0.504 -3.942
403 H ALA 55 HN ALA 55 15.256 3.077 -4.531
404 HA ALA 55 HA ALA 55 12.832 4.118 -5.657
405 HB1 ALA 55 HB1 ALA 55 14.831 5.479 -3.859
406 HB2 ALA 55 HB2 ALA 55 13.438 4.538 -3.326
407 HB3 ALA 55 HB3 ALA 55 13.198 6.039 -4.219
408 H SER 56 HN SER 56 16.127 4.318 -6.559
409 HA SER 56 HA SER 56 15.447 6.442 -8.460
410 HB2 SER 56 HB2 SER 56 16.716 7.363 -6.489
411 HB3 SER 56 HB1 SER 56 18.064 6.323 -6.940
412 HG SER 56 HG SER 56 18.630 7.929 -8.154
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 -8.837 0.531 2.692
2 H2 GLY 1 HT2 GLY 1 -10.171 1.558 2.850
3 H3 GLY 1 HT3 GLY 1 -10.190 0.029 3.580
4 HA2 GLY 1 HA1 GLY 1 -8.367 0.698 5.040
5 HA3 GLY 1 HA2 GLY 1 -8.400 2.292 4.292
6 H SER 2 HN SER 2 -8.727 2.719 6.740
7 HA SER 2 HA SER 2 -11.223 2.069 7.896
8 HB2 SER 2 HB2 SER 2 -9.031 2.805 9.053
9 HB3 SER 2 HB1 SER 2 -9.572 4.448 8.712
10 HG SER 2 HG SER 2 -10.843 4.288 10.368
11 H ASP 3 HN ASP 3 -9.985 5.014 6.352
12 HA ASP 3 HA ASP 3 -12.605 6.260 6.483
13 HB2 ASP 3 HB2 ASP 3 -10.561 7.577 6.952
14 HB3 ASP 3 HB1 ASP 3 -10.036 7.314 5.292
15 H LEU 4 HN LEU 4 -10.380 5.023 4.020
16 HA LEU 4 HA LEU 4 -12.338 5.777 1.947
17 HB2 LEU 4 HB2 LEU 4 -9.334 5.561 1.809
18 HB3 LEU 4 HB1 LEU 4 -10.354 5.789 0.402
19 HG LEU 4 HG LEU 4 -10.142 7.716 2.714
20 HD11 LEU 4 HD11 LEU 4 -8.073 7.635 1.451
21 HD12 LEU 4 HD12 LEU 4 -8.936 9.138 1.119
22 HD13 LEU 4 HD13 LEU 4 -8.965 7.827 -0.059
23 HD21 LEU 4 HD21 LEU 4 -11.399 9.225 1.288
24 HD22 LEU 4 HD22 LEU 4 -12.317 7.752 1.593
25 HD23 LEU 4 HD23 LEU 4 -11.509 7.981 0.042
26 HA PRO 5 HA PRO 5 -12.597 1.505 0.627
27 HB2 PRO 5 HB2 PRO 5 -13.316 2.579 -2.006
28 HB3 PRO 5 HB1 PRO 5 -14.303 1.649 -0.875
29 HG2 PRO 5 HG2 PRO 5 -14.766 4.253 -1.371
30 HG3 PRO 5 HG1 PRO 5 -15.054 3.525 0.221
31 HD2 PRO 5 HD2 PRO 5 -12.734 5.179 -0.712
32 HD3 PRO 5 HD1 PRO 5 -13.629 5.257 0.823
33 HA PRO 6 HA PRO 6 -8.791 0.615 -1.312
34 HB2 PRO 6 HB2 PRO 6 -10.100 -1.444 -2.977
35 HB3 PRO 6 HB1 PRO 6 -8.826 -1.618 -1.767
36 HG2 PRO 6 HG2 PRO 6 -11.319 -2.446 -1.276
37 HG3 PRO 6 HG1 PRO 6 -10.324 -1.703 -0.007
38 HD2 PRO 6 HD2 PRO 6 -12.537 -0.503 -1.629
39 HD3 PRO 6 HD1 PRO 6 -12.177 -0.311 0.100
40 HA PRO 7 HA PRO 7 -8.658 2.566 -5.334
41 HB2 PRO 7 HB2 PRO 7 -5.813 2.069 -5.245
42 HB3 PRO 7 HB1 PRO 7 -6.655 3.596 -5.055
43 HG2 PRO 7 HG2 PRO 7 -5.320 2.395 -3.029
44 HG3 PRO 7 HG1 PRO 7 -6.748 3.417 -2.773
45 HD2 PRO 7 HD2 PRO 7 -6.559 0.425 -2.883
46 HD3 PRO 7 HD1 PRO 7 -7.439 1.455 -1.733
47 H SER 8 HN SER 8 -8.173 2.021 -7.472
48 HA SER 8 HA SER 8 -7.525 -0.748 -8.056
49 HB2 SER 8 HB2 SER 8 -7.681 0.095 -10.439
50 HB3 SER 8 HB1 SER 8 -9.156 0.316 -9.505
51 HG SER 8 HG SER 8 -8.556 2.492 -9.190
52 HA PRO 9 HA PRO 9 -3.342 -0.389 -7.760
53 HB2 PRO 9 HB2 PRO 9 -2.741 -1.510 -10.429
54 HB3 PRO 9 HB1 PRO 9 -2.366 -2.157 -8.829
55 HG2 PRO 9 HG2 PRO 9 -4.267 -3.251 -10.369
56 HG3 PRO 9 HG1 PRO 9 -4.429 -3.167 -8.606
57 HD2 PRO 9 HD2 PRO 9 -5.709 -1.469 -10.709
58 HD3 PRO 9 HD1 PRO 9 -6.395 -2.091 -9.193
59 HA PRO 10 HA PRO 10 -2.056 3.250 -9.925
60 HB2 PRO 10 HB2 PRO 10 -0.159 3.801 -7.945
61 HB3 PRO 10 HB1 PRO 10 -1.847 4.311 -7.941
62 HG2 PRO 10 HG2 PRO 10 -0.629 2.495 -6.160
63 HG3 PRO 10 HG1 PRO 10 -2.362 2.825 -6.320
64 HD2 PRO 10 HD2 PRO 10 -0.739 0.600 -7.450
65 HD3 PRO 10 HD1 PRO 10 -2.433 0.607 -6.913
66 H ALA 11 HN ALA 11 -0.447 3.817 -11.307
67 HA ALA 11 HA ALA 11 1.942 2.239 -11.582
68 HB1 ALA 11 HB1 ALA 11 1.181 4.917 -12.765
69 HB2 ALA 11 HB2 ALA 11 0.971 3.339 -13.527
70 HB3 ALA 11 HB3 ALA 11 2.593 3.965 -13.226
71 H ALA 12 HN ALA 12 0.883 5.106 -9.997
72 HA ALA 12 HA ALA 12 3.352 6.271 -9.326
73 HB1 ALA 12 HB1 ALA 12 0.699 6.557 -7.939
74 HB2 ALA 12 HB2 ALA 12 1.240 7.494 -9.333
75 HB3 ALA 12 HB3 ALA 12 2.079 7.646 -7.788
76 H ALA 13 HN ALA 13 1.951 3.464 -8.127
77 HA ALA 13 HA ALA 13 2.044 3.710 -5.369
78 HB1 ALA 13 HB1 ALA 13 0.902 1.902 -6.572
79 HB2 ALA 13 HB2 ALA 13 1.931 1.296 -5.274
80 HB3 ALA 13 HB3 ALA 13 2.466 1.182 -6.951
81 H THR 14 HN THR 14 4.668 3.061 -7.547
82 HA THR 14 HA THR 14 6.425 1.877 -5.623
83 HB THR 14 HB THR 14 7.953 1.667 -7.366
84 HG1 THR 14 HG1 THR 14 7.978 3.141 -9.156
85 HG21 THR 14 HG21 THR 14 5.263 2.044 -8.659
86 HG22 THR 14 HG22 THR 14 5.911 0.537 -7.993
87 HG23 THR 14 HG23 THR 14 6.637 1.250 -9.435
88 H ILE 15 HN ILE 15 5.644 5.069 -6.617
89 HA ILE 15 HA ILE 15 7.986 6.473 -6.002
90 HB ILE 15 HB ILE 15 5.805 7.195 -7.251
91 HG12 ILE 15 HG12 ILE 15 6.368 9.578 -6.868
92 HG13 ILE 15 HG11 ILE 15 7.379 9.096 -5.508
93 HG21 ILE 15 HG21 ILE 15 4.234 6.999 -5.447
94 HG22 ILE 15 HG22 ILE 15 4.379 8.696 -5.888
95 HG23 ILE 15 HG23 ILE 15 5.186 8.094 -4.444
96 HD11 ILE 15 HD11 ILE 15 8.679 9.522 -7.528
97 HD12 ILE 15 HD12 ILE 15 7.776 8.256 -8.363
98 HD13 ILE 15 HD13 ILE 15 8.815 7.846 -7.001
99 H VAL 16 HN VAL 16 7.288 8.495 -4.283
100 HA VAL 16 HA VAL 16 7.950 7.442 -1.738
101 HB VAL 16 HB VAL 16 6.794 10.162 -2.395
102 HG11 VAL 16 HG11 VAL 16 8.022 10.820 -0.295
103 HG12 VAL 16 HG12 VAL 16 8.205 9.094 0.038
104 HG13 VAL 16 HG13 VAL 16 6.596 9.809 -0.063
105 HG21 VAL 16 HG21 VAL 16 9.112 10.939 -2.427
106 HG22 VAL 16 HG22 VAL 16 8.825 9.714 -3.664
107 HG23 VAL 16 HG23 VAL 16 9.671 9.284 -2.178
108 H LEU 17 HN LEU 17 6.749 7.077 0.059
109 HA LEU 17 HA LEU 17 3.868 6.860 -0.430
110 HB2 LEU 17 HB2 LEU 17 5.831 4.919 0.736
111 HB3 LEU 17 HB1 LEU 17 4.106 4.702 0.845
112 HG LEU 17 HG LEU 17 5.510 4.999 -1.794
113 HD11 LEU 17 HD11 LEU 17 5.513 2.577 -1.978
114 HD12 LEU 17 HD12 LEU 17 4.888 2.438 -0.335
115 HD13 LEU 17 HD13 LEU 17 6.503 3.092 -0.610
116 HD21 LEU 17 HD21 LEU 17 3.209 5.338 -1.990
117 HD22 LEU 17 HD22 LEU 17 2.858 4.049 -0.845
118 HD23 LEU 17 HD23 LEU 17 3.462 3.651 -2.454
119 HA PRO 18 HA PRO 18 3.682 8.950 3.511
120 HB2 PRO 18 HB2 PRO 18 0.807 8.772 3.342
121 HB3 PRO 18 HB1 PRO 18 1.839 10.181 3.103
122 HG2 PRO 18 HG2 PRO 18 0.409 8.978 1.099
123 HG3 PRO 18 HG1 PRO 18 1.893 9.908 0.832
124 HD2 PRO 18 HD2 PRO 18 1.511 6.944 0.978
125 HD3 PRO 18 HD1 PRO 18 2.541 7.895 -0.115
126 HA PRO 19 HA PRO 19 3.190 5.723 6.576
127 HB2 PRO 19 HB2 PRO 19 2.726 8.173 8.169
128 HB3 PRO 19 HB1 PRO 19 3.772 6.817 8.515
129 HG2 PRO 19 HG2 PRO 19 4.858 8.997 7.687
130 HG3 PRO 19 HG1 PRO 19 5.338 7.482 6.892
131 HD2 PRO 19 HD2 PRO 19 3.373 9.551 5.960
132 HD3 PRO 19 HD1 PRO 19 4.672 8.758 5.056
133 H ASN 20 HN ASN 20 0.894 8.164 5.935
134 HA ASN 20 HA ASN 20 -1.158 7.634 7.714
135 HB2 ASN 20 HB2 ASN 20 -1.337 8.614 4.871
136 HB3 ASN 20 HB1 ASN 20 -2.675 8.629 6.007
137 HD21 ASN 20 HD21 ASN 20 -2.957 10.761 6.062
138 HD22 ASN 20 HD22 ASN 20 -1.789 11.880 6.663
139 H TRP 21 HN TRP 21 -0.017 5.381 5.527
140 HA TRP 21 HA TRP 21 -2.471 4.638 4.289
141 HB2 TRP 21 HB2 TRP 21 -1.188 3.364 2.914
142 HB3 TRP 21 HB1 TRP 21 0.103 4.360 3.562
143 HD1 TRP 21 HD1 TRP 21 -0.807 0.859 3.009
144 HE1 TRP 21 HE1 TRP 21 0.772 -0.726 4.282
145 HE3 TRP 21 HE3 TRP 21 1.431 4.245 6.120
146 HZ2 TRP 21 HZ2 TRP 21 2.695 -0.569 6.332
147 HZ3 TRP 21 HZ3 TRP 21 3.127 3.441 7.708
148 HH2 TRP 21 HH2 TRP 21 3.743 1.082 7.812
149 H LYS 22 HN LYS 22 -3.421 2.601 4.416
150 HA LYS 22 HA LYS 22 -3.276 1.358 7.077
151 HB2 LYS 22 HB2 LYS 22 -5.755 1.943 5.475
152 HB3 LYS 22 HB1 LYS 22 -5.697 1.088 7.001
153 HG2 LYS 22 HG2 LYS 22 -4.830 3.931 6.612
154 HG3 LYS 22 HG1 LYS 22 -6.369 3.410 7.303
155 HD2 LYS 22 HD2 LYS 22 -5.044 2.102 8.978
156 HD3 LYS 22 HD1 LYS 22 -3.634 2.999 8.421
157 HE2 LYS 22 HE2 LYS 22 -6.127 4.383 9.181
158 HE3 LYS 22 HE1 LYS 22 -4.951 3.873 10.365
159 HZ1 LYS 22 HZ1 LYS 22 -4.636 6.189 9.609
160 HZ2 LYS 22 HZ2 LYS 22 -4.297 5.601 8.063
161 HZ3 LYS 22 HZ3 LYS 22 -3.276 5.213 9.355
162 H THR 23 HN THR 23 -4.514 -0.742 7.075
163 HA THR 23 HA THR 23 -3.941 -2.240 4.613
164 HB THR 23 HB THR 23 -3.451 -4.198 5.972
165 HG1 THR 23 HG1 THR 23 -4.097 -2.454 8.143
166 HG21 THR 23 HG21 THR 23 -1.814 -2.173 5.569
167 HG22 THR 23 HG22 THR 23 -1.329 -3.569 6.529
168 HG23 THR 23 HG23 THR 23 -1.859 -2.088 7.330
169 H ALA 24 HN ALA 24 -5.426 -3.651 3.867
170 HA ALA 24 HA ALA 24 -7.549 -4.685 5.474
171 HB1 ALA 24 HB1 ALA 24 -9.410 -3.677 4.541
172 HB2 ALA 24 HB2 ALA 24 -8.519 -3.135 3.126
173 HB3 ALA 24 HB3 ALA 24 -8.294 -2.313 4.671
174 H ARG 25 HN ARG 25 -9.087 -5.935 3.919
175 HA ARG 25 HA ARG 25 -7.460 -7.135 1.799
176 HB2 ARG 25 HB2 ARG 25 -9.141 -8.615 3.797
177 HB3 ARG 25 HB1 ARG 25 -8.168 -9.322 2.548
178 HG2 ARG 25 HG2 ARG 25 -6.167 -8.675 3.642
179 HG3 ARG 25 HG1 ARG 25 -7.061 -7.683 4.795
180 HD2 ARG 25 HD2 ARG 25 -6.440 -9.703 5.891
181 HD3 ARG 25 HD1 ARG 25 -8.178 -9.750 5.605
182 HE ARG 25 HE ARG 25 -6.564 -11.055 3.588
183 HH11 ARG 25 HH11 ARG 25 -8.430 -11.384 6.522
184 HH12 ARG 25 HH12 ARG 25 -8.557 -13.108 6.413
185 HH21 ARG 25 HH21 ARG 25 -6.722 -13.348 3.440
186 HH22 ARG 25 HH22 ARG 25 -7.597 -14.223 4.663
187 H ASP 26 HN ASP 26 -8.722 -8.264 0.173
188 HA ASP 26 HA ASP 26 -11.438 -7.231 -0.131
189 HB2 ASP 26 HB2 ASP 26 -9.538 -8.613 -1.996
190 HB3 ASP 26 HB1 ASP 26 -11.255 -8.667 -2.325
191 HA PRO 27 HA PRO 27 -13.897 -10.677 0.904
192 HB2 PRO 27 HB2 PRO 27 -14.699 -11.579 -1.649
193 HB3 PRO 27 HB1 PRO 27 -15.546 -10.433 -0.626
194 HG2 PRO 27 HG2 PRO 27 -13.613 -9.899 -2.810
195 HG3 PRO 27 HG1 PRO 27 -15.132 -9.060 -2.433
196 HD2 PRO 27 HD2 PRO 27 -12.876 -7.947 -1.750
197 HD3 PRO 27 HD1 PRO 27 -14.171 -8.012 -0.540
198 H GLU 28 HN GLU 28 -11.679 -11.230 -1.798
199 HA GLU 28 HA GLU 28 -11.748 -14.095 -1.368
200 HB2 GLU 28 HB2 GLU 28 -10.396 -12.381 -3.440
201 HB3 GLU 28 HB1 GLU 28 -10.233 -14.134 -3.369
202 HG2 GLU 28 HG2 GLU 28 -12.872 -12.737 -3.546
203 HG3 GLU 28 HG1 GLU 28 -11.963 -13.254 -4.968
204 H GLY 29 HN GLY 29 -10.659 -12.651 0.757
205 HA2 GLY 29 HA2 GLY 29 -9.043 -13.059 2.309
206 HA3 GLY 29 HA1 GLY 29 -8.590 -14.438 1.335
207 H LYS 30 HN LYS 30 -8.169 -11.696 -0.576
208 HA LYS 30 HA LYS 30 -5.309 -11.754 -0.088
209 HB2 LYS 30 HB2 LYS 30 -7.064 -10.575 -2.185
210 HB3 LYS 30 HB1 LYS 30 -5.515 -9.798 -1.899
211 HG2 LYS 30 HG2 LYS 30 -5.066 -11.288 -3.605
212 HG3 LYS 30 HG1 LYS 30 -4.520 -12.145 -2.166
213 HD2 LYS 30 HD2 LYS 30 -6.664 -13.361 -2.117
214 HD3 LYS 30 HD1 LYS 30 -7.133 -12.543 -3.610
215 HE2 LYS 30 HE2 LYS 30 -6.286 -14.719 -4.162
216 HE3 LYS 30 HE1 LYS 30 -5.130 -13.507 -4.707
217 HZ1 LYS 30 HZ1 LYS 30 -3.967 -15.306 -3.666
218 HZ2 LYS 30 HZ2 LYS 30 -4.918 -15.187 -2.266
219 HZ3 LYS 30 HZ3 LYS 30 -3.839 -13.940 -2.667
220 H ILE 31 HN ILE 31 -4.136 -10.226 0.896
221 HA ILE 31 HA ILE 31 -5.611 -8.028 2.215
222 HB ILE 31 HB ILE 31 -4.513 -9.386 3.839
223 HG12 ILE 31 HG12 ILE 31 -2.390 -7.606 4.156
224 HG13 ILE 31 HG11 ILE 31 -3.614 -6.693 3.306
225 HG21 ILE 31 HG21 ILE 31 -2.977 -10.622 2.473
226 HG22 ILE 31 HG22 ILE 31 -2.079 -9.843 3.780
227 HG23 ILE 31 HG23 ILE 31 -2.029 -9.166 2.150
228 HD11 ILE 31 HD11 ILE 31 -4.026 -8.164 5.890
229 HD12 ILE 31 HD12 ILE 31 -5.211 -7.182 5.032
230 HD13 ILE 31 HD13 ILE 31 -3.777 -6.425 5.717
231 H TYR 32 HN TYR 32 -4.954 -5.903 1.820
232 HA TYR 32 HA TYR 32 -2.660 -5.530 -0.002
233 HB2 TYR 32 HB2 TYR 32 -5.307 -4.069 -0.152
234 HB3 TYR 32 HB1 TYR 32 -3.914 -3.803 -1.195
235 HD1 TYR 32 HD2 TYR 32 -6.600 -6.187 -0.338
236 HD2 TYR 32 HD1 TYR 32 -3.521 -5.176 -3.091
237 HE1 TYR 32 HE2 TYR 32 -7.458 -7.874 -1.909
238 HE2 TYR 32 HE1 TYR 32 -4.365 -6.861 -4.663
239 HH TYR 32 HH TYR 32 -5.679 -8.949 -4.571
240 H TYR 33 HN TYR 33 -2.241 -3.081 -0.183
241 HA TYR 33 HA TYR 33 -2.415 -1.795 2.454
242 HB2 TYR 33 HB2 TYR 33 -0.228 -1.702 0.375
243 HB3 TYR 33 HB1 TYR 33 -0.258 -0.711 1.813
244 HD1 TYR 33 HD2 TYR 33 -0.600 -2.154 4.073
245 HD2 TYR 33 HD1 TYR 33 1.042 -3.629 0.436
246 HE1 TYR 33 HE2 TYR 33 0.502 -3.971 5.312
247 HE2 TYR 33 HE1 TYR 33 2.140 -5.453 1.667
248 HH TYR 33 HH TYR 33 1.359 -6.252 4.863
249 H TYR 34 HN TYR 34 -3.018 0.381 2.457
250 HA TYR 34 HA TYR 34 -3.743 1.510 -0.169
251 HB2 TYR 34 HB2 TYR 34 -5.543 1.566 2.259
252 HB3 TYR 34 HB1 TYR 34 -5.914 2.195 0.656
253 HD1 TYR 34 HD2 TYR 34 -5.348 0.167 -1.206
254 HD2 TYR 34 HD1 TYR 34 -6.781 -0.302 2.770
255 HE1 TYR 34 HE2 TYR 34 -6.333 -1.995 -1.824
256 HE2 TYR 34 HE1 TYR 34 -7.770 -2.467 2.160
257 HH TYR 34 HH TYR 34 -8.551 -3.642 0.149
258 H HIS 35 HN HIS 35 -3.022 3.487 -0.475
259 HA HIS 35 HA HIS 35 -2.205 5.030 1.868
260 HB2 HIS 35 HB2 HIS 35 -1.399 5.166 -1.040
261 HB3 HIS 35 HB1 HIS 35 -0.910 6.357 0.147
262 HD1 HIS 35 HD1 HIS 35 0.964 5.685 1.803
263 HD2 HIS 35 HD2 HIS 35 -0.163 2.628 -0.782
264 HE1 HIS 35 HE1 HIS 35 2.707 3.898 2.070
265 HE2 HIS 35 HE2 HIS 35 2.048 2.082 0.452
266 H VAL 36 HN VAL 36 -3.443 6.621 2.477
267 HA VAL 36 HA VAL 36 -5.903 7.009 1.155
268 HB VAL 36 HB VAL 36 -6.235 8.624 3.121
269 HG11 VAL 36 HG11 VAL 36 -5.418 5.911 4.056
270 HG12 VAL 36 HG12 VAL 36 -6.714 6.046 2.879
271 HG13 VAL 36 HG13 VAL 36 -6.869 6.838 4.448
272 HG21 VAL 36 HG21 VAL 36 -3.951 9.145 3.607
273 HG22 VAL 36 HG22 VAL 36 -3.540 7.429 3.744
274 HG23 VAL 36 HG23 VAL 36 -4.577 8.197 4.960
275 H ILE 37 HN ILE 37 -3.088 9.198 1.632
276 HA ILE 37 HA ILE 37 -4.393 11.477 0.590
277 HB ILE 37 HB ILE 37 -1.480 10.810 0.916
278 HG12 ILE 37 HG12 ILE 37 -1.718 12.923 2.390
279 HG13 ILE 37 HG11 ILE 37 -3.444 12.628 2.223
280 HG21 ILE 37 HG21 ILE 37 -2.601 13.352 -0.263
281 HG22 ILE 37 HG22 ILE 37 -1.596 12.165 -1.098
282 HG23 ILE 37 HG23 ILE 37 -0.926 13.111 0.234
283 HD11 ILE 37 HD11 ILE 37 -1.514 10.601 3.272
284 HD12 ILE 37 HD12 ILE 37 -3.274 10.537 3.280
285 HD13 ILE 37 HD13 ILE 37 -2.437 11.714 4.285
286 H THR 38 HN THR 38 -2.004 9.331 -0.817
287 HA THR 38 HA THR 38 -2.134 10.548 -3.385
288 HB THR 38 HB THR 38 -0.571 8.598 -3.959
289 HG1 THR 38 HG1 THR 38 0.212 7.456 -2.187
290 HG21 THR 38 HG21 THR 38 0.058 10.583 -1.777
291 HG22 THR 38 HG22 THR 38 0.266 10.820 -3.515
292 HG23 THR 38 HG23 THR 38 1.281 9.660 -2.654
293 H ARG 39 HN ARG 39 -3.883 8.052 -1.893
294 HA ARG 39 HA ARG 39 -5.378 6.502 -2.578
295 HB2 ARG 39 HB2 ARG 39 -5.335 8.275 -4.991
296 HB3 ARG 39 HB1 ARG 39 -6.171 6.739 -5.065
297 HG2 ARG 39 HG2 ARG 39 -7.787 8.354 -4.519
298 HG3 ARG 39 HG1 ARG 39 -7.452 7.461 -3.029
299 HD2 ARG 39 HD2 ARG 39 -5.674 9.294 -2.671
300 HD3 ARG 39 HD1 ARG 39 -6.640 10.217 -3.815
301 HE ARG 39 HE ARG 39 -7.747 9.125 -1.312
302 HH11 ARG 39 HH11 ARG 39 -7.389 11.696 -3.641
303 HH12 ARG 39 HH12 ARG 39 -8.458 12.785 -2.807
304 HH21 ARG 39 HH21 ARG 39 -9.147 10.543 -0.195
305 HH22 ARG 39 HH22 ARG 39 -9.442 12.135 -0.828
306 H GLN 40 HN GLN 40 -2.948 5.533 -2.419
307 HA GLN 40 HA GLN 40 -2.536 4.032 -4.903
308 HB2 GLN 40 HB2 GLN 40 -0.607 4.656 -2.708
309 HB3 GLN 40 HB1 GLN 40 -0.223 3.763 -4.161
310 HG2 GLN 40 HG2 GLN 40 -0.561 5.692 -5.477
311 HG3 GLN 40 HG1 GLN 40 -1.190 6.602 -4.123
312 HE21 GLN 40 HE21 GLN 40 1.040 7.118 -5.928
313 HE22 GLN 40 HE22 GLN 40 2.431 7.280 -4.928
314 H THR 41 HN THR 41 -1.715 1.843 -4.552
315 HA THR 41 HA THR 41 -2.421 0.652 -2.028
316 HB THR 41 HB THR 41 -4.521 0.342 -2.887
317 HG1 THR 41 HG1 THR 41 -3.792 -1.708 -2.363
318 HG21 THR 41 HG21 THR 41 -4.135 1.305 -5.032
319 HG22 THR 41 HG22 THR 41 -5.003 -0.223 -5.229
320 HG23 THR 41 HG23 THR 41 -3.274 -0.134 -5.583
321 H GLN 42 HN GLN 42 -1.231 -1.175 -1.568
322 HA GLN 42 HA GLN 42 0.498 -2.146 -3.758
323 HB2 GLN 42 HB2 GLN 42 1.234 -1.958 -0.831
324 HB3 GLN 42 HB1 GLN 42 2.291 -2.413 -2.160
325 HG2 GLN 42 HG2 GLN 42 2.280 -0.200 -3.028
326 HG3 GLN 42 HG1 GLN 42 1.007 0.287 -1.925
327 HE21 GLN 42 HE21 GLN 42 4.379 -0.379 -2.253
328 HE22 GLN 42 HE22 GLN 42 4.842 0.246 -0.714
329 H TRP 43 HN TRP 43 0.186 -4.205 -4.199
330 HA TRP 43 HA TRP 43 -0.959 -5.975 -2.172
331 HB2 TRP 43 HB2 TRP 43 -1.956 -6.019 -4.412
332 HB3 TRP 43 HB1 TRP 43 -0.396 -6.443 -5.107
333 HD1 TRP 43 HD1 TRP 43 -2.375 -8.011 -2.146
334 HE1 TRP 43 HE1 TRP 43 -2.524 -10.550 -2.558
335 HE3 TRP 43 HE3 TRP 43 0.019 -8.242 -6.652
336 HZ2 TRP 43 HZ2 TRP 43 -1.741 -12.401 -4.544
337 HZ3 TRP 43 HZ3 TRP 43 0.274 -10.430 -7.744
338 HH2 TRP 43 HH2 TRP 43 -0.587 -12.462 -6.709
339 H ASP 44 HN ASP 44 1.914 -5.479 -4.105
340 HA ASP 44 HA ASP 44 3.181 -7.802 -2.833
341 HB2 ASP 44 HB2 ASP 44 3.070 -7.983 -5.235
342 HB3 ASP 44 HB1 ASP 44 3.798 -6.395 -5.433
343 HA PRO 45 HA PRO 45 6.445 -4.309 -2.280
344 HB2 PRO 45 HB2 PRO 45 5.035 -1.772 -2.618
345 HB3 PRO 45 HB1 PRO 45 6.529 -2.324 -3.378
346 HG2 PRO 45 HG2 PRO 45 4.218 -2.028 -4.754
347 HG3 PRO 45 HG1 PRO 45 5.431 -3.255 -5.168
348 HD2 PRO 45 HD2 PRO 45 2.862 -3.560 -3.653
349 HD3 PRO 45 HD1 PRO 45 3.572 -4.618 -4.893
350 HA PRO 46 HA PRO 46 4.531 -3.701 1.735
351 HB2 PRO 46 HB2 PRO 46 6.880 -4.093 3.108
352 HB3 PRO 46 HB1 PRO 46 5.714 -5.348 2.692
353 HG2 PRO 46 HG2 PRO 46 8.351 -4.907 1.646
354 HG3 PRO 46 HG1 PRO 46 7.261 -6.263 1.356
355 HD2 PRO 46 HD2 PRO 46 7.878 -4.013 -0.363
356 HD3 PRO 46 HD1 PRO 46 6.949 -5.476 -0.733
357 H THR 47 HN THR 47 4.428 -1.995 3.069
358 HA THR 47 HA THR 47 4.532 0.155 3.692
359 HB THR 47 HB THR 47 6.071 -1.051 5.197
360 HG1 THR 47 HG1 THR 47 6.299 0.790 6.170
361 HG21 THR 47 HG21 THR 47 7.800 -1.590 3.509
362 HG22 THR 47 HG22 THR 47 8.453 -0.878 4.985
363 HG23 THR 47 HG23 THR 47 8.292 0.102 3.527
364 H TRP 48 HN TRP 48 6.786 1.812 3.764
365 HA TRP 48 HA TRP 48 6.465 3.181 1.263
366 HB2 TRP 48 HB2 TRP 48 8.479 3.984 3.300
367 HB3 TRP 48 HB1 TRP 48 7.418 4.972 2.331
368 HD1 TRP 48 HD1 TRP 48 4.629 4.482 3.096
369 HE1 TRP 48 HE1 TRP 48 3.739 4.624 5.503
370 HE3 TRP 48 HE3 TRP 48 9.032 3.891 5.638
371 HZ2 TRP 48 HZ2 TRP 48 4.768 4.507 8.135
372 HZ3 TRP 48 HZ3 TRP 48 8.988 3.925 8.095
373 HH2 TRP 48 HH2 TRP 48 6.900 4.227 9.316
374 H GLU 49 HN GLU 49 9.030 1.513 2.956
375 HA GLU 49 HA GLU 49 10.853 1.918 0.715
376 HB2 GLU 49 HB2 GLU 49 11.093 2.212 3.495
377 HB3 GLU 49 HB1 GLU 49 12.028 0.781 3.090
378 HG2 GLU 49 HG2 GLU 49 12.280 3.344 1.626
379 HG3 GLU 49 HG1 GLU 49 13.212 3.019 3.086
380 H SER 50 HN SER 50 11.235 0.248 -0.562
381 HA SER 50 HA SER 50 10.464 -2.428 0.381
382 HB2 SER 50 HB2 SER 50 10.346 -2.881 -2.158
383 HB3 SER 50 HB1 SER 50 9.086 -1.870 -1.450
384 HG SER 50 HG SER 50 10.227 -0.041 -2.193
385 HA PRO 51 HA PRO 51 14.775 -3.611 0.056
386 HB2 PRO 51 HB2 PRO 51 14.316 -6.293 0.265
387 HB3 PRO 51 HB1 PRO 51 14.389 -5.200 1.654
388 HG2 PRO 51 HG2 PRO 51 12.000 -6.264 0.198
389 HG3 PRO 51 HG1 PRO 51 12.261 -6.087 1.945
390 HD2 PRO 51 HD2 PRO 51 10.782 -4.324 0.549
391 HD3 PRO 51 HD1 PRO 51 11.809 -3.815 1.906
392 H GLY 52 HN GLY 52 15.997 -5.271 -1.249
393 HA2 GLY 52 HA2 GLY 52 15.215 -5.096 -3.978
394 HA3 GLY 52 HA1 GLY 52 16.570 -6.031 -3.351
395 H ASP 53 HN ASP 53 14.734 -7.411 -1.456
396 HA ASP 53 HA ASP 53 14.217 -9.741 -2.905
397 HB2 ASP 53 HB2 ASP 53 12.964 -8.802 -0.313
398 HB3 ASP 53 HB1 ASP 53 12.921 -10.452 -0.920
399 H ASP 54 HN ASP 54 12.061 -7.118 -1.944
400 HA ASP 54 HA ASP 54 9.838 -8.333 -3.375
401 HB2 ASP 54 HB2 ASP 54 9.987 -5.810 -1.715
402 HB3 ASP 54 HB1 ASP 54 8.526 -6.399 -2.500
403 H ALA 55 HN ALA 55 12.224 -5.909 -3.756
404 HA ALA 55 HA ALA 55 12.912 -4.736 -5.564
405 HB1 ALA 55 HB1 ALA 55 10.630 -6.026 -7.056
406 HB2 ALA 55 HB2 ALA 55 12.270 -6.662 -6.934
407 HB3 ALA 55 HB3 ALA 55 11.977 -5.137 -7.768
408 H SER 56 HN SER 56 11.909 -3.126 -7.309
409 HA SER 56 HA SER 56 9.608 -1.700 -6.298
410 HB2 SER 56 HB2 SER 56 11.527 -0.949 -4.868
411 HB3 SER 56 HB1 SER 56 12.335 -0.378 -6.326
412 HG SER 56 HG SER 56 10.228 0.706 -4.914
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 -5.769 7.305 8.368
2 H2 GLY 1 HT2 GLY 1 -5.422 5.716 7.914
3 H3 GLY 1 HT3 GLY 1 -6.781 6.041 8.876
4 HA2 GLY 1 HA1 GLY 1 -7.614 7.459 6.975
5 HA3 GLY 1 HA2 GLY 1 -6.346 6.704 6.021
6 H SER 2 HN SER 2 -8.575 5.421 8.476
7 HA SER 2 HA SER 2 -9.257 3.119 6.938
8 HB2 SER 2 HB2 SER 2 -10.862 4.270 9.227
9 HB3 SER 2 HB1 SER 2 -10.738 2.584 8.721
10 HG SER 2 HG SER 2 -9.253 2.504 10.214
11 H ASP 3 HN ASP 3 -10.200 6.342 6.925
12 HA ASP 3 HA ASP 3 -12.954 6.262 6.456
13 HB2 ASP 3 HB2 ASP 3 -11.862 8.260 7.233
14 HB3 ASP 3 HB1 ASP 3 -10.873 8.342 5.780
15 H LEU 4 HN LEU 4 -10.425 5.487 4.193
16 HA LEU 4 HA LEU 4 -12.081 6.403 1.969
17 HB2 LEU 4 HB2 LEU 4 -10.035 7.505 1.843
18 HB3 LEU 4 HB1 LEU 4 -9.133 6.098 2.395
19 HG LEU 4 HG LEU 4 -9.919 5.020 0.233
20 HD11 LEU 4 HD11 LEU 4 -10.301 7.924 -0.478
21 HD12 LEU 4 HD12 LEU 4 -11.544 6.675 -0.443
22 HD13 LEU 4 HD13 LEU 4 -10.253 6.600 -1.641
23 HD21 LEU 4 HD21 LEU 4 -7.598 5.591 0.711
24 HD22 LEU 4 HD22 LEU 4 -7.879 7.238 0.144
25 HD23 LEU 4 HD23 LEU 4 -7.983 5.886 -0.984
26 HA PRO 5 HA PRO 5 -12.821 2.106 0.922
27 HB2 PRO 5 HB2 PRO 5 -13.581 3.316 -1.673
28 HB3 PRO 5 HB1 PRO 5 -14.537 2.308 -0.582
29 HG2 PRO 5 HG2 PRO 5 -15.032 4.916 -0.833
30 HG3 PRO 5 HG1 PRO 5 -15.163 4.102 0.738
31 HD2 PRO 5 HD2 PRO 5 -12.951 5.822 -0.325
32 HD3 PRO 5 HD1 PRO 5 -13.678 5.802 1.296
33 HA PRO 6 HA PRO 6 -9.194 0.886 -1.042
34 HB2 PRO 6 HB2 PRO 6 -10.636 -1.170 -2.599
35 HB3 PRO 6 HB1 PRO 6 -9.395 -1.359 -1.357
36 HG2 PRO 6 HG2 PRO 6 -11.949 -1.976 -0.867
37 HG3 PRO 6 HG1 PRO 6 -10.921 -1.237 0.377
38 HD2 PRO 6 HD2 PRO 6 -13.009 0.034 -1.354
39 HD3 PRO 6 HD1 PRO 6 -12.671 0.283 0.373
40 HA PRO 7 HA PRO 7 -8.979 2.553 -5.185
41 HB2 PRO 7 HB2 PRO 7 -6.147 2.296 -5.002
42 HB3 PRO 7 HB1 PRO 7 -7.101 3.747 -4.758
43 HG2 PRO 7 HG2 PRO 7 -5.660 2.475 -2.791
44 HG3 PRO 7 HG1 PRO 7 -7.041 3.550 -2.489
45 HD2 PRO 7 HD2 PRO 7 -6.943 0.556 -2.584
46 HD3 PRO 7 HD1 PRO 7 -7.821 1.619 -1.461
47 H SER 8 HN SER 8 -8.376 1.841 -7.264
48 HA SER 8 HA SER 8 -7.361 -0.891 -7.534
49 HB2 SER 8 HB2 SER 8 -9.158 0.095 -9.070
50 HB3 SER 8 HB1 SER 8 -7.908 1.151 -9.722
51 HG SER 8 HG SER 8 -6.968 -0.518 -10.702
52 HA PRO 9 HA PRO 9 -3.296 0.465 -7.179
53 HB2 PRO 9 HB2 PRO 9 -1.855 -1.234 -8.748
54 HB3 PRO 9 HB1 PRO 9 -2.594 -1.706 -7.213
55 HG2 PRO 9 HG2 PRO 9 -3.584 -2.143 -10.007
56 HG3 PRO 9 HG1 PRO 9 -3.584 -3.260 -8.629
57 HD2 PRO 9 HD2 PRO 9 -5.792 -1.906 -9.394
58 HD3 PRO 9 HD1 PRO 9 -5.467 -2.311 -7.696
59 HA PRO 10 HA PRO 10 -2.007 2.993 -10.659
60 HB2 PRO 10 HB2 PRO 10 -0.627 4.738 -9.136
61 HB3 PRO 10 HB1 PRO 10 -2.387 4.769 -9.261
62 HG2 PRO 10 HG2 PRO 10 -0.688 3.945 -7.018
63 HG3 PRO 10 HG1 PRO 10 -2.388 4.435 -7.021
64 HD2 PRO 10 HD2 PRO 10 -1.283 1.773 -6.961
65 HD3 PRO 10 HD1 PRO 10 -2.987 2.261 -6.882
66 H ALA 11 HN ALA 11 -0.026 3.357 -11.714
67 HA ALA 11 HA ALA 11 2.191 1.665 -11.082
68 HB1 ALA 11 HB1 ALA 11 1.671 2.324 -13.389
69 HB2 ALA 11 HB2 ALA 11 3.313 2.778 -12.933
70 HB3 ALA 11 HB3 ALA 11 2.043 4.001 -12.989
71 H ALA 12 HN ALA 12 1.260 4.945 -10.471
72 HA ALA 12 HA ALA 12 3.691 6.045 -9.643
73 HB1 ALA 12 HB1 ALA 12 0.913 6.754 -8.731
74 HB2 ALA 12 HB2 ALA 12 1.720 7.381 -10.169
75 HB3 ALA 12 HB3 ALA 12 2.348 7.764 -8.567
76 H ALA 13 HN ALA 13 1.796 3.708 -8.131
77 HA ALA 13 HA ALA 13 1.828 4.395 -5.437
78 HB1 ALA 13 HB1 ALA 13 1.332 2.061 -4.992
79 HB2 ALA 13 HB2 ALA 13 1.817 1.637 -6.634
80 HB3 ALA 13 HB3 ALA 13 0.405 2.660 -6.368
81 H THR 14 HN THR 14 4.365 3.034 -7.362
82 HA THR 14 HA THR 14 5.833 1.824 -5.255
83 HB THR 14 HB THR 14 6.126 1.084 -7.570
84 HG1 THR 14 HG1 THR 14 8.210 1.875 -5.937
85 HG21 THR 14 HG21 THR 14 5.898 3.216 -8.725
86 HG22 THR 14 HG22 THR 14 7.426 2.449 -9.160
87 HG23 THR 14 HG23 THR 14 7.404 3.789 -8.012
88 H ILE 15 HN ILE 15 5.552 5.068 -6.342
89 HA ILE 15 HA ILE 15 8.026 6.168 -5.723
90 HB ILE 15 HB ILE 15 5.963 7.179 -6.902
91 HG12 ILE 15 HG12 ILE 15 6.670 9.484 -6.341
92 HG13 ILE 15 HG11 ILE 15 7.606 8.850 -4.990
93 HG21 ILE 15 HG21 ILE 15 4.350 6.934 -5.133
94 HG22 ILE 15 HG22 ILE 15 4.586 8.645 -5.479
95 HG23 ILE 15 HG23 ILE 15 5.331 7.926 -4.054
96 HD11 ILE 15 HD11 ILE 15 8.965 9.343 -6.985
97 HD12 ILE 15 HD12 ILE 15 8.046 8.126 -7.870
98 HD13 ILE 15 HD13 ILE 15 9.045 7.650 -6.499
99 H VAL 16 HN VAL 16 7.458 8.211 -3.877
100 HA VAL 16 HA VAL 16 8.385 7.043 -1.506
101 HB VAL 16 HB VAL 16 7.049 9.743 -1.753
102 HG11 VAL 16 HG11 VAL 16 8.629 10.331 0.092
103 HG12 VAL 16 HG12 VAL 16 9.025 8.615 0.220
104 HG13 VAL 16 HG13 VAL 16 7.381 9.167 0.537
105 HG21 VAL 16 HG21 VAL 16 9.237 10.658 -2.246
106 HG22 VAL 16 HG22 VAL 16 8.799 9.449 -3.454
107 HG23 VAL 16 HG23 VAL 16 9.952 9.047 -2.182
108 H LEU 17 HN LEU 17 7.410 6.742 0.513
109 HA LEU 17 HA LEU 17 4.500 6.358 0.363
110 HB2 LEU 17 HB2 LEU 17 5.934 4.300 0.155
111 HB3 LEU 17 HB1 LEU 17 6.506 4.598 1.768
112 HG LEU 17 HG LEU 17 3.568 4.316 1.347
113 HD11 LEU 17 HD11 LEU 17 3.751 1.899 1.570
114 HD12 LEU 17 HD12 LEU 17 5.510 2.012 1.522
115 HD13 LEU 17 HD13 LEU 17 4.558 2.440 0.099
116 HD21 LEU 17 HD21 LEU 17 3.577 3.795 3.579
117 HD22 LEU 17 HD22 LEU 17 4.965 4.884 3.468
118 HD23 LEU 17 HD23 LEU 17 5.215 3.143 3.525
119 HA PRO 18 HA PRO 18 4.681 8.397 4.367
120 HB2 PRO 18 HB2 PRO 18 2.244 9.463 4.219
121 HB3 PRO 18 HB1 PRO 18 3.551 10.049 3.185
122 HG2 PRO 18 HG2 PRO 18 1.191 8.421 2.484
123 HG3 PRO 18 HG1 PRO 18 2.172 9.476 1.457
124 HD2 PRO 18 HD2 PRO 18 2.344 6.607 1.765
125 HD3 PRO 18 HD1 PRO 18 3.265 7.658 0.670
126 HA PRO 19 HA PRO 19 2.742 5.618 7.274
127 HB2 PRO 19 HB2 PRO 19 1.894 8.175 8.505
128 HB3 PRO 19 HB1 PRO 19 2.639 6.785 9.251
129 HG2 PRO 19 HG2 PRO 19 4.125 8.836 8.802
130 HG3 PRO 19 HG1 PRO 19 4.730 7.251 8.276
131 HD2 PRO 19 HD2 PRO 19 3.402 9.390 6.647
132 HD3 PRO 19 HD1 PRO 19 4.862 8.457 6.288
133 H ASN 20 HN ASN 20 1.005 7.880 5.539
134 HA ASN 20 HA ASN 20 -1.579 7.763 6.540
135 HB2 ASN 20 HB2 ASN 20 -0.720 8.080 3.663
136 HB3 ASN 20 HB1 ASN 20 -2.323 8.432 4.287
137 HD21 ASN 20 HD21 ASN 20 -0.537 10.174 2.943
138 HD22 ASN 20 HD22 ASN 20 -0.254 11.498 4.012
139 H TRP 21 HN TRP 21 0.114 5.150 5.146
140 HA TRP 21 HA TRP 21 -2.078 4.159 3.598
141 HB2 TRP 21 HB2 TRP 21 -0.659 2.510 2.833
142 HB3 TRP 21 HB1 TRP 21 0.492 3.769 3.244
143 HD1 TRP 21 HD1 TRP 21 -0.513 0.242 4.115
144 HE1 TRP 21 HE1 TRP 21 1.142 -0.742 5.828
145 HE3 TRP 21 HE3 TRP 21 2.061 4.498 5.291
146 HZ2 TRP 21 HZ2 TRP 21 3.254 0.170 7.447
147 HZ3 TRP 21 HZ3 TRP 21 3.889 4.350 6.933
148 HH2 TRP 21 HH2 TRP 21 4.470 2.233 7.986
149 H LYS 22 HN LYS 22 -3.253 2.367 3.972
150 HA LYS 22 HA LYS 22 -3.303 1.352 6.738
151 HB2 LYS 22 HB2 LYS 22 -5.626 1.978 4.941
152 HB3 LYS 22 HB1 LYS 22 -5.765 1.032 6.405
153 HG2 LYS 22 HG2 LYS 22 -4.671 3.822 6.350
154 HG3 LYS 22 HG1 LYS 22 -6.367 3.428 6.665
155 HD2 LYS 22 HD2 LYS 22 -4.210 2.086 8.226
156 HD3 LYS 22 HD1 LYS 22 -4.718 3.714 8.663
157 HE2 LYS 22 HE2 LYS 22 -7.029 2.883 8.841
158 HE3 LYS 22 HE1 LYS 22 -6.442 1.268 8.466
159 HZ1 LYS 22 HZ1 LYS 22 -5.198 1.208 10.466
160 HZ2 LYS 22 HZ2 LYS 22 -6.763 1.720 10.874
161 HZ3 LYS 22 HZ3 LYS 22 -5.497 2.844 10.789
162 H THR 23 HN THR 23 -4.686 -0.693 6.799
163 HA THR 23 HA THR 23 -3.769 -2.464 4.641
164 HB THR 23 HB THR 23 -3.623 -4.208 6.528
165 HG1 THR 23 HG1 THR 23 -3.004 -2.080 8.236
166 HG21 THR 23 HG21 THR 23 -1.806 -2.081 5.746
167 HG22 THR 23 HG22 THR 23 -1.554 -3.826 5.759
168 HG23 THR 23 HG23 THR 23 -1.368 -2.891 7.247
169 H ALA 24 HN ALA 24 -5.272 -3.676 3.738
170 HA ALA 24 HA ALA 24 -7.530 -4.618 5.298
171 HB1 ALA 24 HB1 ALA 24 -9.194 -3.518 4.273
172 HB2 ALA 24 HB2 ALA 24 -8.375 -3.566 2.717
173 HB3 ALA 24 HB3 ALA 24 -7.938 -2.332 3.900
174 H ARG 25 HN ARG 25 -8.796 -6.184 4.128
175 HA ARG 25 HA ARG 25 -7.399 -7.466 1.902
176 HB2 ARG 25 HB2 ARG 25 -6.639 -8.810 3.631
177 HB3 ARG 25 HB1 ARG 25 -8.125 -8.659 4.520
178 HG2 ARG 25 HG2 ARG 25 -9.227 -10.112 2.836
179 HG3 ARG 25 HG1 ARG 25 -7.648 -10.336 2.098
180 HD2 ARG 25 HD2 ARG 25 -8.239 -10.953 4.945
181 HD3 ARG 25 HD1 ARG 25 -8.335 -12.149 3.663
182 HE ARG 25 HE ARG 25 -5.868 -11.451 3.308
183 HH11 ARG 25 HH11 ARG 25 -7.521 -11.628 6.389
184 HH12 ARG 25 HH12 ARG 25 -6.084 -12.045 7.278
185 HH21 ARG 25 HH21 ARG 25 -3.982 -12.026 4.470
186 HH22 ARG 25 HH22 ARG 25 -4.069 -12.261 6.194
187 H ASP 26 HN ASP 26 -8.696 -8.555 0.499
188 HA ASP 26 HA ASP 26 -11.500 -7.744 0.609
189 HB2 ASP 26 HB2 ASP 26 -11.596 -8.279 -1.782
190 HB3 ASP 26 HB1 ASP 26 -10.318 -7.134 -1.434
191 HA PRO 27 HA PRO 27 -13.300 -11.523 1.350
192 HB2 PRO 27 HB2 PRO 27 -14.721 -12.289 -0.892
193 HB3 PRO 27 HB1 PRO 27 -15.306 -11.205 0.367
194 HG2 PRO 27 HG2 PRO 27 -14.263 -10.610 -2.332
195 HG3 PRO 27 HG1 PRO 27 -15.426 -9.704 -1.347
196 HD2 PRO 27 HD2 PRO 27 -12.820 -9.009 -1.739
197 HD3 PRO 27 HD1 PRO 27 -13.775 -8.476 -0.357
198 H GLU 28 HN GLU 28 -11.619 -11.502 -1.718
199 HA GLU 28 HA GLU 28 -11.447 -14.400 -1.768
200 HB2 GLU 28 HB2 GLU 28 -10.248 -12.429 -3.708
201 HB3 GLU 28 HB1 GLU 28 -10.595 -14.137 -3.981
202 HG2 GLU 28 HG2 GLU 28 -13.003 -13.626 -3.665
203 HG3 GLU 28 HG1 GLU 28 -12.589 -11.920 -3.580
204 H GLY 29 HN GLY 29 -10.167 -13.184 0.396
205 HA2 GLY 29 HA2 GLY 29 -8.346 -13.688 1.656
206 HA3 GLY 29 HA1 GLY 29 -7.945 -14.877 0.436
207 H LYS 30 HN LYS 30 -8.052 -11.631 -0.728
208 HA LYS 30 HA LYS 30 -5.116 -11.603 -0.740
209 HB2 LYS 30 HB2 LYS 30 -6.258 -11.314 -2.890
210 HB3 LYS 30 HB1 LYS 30 -7.130 -9.931 -2.252
211 HG2 LYS 30 HG2 LYS 30 -5.387 -9.123 -3.638
212 HG3 LYS 30 HG1 LYS 30 -4.946 -8.774 -1.966
213 HD2 LYS 30 HD2 LYS 30 -3.321 -10.466 -1.927
214 HD3 LYS 30 HD1 LYS 30 -3.972 -11.243 -3.375
215 HE2 LYS 30 HE2 LYS 30 -2.721 -8.497 -3.328
216 HE3 LYS 30 HE1 LYS 30 -1.853 -9.973 -3.742
217 HZ1 LYS 30 HZ1 LYS 30 -2.687 -8.687 -5.682
218 HZ2 LYS 30 HZ2 LYS 30 -4.271 -9.033 -5.189
219 HZ3 LYS 30 HZ3 LYS 30 -3.228 -10.292 -5.636
220 H ILE 31 HN ILE 31 -3.974 -10.187 0.443
221 HA ILE 31 HA ILE 31 -5.451 -8.103 1.946
222 HB ILE 31 HB ILE 31 -4.442 -9.831 3.389
223 HG12 ILE 31 HG12 ILE 31 -2.737 -8.003 4.478
224 HG13 ILE 31 HG11 ILE 31 -3.743 -6.982 3.471
225 HG21 ILE 31 HG21 ILE 31 -2.573 -10.527 2.040
226 HG22 ILE 31 HG22 ILE 31 -1.997 -9.973 3.611
227 HG23 ILE 31 HG23 ILE 31 -1.828 -8.936 2.196
228 HD11 ILE 31 HD11 ILE 31 -4.706 -8.856 5.609
229 HD12 ILE 31 HD12 ILE 31 -5.720 -7.854 4.575
230 HD13 ILE 31 HD13 ILE 31 -4.612 -7.096 5.716
231 H TYR 32 HN TYR 32 -4.634 -5.975 1.799
232 HA TYR 32 HA TYR 32 -2.098 -5.557 0.414
233 HB2 TYR 32 HB2 TYR 32 -3.223 -3.966 -1.206
234 HB3 TYR 32 HB1 TYR 32 -3.534 -5.681 -1.477
235 HD1 TYR 32 HD2 TYR 32 -5.737 -6.640 -0.962
236 HD2 TYR 32 HD1 TYR 32 -5.004 -2.464 -0.580
237 HE1 TYR 32 HE2 TYR 32 -8.158 -6.225 -0.926
238 HE2 TYR 32 HE1 TYR 32 -7.428 -2.039 -0.541
239 HH TYR 32 HH TYR 32 -9.526 -3.247 -1.400
240 H TYR 33 HN TYR 33 -1.815 -3.052 0.092
241 HA TYR 33 HA TYR 33 -2.774 -1.666 2.498
242 HB2 TYR 33 HB2 TYR 33 -0.260 -0.916 1.053
243 HB3 TYR 33 HB1 TYR 33 -0.723 -0.577 2.699
244 HD1 TYR 33 HD2 TYR 33 -0.488 -2.290 4.452
245 HD2 TYR 33 HD1 TYR 33 0.884 -2.966 0.488
246 HE1 TYR 33 HE2 TYR 33 0.836 -4.199 5.246
247 HE2 TYR 33 HE1 TYR 33 2.209 -4.885 1.268
248 HH TYR 33 HH TYR 33 1.798 -6.251 4.360
249 H TYR 34 HN TYR 34 -3.300 0.541 2.222
250 HA TYR 34 HA TYR 34 -3.318 1.544 -0.513
251 HB2 TYR 34 HB2 TYR 34 -5.674 2.316 -0.284
252 HB3 TYR 34 HB1 TYR 34 -5.492 0.571 -0.364
253 HD1 TYR 34 HD1 TYR 34 -5.852 -0.802 1.667
254 HD2 TYR 34 HD2 TYR 34 -6.609 3.385 1.643
255 HE1 TYR 34 HE1 TYR 34 -7.217 -1.043 3.698
256 HE2 TYR 34 HE2 TYR 34 -7.976 3.152 3.673
257 HH TYR 34 HH TYR 34 -7.992 0.330 5.575
258 H HIS 35 HN HIS 35 -3.079 3.624 -0.801
259 HA HIS 35 HA HIS 35 -2.443 5.222 1.569
260 HB2 HIS 35 HB2 HIS 35 -1.923 5.675 -1.388
261 HB3 HIS 35 HB1 HIS 35 -1.409 6.756 -0.114
262 HD1 HIS 35 HD1 HIS 35 1.062 6.463 -0.860
263 HD2 HIS 35 HD2 HIS 35 -0.772 2.939 0.395
264 HE1 HIS 35 HE1 HIS 35 2.917 4.788 -0.599
265 HE2 HIS 35 HE2 HIS 35 1.770 2.629 -0.002
266 H VAL 36 HN VAL 36 -3.622 7.035 2.094
267 HA VAL 36 HA VAL 36 -6.244 7.115 0.892
268 HB VAL 36 HB VAL 36 -6.494 8.901 2.820
269 HG11 VAL 36 HG11 VAL 36 -6.960 6.983 4.376
270 HG12 VAL 36 HG12 VAL 36 -6.310 5.913 3.133
271 HG13 VAL 36 HG13 VAL 36 -7.744 6.879 2.802
272 HG21 VAL 36 HG21 VAL 36 -4.252 9.131 3.498
273 HG22 VAL 36 HG22 VAL 36 -3.981 7.384 3.486
274 HG23 VAL 36 HG23 VAL 36 -5.005 8.117 4.733
275 H ILE 37 HN ILE 37 -3.571 9.467 1.324
276 HA ILE 37 HA ILE 37 -5.032 11.596 0.168
277 HB ILE 37 HB ILE 37 -2.094 11.211 0.674
278 HG12 ILE 37 HG12 ILE 37 -2.639 13.299 2.100
279 HG13 ILE 37 HG11 ILE 37 -4.312 12.864 1.788
280 HG21 ILE 37 HG21 ILE 37 -3.380 13.628 -0.597
281 HG22 ILE 37 HG22 ILE 37 -2.276 12.508 -1.394
282 HG23 ILE 37 HG23 ILE 37 -1.704 13.510 -0.059
283 HD11 ILE 37 HD11 ILE 37 -2.273 11.255 3.261
284 HD12 ILE 37 HD12 ILE 37 -3.841 10.640 2.760
285 HD13 ILE 37 HD13 ILE 37 -3.748 11.985 3.897
286 H THR 38 HN THR 38 -2.411 9.616 -1.067
287 HA THR 38 HA THR 38 -2.593 10.721 -3.676
288 HB THR 38 HB THR 38 -0.895 8.859 -4.177
289 HG1 THR 38 HG1 THR 38 0.098 8.176 -2.097
290 HG21 THR 38 HG21 THR 38 -0.403 10.962 -2.078
291 HG22 THR 38 HG22 THR 38 -0.275 11.179 -3.826
292 HG23 THR 38 HG23 THR 38 0.867 10.132 -2.979
293 H ARG 39 HN ARG 39 -4.178 8.127 -2.146
294 HA ARG 39 HA ARG 39 -5.573 6.484 -2.834
295 HB2 ARG 39 HB2 ARG 39 -5.656 8.346 -5.157
296 HB3 ARG 39 HB1 ARG 39 -6.323 6.747 -5.371
297 HG2 ARG 39 HG2 ARG 39 -8.162 7.968 -4.777
298 HG3 ARG 39 HG1 ARG 39 -7.655 7.294 -3.224
299 HD2 ARG 39 HD2 ARG 39 -6.375 9.344 -2.826
300 HD3 ARG 39 HD1 ARG 39 -7.042 10.031 -4.296
301 HE ARG 39 HE ARG 39 -9.233 9.261 -2.856
302 HH11 ARG 39 HH11 ARG 39 -6.515 11.379 -2.255
303 HH12 ARG 39 HH12 ARG 39 -7.420 12.461 -1.239
304 HH21 ARG 39 HH21 ARG 39 -10.428 10.671 -1.543
305 HH22 ARG 39 HH22 ARG 39 -9.648 12.033 -0.798
306 H GLN 40 HN GLN 40 -3.089 5.608 -2.719
307 HA GLN 40 HA GLN 40 -2.652 4.135 -5.226
308 HB2 GLN 40 HB2 GLN 40 -0.702 4.679 -3.042
309 HB3 GLN 40 HB1 GLN 40 -0.337 3.958 -4.588
310 HG2 GLN 40 HG2 GLN 40 -0.809 6.030 -5.674
311 HG3 GLN 40 HG1 GLN 40 -1.304 6.766 -4.164
312 HE21 GLN 40 HE21 GLN 40 0.722 7.606 -6.013
313 HE22 GLN 40 HE22 GLN 40 2.220 7.577 -5.156
314 H THR 41 HN THR 41 -1.987 1.902 -4.959
315 HA THR 41 HA THR 41 -2.277 0.714 -2.375
316 HB THR 41 HB THR 41 -4.542 0.694 -2.697
317 HG1 THR 41 HG1 THR 41 -4.702 -1.682 -3.793
318 HG21 THR 41 HG21 THR 41 -4.567 1.510 -4.934
319 HG22 THR 41 HG22 THR 41 -5.636 0.108 -4.813
320 HG23 THR 41 HG23 THR 41 -4.042 -0.052 -5.561
321 H GLN 42 HN GLN 42 -0.871 -0.867 -2.242
322 HA GLN 42 HA GLN 42 -0.552 -2.796 -4.388
323 HB2 GLN 42 HB2 GLN 42 1.856 -1.394 -3.272
324 HB3 GLN 42 HB1 GLN 42 1.874 -2.716 -4.402
325 HG2 GLN 42 HG2 GLN 42 0.631 -0.067 -5.041
326 HG3 GLN 42 HG1 GLN 42 2.324 -0.434 -5.349
327 HE21 GLN 42 HE21 GLN 42 1.681 -3.250 -5.992
328 HE22 GLN 42 HE22 GLN 42 0.985 -3.221 -7.570
329 H TRP 43 HN TRP 43 -0.020 -4.743 -3.654
330 HA TRP 43 HA TRP 43 0.306 -5.129 -0.764
331 HB2 TRP 43 HB2 TRP 43 -1.431 -6.486 -1.527
332 HB3 TRP 43 HB1 TRP 43 -0.605 -6.885 -3.020
333 HD1 TRP 43 HD1 TRP 43 0.038 -9.343 -3.066
334 HE1 TRP 43 HE1 TRP 43 0.853 -11.091 -1.359
335 HE3 TRP 43 HE3 TRP 43 0.046 -6.434 1.149
336 HZ2 TRP 43 HZ2 TRP 43 1.431 -11.214 1.396
337 HZ3 TRP 43 HZ3 TRP 43 0.748 -7.451 3.273
338 HH2 TRP 43 HH2 TRP 43 1.425 -9.788 3.393
339 H ASP 44 HN ASP 44 1.821 -5.806 -3.837
340 HA ASP 44 HA ASP 44 3.552 -7.814 -2.765
341 HB2 ASP 44 HB2 ASP 44 2.623 -8.012 -5.000
342 HB3 ASP 44 HB1 ASP 44 3.468 -6.553 -5.501
343 HA PRO 45 HA PRO 45 7.086 -4.629 -3.568
344 HB2 PRO 45 HB2 PRO 45 6.427 -1.992 -3.429
345 HB3 PRO 45 HB1 PRO 45 6.510 -2.893 -4.946
346 HG2 PRO 45 HG2 PRO 45 4.125 -2.176 -3.294
347 HG3 PRO 45 HG1 PRO 45 4.322 -2.137 -5.056
348 HD2 PRO 45 HD2 PRO 45 3.028 -4.140 -3.783
349 HD3 PRO 45 HD1 PRO 45 3.954 -4.399 -5.276
350 HA PRO 46 HA PRO 46 7.470 -4.084 0.829
351 HB2 PRO 46 HB2 PRO 46 9.971 -2.663 0.207
352 HB3 PRO 46 HB1 PRO 46 9.712 -4.137 1.145
353 HG2 PRO 46 HG2 PRO 46 10.823 -4.208 -1.274
354 HG3 PRO 46 HG1 PRO 46 9.740 -5.493 -0.720
355 HD2 PRO 46 HD2 PRO 46 9.176 -3.203 -2.574
356 HD3 PRO 46 HD1 PRO 46 8.667 -4.902 -2.696
357 H THR 47 HN THR 47 7.732 -2.389 2.420
358 HA THR 47 HA THR 47 6.250 -0.081 1.772
359 HB THR 47 HB THR 47 6.180 -1.129 3.977
360 HG1 THR 47 HG1 THR 47 6.528 0.863 5.248
361 HG21 THR 47 HG21 THR 47 7.999 -0.951 5.550
362 HG22 THR 47 HG22 THR 47 8.980 -0.094 4.369
363 HG23 THR 47 HG23 THR 47 8.550 -1.783 4.100
364 H TRP 48 HN TRP 48 7.576 1.820 3.352
365 HA TRP 48 HA TRP 48 8.880 3.269 1.343
366 HB2 TRP 48 HB2 TRP 48 7.754 4.192 3.392
367 HB3 TRP 48 HB1 TRP 48 9.195 3.746 4.287
368 HD1 TRP 48 HD1 TRP 48 9.117 5.426 0.809
369 HE1 TRP 48 HE1 TRP 48 10.383 7.663 0.968
370 HE3 TRP 48 HE3 TRP 48 10.058 5.471 5.839
371 HZ2 TRP 48 HZ2 TRP 48 11.614 9.236 2.963
372 HZ3 TRP 48 HZ3 TRP 48 11.283 7.383 6.792
373 HH2 TRP 48 HH2 TRP 48 12.041 9.222 5.381
374 H GLU 49 HN GLU 49 10.180 1.161 3.799
375 HA GLU 49 HA GLU 49 12.885 1.826 2.905
376 HB2 GLU 49 HB2 GLU 49 11.905 0.674 5.504
377 HB3 GLU 49 HB1 GLU 49 13.609 0.802 5.062
378 HG2 GLU 49 HG2 GLU 49 13.316 3.190 4.730
379 HG3 GLU 49 HG1 GLU 49 11.652 3.059 5.288
380 H SER 50 HN SER 50 14.078 0.425 1.932
381 HA SER 50 HA SER 50 13.125 -2.358 1.678
382 HB2 SER 50 HB2 SER 50 14.312 -0.650 -0.524
383 HB3 SER 50 HB1 SER 50 13.686 -2.289 -0.688
384 HG SER 50 HG SER 50 11.979 -1.161 -1.280
385 HA PRO 51 HA PRO 51 17.325 -3.585 2.562
386 HB2 PRO 51 HB2 PRO 51 17.477 -5.828 1.002
387 HB3 PRO 51 HB1 PRO 51 16.677 -5.776 2.577
388 HG2 PRO 51 HG2 PRO 51 15.484 -5.582 -0.162
389 HG3 PRO 51 HG1 PRO 51 14.910 -6.494 1.248
390 HD2 PRO 51 HD2 PRO 51 13.807 -4.148 0.558
391 HD3 PRO 51 HD1 PRO 51 14.016 -4.612 2.260
392 H GLY 52 HN GLY 52 19.347 -4.325 1.342
393 HA2 GLY 52 HA2 GLY 52 19.890 -2.429 -0.705
394 HA3 GLY 52 HA1 GLY 52 20.970 -3.714 -0.178
395 H ASP 53 HN ASP 53 18.830 -5.720 -0.663
396 HA ASP 53 HA ASP 53 19.477 -6.408 -3.332
397 HB2 ASP 53 HB2 ASP 53 17.284 -7.483 -1.540
398 HB3 ASP 53 HB1 ASP 53 17.815 -8.223 -3.046
399 H ASP 54 HN ASP 54 16.743 -4.795 -1.848
400 HA ASP 54 HA ASP 54 15.102 -5.015 -4.220
401 HB2 ASP 54 HB2 ASP 54 14.099 -5.153 -1.969
402 HB3 ASP 54 HB1 ASP 54 14.618 -3.502 -1.645
403 H ALA 55 HN ALA 55 16.839 -2.481 -2.484
404 HA ALA 55 HA ALA 55 15.882 -0.406 -4.232
405 HB1 ALA 55 HB1 ALA 55 18.048 -0.329 -2.137
406 HB2 ALA 55 HB2 ALA 55 16.340 0.027 -1.871
407 HB3 ALA 55 HB3 ALA 55 17.305 1.065 -2.921
408 H SER 56 HN SER 56 17.078 0.788 -5.699
409 HA SER 56 HA SER 56 19.804 0.096 -6.324
410 HB2 SER 56 HB2 SER 56 18.528 -1.634 -7.569
411 HB3 SER 56 HB1 SER 56 17.617 -0.361 -8.379
412 HG SER 56 HG SER 56 20.444 -0.489 -8.493
Start of MODEL 11
1 H1 GLY 1 HT1 GLY 1 -8.716 7.814 7.875
2 H2 GLY 1 HT2 GLY 1 -8.005 8.283 6.406
3 H3 GLY 1 HT3 GLY 1 -7.157 8.481 7.859
4 HA2 GLY 1 HA1 GLY 1 -6.402 6.558 6.500
5 HA3 GLY 1 HA2 GLY 1 -6.875 6.170 8.149
6 H SER 2 HN SER 2 -8.678 4.957 8.537
7 HA SER 2 HA SER 2 -9.446 3.041 6.637
8 HB2 SER 2 HB2 SER 2 -9.577 2.769 9.117
9 HB3 SER 2 HB1 SER 2 -10.960 3.859 9.129
10 HG SER 2 HG SER 2 -11.026 1.623 7.433
11 H ASP 3 HN ASP 3 -10.482 6.209 7.120
12 HA ASP 3 HA ASP 3 -13.210 6.149 6.530
13 HB2 ASP 3 HB2 ASP 3 -11.389 8.454 5.871
14 HB3 ASP 3 HB1 ASP 3 -13.058 8.501 6.431
15 H LEU 4 HN LEU 4 -10.537 5.743 4.388
16 HA LEU 4 HA LEU 4 -12.108 6.802 2.133
17 HB2 LEU 4 HB2 LEU 4 -9.123 6.485 2.439
18 HB3 LEU 4 HB1 LEU 4 -9.921 7.029 0.975
19 HG LEU 4 HG LEU 4 -10.016 8.456 3.633
20 HD11 LEU 4 HD11 LEU 4 -8.605 10.123 2.538
21 HD12 LEU 4 HD12 LEU 4 -8.506 9.098 1.107
22 HD13 LEU 4 HD13 LEU 4 -7.804 8.556 2.632
23 HD21 LEU 4 HD21 LEU 4 -11.052 10.269 2.360
24 HD22 LEU 4 HD22 LEU 4 -12.030 8.802 2.308
25 HD23 LEU 4 HD23 LEU 4 -11.049 9.257 0.916
26 HA PRO 5 HA PRO 5 -12.514 2.789 0.460
27 HB2 PRO 5 HB2 PRO 5 -12.731 3.916 -2.210
28 HB3 PRO 5 HB1 PRO 5 -14.001 3.259 -1.177
29 HG2 PRO 5 HG2 PRO 5 -13.812 5.897 -1.791
30 HG3 PRO 5 HG1 PRO 5 -14.502 5.300 -0.271
31 HD2 PRO 5 HD2 PRO 5 -11.767 6.398 -0.808
32 HD3 PRO 5 HD1 PRO 5 -12.851 6.702 0.568
33 HA PRO 6 HA PRO 6 -8.652 1.371 -1.090
34 HB2 PRO 6 HB2 PRO 6 -9.488 -0.906 -2.354
35 HB3 PRO 6 HB1 PRO 6 -9.310 -0.763 -0.603
36 HG2 PRO 6 HG2 PRO 6 -11.780 -0.554 -2.277
37 HG3 PRO 6 HG1 PRO 6 -11.544 -1.373 -0.720
38 HD2 PRO 6 HD2 PRO 6 -12.725 1.036 -0.893
39 HD3 PRO 6 HD1 PRO 6 -11.690 0.591 0.480
40 HA PRO 7 HA PRO 7 -8.483 2.688 -5.333
41 HB2 PRO 7 HB2 PRO 7 -5.679 2.178 -5.311
42 HB3 PRO 7 HB1 PRO 7 -6.491 3.718 -5.081
43 HG2 PRO 7 HG2 PRO 7 -5.051 2.412 -3.137
44 HG3 PRO 7 HG1 PRO 7 -6.324 3.607 -2.811
45 HD2 PRO 7 HD2 PRO 7 -6.476 0.611 -2.779
46 HD3 PRO 7 HD1 PRO 7 -7.194 1.789 -1.656
47 H SER 8 HN SER 8 -8.158 1.885 -7.389
48 HA SER 8 HA SER 8 -7.310 -0.890 -7.743
49 HB2 SER 8 HB2 SER 8 -9.160 0.278 -9.108
50 HB3 SER 8 HB1 SER 8 -7.866 1.182 -9.888
51 HG SER 8 HG SER 8 -8.033 -1.659 -9.822
52 HA PRO 9 HA PRO 9 -3.222 0.247 -7.601
53 HB2 PRO 9 HB2 PRO 9 -1.898 -1.464 -9.239
54 HB3 PRO 9 HB1 PRO 9 -2.662 -1.970 -7.725
55 HG2 PRO 9 HG2 PRO 9 -3.664 -2.225 -10.537
56 HG3 PRO 9 HG1 PRO 9 -3.738 -3.399 -9.209
57 HD2 PRO 9 HD2 PRO 9 -5.852 -1.845 -9.936
58 HD3 PRO 9 HD1 PRO 9 -5.593 -2.407 -8.272
59 HA PRO 10 HA PRO 10 -1.884 2.800 -11.057
60 HB2 PRO 10 HB2 PRO 10 -0.350 4.326 -9.260
61 HB3 PRO 10 HB1 PRO 10 -1.975 4.699 -9.829
62 HG2 PRO 10 HG2 PRO 10 -1.246 4.043 -7.200
63 HG3 PRO 10 HG1 PRO 10 -2.893 4.106 -7.851
64 HD2 PRO 10 HD2 PRO 10 -1.108 1.754 -7.425
65 HD3 PRO 10 HD1 PRO 10 -2.873 1.881 -7.265
66 H ALA 11 HN ALA 11 0.106 3.022 -12.128
67 HA ALA 11 HA ALA 11 2.320 1.362 -11.382
68 HB1 ALA 11 HB1 ALA 11 1.887 1.952 -13.718
69 HB2 ALA 11 HB2 ALA 11 3.497 2.462 -13.219
70 HB3 ALA 11 HB3 ALA 11 2.200 3.648 -13.351
71 H ALA 12 HN ALA 12 1.345 4.643 -10.900
72 HA ALA 12 HA ALA 12 3.734 5.769 -9.967
73 HB1 ALA 12 HB1 ALA 12 0.905 6.566 -9.326
74 HB2 ALA 12 HB2 ALA 12 1.829 7.086 -10.734
75 HB3 ALA 12 HB3 ALA 12 2.341 7.568 -9.117
76 H ALA 13 HN ALA 13 1.829 3.434 -8.487
77 HA ALA 13 HA ALA 13 1.330 4.394 -5.939
78 HB1 ALA 13 HB1 ALA 13 0.959 2.100 -5.278
79 HB2 ALA 13 HB2 ALA 13 1.825 1.525 -6.702
80 HB3 ALA 13 HB3 ALA 13 0.297 2.388 -6.887
81 H THR 14 HN THR 14 4.315 3.046 -7.157
82 HA THR 14 HA THR 14 5.399 2.432 -4.588
83 HB THR 14 HB THR 14 6.169 1.206 -6.541
84 HG1 THR 14 HG1 THR 14 7.907 2.637 -4.912
85 HG21 THR 14 HG21 THR 14 5.991 2.947 -8.226
86 HG22 THR 14 HG22 THR 14 7.623 2.275 -8.216
87 HG23 THR 14 HG23 THR 14 7.309 3.842 -7.473
88 H ILE 15 HN ILE 15 5.237 5.339 -6.480
89 HA ILE 15 HA ILE 15 7.593 6.601 -6.054
90 HB ILE 15 HB ILE 15 5.829 7.490 -7.470
91 HG12 ILE 15 HG12 ILE 15 6.122 9.882 -6.910
92 HG13 ILE 15 HG11 ILE 15 6.832 9.408 -5.371
93 HG21 ILE 15 HG21 ILE 15 3.883 7.144 -6.021
94 HG22 ILE 15 HG22 ILE 15 3.975 8.801 -6.621
95 HG23 ILE 15 HG23 ILE 15 4.450 8.437 -4.963
96 HD11 ILE 15 HD11 ILE 15 8.419 9.971 -7.268
97 HD12 ILE 15 HD12 ILE 15 7.898 8.439 -7.980
98 HD13 ILE 15 HD13 ILE 15 8.693 8.455 -6.407
99 H VAL 16 HN VAL 16 4.855 7.600 -3.962
100 HA VAL 16 HA VAL 16 6.807 7.875 -1.775
101 HB VAL 16 HB VAL 16 4.371 9.616 -2.171
102 HG11 VAL 16 HG11 VAL 16 5.709 11.082 -0.561
103 HG12 VAL 16 HG12 VAL 16 6.668 9.633 -0.244
104 HG13 VAL 16 HG13 VAL 16 4.937 9.639 0.093
105 HG21 VAL 16 HG21 VAL 16 5.825 11.356 -2.981
106 HG22 VAL 16 HG22 VAL 16 6.012 9.919 -3.992
107 HG23 VAL 16 HG23 VAL 16 7.237 10.317 -2.786
108 H LEU 17 HN LEU 17 6.248 7.179 0.205
109 HA LEU 17 HA LEU 17 3.579 5.979 0.464
110 HB2 LEU 17 HB2 LEU 17 6.277 4.894 0.956
111 HB3 LEU 17 HB1 LEU 17 5.063 4.490 2.154
112 HG LEU 17 HG LEU 17 3.654 3.530 0.339
113 HD11 LEU 17 HD11 LEU 17 4.858 3.012 -1.811
114 HD12 LEU 17 HD12 LEU 17 6.046 4.226 -1.335
115 HD13 LEU 17 HD13 LEU 17 4.366 4.690 -1.589
116 HD21 LEU 17 HD21 LEU 17 5.059 2.080 1.652
117 HD22 LEU 17 HD22 LEU 17 6.432 2.413 0.601
118 HD23 LEU 17 HD23 LEU 17 5.037 1.537 -0.026
119 HA PRO 18 HA PRO 18 3.687 8.410 4.230
120 HB2 PRO 18 HB2 PRO 18 1.030 8.748 4.359
121 HB3 PRO 18 HB1 PRO 18 2.003 9.550 3.122
122 HG2 PRO 18 HG2 PRO 18 0.088 7.342 2.839
123 HG3 PRO 18 HG1 PRO 18 0.728 8.436 1.603
124 HD2 PRO 18 HD2 PRO 18 1.597 5.743 2.297
125 HD3 PRO 18 HD1 PRO 18 2.073 6.747 0.912
126 HA PRO 19 HA PRO 19 2.833 5.424 7.518
127 HB2 PRO 19 HB2 PRO 19 2.382 7.998 8.906
128 HB3 PRO 19 HB1 PRO 19 3.320 6.620 9.428
129 HG2 PRO 19 HG2 PRO 19 4.586 8.694 8.561
130 HG3 PRO 19 HG1 PRO 19 5.060 7.105 7.926
131 HD2 PRO 19 HD2 PRO 19 3.307 9.188 6.663
132 HD3 PRO 19 HD1 PRO 19 4.637 8.262 5.951
133 H ASN 20 HN ASN 20 0.864 8.052 6.529
134 HA ASN 20 HA ASN 20 -1.498 7.639 7.954
135 HB2 ASN 20 HB2 ASN 20 -1.129 8.654 5.133
136 HB3 ASN 20 HB1 ASN 20 -2.630 8.757 6.035
137 HD21 ASN 20 HD21 ASN 20 -2.715 10.938 5.894
138 HD22 ASN 20 HD22 ASN 20 -1.635 11.984 6.730
139 H TRP 21 HN TRP 21 -0.095 5.572 5.610
140 HA TRP 21 HA TRP 21 -2.556 4.903 4.323
141 HB2 TRP 21 HB2 TRP 21 -1.309 3.552 2.868
142 HB3 TRP 21 HB1 TRP 21 -0.257 4.910 3.219
143 HD1 TRP 21 HD1 TRP 21 0.611 3.381 6.151
144 HE1 TRP 21 HE1 TRP 21 2.434 1.574 5.935
145 HE3 TRP 21 HE3 TRP 21 0.277 2.483 1.134
146 HZ2 TRP 21 HZ2 TRP 21 3.582 0.000 3.910
147 HZ3 TRP 21 HZ3 TRP 21 1.785 0.817 0.134
148 HH2 TRP 21 HH2 TRP 21 3.404 -0.397 1.496
149 H LYS 22 HN LYS 22 -3.333 2.710 4.204
150 HA LYS 22 HA LYS 22 -3.134 1.421 6.842
151 HB2 LYS 22 HB2 LYS 22 -5.640 2.083 5.321
152 HB3 LYS 22 HB1 LYS 22 -5.586 1.014 6.703
153 HG2 LYS 22 HG2 LYS 22 -4.715 3.882 6.760
154 HG3 LYS 22 HG1 LYS 22 -6.305 3.300 7.267
155 HD2 LYS 22 HD2 LYS 22 -3.766 2.187 8.405
156 HD3 LYS 22 HD1 LYS 22 -4.532 3.611 9.079
157 HE2 LYS 22 HE2 LYS 22 -6.632 2.205 9.277
158 HE3 LYS 22 HE1 LYS 22 -5.604 0.825 8.888
159 HZ1 LYS 22 HZ1 LYS 22 -5.337 2.632 11.226
160 HZ2 LYS 22 HZ2 LYS 22 -4.216 1.429 10.819
161 HZ3 LYS 22 HZ3 LYS 22 -5.801 0.999 11.247
162 H THR 23 HN THR 23 -4.387 -0.658 6.827
163 HA THR 23 HA THR 23 -3.797 -2.163 4.371
164 HB THR 23 HB THR 23 -3.373 -4.116 5.979
165 HG1 THR 23 HG1 THR 23 -3.061 -3.674 8.058
166 HG21 THR 23 HG21 THR 23 -1.629 -1.835 5.362
167 HG22 THR 23 HG22 THR 23 -1.495 -3.518 4.861
168 HG23 THR 23 HG23 THR 23 -1.012 -3.036 6.491
169 H ALA 24 HN ALA 24 -5.105 -3.885 3.896
170 HA ALA 24 HA ALA 24 -7.226 -4.794 5.563
171 HB1 ALA 24 HB1 ALA 24 -9.123 -3.978 4.453
172 HB2 ALA 24 HB2 ALA 24 -8.177 -3.404 3.088
173 HB3 ALA 24 HB3 ALA 24 -8.092 -2.555 4.634
174 H ARG 25 HN ARG 25 -8.789 -6.131 4.009
175 HA ARG 25 HA ARG 25 -7.107 -7.479 2.034
176 HB2 ARG 25 HB2 ARG 25 -8.948 -8.786 4.009
177 HB3 ARG 25 HB1 ARG 25 -7.990 -9.607 2.823
178 HG2 ARG 25 HG2 ARG 25 -5.976 -9.005 3.955
179 HG3 ARG 25 HG1 ARG 25 -6.869 -7.970 5.070
180 HD2 ARG 25 HD2 ARG 25 -6.342 -10.027 6.184
181 HD3 ARG 25 HD1 ARG 25 -8.076 -9.977 5.885
182 HE ARG 25 HE ARG 25 -6.623 -11.340 3.825
183 HH11 ARG 25 HH11 ARG 25 -8.070 -11.703 7.000
184 HH12 ARG 25 HH12 ARG 25 -8.278 -13.425 6.841
185 HH21 ARG 25 HH21 ARG 25 -6.879 -13.591 3.625
186 HH22 ARG 25 HH22 ARG 25 -7.598 -14.498 4.924
187 H ASP 26 HN ASP 26 -8.233 -8.431 0.292
188 HA ASP 26 HA ASP 26 -10.809 -7.229 -0.306
189 HB2 ASP 26 HB2 ASP 26 -9.116 -9.151 -1.925
190 HB3 ASP 26 HB1 ASP 26 -10.600 -8.402 -2.486
191 HA PRO 27 HA PRO 27 -13.677 -10.372 0.573
192 HB2 PRO 27 HB2 PRO 27 -14.432 -11.214 -2.010
193 HB3 PRO 27 HB1 PRO 27 -15.204 -9.971 -1.041
194 HG2 PRO 27 HG2 PRO 27 -13.160 -9.683 -3.154
195 HG3 PRO 27 HG1 PRO 27 -14.561 -8.656 -2.803
196 HD2 PRO 27 HD2 PRO 27 -12.156 -7.872 -2.082
197 HD3 PRO 27 HD1 PRO 27 -13.504 -7.671 -0.951
198 H GLU 28 HN GLU 28 -11.361 -11.177 -1.978
199 HA GLU 28 HA GLU 28 -11.623 -14.014 -1.451
200 HB2 GLU 28 HB2 GLU 28 -9.737 -12.652 -3.365
201 HB3 GLU 28 HB1 GLU 28 -10.291 -14.323 -3.406
202 HG2 GLU 28 HG2 GLU 28 -12.594 -13.466 -3.807
203 HG3 GLU 28 HG1 GLU 28 -11.910 -11.852 -3.950
204 H GLY 29 HN GLY 29 -10.647 -12.528 0.697
205 HA2 GLY 29 HA2 GLY 29 -9.202 -12.927 2.409
206 HA3 GLY 29 HA1 GLY 29 -8.737 -14.372 1.547
207 H LYS 30 HN LYS 30 -7.973 -11.716 -0.410
208 HA LYS 30 HA LYS 30 -5.178 -12.011 0.340
209 HB2 LYS 30 HB2 LYS 30 -5.855 -11.943 -2.054
210 HB3 LYS 30 HB1 LYS 30 -6.411 -10.292 -1.825
211 HG2 LYS 30 HG2 LYS 30 -4.255 -10.244 -2.866
212 HG3 LYS 30 HG1 LYS 30 -4.096 -9.641 -1.215
213 HD2 LYS 30 HD2 LYS 30 -3.211 -11.768 -0.481
214 HD3 LYS 30 HD1 LYS 30 -3.478 -12.467 -2.078
215 HE2 LYS 30 HE2 LYS 30 -1.172 -11.951 -1.959
216 HE3 LYS 30 HE1 LYS 30 -1.901 -10.715 -2.978
217 HZ1 LYS 30 HZ1 LYS 30 -1.159 -10.417 -0.114
218 HZ2 LYS 30 HZ2 LYS 30 -1.916 -9.224 -1.046
219 HZ3 LYS 30 HZ3 LYS 30 -0.348 -9.733 -1.434
220 H ILE 31 HN ILE 31 -3.955 -10.499 1.370
221 HA ILE 31 HA ILE 31 -5.375 -8.151 2.462
222 HB ILE 31 HB ILE 31 -4.418 -9.518 4.180
223 HG12 ILE 31 HG12 ILE 31 -2.269 -7.754 4.560
224 HG13 ILE 31 HG11 ILE 31 -3.473 -6.846 3.667
225 HG21 ILE 31 HG21 ILE 31 -2.825 -10.818 2.957
226 HG22 ILE 31 HG22 ILE 31 -1.986 -10.008 4.282
227 HG23 ILE 31 HG23 ILE 31 -1.839 -9.392 2.638
228 HD11 ILE 31 HD11 ILE 31 -3.929 -8.292 6.258
229 HD12 ILE 31 HD12 ILE 31 -5.123 -7.370 5.347
230 HD13 ILE 31 HD13 ILE 31 -3.733 -6.549 6.055
231 H TYR 32 HN TYR 32 -4.577 -6.067 2.014
232 HA TYR 32 HA TYR 32 -2.102 -5.820 0.479
233 HB2 TYR 32 HB2 TYR 32 -3.196 -4.487 -1.271
234 HB3 TYR 32 HB1 TYR 32 -3.821 -6.132 -1.216
235 HD1 TYR 32 HD2 TYR 32 -6.027 -6.484 0.095
236 HD2 TYR 32 HD1 TYR 32 -4.654 -2.688 -1.252
237 HE1 TYR 32 HE2 TYR 32 -8.317 -5.611 0.241
238 HE2 TYR 32 HE1 TYR 32 -6.942 -1.807 -1.115
239 HH TYR 32 HH TYR 32 -9.327 -2.878 -1.225
240 H TYR 33 HN TYR 33 -1.899 -3.392 -0.195
241 HA TYR 33 HA TYR 33 -2.245 -1.758 2.237
242 HB2 TYR 33 HB2 TYR 33 -0.161 -1.713 0.059
243 HB3 TYR 33 HB1 TYR 33 -0.259 -0.524 1.330
244 HD1 TYR 33 HD2 TYR 33 0.108 -1.282 3.721
245 HD2 TYR 33 HD1 TYR 33 0.955 -3.769 0.374
246 HE1 TYR 33 HE2 TYR 33 1.508 -2.717 5.150
247 HE2 TYR 33 HE1 TYR 33 2.346 -5.216 1.794
248 HH TYR 33 HH TYR 33 3.650 -4.994 3.958
249 H TYR 34 HN TYR 34 -3.051 0.341 2.013
250 HA TYR 34 HA TYR 34 -3.338 1.382 -0.696
251 HB2 TYR 34 HB2 TYR 34 -5.655 2.246 -0.115
252 HB3 TYR 34 HB1 TYR 34 -5.508 0.531 -0.460
253 HD1 TYR 34 HD1 TYR 34 -5.690 -1.122 1.379
254 HD2 TYR 34 HD2 TYR 34 -6.343 3.034 2.023
255 HE1 TYR 34 HE1 TYR 34 -6.780 -1.628 3.525
256 HE2 TYR 34 HE2 TYR 34 -7.437 2.539 4.162
257 HH TYR 34 HH TYR 34 -8.577 0.706 5.263
258 H HIS 35 HN HIS 35 -3.156 3.519 -0.968
259 HA HIS 35 HA HIS 35 -2.083 4.966 1.343
260 HB2 HIS 35 HB2 HIS 35 -1.981 5.628 -1.622
261 HB3 HIS 35 HB1 HIS 35 -1.134 6.475 -0.352
262 HD1 HIS 35 HD1 HIS 35 -1.201 2.855 -1.564
263 HD2 HIS 35 HD2 HIS 35 1.475 5.822 -0.425
264 HE1 HIS 35 HE1 HIS 35 1.086 1.879 -1.931
265 HE2 HIS 35 HE2 HIS 35 2.672 3.777 -1.463
266 H VAL 36 HN VAL 36 -3.393 6.354 2.287
267 HA VAL 36 HA VAL 36 -5.924 7.035 1.245
268 HB VAL 36 HB VAL 36 -5.965 8.493 3.342
269 HG11 VAL 36 HG11 VAL 36 -5.208 5.649 3.920
270 HG12 VAL 36 HG12 VAL 36 -6.667 6.020 3.010
271 HG13 VAL 36 HG13 VAL 36 -6.480 6.629 4.656
272 HG21 VAL 36 HG21 VAL 36 -3.645 8.901 3.664
273 HG22 VAL 36 HG22 VAL 36 -3.264 7.174 3.565
274 HG23 VAL 36 HG23 VAL 36 -4.139 7.817 4.968
275 H ILE 37 HN ILE 37 -2.883 8.896 1.551
276 HA ILE 37 HA ILE 37 -4.004 11.362 0.769
277 HB ILE 37 HB ILE 37 -1.194 10.320 0.766
278 HG12 ILE 37 HG12 ILE 37 -1.012 12.412 2.285
279 HG13 ILE 37 HG11 ILE 37 -2.768 12.325 2.288
280 HG21 ILE 37 HG21 ILE 37 -1.321 11.745 -1.200
281 HG22 ILE 37 HG22 ILE 37 -0.387 12.531 0.073
282 HG23 ILE 37 HG23 ILE 37 -2.049 13.032 -0.237
283 HD11 ILE 37 HD11 ILE 37 -1.059 10.009 3.063
284 HD12 ILE 37 HD12 ILE 37 -2.780 10.266 3.346
285 HD13 ILE 37 HD13 ILE 37 -1.595 11.237 4.211
286 H THR 38 HN THR 38 -2.074 9.030 -1.030
287 HA THR 38 HA THR 38 -2.410 10.520 -3.454
288 HB THR 38 HB THR 38 -0.864 8.745 -4.386
289 HG1 THR 38 HG1 THR 38 0.147 7.424 -2.845
290 HG21 THR 38 HG21 THR 38 -0.094 10.407 -2.000
291 HG22 THR 38 HG22 THR 38 -0.021 10.885 -3.697
292 HG23 THR 38 HG23 THR 38 1.074 9.643 -3.082
293 H ARG 39 HN ARG 39 -4.015 7.865 -2.050
294 HA ARG 39 HA ARG 39 -5.583 6.391 -2.763
295 HB2 ARG 39 HB2 ARG 39 -5.643 8.375 -4.984
296 HB3 ARG 39 HB1 ARG 39 -6.447 6.845 -5.223
297 HG2 ARG 39 HG2 ARG 39 -8.125 8.230 -4.474
298 HG3 ARG 39 HG1 ARG 39 -7.632 7.362 -3.012
299 HD2 ARG 39 HD2 ARG 39 -6.105 9.235 -2.527
300 HD3 ARG 39 HD1 ARG 39 -6.814 10.121 -3.865
301 HE ARG 39 HE ARG 39 -8.899 9.309 -2.210
302 HH11 ARG 39 HH11 ARG 39 -6.123 11.427 -2.028
303 HH12 ARG 39 HH12 ARG 39 -6.903 12.581 -0.992
304 HH21 ARG 39 HH21 ARG 39 -9.934 10.811 -0.830
305 HH22 ARG 39 HH22 ARG 39 -9.064 12.225 -0.299
306 H GLN 40 HN GLN 40 -3.024 5.536 -2.898
307 HA GLN 40 HA GLN 40 -2.896 4.027 -5.414
308 HB2 GLN 40 HB2 GLN 40 -0.694 4.786 -3.542
309 HB3 GLN 40 HB1 GLN 40 -0.485 3.932 -5.055
310 HG2 GLN 40 HG2 GLN 40 -1.211 5.865 -6.250
311 HG3 GLN 40 HG1 GLN 40 -1.571 6.717 -4.766
312 HE21 GLN 40 HE21 GLN 40 0.173 7.392 -6.971
313 HE22 GLN 40 HE22 GLN 40 1.743 7.590 -6.286
314 H THR 41 HN THR 41 -1.781 1.822 -5.068
315 HA THR 41 HA THR 41 -2.179 0.744 -2.428
316 HB THR 41 HB THR 41 -4.391 0.459 -2.997
317 HG1 THR 41 HG1 THR 41 -3.599 -1.556 -2.360
318 HG21 THR 41 HG21 THR 41 -4.210 1.209 -5.259
319 HG22 THR 41 HG22 THR 41 -5.161 -0.277 -5.202
320 HG23 THR 41 HG23 THR 41 -3.486 -0.321 -5.761
321 H GLN 42 HN GLN 42 -1.085 -1.171 -2.034
322 HA GLN 42 HA GLN 42 0.165 -2.483 -4.367
323 HB2 GLN 42 HB2 GLN 42 1.543 -2.348 -1.693
324 HB3 GLN 42 HB1 GLN 42 2.227 -2.748 -3.260
325 HG2 GLN 42 HG2 GLN 42 1.823 -0.357 -3.926
326 HG3 GLN 42 HG1 GLN 42 1.429 -0.039 -2.237
327 HE21 GLN 42 HE21 GLN 42 3.083 -0.348 -0.656
328 HE22 GLN 42 HE22 GLN 42 4.752 -0.269 -1.091
329 H TRP 43 HN TRP 43 -0.290 -4.631 -4.433
330 HA TRP 43 HA TRP 43 -1.602 -5.824 -2.116
331 HB2 TRP 43 HB2 TRP 43 -1.399 -6.545 -5.010
332 HB3 TRP 43 HB1 TRP 43 -1.736 -7.819 -3.844
333 HD1 TRP 43 HD1 TRP 43 -4.136 -7.916 -2.803
334 HE1 TRP 43 HE1 TRP 43 -6.342 -6.662 -3.273
335 HE3 TRP 43 HE3 TRP 43 -2.300 -4.170 -5.752
336 HZ2 TRP 43 HZ2 TRP 43 -7.172 -4.390 -4.716
337 HZ3 TRP 43 HZ3 TRP 43 -3.873 -2.498 -6.638
338 HH2 TRP 43 HH2 TRP 43 -6.255 -2.606 -6.132
339 H ASP 44 HN ASP 44 1.271 -6.224 -4.084
340 HA ASP 44 HA ASP 44 2.145 -8.392 -2.307
341 HB2 ASP 44 HB2 ASP 44 1.839 -8.906 -4.742
342 HB3 ASP 44 HB1 ASP 44 3.166 -7.799 -5.083
343 HA PRO 45 HA PRO 45 6.054 -5.376 -3.001
344 HB2 PRO 45 HB2 PRO 45 4.436 -2.873 -3.012
345 HB3 PRO 45 HB1 PRO 45 5.957 -3.238 -3.833
346 HG2 PRO 45 HG2 PRO 45 3.702 -3.197 -5.203
347 HG3 PRO 45 HG1 PRO 45 4.905 -4.465 -5.509
348 HD2 PRO 45 HD2 PRO 45 2.340 -4.616 -3.980
349 HD3 PRO 45 HD1 PRO 45 3.066 -5.801 -5.083
350 HA PRO 46 HA PRO 46 6.153 -4.759 1.352
351 HB2 PRO 46 HB2 PRO 46 8.586 -3.190 0.992
352 HB3 PRO 46 HB1 PRO 46 8.374 -4.782 1.723
353 HG2 PRO 46 HG2 PRO 46 9.595 -4.450 -0.640
354 HG3 PRO 46 HG1 PRO 46 8.621 -5.883 -0.281
355 HD2 PRO 46 HD2 PRO 46 7.891 -3.441 -1.864
356 HD3 PRO 46 HD1 PRO 46 7.578 -5.152 -2.229
357 H THR 47 HN THR 47 6.320 -3.210 3.055
358 HA THR 47 HA THR 47 4.763 -0.914 2.772
359 HB THR 47 HB THR 47 5.091 -2.185 4.871
360 HG1 THR 47 HG1 THR 47 4.317 -0.412 5.687
361 HG21 THR 47 HG21 THR 47 7.535 -2.478 4.714
362 HG22 THR 47 HG22 THR 47 7.030 -1.819 6.270
363 HG23 THR 47 HG23 THR 47 7.739 -0.760 5.050
364 H TRP 48 HN TRP 48 6.308 0.849 4.445
365 HA TRP 48 HA TRP 48 6.922 2.764 2.588
366 HB2 TRP 48 HB2 TRP 48 8.125 2.556 5.326
367 HB3 TRP 48 HB1 TRP 48 7.902 4.005 4.383
368 HD1 TRP 48 HD1 TRP 48 5.112 4.445 3.774
369 HE1 TRP 48 HE1 TRP 48 3.187 4.378 5.481
370 HE3 TRP 48 HE3 TRP 48 7.373 1.676 7.428
371 HZ2 TRP 48 HZ2 TRP 48 2.697 3.293 8.047
372 HZ3 TRP 48 HZ3 TRP 48 6.111 1.170 9.476
373 HH2 TRP 48 HH2 TRP 48 3.822 1.964 9.779
374 H GLU 49 HN GLU 49 9.210 0.671 4.303
375 HA GLU 49 HA GLU 49 11.274 1.577 2.435
376 HB2 GLU 49 HB2 GLU 49 11.518 0.425 5.209
377 HB3 GLU 49 HB1 GLU 49 12.883 0.722 4.133
378 HG2 GLU 49 HG2 GLU 49 12.172 3.059 3.978
379 HG3 GLU 49 HG1 GLU 49 10.969 2.745 5.227
380 H SER 50 HN SER 50 12.385 0.154 1.250
381 HA SER 50 HA SER 50 11.322 -2.584 1.250
382 HB2 SER 50 HB2 SER 50 11.086 -1.053 -0.818
383 HB3 SER 50 HB1 SER 50 12.817 -1.309 -1.039
384 HG SER 50 HG SER 50 11.832 -2.905 -2.199
385 HA PRO 51 HA PRO 51 15.121 -3.969 2.911
386 HB2 PRO 51 HB2 PRO 51 14.997 -6.567 2.062
387 HB3 PRO 51 HB1 PRO 51 14.085 -5.928 3.434
388 HG2 PRO 51 HG2 PRO 51 13.202 -6.369 0.610
389 HG3 PRO 51 HG1 PRO 51 12.343 -6.730 2.120
390 HD2 PRO 51 HD2 PRO 51 11.763 -4.557 0.666
391 HD3 PRO 51 HD1 PRO 51 11.728 -4.520 2.441
392 H GLY 52 HN GLY 52 17.000 -5.493 2.243
393 HA2 GLY 52 HA2 GLY 52 18.273 -4.248 0.032
394 HA3 GLY 52 HA1 GLY 52 18.908 -5.596 0.964
395 H ASP 53 HN ASP 53 16.581 -7.303 0.410
396 HA ASP 53 HA ASP 53 17.566 -8.512 -1.948
397 HB2 ASP 53 HB2 ASP 53 15.564 -10.016 -1.738
398 HB3 ASP 53 HB1 ASP 53 16.578 -9.932 -0.304
399 H ASP 54 HN ASP 54 14.976 -6.248 -1.359
400 HA ASP 54 HA ASP 54 14.032 -6.541 -4.112
401 HB2 ASP 54 HB2 ASP 54 12.326 -6.435 -2.356
402 HB3 ASP 54 HB1 ASP 54 12.940 -4.865 -1.846
403 H ALA 55 HN ALA 55 15.440 -4.101 -1.946
404 HA ALA 55 HA ALA 55 16.061 -2.502 -4.338
405 HB1 ALA 55 HB1 ALA 55 15.596 -0.454 -3.088
406 HB2 ALA 55 HB2 ALA 55 15.084 -1.417 -1.700
407 HB3 ALA 55 HB3 ALA 55 14.165 -1.480 -3.204
408 H SER 56 HN SER 56 18.185 -2.930 -4.483
409 HA SER 56 HA SER 56 19.877 -1.635 -2.539
410 HB2 SER 56 HB2 SER 56 19.597 -4.065 -1.772
411 HB3 SER 56 HB1 SER 56 20.490 -4.514 -3.225
412 HG SER 56 HG SER 56 21.652 -4.106 -1.095
Start of MODEL 12
1 H1 GLY 1 HT1 GLY 1 -7.764 7.417 6.748
2 H2 GLY 1 HT2 GLY 1 -6.282 7.715 7.509
3 H3 GLY 1 HT3 GLY 1 -7.453 6.765 8.281
4 HA2 GLY 1 HA1 GLY 1 -5.967 6.075 5.805
5 HA3 GLY 1 HA2 GLY 1 -5.724 5.354 7.389
6 H SER 2 HN SER 2 -7.690 4.297 8.354
7 HA SER 2 HA SER 2 -8.658 2.281 6.671
8 HB2 SER 2 HB2 SER 2 -10.370 2.866 8.976
9 HB3 SER 2 HB1 SER 2 -9.432 1.417 8.604
10 HG SER 2 HG SER 2 -8.760 3.645 10.124
11 H ASP 3 HN ASP 3 -9.691 5.463 7.199
12 HA ASP 3 HA ASP 3 -12.473 5.321 6.996
13 HB2 ASP 3 HB2 ASP 3 -10.756 7.667 6.195
14 HB3 ASP 3 HB1 ASP 3 -12.397 7.699 6.834
15 H LEU 4 HN LEU 4 -10.102 5.114 4.489
16 HA LEU 4 HA LEU 4 -12.074 6.057 2.522
17 HB2 LEU 4 HB2 LEU 4 -9.063 6.008 2.389
18 HB3 LEU 4 HB1 LEU 4 -10.098 6.444 1.043
19 HG LEU 4 HG LEU 4 -9.956 7.914 3.675
20 HD11 LEU 4 HD11 LEU 4 -8.880 9.683 2.390
21 HD12 LEU 4 HD12 LEU 4 -8.902 8.660 0.954
22 HD13 LEU 4 HD13 LEU 4 -7.931 8.197 2.353
23 HD21 LEU 4 HD21 LEU 4 -11.319 9.608 2.526
24 HD22 LEU 4 HD22 LEU 4 -12.164 8.069 2.692
25 HD23 LEU 4 HD23 LEU 4 -11.467 8.528 1.140
26 HA PRO 5 HA PRO 5 -12.509 2.005 0.901
27 HB2 PRO 5 HB2 PRO 5 -13.327 2.687 -1.611
28 HB3 PRO 5 HB1 PRO 5 -14.369 2.788 -0.188
29 HG2 PRO 5 HG2 PRO 5 -12.805 4.952 -1.551
30 HG3 PRO 5 HG1 PRO 5 -14.474 4.987 -0.948
31 HD2 PRO 5 HD2 PRO 5 -12.457 6.076 0.442
32 HD3 PRO 5 HD1 PRO 5 -13.805 5.252 1.251
33 HA PRO 6 HA PRO 6 -8.807 0.897 -1.113
34 HB2 PRO 6 HB2 PRO 6 -9.614 -1.192 -2.692
35 HB3 PRO 6 HB1 PRO 6 -9.372 -1.309 -0.946
36 HG2 PRO 6 HG2 PRO 6 -11.907 -0.937 -2.491
37 HG3 PRO 6 HG1 PRO 6 -11.592 -1.976 -1.086
38 HD2 PRO 6 HD2 PRO 6 -12.856 0.389 -0.854
39 HD3 PRO 6 HD1 PRO 6 -11.757 -0.213 0.407
40 HA PRO 7 HA PRO 7 -8.761 2.797 -5.143
41 HB2 PRO 7 HB2 PRO 7 -5.932 2.473 -5.168
42 HB3 PRO 7 HB1 PRO 7 -6.836 3.915 -4.734
43 HG2 PRO 7 HG2 PRO 7 -5.301 2.433 -2.989
44 HG3 PRO 7 HG1 PRO 7 -6.615 3.522 -2.504
45 HD2 PRO 7 HD2 PRO 7 -6.638 0.545 -2.834
46 HD3 PRO 7 HD1 PRO 7 -7.410 1.549 -1.585
47 H SER 8 HN SER 8 -8.275 2.245 -7.301
48 HA SER 8 HA SER 8 -7.509 -0.505 -7.843
49 HB2 SER 8 HB2 SER 8 -7.961 1.794 -9.772
50 HB3 SER 8 HB1 SER 8 -7.935 0.077 -10.158
51 HG SER 8 HG SER 8 -9.744 0.523 -8.223
52 HA PRO 9 HA PRO 9 -3.382 0.455 -7.533
53 HB2 PRO 9 HB2 PRO 9 -2.128 -1.444 -8.978
54 HB3 PRO 9 HB1 PRO 9 -3.051 -1.814 -7.517
55 HG2 PRO 9 HG2 PRO 9 -3.841 -2.108 -10.387
56 HG3 PRO 9 HG1 PRO 9 -4.142 -3.206 -9.026
57 HD2 PRO 9 HD2 PRO 9 -6.002 -1.455 -10.021
58 HD3 PRO 9 HD1 PRO 9 -5.994 -2.042 -8.346
59 HA PRO 10 HA PRO 10 -1.528 2.567 -11.044
60 HB2 PRO 10 HB2 PRO 10 0.037 4.063 -9.253
61 HB3 PRO 10 HB1 PRO 10 -1.482 4.576 -9.989
62 HG2 PRO 10 HG2 PRO 10 -1.038 4.079 -7.259
63 HG3 PRO 10 HG1 PRO 10 -2.608 4.295 -8.051
64 HD2 PRO 10 HD2 PRO 10 -1.200 1.782 -7.282
65 HD3 PRO 10 HD1 PRO 10 -2.939 2.151 -7.295
66 H ALA 11 HN ALA 11 0.550 2.416 -11.917
67 HA ALA 11 HA ALA 11 2.443 0.587 -10.755
68 HB1 ALA 11 HB1 ALA 11 2.261 0.851 -13.189
69 HB2 ALA 11 HB2 ALA 11 3.884 1.233 -12.622
70 HB3 ALA 11 HB3 ALA 11 2.771 2.534 -13.044
71 H ALA 12 HN ALA 12 1.829 3.966 -10.845
72 HA ALA 12 HA ALA 12 4.251 5.010 -9.909
73 HB1 ALA 12 HB1 ALA 12 2.517 6.341 -11.010
74 HB2 ALA 12 HB2 ALA 12 3.010 7.037 -9.468
75 HB3 ALA 12 HB3 ALA 12 1.487 6.156 -9.589
76 H ALA 13 HN ALA 13 2.083 3.092 -8.237
77 HA ALA 13 HA ALA 13 1.421 4.496 -5.951
78 HB1 ALA 13 HB1 ALA 13 0.818 2.373 -4.975
79 HB2 ALA 13 HB2 ALA 13 1.785 1.520 -6.180
80 HB3 ALA 13 HB3 ALA 13 0.354 2.423 -6.677
81 H THR 14 HN THR 14 4.422 2.814 -6.585
82 HA THR 14 HA THR 14 5.171 2.588 -3.835
83 HB THR 14 HB THR 14 6.036 1.025 -5.504
84 HG1 THR 14 HG1 THR 14 7.394 2.142 -3.583
85 HG21 THR 14 HG21 THR 14 6.251 2.518 -7.406
86 HG22 THR 14 HG22 THR 14 7.799 1.739 -7.072
87 HG23 THR 14 HG23 THR 14 7.531 3.414 -6.587
88 H ILE 15 HN ILE 15 5.430 5.105 -6.204
89 HA ILE 15 HA ILE 15 7.770 6.350 -5.845
90 HB ILE 15 HB ILE 15 6.085 7.084 -7.427
91 HG12 ILE 15 HG12 ILE 15 6.421 9.535 -7.180
92 HG13 ILE 15 HG11 ILE 15 7.094 9.243 -5.582
93 HG21 ILE 15 HG21 ILE 15 4.089 6.985 -6.031
94 HG22 ILE 15 HG22 ILE 15 4.247 8.553 -6.820
95 HG23 ILE 15 HG23 ILE 15 4.657 8.380 -5.114
96 HD11 ILE 15 HD11 ILE 15 8.724 9.523 -7.497
97 HD12 ILE 15 HD12 ILE 15 8.172 7.930 -8.029
98 HD13 ILE 15 HD13 ILE 15 8.941 8.117 -6.455
99 H VAL 16 HN VAL 16 4.999 7.671 -3.986
100 HA VAL 16 HA VAL 16 6.849 8.136 -1.743
101 HB VAL 16 HB VAL 16 4.584 9.994 -2.430
102 HG11 VAL 16 HG11 VAL 16 7.063 10.688 -0.917
103 HG12 VAL 16 HG12 VAL 16 5.773 9.789 -0.127
104 HG13 VAL 16 HG13 VAL 16 5.446 11.389 -0.800
105 HG21 VAL 16 HG21 VAL 16 6.103 11.470 -3.534
106 HG22 VAL 16 HG22 VAL 16 6.249 9.881 -4.290
107 HG23 VAL 16 HG23 VAL 16 7.475 10.433 -3.149
108 H LEU 17 HN LEU 17 6.093 7.657 0.248
109 HA LEU 17 HA LEU 17 3.358 6.601 0.361
110 HB2 LEU 17 HB2 LEU 17 5.243 4.928 0.211
111 HB3 LEU 17 HB1 LEU 17 5.753 5.453 1.784
112 HG LEU 17 HG LEU 17 2.966 4.439 1.395
113 HD11 LEU 17 HD11 LEU 17 5.246 2.646 2.135
114 HD12 LEU 17 HD12 LEU 17 4.808 2.890 0.449
115 HD13 LEU 17 HD13 LEU 17 3.626 2.217 1.575
116 HD21 LEU 17 HD21 LEU 17 2.997 4.205 3.674
117 HD22 LEU 17 HD22 LEU 17 4.092 5.576 3.466
118 HD23 LEU 17 HD23 LEU 17 4.745 3.963 3.729
119 HA PRO 18 HA PRO 18 3.271 9.055 4.103
120 HB2 PRO 18 HB2 PRO 18 0.593 9.327 4.137
121 HB3 PRO 18 HB1 PRO 18 1.612 10.215 3.002
122 HG2 PRO 18 HG2 PRO 18 -0.251 8.008 2.493
123 HG3 PRO 18 HG1 PRO 18 0.449 9.167 1.354
124 HD2 PRO 18 HD2 PRO 18 1.292 6.447 1.939
125 HD3 PRO 18 HD1 PRO 18 1.855 7.538 0.655
126 HA PRO 19 HA PRO 19 2.710 5.894 7.193
127 HB2 PRO 19 HB2 PRO 19 2.005 8.308 8.794
128 HB3 PRO 19 HB1 PRO 19 3.112 7.004 9.166
129 HG2 PRO 19 HG2 PRO 19 4.134 9.259 8.399
130 HG3 PRO 19 HG1 PRO 19 4.722 7.771 7.621
131 HD2 PRO 19 HD2 PRO 19 2.655 9.698 6.645
132 HD3 PRO 19 HD1 PRO 19 4.060 9.070 5.766
133 H ASN 20 HN ASN 20 0.375 8.302 6.537
134 HA ASN 20 HA ASN 20 -1.832 7.517 8.028
135 HB2 ASN 20 HB2 ASN 20 -1.873 8.617 5.215
136 HB3 ASN 20 HB1 ASN 20 -3.209 8.634 6.352
137 HD21 ASN 20 HD21 ASN 20 -3.405 10.821 6.175
138 HD22 ASN 20 HD22 ASN 20 -2.266 11.927 6.845
139 H TRP 21 HN TRP 21 -0.318 5.709 5.583
140 HA TRP 21 HA TRP 21 -2.680 4.761 4.288
141 HB2 TRP 21 HB2 TRP 21 -1.249 3.624 2.827
142 HB3 TRP 21 HB1 TRP 21 -0.312 5.040 3.278
143 HD1 TRP 21 HD1 TRP 21 0.957 4.017 6.006
144 HE1 TRP 21 HE1 TRP 21 2.706 2.127 5.972
145 HE3 TRP 21 HE3 TRP 21 -0.153 1.973 1.457
146 HZ2 TRP 21 HZ2 TRP 21 3.520 0.054 4.226
147 HZ3 TRP 21 HZ3 TRP 21 1.162 0.049 0.672
148 HH2 TRP 21 HH2 TRP 21 2.961 -0.888 2.030
149 H LYS 22 HN LYS 22 -3.193 2.465 4.169
150 HA LYS 22 HA LYS 22 -2.731 1.159 6.755
151 HB2 LYS 22 HB2 LYS 22 -5.382 1.680 5.464
152 HB3 LYS 22 HB1 LYS 22 -5.154 0.474 6.706
153 HG2 LYS 22 HG2 LYS 22 -4.475 3.368 7.038
154 HG3 LYS 22 HG1 LYS 22 -5.993 2.625 7.570
155 HD2 LYS 22 HD2 LYS 22 -3.280 1.654 8.427
156 HD3 LYS 22 HD1 LYS 22 -4.213 2.825 9.349
157 HE2 LYS 22 HE2 LYS 22 -5.167 0.095 8.579
158 HE3 LYS 22 HE1 LYS 22 -4.403 0.458 10.113
159 HZ1 LYS 22 HZ1 LYS 22 -6.867 0.429 10.190
160 HZ2 LYS 22 HZ2 LYS 22 -6.884 1.780 9.171
161 HZ3 LYS 22 HZ3 LYS 22 -6.186 1.893 10.708
162 H THR 23 HN THR 23 -3.743 -0.993 6.794
163 HA THR 23 HA THR 23 -3.280 -2.448 4.300
164 HB THR 23 HB THR 23 -2.479 -4.310 5.906
165 HG1 THR 23 HG1 THR 23 -1.800 -2.077 7.530
166 HG21 THR 23 HG21 THR 23 -1.128 -1.943 4.882
167 HG22 THR 23 HG22 THR 23 -0.770 -3.648 4.610
168 HG23 THR 23 HG23 THR 23 -0.222 -2.849 6.089
169 H ALA 24 HN ALA 24 -4.905 -3.674 3.720
170 HA ALA 24 HA ALA 24 -6.679 -4.856 5.685
171 HB1 ALA 24 HB1 ALA 24 -8.629 -3.792 5.127
172 HB2 ALA 24 HB2 ALA 24 -8.055 -3.364 3.523
173 HB3 ALA 24 HB3 ALA 24 -7.490 -2.457 4.927
174 H ARG 25 HN ARG 25 -8.424 -6.136 4.450
175 HA ARG 25 HA ARG 25 -7.245 -7.263 2.031
176 HB2 ARG 25 HB2 ARG 25 -8.526 -8.910 4.175
177 HB3 ARG 25 HB1 ARG 25 -7.619 -9.462 2.810
178 HG2 ARG 25 HG2 ARG 25 -5.593 -8.498 3.797
179 HG3 ARG 25 HG1 ARG 25 -6.545 -8.018 5.206
180 HD2 ARG 25 HD2 ARG 25 -6.033 -10.809 4.211
181 HD3 ARG 25 HD1 ARG 25 -5.430 -10.086 5.701
182 HE ARG 25 HE ARG 25 -8.237 -9.987 5.704
183 HH11 ARG 25 HH11 ARG 25 -5.653 -12.336 5.909
184 HH12 ARG 25 HH12 ARG 25 -6.572 -13.440 6.886
185 HH21 ARG 25 HH21 ARG 25 -9.464 -11.451 6.926
186 HH22 ARG 25 HH22 ARG 25 -8.745 -12.951 7.451
187 H ASP 26 HN ASP 26 -8.759 -8.410 0.705
188 HA ASP 26 HA ASP 26 -11.356 -7.259 0.516
189 HB2 ASP 26 HB2 ASP 26 -10.244 -9.754 -0.793
190 HB3 ASP 26 HB1 ASP 26 -11.753 -8.975 -1.225
191 HA PRO 27 HA PRO 27 -14.152 -9.648 2.838
192 HB2 PRO 27 HB2 PRO 27 -15.358 -11.101 0.714
193 HB3 PRO 27 HB1 PRO 27 -16.003 -9.700 1.556
194 HG2 PRO 27 HG2 PRO 27 -14.539 -9.882 -1.008
195 HG3 PRO 27 HG1 PRO 27 -15.718 -8.669 -0.463
196 HD2 PRO 27 HD2 PRO 27 -13.122 -8.139 -0.634
197 HD3 PRO 27 HD1 PRO 27 -14.101 -7.459 0.677
198 H GLU 28 HN GLU 28 -12.598 -11.488 0.219
199 HA GLU 28 HA GLU 28 -12.723 -13.897 1.856
200 HB2 GLU 28 HB2 GLU 28 -11.971 -13.472 -1.025
201 HB3 GLU 28 HB1 GLU 28 -11.873 -15.029 -0.208
202 HG2 GLU 28 HG2 GLU 28 -14.377 -13.398 -0.370
203 HG3 GLU 28 HG1 GLU 28 -13.956 -14.645 -1.546
204 H GLY 29 HN GLY 29 -11.041 -11.940 2.824
205 HA2 GLY 29 HA2 GLY 29 -9.053 -11.892 3.930
206 HA3 GLY 29 HA1 GLY 29 -8.902 -13.587 3.533
207 H LYS 30 HN LYS 30 -9.022 -11.786 0.646
208 HA LYS 30 HA LYS 30 -6.207 -12.188 0.218
209 HB2 LYS 30 HB2 LYS 30 -8.031 -12.272 -1.571
210 HB3 LYS 30 HB1 LYS 30 -8.069 -10.519 -1.485
211 HG2 LYS 30 HG2 LYS 30 -5.522 -11.990 -2.059
212 HG3 LYS 30 HG1 LYS 30 -6.684 -11.627 -3.332
213 HD2 LYS 30 HD2 LYS 30 -6.092 -9.313 -1.678
214 HD3 LYS 30 HD1 LYS 30 -4.650 -9.978 -2.443
215 HE2 LYS 30 HE2 LYS 30 -5.666 -8.272 -3.849
216 HE3 LYS 30 HE1 LYS 30 -5.748 -9.853 -4.623
217 HZ1 LYS 30 HZ1 LYS 30 -7.987 -8.562 -3.148
218 HZ2 LYS 30 HZ2 LYS 30 -8.053 -10.036 -3.992
219 HZ3 LYS 30 HZ3 LYS 30 -7.812 -8.586 -4.839
220 H ILE 31 HN ILE 31 -4.568 -10.641 0.330
221 HA ILE 31 HA ILE 31 -5.357 -8.349 2.003
222 HB ILE 31 HB ILE 31 -3.877 -9.829 3.138
223 HG12 ILE 31 HG12 ILE 31 -1.777 -8.298 3.269
224 HG13 ILE 31 HG11 ILE 31 -2.667 -7.260 2.186
225 HG21 ILE 31 HG21 ILE 31 -2.917 -11.035 1.294
226 HG22 ILE 31 HG22 ILE 31 -1.621 -10.370 2.291
227 HG23 ILE 31 HG23 ILE 31 -2.044 -9.601 0.761
228 HD11 ILE 31 HD11 ILE 31 -3.522 -8.133 4.924
229 HD12 ILE 31 HD12 ILE 31 -4.466 -7.141 3.816
230 HD13 ILE 31 HD13 ILE 31 -2.940 -6.534 4.454
231 H TYR 32 HN TYR 32 -4.713 -6.263 1.508
232 HA TYR 32 HA TYR 32 -2.825 -5.831 -0.675
233 HB2 TYR 32 HB2 TYR 32 -4.283 -4.246 -1.833
234 HB3 TYR 32 HB1 TYR 32 -5.019 -5.844 -1.780
235 HD1 TYR 32 HD2 TYR 32 -7.002 -6.253 -0.402
236 HD2 TYR 32 HD1 TYR 32 -5.280 -2.369 -0.657
237 HE1 TYR 32 HE2 TYR 32 -9.040 -5.289 0.572
238 HE2 TYR 32 HE1 TYR 32 -7.316 -1.400 0.328
239 HH TYR 32 HH TYR 32 -9.746 -2.005 0.545
240 H TYR 33 HN TYR 33 -2.692 -3.255 -0.941
241 HA TYR 33 HA TYR 33 -2.440 -2.050 1.732
242 HB2 TYR 33 HB2 TYR 33 -0.398 -2.205 -0.475
243 HB3 TYR 33 HB1 TYR 33 -0.254 -1.113 0.871
244 HD1 TYR 33 HD1 TYR 33 -0.451 -4.725 0.008
245 HD2 TYR 33 HD2 TYR 33 0.747 -1.826 2.877
246 HE1 TYR 33 HE1 TYR 33 0.702 -6.478 1.290
247 HE2 TYR 33 HE2 TYR 33 1.899 -3.570 4.169
248 HH TYR 33 HH TYR 33 1.790 -6.008 4.467
249 H TYR 34 HN TYR 34 -2.978 0.166 1.758
250 HA TYR 34 HA TYR 34 -3.282 1.441 -0.845
251 HB2 TYR 34 HB2 TYR 34 -5.544 2.223 -0.411
252 HB3 TYR 34 HB1 TYR 34 -5.464 0.472 -0.461
253 HD1 TYR 34 HD1 TYR 34 -5.545 -0.802 1.697
254 HD2 TYR 34 HD2 TYR 34 -6.388 3.358 1.470
255 HE1 TYR 34 HE1 TYR 34 -6.644 -0.912 3.887
256 HE2 TYR 34 HE2 TYR 34 -7.497 3.260 3.663
257 HH TYR 34 HH TYR 34 -7.186 0.603 5.738
258 H HIS 35 HN HIS 35 -3.074 3.544 -0.986
259 HA HIS 35 HA HIS 35 -2.077 4.915 1.410
260 HB2 HIS 35 HB2 HIS 35 -1.713 5.606 -1.524
261 HB3 HIS 35 HB1 HIS 35 -0.886 6.343 -0.177
262 HD1 HIS 35 HD1 HIS 35 -1.150 2.850 -1.684
263 HD2 HIS 35 HD2 HIS 35 1.645 5.394 0.042
264 HE1 HIS 35 HE1 HIS 35 1.052 1.654 -1.870
265 HE2 HIS 35 HE2 HIS 35 2.746 3.328 -1.056
266 H VAL 36 HN VAL 36 -3.321 6.515 2.171
267 HA VAL 36 HA VAL 36 -5.787 7.103 0.861
268 HB VAL 36 HB VAL 36 -6.065 8.552 2.971
269 HG11 VAL 36 HG11 VAL 36 -5.515 5.736 3.720
270 HG12 VAL 36 HG12 VAL 36 -6.657 6.012 2.412
271 HG13 VAL 36 HG13 VAL 36 -6.957 6.715 4.004
272 HG21 VAL 36 HG21 VAL 36 -3.776 8.834 3.590
273 HG22 VAL 36 HG22 VAL 36 -3.488 7.089 3.523
274 HG23 VAL 36 HG23 VAL 36 -4.513 7.773 4.796
275 H ILE 37 HN ILE 37 -2.842 9.021 1.586
276 HA ILE 37 HA ILE 37 -3.932 11.479 0.726
277 HB ILE 37 HB ILE 37 -1.104 10.519 1.029
278 HG12 ILE 37 HG12 ILE 37 -1.159 12.524 2.653
279 HG13 ILE 37 HG11 ILE 37 -2.899 12.442 2.422
280 HG21 ILE 37 HG21 ILE 37 -1.059 12.012 -0.890
281 HG22 ILE 37 HG22 ILE 37 -0.306 12.781 0.506
282 HG23 ILE 37 HG23 ILE 37 -1.940 13.237 0.026
283 HD11 ILE 37 HD11 ILE 37 -1.277 10.118 3.353
284 HD12 ILE 37 HD12 ILE 37 -3.029 10.308 3.351
285 HD13 ILE 37 HD13 ILE 37 -2.042 11.279 4.437
286 H THR 38 HN THR 38 -1.689 9.272 -0.854
287 HA THR 38 HA THR 38 -1.844 10.654 -3.337
288 HB THR 38 HB THR 38 -0.395 8.731 -4.144
289 HG1 THR 38 HG1 THR 38 0.403 7.353 -2.576
290 HG21 THR 38 HG21 THR 38 0.401 10.440 -1.795
291 HG22 THR 38 HG22 THR 38 0.602 10.814 -3.509
292 HG23 THR 38 HG23 THR 38 1.553 9.524 -2.769
293 H ARG 39 HN ARG 39 -3.618 8.156 -1.904
294 HA ARG 39 HA ARG 39 -5.346 6.873 -2.564
295 HB2 ARG 39 HB2 ARG 39 -5.266 8.615 -4.966
296 HB3 ARG 39 HB1 ARG 39 -6.505 7.415 -4.697
297 HG2 ARG 39 HG2 ARG 39 -5.901 9.648 -2.797
298 HG3 ARG 39 HG1 ARG 39 -7.134 9.742 -4.064
299 HD2 ARG 39 HD2 ARG 39 -7.023 7.508 -2.104
300 HD3 ARG 39 HD1 ARG 39 -7.877 9.007 -1.722
301 HE ARG 39 HE ARG 39 -8.544 7.268 -4.028
302 HH11 ARG 39 HH11 ARG 39 -9.475 9.330 -1.352
303 HH12 ARG 39 HH12 ARG 39 -11.183 9.141 -1.639
304 HH21 ARG 39 HH21 ARG 39 -10.792 7.010 -4.400
305 HH22 ARG 39 HH22 ARG 39 -11.927 7.834 -3.368
306 H GLN 40 HN GLN 40 -2.919 5.717 -2.776
307 HA GLN 40 HA GLN 40 -2.942 4.363 -5.379
308 HB2 GLN 40 HB2 GLN 40 -0.655 4.865 -3.524
309 HB3 GLN 40 HB1 GLN 40 -0.539 4.078 -5.080
310 HG2 GLN 40 HG2 GLN 40 -1.135 6.114 -6.164
311 HG3 GLN 40 HG1 GLN 40 -1.425 6.913 -4.636
312 HE21 GLN 40 HE21 GLN 40 0.362 7.556 -6.850
313 HE22 GLN 40 HE22 GLN 40 1.942 7.622 -6.160
314 H THR 41 HN THR 41 -2.032 2.140 -5.271
315 HA THR 41 HA THR 41 -2.267 0.842 -2.705
316 HB THR 41 HB THR 41 -4.476 0.476 -3.182
317 HG1 THR 41 HG1 THR 41 -4.333 -1.704 -4.579
318 HG21 THR 41 HG21 THR 41 -4.445 1.617 -5.297
319 HG22 THR 41 HG22 THR 41 -5.384 0.125 -5.408
320 HG23 THR 41 HG23 THR 41 -3.755 0.197 -6.088
321 H GLN 42 HN GLN 42 -1.012 -1.027 -2.562
322 HA GLN 42 HA GLN 42 0.169 -1.982 -5.056
323 HB2 GLN 42 HB2 GLN 42 2.446 -1.815 -4.205
324 HB3 GLN 42 HB1 GLN 42 1.688 -0.230 -4.254
325 HG2 GLN 42 HG2 GLN 42 1.192 -0.525 -1.802
326 HG3 GLN 42 HG1 GLN 42 2.239 -1.943 -1.851
327 HE21 GLN 42 HE21 GLN 42 3.794 -1.140 -0.523
328 HE22 GLN 42 HE22 GLN 42 4.850 0.157 -0.972
329 H TRP 43 HN TRP 43 0.217 -4.092 -5.113
330 HA TRP 43 HA TRP 43 -0.206 -5.614 -2.651
331 HB2 TRP 43 HB2 TRP 43 -1.630 -6.078 -4.624
332 HB3 TRP 43 HB1 TRP 43 -0.199 -6.525 -5.544
333 HD1 TRP 43 HD1 TRP 43 -2.311 -7.746 -2.559
334 HE1 TRP 43 HE1 TRP 43 -1.974 -10.288 -2.312
335 HE3 TRP 43 HE3 TRP 43 1.315 -8.416 -6.094
336 HZ2 TRP 43 HZ2 TRP 43 -0.371 -12.304 -3.470
337 HZ3 TRP 43 HZ3 TRP 43 2.198 -10.681 -6.466
338 HH2 TRP 43 HH2 TRP 43 1.372 -12.587 -5.178
339 H ASP 44 HN ASP 44 2.127 -5.101 -5.207
340 HA ASP 44 HA ASP 44 3.869 -7.173 -4.063
341 HB2 ASP 44 HB2 ASP 44 3.140 -7.534 -6.390
342 HB3 ASP 44 HB1 ASP 44 3.909 -6.020 -6.854
343 HA PRO 45 HA PRO 45 6.785 -3.262 -4.977
344 HB2 PRO 45 HB2 PRO 45 4.742 -1.198 -4.302
345 HB3 PRO 45 HB1 PRO 45 6.074 -1.133 -5.463
346 HG2 PRO 45 HG2 PRO 45 3.587 -1.453 -6.316
347 HG3 PRO 45 HG1 PRO 45 4.918 -2.360 -7.062
348 HD2 PRO 45 HD2 PRO 45 2.868 -3.284 -5.088
349 HD3 PRO 45 HD1 PRO 45 3.539 -4.130 -6.496
350 HA PRO 46 HA PRO 46 7.450 -3.325 -0.604
351 HB2 PRO 46 HB2 PRO 46 9.639 -1.442 -1.113
352 HB3 PRO 46 HB1 PRO 46 9.696 -3.089 -0.479
353 HG2 PRO 46 HG2 PRO 46 10.562 -2.496 -2.929
354 HG3 PRO 46 HG1 PRO 46 9.762 -4.035 -2.580
355 HD2 PRO 46 HD2 PRO 46 8.648 -1.568 -3.872
356 HD3 PRO 46 HD1 PRO 46 8.421 -3.271 -4.324
357 H THR 47 HN THR 47 7.599 -1.946 1.229
358 HA THR 47 HA THR 47 5.797 0.257 1.072
359 HB THR 47 HB THR 47 5.915 -1.324 2.999
360 HG1 THR 47 HG1 THR 47 5.347 0.196 4.453
361 HG21 THR 47 HG21 THR 47 8.410 -1.386 3.101
362 HG22 THR 47 HG22 THR 47 7.619 -1.161 4.658
363 HG23 THR 47 HG23 THR 47 8.359 0.213 3.835
364 H TRP 48 HN TRP 48 6.868 1.871 3.072
365 HA TRP 48 HA TRP 48 8.261 3.774 1.467
366 HB2 TRP 48 HB2 TRP 48 6.677 4.348 3.312
367 HB3 TRP 48 HB1 TRP 48 7.891 3.802 4.451
368 HD1 TRP 48 HD1 TRP 48 7.468 6.521 1.732
369 HE1 TRP 48 HE1 TRP 48 8.906 8.549 2.406
370 HE3 TRP 48 HE3 TRP 48 9.698 4.582 5.907
371 HZ2 TRP 48 HZ2 TRP 48 10.736 9.236 4.443
372 HZ3 TRP 48 HZ3 TRP 48 11.278 5.991 7.161
373 HH2 TRP 48 HH2 TRP 48 11.785 8.267 6.445
374 H GLU 49 HN GLU 49 9.198 1.410 3.797
375 HA GLU 49 HA GLU 49 11.958 2.333 3.749
376 HB2 GLU 49 HB2 GLU 49 10.284 1.519 5.807
377 HB3 GLU 49 HB1 GLU 49 11.332 0.130 5.541
378 HG2 GLU 49 HG2 GLU 49 12.274 2.922 5.903
379 HG3 GLU 49 HG1 GLU 49 12.150 1.760 7.226
380 H SER 50 HN SER 50 13.336 1.298 2.516
381 HA SER 50 HA SER 50 12.659 -1.410 1.585
382 HB2 SER 50 HB2 SER 50 14.403 0.666 0.227
383 HB3 SER 50 HB1 SER 50 13.914 -0.892 -0.441
384 HG SER 50 HG SER 50 11.757 0.514 0.374
385 HA PRO 51 HA PRO 51 16.124 -2.838 3.935
386 HB2 PRO 51 HB2 PRO 51 16.525 -5.188 2.587
387 HB3 PRO 51 HB1 PRO 51 15.266 -4.950 3.804
388 HG2 PRO 51 HG2 PRO 51 15.062 -4.825 0.820
389 HG3 PRO 51 HG1 PRO 51 13.961 -5.584 1.987
390 HD2 PRO 51 HD2 PRO 51 13.412 -3.192 0.901
391 HD3 PRO 51 HD1 PRO 51 13.010 -3.552 2.595
392 H GLY 52 HN GLY 52 18.321 -3.791 3.572
393 HA2 GLY 52 HA2 GLY 52 19.787 -2.143 1.797
394 HA3 GLY 52 HA1 GLY 52 20.433 -3.496 2.717
395 H ASP 53 HN ASP 53 18.398 -5.306 1.492
396 HA ASP 53 HA ASP 53 19.903 -6.151 -0.756
397 HB2 ASP 53 HB2 ASP 53 17.168 -6.978 0.219
398 HB3 ASP 53 HB1 ASP 53 17.996 -7.743 -1.133
399 H ASP 54 HN ASP 54 17.140 -4.078 -0.369
400 HA ASP 54 HA ASP 54 16.603 -4.119 -3.244
401 HB2 ASP 54 HB2 ASP 54 14.679 -4.333 -1.719
402 HB3 ASP 54 HB1 ASP 54 15.073 -2.771 -1.006
403 H ALA 55 HN ALA 55 17.502 -1.865 -0.654
404 HA ALA 55 HA ALA 55 18.128 0.127 -2.735
405 HB1 ALA 55 HB1 ALA 55 17.089 0.692 0.039
406 HB2 ALA 55 HB2 ALA 55 16.145 0.774 -1.449
407 HB3 ALA 55 HB3 ALA 55 17.485 1.892 -1.193
408 H SER 56 HN SER 56 20.234 0.326 -2.915
409 HA SER 56 HA SER 56 21.790 1.112 -0.617
410 HB2 SER 56 HB2 SER 56 22.534 -1.334 -2.241
411 HB3 SER 56 HB1 SER 56 23.641 -0.501 -1.149
412 HG SER 56 HG SER 56 21.158 -1.230 -0.121
Start of MODEL 13
1 H1 GLY 1 HT1 GLY 1 -6.445 8.019 6.984
2 H2 GLY 1 HT2 GLY 1 -8.024 7.532 7.367
3 H3 GLY 1 HT3 GLY 1 -7.576 7.767 5.750
4 HA2 GLY 1 HA1 GLY 1 -6.053 5.918 5.835
5 HA3 GLY 1 HA2 GLY 1 -6.430 5.693 7.538
6 H SER 2 HN SER 2 -8.334 4.727 8.140
7 HA SER 2 HA SER 2 -9.543 2.864 6.434
8 HB2 SER 2 HB2 SER 2 -9.488 2.987 9.021
9 HB3 SER 2 HB1 SER 2 -10.906 4.021 8.861
10 HG SER 2 HG SER 2 -11.995 2.322 7.851
11 H ASP 3 HN ASP 3 -10.020 6.183 6.825
12 HA ASP 3 HA ASP 3 -12.744 6.551 6.340
13 HB2 ASP 3 HB2 ASP 3 -10.583 8.487 5.517
14 HB3 ASP 3 HB1 ASP 3 -12.216 8.844 6.073
15 H LEU 4 HN LEU 4 -10.211 5.715 4.117
16 HA LEU 4 HA LEU 4 -11.812 6.656 1.862
17 HB2 LEU 4 HB2 LEU 4 -9.763 7.731 1.717
18 HB3 LEU 4 HB1 LEU 4 -8.884 6.351 2.358
19 HG LEU 4 HG LEU 4 -9.594 5.175 0.221
20 HD11 LEU 4 HD11 LEU 4 -9.880 6.641 -1.730
21 HD12 LEU 4 HD12 LEU 4 -9.923 8.039 -0.656
22 HD13 LEU 4 HD13 LEU 4 -11.195 6.820 -0.569
23 HD21 LEU 4 HD21 LEU 4 -7.625 6.024 -0.975
24 HD22 LEU 4 HD22 LEU 4 -7.295 5.751 0.736
25 HD23 LEU 4 HD23 LEU 4 -7.556 7.389 0.138
26 HA PRO 5 HA PRO 5 -12.568 2.327 0.894
27 HB2 PRO 5 HB2 PRO 5 -13.494 2.814 -1.641
28 HB3 PRO 5 HB1 PRO 5 -14.484 2.981 -0.187
29 HG2 PRO 5 HG2 PRO 5 -13.047 5.085 -1.756
30 HG3 PRO 5 HG1 PRO 5 -14.676 5.128 -1.055
31 HD2 PRO 5 HD2 PRO 5 -12.602 6.352 0.129
32 HD3 PRO 5 HD1 PRO 5 -13.882 5.563 1.078
33 HA PRO 6 HA PRO 6 -8.881 1.198 -1.122
34 HB2 PRO 6 HB2 PRO 6 -9.570 -1.151 -2.332
35 HB3 PRO 6 HB1 PRO 6 -9.300 -0.985 -0.594
36 HG2 PRO 6 HG2 PRO 6 -11.875 -1.025 -2.115
37 HG3 PRO 6 HG1 PRO 6 -11.471 -1.807 -0.576
38 HD2 PRO 6 HD2 PRO 6 -12.886 0.490 -0.702
39 HD3 PRO 6 HD1 PRO 6 -11.769 0.134 0.632
40 HA PRO 7 HA PRO 7 -9.108 2.455 -5.398
41 HB2 PRO 7 HB2 PRO 7 -6.251 2.359 -5.425
42 HB3 PRO 7 HB1 PRO 7 -7.274 3.778 -5.291
43 HG2 PRO 7 HG2 PRO 7 -5.632 2.874 -3.292
44 HG3 PRO 7 HG1 PRO 7 -7.083 3.857 -3.020
45 HD2 PRO 7 HD2 PRO 7 -6.732 0.889 -2.780
46 HD3 PRO 7 HD1 PRO 7 -7.618 2.009 -1.718
47 H SER 8 HN SER 8 -8.673 1.549 -7.441
48 HA SER 8 HA SER 8 -7.492 -1.108 -7.522
49 HB2 SER 8 HB2 SER 8 -8.384 0.730 -9.770
50 HB3 SER 8 HB1 SER 8 -8.001 -0.983 -9.912
51 HG SER 8 HG SER 8 -9.896 -0.401 -8.000
52 HA PRO 9 HA PRO 9 -3.593 0.493 -7.442
53 HB2 PRO 9 HB2 PRO 9 -2.030 -1.346 -8.646
54 HB3 PRO 9 HB1 PRO 9 -2.900 -1.670 -7.142
55 HG2 PRO 9 HG2 PRO 9 -3.608 -2.442 -9.947
56 HG3 PRO 9 HG1 PRO 9 -3.724 -3.397 -8.456
57 HD2 PRO 9 HD2 PRO 9 -5.855 -2.133 -9.611
58 HD3 PRO 9 HD1 PRO 9 -5.739 -2.465 -7.872
59 HA PRO 10 HA PRO 10 -2.057 2.451 -11.197
60 HB2 PRO 10 HB2 PRO 10 -0.695 4.326 -9.615
61 HB3 PRO 10 HB1 PRO 10 -2.278 4.545 -10.360
62 HG2 PRO 10 HG2 PRO 10 -1.724 4.401 -7.603
63 HG3 PRO 10 HG1 PRO 10 -3.321 4.354 -8.366
64 HD2 PRO 10 HD2 PRO 10 -1.636 2.116 -7.360
65 HD3 PRO 10 HD1 PRO 10 -3.405 2.265 -7.415
66 H ALA 11 HN ALA 11 0.078 2.568 -12.067
67 HA ALA 11 HA ALA 11 2.049 0.826 -11.032
68 HB1 ALA 11 HB1 ALA 11 1.929 1.448 -13.399
69 HB2 ALA 11 HB2 ALA 11 3.524 1.771 -12.722
70 HB3 ALA 11 HB3 ALA 11 2.394 3.100 -12.990
71 H ALA 12 HN ALA 12 1.410 4.219 -10.623
72 HA ALA 12 HA ALA 12 3.808 5.050 -9.444
73 HB1 ALA 12 HB1 ALA 12 1.056 6.171 -8.997
74 HB2 ALA 12 HB2 ALA 12 2.129 6.586 -10.332
75 HB3 ALA 12 HB3 ALA 12 2.585 6.989 -8.677
76 H ALA 13 HN ALA 13 1.486 2.990 -8.187
77 HA ALA 13 HA ALA 13 1.004 3.904 -5.617
78 HB1 ALA 13 HB1 ALA 13 -0.265 2.143 -6.750
79 HB2 ALA 13 HB2 ALA 13 0.219 1.691 -5.115
80 HB3 ALA 13 HB3 ALA 13 1.086 1.037 -6.507
81 H THR 14 HN THR 14 3.796 2.210 -6.794
82 HA THR 14 HA THR 14 4.627 1.142 -4.289
83 HB THR 14 HB THR 14 5.328 0.100 -6.381
84 HG1 THR 14 HG1 THR 14 7.118 0.966 -4.451
85 HG21 THR 14 HG21 THR 14 6.933 2.619 -6.832
86 HG22 THR 14 HG22 THR 14 5.534 2.095 -7.770
87 HG23 THR 14 HG23 THR 14 7.026 1.155 -7.809
88 H ILE 15 HN ILE 15 4.946 4.249 -5.750
89 HA ILE 15 HA ILE 15 7.422 5.061 -4.702
90 HB ILE 15 HB ILE 15 5.990 6.067 -6.599
91 HG12 ILE 15 HG12 ILE 15 7.045 8.269 -6.324
92 HG13 ILE 15 HG11 ILE 15 7.399 7.889 -4.639
93 HG21 ILE 15 HG21 ILE 15 3.968 6.520 -5.393
94 HG22 ILE 15 HG22 ILE 15 4.669 8.042 -5.945
95 HG23 ILE 15 HG23 ILE 15 4.830 7.558 -4.258
96 HD11 ILE 15 HD11 ILE 15 9.327 7.609 -6.164
97 HD12 ILE 15 HD12 ILE 15 8.428 6.332 -6.989
98 HD13 ILE 15 HD13 ILE 15 8.888 6.135 -5.299
99 H VAL 16 HN VAL 16 6.814 7.541 -3.526
100 HA VAL 16 HA VAL 16 7.252 7.074 -0.915
101 HB VAL 16 HB VAL 16 5.675 9.439 -1.898
102 HG11 VAL 16 HG11 VAL 16 6.963 10.594 -0.064
103 HG12 VAL 16 HG12 VAL 16 7.412 8.985 0.509
104 HG13 VAL 16 HG13 VAL 16 5.715 9.464 0.464
105 HG21 VAL 16 HG21 VAL 16 7.485 9.395 -3.330
106 HG22 VAL 16 HG22 VAL 16 8.556 8.770 -2.089
107 HG23 VAL 16 HG23 VAL 16 8.030 10.449 -2.024
108 H LEU 17 HN LEU 17 6.229 6.817 0.939
109 HA LEU 17 HA LEU 17 3.338 6.319 0.825
110 HB2 LEU 17 HB2 LEU 17 4.815 4.299 0.812
111 HB3 LEU 17 HB1 LEU 17 5.408 4.774 2.376
112 HG LEU 17 HG LEU 17 2.471 4.403 2.057
113 HD11 LEU 17 HD11 LEU 17 2.710 2.009 2.528
114 HD12 LEU 17 HD12 LEU 17 4.459 2.148 2.349
115 HD13 LEU 17 HD13 LEU 17 3.405 2.430 0.963
116 HD21 LEU 17 HD21 LEU 17 2.549 4.086 4.331
117 HD22 LEU 17 HD22 LEU 17 3.893 5.204 4.067
118 HD23 LEU 17 HD23 LEU 17 4.211 3.487 4.293
119 HA PRO 18 HA PRO 18 3.503 8.884 4.498
120 HB2 PRO 18 HB2 PRO 18 0.901 9.554 4.477
121 HB3 PRO 18 HB1 PRO 18 2.037 10.206 3.293
122 HG2 PRO 18 HG2 PRO 18 -0.099 8.207 2.938
123 HG3 PRO 18 HG1 PRO 18 0.671 9.257 1.738
124 HD2 PRO 18 HD2 PRO 18 1.229 6.489 2.315
125 HD3 PRO 18 HD1 PRO 18 1.961 7.523 1.073
126 HA PRO 19 HA PRO 19 2.401 6.127 7.829
127 HB2 PRO 19 HB2 PRO 19 1.739 8.720 9.104
128 HB3 PRO 19 HB1 PRO 19 2.702 7.401 9.729
129 HG2 PRO 19 HG2 PRO 19 3.931 9.495 8.869
130 HG3 PRO 19 HG1 PRO 19 4.504 7.909 8.311
131 HD2 PRO 19 HD2 PRO 19 2.750 9.882 6.885
132 HD3 PRO 19 HD1 PRO 19 4.147 8.983 6.275
133 H ASN 20 HN ASN 20 0.291 8.567 6.671
134 HA ASN 20 HA ASN 20 -2.090 7.965 8.021
135 HB2 ASN 20 HB2 ASN 20 -1.643 9.090 5.258
136 HB3 ASN 20 HB1 ASN 20 -3.211 9.022 6.047
137 HD21 ASN 20 HD21 ASN 20 -3.343 11.255 5.816
138 HD22 ASN 20 HD22 ASN 20 -2.469 12.324 6.850
139 H TRP 21 HN TRP 21 -0.396 6.023 5.833
140 HA TRP 21 HA TRP 21 -2.611 5.114 4.275
141 HB2 TRP 21 HB2 TRP 21 -1.024 4.208 2.941
142 HB3 TRP 21 HB1 TRP 21 0.119 5.116 3.918
143 HD1 TRP 21 HD1 TRP 21 -0.587 1.706 2.758
144 HE1 TRP 21 HE1 TRP 21 0.809 -0.030 4.044
145 HE3 TRP 21 HE3 TRP 21 1.055 4.659 6.597
146 HZ2 TRP 21 HZ2 TRP 21 2.394 -0.137 6.370
147 HZ3 TRP 21 HZ3 TRP 21 2.502 3.661 8.312
148 HH2 TRP 21 HH2 TRP 21 3.157 1.311 8.201
149 H LYS 22 HN LYS 22 -3.156 2.831 4.163
150 HA LYS 22 HA LYS 22 -3.010 1.536 6.794
151 HB2 LYS 22 HB2 LYS 22 -5.474 1.871 5.110
152 HB3 LYS 22 HB1 LYS 22 -5.355 0.785 6.471
153 HG2 LYS 22 HG2 LYS 22 -4.878 3.736 6.667
154 HG3 LYS 22 HG1 LYS 22 -6.429 2.954 6.999
155 HD2 LYS 22 HD2 LYS 22 -3.907 2.066 8.342
156 HD3 LYS 22 HD1 LYS 22 -4.859 3.394 8.989
157 HE2 LYS 22 HE2 LYS 22 -6.800 1.886 9.106
158 HE3 LYS 22 HE1 LYS 22 -5.788 0.592 8.472
159 HZ1 LYS 22 HZ1 LYS 22 -4.414 0.696 10.413
160 HZ2 LYS 22 HZ2 LYS 22 -6.024 0.500 10.896
161 HZ3 LYS 22 HZ3 LYS 22 -5.280 2.021 11.018
162 H THR 23 HN THR 23 -3.854 -0.686 6.690
163 HA THR 23 HA THR 23 -3.083 -2.057 4.211
164 HB THR 23 HB THR 23 -2.135 -3.878 5.709
165 HG1 THR 23 HG1 THR 23 -1.819 -1.819 7.632
166 HG21 THR 23 HG21 THR 23 -1.054 -1.340 4.917
167 HG22 THR 23 HG22 THR 23 -0.329 -2.946 4.803
168 HG23 THR 23 HG23 THR 23 -0.184 -2.009 6.295
169 H ALA 24 HN ALA 24 -4.525 -3.485 3.538
170 HA ALA 24 HA ALA 24 -6.316 -4.772 5.414
171 HB1 ALA 24 HB1 ALA 24 -8.284 -3.820 4.800
172 HB2 ALA 24 HB2 ALA 24 -7.701 -3.427 3.190
173 HB3 ALA 24 HB3 ALA 24 -7.219 -2.429 4.562
174 H ARG 25 HN ARG 25 -7.847 -6.193 4.279
175 HA ARG 25 HA ARG 25 -6.756 -7.251 1.779
176 HB2 ARG 25 HB2 ARG 25 -5.852 -8.856 3.095
177 HB3 ARG 25 HB1 ARG 25 -6.974 -8.563 4.392
178 HG2 ARG 25 HG2 ARG 25 -8.687 -9.842 3.202
179 HG3 ARG 25 HG1 ARG 25 -7.514 -10.162 1.919
180 HD2 ARG 25 HD2 ARG 25 -7.734 -12.019 3.562
181 HD3 ARG 25 HD1 ARG 25 -6.100 -11.369 3.424
182 HE ARG 25 HE ARG 25 -6.726 -10.032 5.495
183 HH11 ARG 25 HH11 ARG 25 -8.075 -13.170 4.777
184 HH12 ARG 25 HH12 ARG 25 -8.301 -13.606 6.445
185 HH21 ARG 25 HH21 ARG 25 -6.994 -10.584 7.684
186 HH22 ARG 25 HH22 ARG 25 -7.696 -12.115 8.109
187 H ASP 26 HN ASP 26 -8.248 -8.449 0.542
188 HA ASP 26 HA ASP 26 -10.903 -7.254 0.782
189 HB2 ASP 26 HB2 ASP 26 -11.156 -7.565 -1.532
190 HB3 ASP 26 HB1 ASP 26 -9.476 -7.123 -1.339
191 HA PRO 27 HA PRO 27 -13.193 -10.736 1.670
192 HB2 PRO 27 HB2 PRO 27 -14.848 -11.300 -0.461
193 HB3 PRO 27 HB1 PRO 27 -15.166 -10.085 0.774
194 HG2 PRO 27 HG2 PRO 27 -14.181 -9.787 -1.991
195 HG3 PRO 27 HG1 PRO 27 -15.128 -8.659 -1.001
196 HD2 PRO 27 HD2 PRO 27 -12.447 -8.461 -1.539
197 HD3 PRO 27 HD1 PRO 27 -13.232 -7.673 -0.174
198 H GLU 28 HN GLU 28 -11.622 -10.983 -1.440
199 HA GLU 28 HA GLU 28 -11.766 -13.890 -1.351
200 HB2 GLU 28 HB2 GLU 28 -10.674 -12.034 -3.452
201 HB3 GLU 28 HB1 GLU 28 -10.755 -13.788 -3.596
202 HG2 GLU 28 HG2 GLU 28 -13.134 -12.050 -3.106
203 HG3 GLU 28 HG1 GLU 28 -12.610 -12.546 -4.717
204 H GLY 29 HN GLY 29 -10.231 -12.682 0.669
205 HA2 GLY 29 HA2 GLY 29 -8.365 -13.228 1.843
206 HA3 GLY 29 HA1 GLY 29 -8.165 -14.545 0.712
207 H LYS 30 HN LYS 30 -8.010 -11.363 -0.690
208 HA LYS 30 HA LYS 30 -5.110 -11.745 -0.968
209 HB2 LYS 30 HB2 LYS 30 -6.946 -9.875 -2.476
210 HB3 LYS 30 HB1 LYS 30 -5.243 -10.149 -2.817
211 HG2 LYS 30 HG2 LYS 30 -7.379 -12.263 -2.978
212 HG3 LYS 30 HG1 LYS 30 -6.758 -11.348 -4.353
213 HD2 LYS 30 HD2 LYS 30 -4.585 -12.291 -4.096
214 HD3 LYS 30 HD1 LYS 30 -5.012 -13.008 -2.541
215 HE2 LYS 30 HE2 LYS 30 -4.965 -14.654 -4.381
216 HE3 LYS 30 HE1 LYS 30 -6.545 -14.527 -3.613
217 HZ1 LYS 30 HZ1 LYS 30 -5.806 -13.149 -6.139
218 HZ2 LYS 30 HZ2 LYS 30 -7.348 -13.230 -5.439
219 HZ3 LYS 30 HZ3 LYS 30 -6.622 -14.628 -6.067
220 H ILE 31 HN ILE 31 -3.641 -10.292 -0.259
221 HA ILE 31 HA ILE 31 -4.661 -8.251 1.601
222 HB ILE 31 HB ILE 31 -3.296 -9.986 2.677
223 HG12 ILE 31 HG12 ILE 31 -1.643 -8.548 3.762
224 HG13 ILE 31 HG11 ILE 31 -1.820 -7.366 2.492
225 HG21 ILE 31 HG21 ILE 31 -1.690 -10.916 1.466
226 HG22 ILE 31 HG22 ILE 31 -0.727 -9.514 1.937
227 HG23 ILE 31 HG23 ILE 31 -1.579 -9.515 0.396
228 HD11 ILE 31 HD11 ILE 31 -3.009 -6.700 4.491
229 HD12 ILE 31 HD12 ILE 31 -3.920 -8.207 4.457
230 HD13 ILE 31 HD13 ILE 31 -4.143 -7.017 3.177
231 H TYR 32 HN TYR 32 -3.885 -6.141 1.498
232 HA TYR 32 HA TYR 32 -1.843 -5.456 -0.450
233 HB2 TYR 32 HB2 TYR 32 -3.318 -3.832 -1.639
234 HB3 TYR 32 HB1 TYR 32 -3.757 -5.517 -1.911
235 HD1 TYR 32 HD1 TYR 32 -4.775 -2.354 -0.338
236 HD2 TYR 32 HD2 TYR 32 -5.846 -6.410 -1.055
237 HE1 TYR 32 HE1 TYR 32 -7.081 -1.865 0.364
238 HE2 TYR 32 HE2 TYR 32 -8.153 -5.931 -0.356
239 HH TYR 32 HH TYR 32 -9.379 -4.312 0.990
240 H TYR 33 HN TYR 33 -1.680 -2.951 -0.584
241 HA TYR 33 HA TYR 33 -2.291 -1.695 2.006
242 HB2 TYR 33 HB2 TYR 33 0.044 -0.839 0.340
243 HB3 TYR 33 HB1 TYR 33 -0.221 -0.642 2.051
244 HD1 TYR 33 HD1 TYR 33 0.927 -2.961 -0.546
245 HD2 TYR 33 HD2 TYR 33 0.459 -2.335 3.630
246 HE1 TYR 33 HE1 TYR 33 2.427 -4.855 -0.103
247 HE2 TYR 33 HE2 TYR 33 1.955 -4.230 4.089
248 HH TYR 33 HH TYR 33 3.980 -5.552 1.831
249 H TYR 34 HN TYR 34 -2.837 0.576 1.839
250 HA TYR 34 HA TYR 34 -2.911 1.665 -0.861
251 HB2 TYR 34 HB2 TYR 34 -5.207 2.482 -0.672
252 HB3 TYR 34 HB1 TYR 34 -5.136 0.729 -0.611
253 HD1 TYR 34 HD1 TYR 34 -5.568 -0.448 1.537
254 HD2 TYR 34 HD2 TYR 34 -6.075 3.758 1.134
255 HE1 TYR 34 HE1 TYR 34 -6.957 -0.425 3.566
256 HE2 TYR 34 HE2 TYR 34 -7.459 3.791 3.164
257 HH TYR 34 HH TYR 34 -8.837 2.261 4.477
258 H HIS 35 HN HIS 35 -2.647 3.799 -1.080
259 HA HIS 35 HA HIS 35 -1.799 5.188 1.358
260 HB2 HIS 35 HB2 HIS 35 -1.328 5.894 -1.565
261 HB3 HIS 35 HB1 HIS 35 -0.616 6.702 -0.192
262 HD1 HIS 35 HD1 HIS 35 1.733 6.234 -1.256
263 HD2 HIS 35 HD2 HIS 35 -0.401 2.822 -0.214
264 HE1 HIS 35 HE1 HIS 35 3.371 4.346 -1.407
265 HE2 HIS 35 HE2 HIS 35 1.979 2.275 -1.066
266 H VAL 36 HN VAL 36 -3.231 6.549 2.162
267 HA VAL 36 HA VAL 36 -5.637 7.173 0.826
268 HB VAL 36 HB VAL 36 -6.001 8.558 2.936
269 HG11 VAL 36 HG11 VAL 36 -5.182 5.723 3.495
270 HG12 VAL 36 HG12 VAL 36 -6.560 6.084 2.464
271 HG13 VAL 36 HG13 VAL 36 -6.555 6.622 4.144
272 HG21 VAL 36 HG21 VAL 36 -3.750 9.052 3.527
273 HG22 VAL 36 HG22 VAL 36 -3.294 7.341 3.456
274 HG23 VAL 36 HG23 VAL 36 -4.358 7.929 4.751
275 H ILE 37 HN ILE 37 -2.744 9.135 1.545
276 HA ILE 37 HA ILE 37 -3.805 11.611 0.753
277 HB ILE 37 HB ILE 37 -1.017 10.540 0.937
278 HG12 ILE 37 HG12 ILE 37 -0.909 12.584 2.508
279 HG13 ILE 37 HG11 ILE 37 -2.658 12.574 2.348
280 HG21 ILE 37 HG21 ILE 37 -0.924 11.980 -1.006
281 HG22 ILE 37 HG22 ILE 37 -0.118 12.756 0.357
282 HG23 ILE 37 HG23 ILE 37 -1.736 13.268 -0.118
283 HD11 ILE 37 HD11 ILE 37 -1.137 10.173 3.230
284 HD12 ILE 37 HD12 ILE 37 -2.863 10.508 3.368
285 HD13 ILE 37 HD13 ILE 37 -1.713 11.408 4.349
286 H THR 38 HN THR 38 -1.743 9.358 -0.998
287 HA THR 38 HA THR 38 -1.950 10.864 -3.411
288 HB THR 38 HB THR 38 -0.485 8.984 -4.310
289 HG1 THR 38 HG1 THR 38 0.259 7.512 -2.871
290 HG21 THR 38 HG21 THR 38 0.319 10.634 -1.923
291 HG22 THR 38 HG22 THR 38 0.462 11.086 -3.625
292 HG23 THR 38 HG23 THR 38 1.468 9.793 -2.966
293 H ARG 39 HN ARG 39 -3.705 8.307 -2.059
294 HA ARG 39 HA ARG 39 -5.306 6.892 -2.769
295 HB2 ARG 39 HB2 ARG 39 -5.367 8.845 -5.057
296 HB3 ARG 39 HB1 ARG 39 -6.370 7.413 -5.060
297 HG2 ARG 39 HG2 ARG 39 -7.759 9.066 -4.216
298 HG3 ARG 39 HG1 ARG 39 -7.203 8.197 -2.782
299 HD2 ARG 39 HD2 ARG 39 -5.304 9.956 -2.823
300 HD3 ARG 39 HD1 ARG 39 -6.441 10.892 -3.788
301 HE ARG 39 HE ARG 39 -6.740 10.128 -0.979
302 HH11 ARG 39 HH11 ARG 39 -8.020 11.757 -3.806
303 HH12 ARG 39 HH12 ARG 39 -9.162 12.704 -2.895
304 HH21 ARG 39 HH21 ARG 39 -8.251 11.348 0.216
305 HH22 ARG 39 HH22 ARG 39 -9.296 12.465 -0.602
306 H GLN 40 HN GLN 40 -2.919 5.861 -2.919
307 HA GLN 40 HA GLN 40 -2.824 4.455 -5.492
308 HB2 GLN 40 HB2 GLN 40 -0.637 4.866 -3.501
309 HB3 GLN 40 HB1 GLN 40 -0.461 4.125 -5.074
310 HG2 GLN 40 HG2 GLN 40 -0.949 6.220 -6.115
311 HG3 GLN 40 HG1 GLN 40 -1.259 6.970 -4.562
312 HE21 GLN 40 HE21 GLN 40 0.598 7.668 -6.658
313 HE22 GLN 40 HE22 GLN 40 2.170 7.616 -5.947
314 H THR 41 HN THR 41 -2.108 2.181 -5.282
315 HA THR 41 HA THR 41 -2.311 0.980 -2.697
316 HB THR 41 HB THR 41 -4.617 1.005 -3.043
317 HG1 THR 41 HG1 THR 41 -3.791 -1.087 -2.454
318 HG21 THR 41 HG21 THR 41 -4.617 1.644 -5.326
319 HG22 THR 41 HG22 THR 41 -5.655 0.227 -5.128
320 HG23 THR 41 HG23 THR 41 -4.042 0.055 -5.832
321 H GLN 42 HN GLN 42 -1.357 -1.001 -2.583
322 HA GLN 42 HA GLN 42 -0.443 -2.206 -5.092
323 HB2 GLN 42 HB2 GLN 42 1.805 -2.505 -4.156
324 HB3 GLN 42 HB1 GLN 42 1.400 -0.803 -4.286
325 HG2 GLN 42 HG2 GLN 42 0.596 -1.450 -1.760
326 HG3 GLN 42 HG1 GLN 42 2.041 -2.427 -1.965
327 HE21 GLN 42 HE21 GLN 42 4.013 -1.426 -2.270
328 HE22 GLN 42 HE22 GLN 42 4.261 0.246 -1.915
329 H TRP 43 HN TRP 43 -0.743 -4.326 -5.115
330 HA TRP 43 HA TRP 43 -1.646 -5.624 -2.665
331 HB2 TRP 43 HB2 TRP 43 -1.600 -6.620 -5.523
332 HB3 TRP 43 HB1 TRP 43 -2.339 -7.457 -4.163
333 HD1 TRP 43 HD1 TRP 43 -2.729 -3.966 -5.855
334 HE1 TRP 43 HE1 TRP 43 -5.235 -3.381 -5.897
335 HE3 TRP 43 HE3 TRP 43 -4.576 -8.111 -3.496
336 HZ2 TRP 43 HZ2 TRP 43 -7.671 -4.526 -5.053
337 HZ3 TRP 43 HZ3 TRP 43 -7.006 -8.285 -3.157
338 HH2 TRP 43 HH2 TRP 43 -8.519 -6.532 -3.919
339 H ASP 44 HN ASP 44 0.883 -5.823 -5.099
340 HA ASP 44 HA ASP 44 2.209 -7.895 -3.494
341 HB2 ASP 44 HB2 ASP 44 1.636 -8.557 -5.787
342 HB3 ASP 44 HB1 ASP 44 2.632 -7.244 -6.411
343 HA PRO 45 HA PRO 45 5.733 -4.659 -4.909
344 HB2 PRO 45 HB2 PRO 45 4.009 -2.259 -4.488
345 HB3 PRO 45 HB1 PRO 45 5.352 -2.500 -5.613
346 HG2 PRO 45 HG2 PRO 45 2.865 -2.579 -6.502
347 HG3 PRO 45 HG1 PRO 45 4.056 -3.758 -7.085
348 HD2 PRO 45 HD2 PRO 45 1.856 -4.115 -5.093
349 HD3 PRO 45 HD1 PRO 45 2.437 -5.232 -6.344
350 HA PRO 46 HA PRO 46 6.679 -4.427 -0.589
351 HB2 PRO 46 HB2 PRO 46 8.840 -2.638 -1.568
352 HB3 PRO 46 HB1 PRO 46 8.942 -4.085 -0.558
353 HG2 PRO 46 HG2 PRO 46 9.663 -4.172 -3.100
354 HG3 PRO 46 HG1 PRO 46 8.778 -5.522 -2.371
355 HD2 PRO 46 HD2 PRO 46 7.794 -3.375 -4.202
356 HD3 PRO 46 HD1 PRO 46 7.369 -5.098 -4.151
357 H THR 47 HN THR 47 7.016 -2.863 1.110
358 HA THR 47 HA THR 47 5.206 -0.616 0.619
359 HB THR 47 HB THR 47 4.605 -2.322 2.325
360 HG1 THR 47 HG1 THR 47 3.530 -0.666 3.030
361 HG21 THR 47 HG21 THR 47 6.901 -2.734 3.160
362 HG22 THR 47 HG22 THR 47 5.735 -2.422 4.444
363 HG23 THR 47 HG23 THR 47 6.858 -1.157 3.945
364 H TRP 48 HN TRP 48 5.832 0.666 3.055
365 HA TRP 48 HA TRP 48 7.373 2.756 2.105
366 HB2 TRP 48 HB2 TRP 48 5.780 2.904 3.988
367 HB3 TRP 48 HB1 TRP 48 6.932 2.030 4.986
368 HD1 TRP 48 HD1 TRP 48 7.529 5.098 2.678
369 HE1 TRP 48 HE1 TRP 48 8.646 6.937 4.092
370 HE3 TRP 48 HE3 TRP 48 7.527 2.751 7.222
371 HZ2 TRP 48 HZ2 TRP 48 9.422 7.339 6.771
372 HZ3 TRP 48 HZ3 TRP 48 8.472 3.934 9.160
373 HH2 TRP 48 HH2 TRP 48 9.400 6.181 8.937
374 H GLU 49 HN GLU 49 8.399 0.120 4.251
375 HA GLU 49 HA GLU 49 11.142 1.104 3.975
376 HB2 GLU 49 HB2 GLU 49 9.889 -0.605 6.116
377 HB3 GLU 49 HB1 GLU 49 11.619 -0.309 5.983
378 HG2 GLU 49 HG2 GLU 49 11.117 2.113 6.060
379 HG3 GLU 49 HG1 GLU 49 9.459 1.700 6.482
380 H SER 50 HN SER 50 12.774 -0.226 3.380
381 HA SER 50 HA SER 50 11.908 -2.668 1.986
382 HB2 SER 50 HB2 SER 50 14.408 -1.037 1.500
383 HB3 SER 50 HB1 SER 50 13.711 -2.274 0.453
384 HG SER 50 HG SER 50 13.311 0.097 0.004
385 HA PRO 51 HA PRO 51 14.285 -5.025 4.933
386 HB2 PRO 51 HB2 PRO 51 14.460 -7.309 3.449
387 HB3 PRO 51 HB1 PRO 51 13.028 -6.851 4.375
388 HG2 PRO 51 HG2 PRO 51 13.586 -6.494 1.455
389 HG3 PRO 51 HG1 PRO 51 12.098 -7.041 2.251
390 HD2 PRO 51 HD2 PRO 51 12.361 -4.523 1.365
391 HD3 PRO 51 HD1 PRO 51 11.489 -4.893 2.866
392 H GLY 52 HN GLY 52 16.190 -6.678 4.699
393 HA2 GLY 52 HA2 GLY 52 18.401 -5.249 3.661
394 HA3 GLY 52 HA1 GLY 52 18.440 -6.895 4.282
395 H ASP 53 HN ASP 53 16.306 -7.666 2.326
396 HA ASP 53 HA ASP 53 17.891 -8.676 0.258
397 HB2 ASP 53 HB2 ASP 53 15.732 -9.660 0.811
398 HB3 ASP 53 HB1 ASP 53 14.902 -8.183 0.332
399 H ASP 54 HN ASP 54 15.812 -5.826 0.389
400 HA ASP 54 HA ASP 54 16.418 -4.993 -2.287
401 HB2 ASP 54 HB2 ASP 54 14.284 -4.400 -1.236
402 HB3 ASP 54 HB1 ASP 54 15.136 -3.508 0.020
403 H ALA 55 HN ALA 55 17.432 -4.095 0.969
404 HA ALA 55 HA ALA 55 19.180 -2.912 1.790
405 HB1 ALA 55 HB1 ALA 55 20.528 -4.497 0.485
406 HB2 ALA 55 HB2 ALA 55 21.281 -2.904 0.562
407 HB3 ALA 55 HB3 ALA 55 20.447 -3.416 -0.907
408 H SER 56 HN SER 56 17.626 -1.151 1.720
409 HA SER 56 HA SER 56 17.564 0.773 -0.329
410 HB2 SER 56 HB2 SER 56 16.609 2.247 1.527
411 HB3 SER 56 HB1 SER 56 15.750 0.741 1.203
412 HG SER 56 HG SER 56 17.784 0.628 3.099
Start of MODEL 14
1 H1 GLY 1 HT1 GLY 1 -7.199 7.836 5.257
2 H2 GLY 1 HT2 GLY 1 -6.539 8.833 6.454
3 H3 GLY 1 HT3 GLY 1 -8.149 8.307 6.576
4 HA2 GLY 1 HA1 GLY 1 -5.771 6.536 6.666
5 HA3 GLY 1 HA2 GLY 1 -6.685 7.071 8.070
6 H SER 2 HN SER 2 -8.105 5.649 8.785
7 HA SER 2 HA SER 2 -8.839 3.320 7.344
8 HB2 SER 2 HB2 SER 2 -10.463 3.075 9.318
9 HB3 SER 2 HB1 SER 2 -8.740 3.130 9.693
10 HG SER 2 HG SER 2 -10.636 4.699 10.638
11 H ASP 3 HN ASP 3 -10.114 6.469 7.547
12 HA ASP 3 HA ASP 3 -12.853 5.990 7.129
13 HB2 ASP 3 HB2 ASP 3 -12.967 8.387 6.567
14 HB3 ASP 3 HB1 ASP 3 -12.135 8.072 8.082
15 H LEU 4 HN LEU 4 -10.257 5.896 4.890
16 HA LEU 4 HA LEU 4 -12.081 6.522 2.667
17 HB2 LEU 4 HB2 LEU 4 -9.075 6.665 2.859
18 HB3 LEU 4 HB1 LEU 4 -9.966 6.897 1.365
19 HG LEU 4 HG LEU 4 -10.249 8.611 3.836
20 HD11 LEU 4 HD11 LEU 4 -8.083 8.922 2.770
21 HD12 LEU 4 HD12 LEU 4 -9.119 10.326 2.516
22 HD13 LEU 4 HD13 LEU 4 -8.873 9.166 1.212
23 HD21 LEU 4 HD21 LEU 4 -11.566 10.066 2.383
24 HD22 LEU 4 HD22 LEU 4 -12.299 8.468 2.520
25 HD23 LEU 4 HD23 LEU 4 -11.403 8.906 1.065
26 HA PRO 5 HA PRO 5 -12.018 2.345 1.345
27 HB2 PRO 5 HB2 PRO 5 -12.813 3.257 -1.300
28 HB3 PRO 5 HB1 PRO 5 -13.781 2.442 -0.073
29 HG2 PRO 5 HG2 PRO 5 -14.172 5.030 -0.790
30 HG3 PRO 5 HG1 PRO 5 -14.529 4.407 0.832
31 HD2 PRO 5 HD2 PRO 5 -12.154 5.963 -0.123
32 HD3 PRO 5 HD1 PRO 5 -13.073 6.119 1.390
33 HA PRO 6 HA PRO 6 -8.286 1.525 -0.822
34 HB2 PRO 6 HB2 PRO 6 -9.479 -0.914 -1.929
35 HB3 PRO 6 HB1 PRO 6 -8.177 -0.740 -0.749
36 HG2 PRO 6 HG2 PRO 6 -10.616 -1.655 -0.065
37 HG3 PRO 6 HG1 PRO 6 -9.626 -0.685 1.040
38 HD2 PRO 6 HD2 PRO 6 -11.945 0.156 -0.661
39 HD3 PRO 6 HD1 PRO 6 -11.556 0.602 1.015
40 HA PRO 7 HA PRO 7 -8.845 2.640 -5.114
41 HB2 PRO 7 HB2 PRO 7 -5.985 2.585 -5.315
42 HB3 PRO 7 HB1 PRO 7 -7.025 3.989 -5.182
43 HG2 PRO 7 HG2 PRO 7 -5.269 3.235 -3.245
44 HG3 PRO 7 HG1 PRO 7 -6.759 4.142 -2.918
45 HD2 PRO 7 HD2 PRO 7 -6.246 1.193 -2.666
46 HD3 PRO 7 HD1 PRO 7 -7.083 2.289 -1.543
47 H SER 8 HN SER 8 -8.443 1.761 -7.191
48 HA SER 8 HA SER 8 -7.334 -0.937 -7.320
49 HB2 SER 8 HB2 SER 8 -9.278 -0.318 -8.761
50 HB3 SER 8 HB1 SER 8 -8.299 0.930 -9.528
51 HG SER 8 HG SER 8 -8.535 -1.532 -10.308
52 HA PRO 9 HA PRO 9 -3.407 0.653 -7.398
53 HB2 PRO 9 HB2 PRO 9 -1.896 -1.283 -8.484
54 HB3 PRO 9 HB1 PRO 9 -2.775 -1.509 -6.968
55 HG2 PRO 9 HG2 PRO 9 -3.498 -2.409 -9.730
56 HG3 PRO 9 HG1 PRO 9 -3.624 -3.291 -8.197
57 HD2 PRO 9 HD2 PRO 9 -5.737 -2.034 -9.410
58 HD3 PRO 9 HD1 PRO 9 -5.630 -2.308 -7.658
59 HA PRO 10 HA PRO 10 -1.802 2.271 -11.290
60 HB2 PRO 10 HB2 PRO 10 -0.369 4.183 -9.768
61 HB3 PRO 10 HB1 PRO 10 -1.871 4.447 -10.653
62 HG2 PRO 10 HG2 PRO 10 -1.578 4.551 -7.880
63 HG3 PRO 10 HG1 PRO 10 -3.111 4.409 -8.758
64 HD2 PRO 10 HD2 PRO 10 -1.473 2.289 -7.435
65 HD3 PRO 10 HD1 PRO 10 -3.240 2.453 -7.541
66 H ALA 11 HN ALA 11 0.347 2.193 -12.131
67 HA ALA 11 HA ALA 11 2.191 0.455 -10.849
68 HB1 ALA 11 HB1 ALA 11 2.087 0.754 -13.292
69 HB2 ALA 11 HB2 ALA 11 3.712 1.016 -12.654
70 HB3 ALA 11 HB3 ALA 11 2.706 2.393 -13.103
71 H ALA 12 HN ALA 12 1.760 3.897 -10.929
72 HA ALA 12 HA ALA 12 4.253 4.715 -9.903
73 HB1 ALA 12 HB1 ALA 12 1.601 6.128 -9.756
74 HB2 ALA 12 HB2 ALA 12 2.737 6.216 -11.101
75 HB3 ALA 12 HB3 ALA 12 3.187 6.864 -9.521
76 H ALA 13 HN ALA 13 1.688 3.145 -8.417
77 HA ALA 13 HA ALA 13 1.294 4.498 -6.027
78 HB1 ALA 13 HB1 ALA 13 1.014 1.543 -6.499
79 HB2 ALA 13 HB2 ALA 13 -0.190 2.767 -6.902
80 HB3 ALA 13 HB3 ALA 13 0.246 2.481 -5.218
81 H THR 14 HN THR 14 3.869 2.305 -6.860
82 HA THR 14 HA THR 14 4.481 1.523 -4.183
83 HB THR 14 HB THR 14 5.015 0.036 -6.035
84 HG1 THR 14 HG1 THR 14 6.842 0.867 -4.177
85 HG21 THR 14 HG21 THR 14 6.985 2.158 -6.889
86 HG22 THR 14 HG22 THR 14 5.530 1.671 -7.759
87 HG23 THR 14 HG23 THR 14 6.865 0.537 -7.573
88 H ILE 15 HN ILE 15 5.352 4.233 -6.146
89 HA ILE 15 HA ILE 15 7.884 4.887 -5.567
90 HB ILE 15 HB ILE 15 6.450 6.176 -7.034
91 HG12 ILE 15 HG12 ILE 15 7.250 8.448 -6.415
92 HG13 ILE 15 HG11 ILE 15 7.796 7.789 -4.874
93 HG21 ILE 15 HG21 ILE 15 4.420 6.273 -5.692
94 HG22 ILE 15 HG22 ILE 15 4.913 7.877 -6.232
95 HG23 ILE 15 HG23 ILE 15 5.211 7.376 -4.567
96 HD11 ILE 15 HD11 ILE 15 9.519 8.006 -6.707
97 HD12 ILE 15 HD12 ILE 15 8.668 6.676 -7.499
98 HD13 ILE 15 HD13 ILE 15 9.397 6.435 -5.913
99 H VAL 16 HN VAL 16 5.376 6.485 -3.557
100 HA VAL 16 HA VAL 16 7.136 6.144 -1.216
101 HB VAL 16 HB VAL 16 5.562 8.660 -1.782
102 HG11 VAL 16 HG11 VAL 16 7.098 9.626 -0.075
103 HG12 VAL 16 HG12 VAL 16 7.721 8.000 0.216
104 HG13 VAL 16 HG13 VAL 16 6.030 8.370 0.548
105 HG21 VAL 16 HG21 VAL 16 7.552 9.734 -2.548
106 HG22 VAL 16 HG22 VAL 16 7.310 8.264 -3.499
107 HG23 VAL 16 HG23 VAL 16 8.517 8.291 -2.212
108 H LEU 17 HN LEU 17 6.087 6.235 0.791
109 HA LEU 17 HA LEU 17 3.210 5.696 0.692
110 HB2 LEU 17 HB2 LEU 17 4.352 3.595 0.748
111 HB3 LEU 17 HB1 LEU 17 5.412 4.132 2.024
112 HG LEU 17 HG LEU 17 2.436 3.776 2.429
113 HD11 LEU 17 HD11 LEU 17 4.559 1.762 3.107
114 HD12 LEU 17 HD12 LEU 17 3.654 1.717 1.598
115 HD13 LEU 17 HD13 LEU 17 2.805 1.564 3.137
116 HD21 LEU 17 HD21 LEU 17 3.048 3.581 4.774
117 HD22 LEU 17 HD22 LEU 17 3.627 5.112 4.112
118 HD23 LEU 17 HD23 LEU 17 4.752 3.777 4.365
119 HA PRO 18 HA PRO 18 3.434 8.531 4.160
120 HB2 PRO 18 HB2 PRO 18 0.868 9.295 4.057
121 HB3 PRO 18 HB1 PRO 18 2.024 9.789 2.817
122 HG2 PRO 18 HG2 PRO 18 -0.166 7.809 2.667
123 HG3 PRO 18 HG1 PRO 18 0.584 8.757 1.374
124 HD2 PRO 18 HD2 PRO 18 1.121 6.036 2.110
125 HD3 PRO 18 HD1 PRO 18 1.887 6.993 0.828
126 HA PRO 19 HA PRO 19 2.286 6.041 7.641
127 HB2 PRO 19 HB2 PRO 19 1.671 8.702 8.779
128 HB3 PRO 19 HB1 PRO 19 2.637 7.413 9.459
129 HG2 PRO 19 HG2 PRO 19 3.865 9.447 8.457
130 HG3 PRO 19 HG1 PRO 19 4.414 7.828 7.979
131 HD2 PRO 19 HD2 PRO 19 2.641 9.730 6.485
132 HD3 PRO 19 HD1 PRO 19 4.029 8.799 5.900
133 H ASN 20 HN ASN 20 0.149 8.489 6.442
134 HA ASN 20 HA ASN 20 -2.190 7.903 7.871
135 HB2 ASN 20 HB2 ASN 20 -1.848 8.981 5.073
136 HB3 ASN 20 HB1 ASN 20 -3.387 8.907 5.918
137 HD21 ASN 20 HD21 ASN 20 -3.737 11.042 5.920
138 HD22 ASN 20 HD22 ASN 20 -2.778 12.175 6.786
139 H TRP 21 HN TRP 21 -0.563 5.894 5.727
140 HA TRP 21 HA TRP 21 -2.806 4.979 4.213
141 HB2 TRP 21 HB2 TRP 21 -1.257 3.991 2.894
142 HB3 TRP 21 HB1 TRP 21 -0.101 4.952 3.801
143 HD1 TRP 21 HD1 TRP 21 -0.787 1.493 2.800
144 HE1 TRP 21 HE1 TRP 21 0.658 -0.171 4.127
145 HE3 TRP 21 HE3 TRP 21 0.887 4.615 6.497
146 HZ2 TRP 21 HZ2 TRP 21 2.284 -0.169 6.423
147 HZ3 TRP 21 HZ3 TRP 21 2.384 3.696 8.219
148 HH2 TRP 21 HH2 TRP 21 3.067 1.353 8.182
149 H LYS 22 HN LYS 22 -3.489 2.800 4.184
150 HA LYS 22 HA LYS 22 -3.174 1.359 6.725
151 HB2 LYS 22 HB2 LYS 22 -5.757 1.834 5.263
152 HB3 LYS 22 HB1 LYS 22 -5.550 0.700 6.572
153 HG2 LYS 22 HG2 LYS 22 -4.955 3.605 6.863
154 HG3 LYS 22 HG1 LYS 22 -6.529 2.889 7.226
155 HD2 LYS 22 HD2 LYS 22 -5.524 1.421 8.862
156 HD3 LYS 22 HD1 LYS 22 -3.918 2.028 8.450
157 HE2 LYS 22 HE2 LYS 22 -4.460 4.178 9.207
158 HE3 LYS 22 HE1 LYS 22 -6.134 3.732 9.474
159 HZ1 LYS 22 HZ1 LYS 22 -3.856 2.487 10.910
160 HZ2 LYS 22 HZ2 LYS 22 -5.506 2.312 11.258
161 HZ3 LYS 22 HZ3 LYS 22 -4.735 3.802 11.522
162 H THR 23 HN THR 23 -4.097 -0.870 6.483
163 HA THR 23 HA THR 23 -3.619 -1.997 3.823
164 HB THR 23 HB THR 23 -2.698 -4.023 5.098
165 HG1 THR 23 HG1 THR 23 -2.829 -3.721 7.214
166 HG21 THR 23 HG21 THR 23 -1.446 -1.468 4.465
167 HG22 THR 23 HG22 THR 23 -1.064 -3.083 3.871
168 HG23 THR 23 HG23 THR 23 -0.474 -2.556 5.451
169 H ALA 24 HN ALA 24 -5.006 -3.560 3.199
170 HA ALA 24 HA ALA 24 -6.754 -4.788 5.163
171 HB1 ALA 24 HB1 ALA 24 -8.706 -3.882 4.557
172 HB2 ALA 24 HB2 ALA 24 -8.249 -3.824 2.863
173 HB3 ALA 24 HB3 ALA 24 -7.708 -2.551 3.959
174 H ARG 25 HN ARG 25 -8.013 -6.469 4.312
175 HA ARG 25 HA ARG 25 -7.140 -7.578 1.761
176 HB2 ARG 25 HB2 ARG 25 -5.792 -8.870 3.109
177 HB3 ARG 25 HB1 ARG 25 -6.925 -8.848 4.429
178 HG2 ARG 25 HG2 ARG 25 -8.352 -10.433 3.277
179 HG3 ARG 25 HG1 ARG 25 -7.240 -10.430 1.905
180 HD2 ARG 25 HD2 ARG 25 -5.488 -11.357 3.254
181 HD3 ARG 25 HD1 ARG 25 -6.470 -11.204 4.709
182 HE ARG 25 HE ARG 25 -8.013 -12.803 3.254
183 HH11 ARG 25 HH11 ARG 25 -4.545 -12.922 3.683
184 HH12 ARG 25 HH12 ARG 25 -4.473 -14.661 3.690
185 HH21 ARG 25 HH21 ARG 25 -7.933 -15.072 3.252
186 HH22 ARG 25 HH22 ARG 25 -6.411 -15.885 3.481
187 H ASP 26 HN ASP 26 -8.649 -8.701 0.702
188 HA ASP 26 HA ASP 26 -11.393 -8.352 1.667
189 HB2 ASP 26 HB2 ASP 26 -10.372 -9.086 -1.089
190 HB3 ASP 26 HB1 ASP 26 -12.068 -8.954 -0.658
191 HA PRO 27 HA PRO 27 -12.393 -12.550 2.364
192 HB2 PRO 27 HB2 PRO 27 -14.384 -12.959 0.441
193 HB3 PRO 27 HB1 PRO 27 -14.639 -12.320 2.059
194 HG2 PRO 27 HG2 PRO 27 -14.248 -10.845 -0.483
195 HG3 PRO 27 HG1 PRO 27 -15.419 -10.535 0.812
196 HD2 PRO 27 HD2 PRO 27 -13.253 -9.061 0.640
197 HD3 PRO 27 HD1 PRO 27 -13.753 -9.659 2.231
198 H GLU 28 HN GLU 28 -11.606 -11.412 -0.817
199 HA GLU 28 HA GLU 28 -11.305 -14.069 -1.936
200 HB2 GLU 28 HB2 GLU 28 -10.807 -11.331 -3.105
201 HB3 GLU 28 HB1 GLU 28 -10.700 -12.843 -4.000
202 HG2 GLU 28 HG2 GLU 28 -13.197 -12.136 -2.548
203 HG3 GLU 28 HG1 GLU 28 -12.861 -11.419 -4.125
204 H GLY 29 HN GLY 29 -9.569 -13.425 0.254
205 HA2 GLY 29 HA2 GLY 29 -7.474 -14.090 0.848
206 HA3 GLY 29 HA1 GLY 29 -7.367 -14.819 -0.737
207 H LYS 30 HN LYS 30 -7.752 -11.485 -1.169
208 HA LYS 30 HA LYS 30 -4.850 -11.242 -1.512
209 HB2 LYS 30 HB2 LYS 30 -7.185 -9.813 -2.703
210 HB3 LYS 30 HB1 LYS 30 -5.657 -8.958 -2.580
211 HG2 LYS 30 HG2 LYS 30 -5.543 -9.843 -4.695
212 HG3 LYS 30 HG1 LYS 30 -4.679 -11.056 -3.753
213 HD2 LYS 30 HD2 LYS 30 -6.628 -12.467 -3.695
214 HD3 LYS 30 HD1 LYS 30 -7.593 -11.226 -4.497
215 HE2 LYS 30 HE2 LYS 30 -6.033 -11.384 -6.441
216 HE3 LYS 30 HE1 LYS 30 -5.272 -12.762 -5.649
217 HZ1 LYS 30 HZ1 LYS 30 -8.143 -12.615 -6.399
218 HZ2 LYS 30 HZ2 LYS 30 -7.343 -13.959 -5.749
219 HZ3 LYS 30 HZ3 LYS 30 -6.950 -13.406 -7.303
220 H ILE 31 HN ILE 31 -3.603 -9.935 -0.353
221 HA ILE 31 HA ILE 31 -4.858 -7.999 1.505
222 HB ILE 31 HB ILE 31 -3.723 -9.767 2.754
223 HG12 ILE 31 HG12 ILE 31 -1.884 -8.176 3.778
224 HG13 ILE 31 HG11 ILE 31 -2.635 -6.991 2.736
225 HG21 ILE 31 HG21 ILE 31 -2.105 -10.513 1.115
226 HG22 ILE 31 HG22 ILE 31 -1.283 -10.054 2.606
227 HG23 ILE 31 HG23 ILE 31 -1.256 -8.971 1.216
228 HD11 ILE 31 HD11 ILE 31 -3.989 -8.585 4.883
229 HD12 ILE 31 HD12 ILE 31 -4.773 -7.446 3.794
230 HD13 ILE 31 HD13 ILE 31 -3.566 -6.872 4.941
231 H TYR 32 HN TYR 32 -4.043 -5.873 1.434
232 HA TYR 32 HA TYR 32 -1.689 -5.304 -0.163
233 HB2 TYR 32 HB2 TYR 32 -3.017 -3.674 -1.612
234 HB3 TYR 32 HB1 TYR 32 -3.195 -5.388 -1.977
235 HD1 TYR 32 HD1 TYR 32 -4.815 -2.506 -0.319
236 HD2 TYR 32 HD2 TYR 32 -5.335 -6.432 -1.878
237 HE1 TYR 32 HE1 TYR 32 -7.247 -2.265 -0.096
238 HE2 TYR 32 HE2 TYR 32 -7.775 -6.198 -1.659
239 HH TYR 32 HH TYR 32 -9.240 -3.119 -0.796
240 H TYR 33 HN TYR 33 -1.504 -2.825 -0.457
241 HA TYR 33 HA TYR 33 -2.216 -1.487 2.073
242 HB2 TYR 33 HB2 TYR 33 -0.058 -0.545 0.214
243 HB3 TYR 33 HB1 TYR 33 -0.253 -0.230 1.916
244 HD1 TYR 33 HD1 TYR 33 0.484 -3.079 -0.384
245 HD2 TYR 33 HD2 TYR 33 1.136 -1.293 3.419
246 HE1 TYR 33 HE1 TYR 33 2.166 -4.792 0.125
247 HE2 TYR 33 HE2 TYR 33 2.817 -3.010 3.942
248 HH TYR 33 HH TYR 33 3.890 -5.314 1.518
249 H TYR 34 HN TYR 34 -2.958 0.682 1.911
250 HA TYR 34 HA TYR 34 -3.208 1.786 -0.774
251 HB2 TYR 34 HB2 TYR 34 -5.547 2.582 -0.268
252 HB3 TYR 34 HB1 TYR 34 -5.367 0.870 -0.598
253 HD1 TYR 34 HD1 TYR 34 -5.588 -0.777 1.259
254 HD2 TYR 34 HD2 TYR 34 -6.337 3.372 1.837
255 HE1 TYR 34 HE1 TYR 34 -6.729 -1.283 3.380
256 HE2 TYR 34 HE2 TYR 34 -7.484 2.878 3.955
257 HH TYR 34 HH TYR 34 -7.277 -0.126 5.500
258 H HIS 35 HN HIS 35 -2.971 3.924 -0.975
259 HA HIS 35 HA HIS 35 -2.253 5.318 1.500
260 HB2 HIS 35 HB2 HIS 35 -1.522 6.051 -1.358
261 HB3 HIS 35 HB1 HIS 35 -0.857 6.734 0.108
262 HD1 HIS 35 HD1 HIS 35 -0.460 3.721 1.372
263 HD2 HIS 35 HD2 HIS 35 1.024 5.250 -2.198
264 HE1 HIS 35 HE1 HIS 35 1.524 2.291 0.794
265 HE2 HIS 35 HE2 HIS 35 2.359 3.171 -1.417
266 H VAL 36 HN VAL 36 -3.675 6.716 2.172
267 HA VAL 36 HA VAL 36 -6.065 7.160 0.746
268 HB VAL 36 HB VAL 36 -6.568 8.572 2.821
269 HG11 VAL 36 HG11 VAL 36 -5.645 5.805 3.501
270 HG12 VAL 36 HG12 VAL 36 -6.953 6.040 2.350
271 HG13 VAL 36 HG13 VAL 36 -7.117 6.639 4.001
272 HG21 VAL 36 HG21 VAL 36 -4.330 9.155 3.468
273 HG22 VAL 36 HG22 VAL 36 -3.844 7.455 3.492
274 HG23 VAL 36 HG23 VAL 36 -4.980 8.074 4.705
275 H ILE 37 HN ILE 37 -3.313 9.320 1.496
276 HA ILE 37 HA ILE 37 -4.572 11.685 0.610
277 HB ILE 37 HB ILE 37 -1.691 10.925 0.970
278 HG12 ILE 37 HG12 ILE 37 -1.917 12.941 2.570
279 HG13 ILE 37 HG11 ILE 37 -3.643 12.721 2.318
280 HG21 ILE 37 HG21 ILE 37 -1.706 12.403 -0.963
281 HG22 ILE 37 HG22 ILE 37 -1.023 13.225 0.439
282 HG23 ILE 37 HG23 ILE 37 -2.673 13.579 -0.070
283 HD11 ILE 37 HD11 ILE 37 -1.853 10.534 3.273
284 HD12 ILE 37 HD12 ILE 37 -3.614 10.594 3.270
285 HD13 ILE 37 HD13 ILE 37 -2.701 11.640 4.351
286 H THR 38 HN THR 38 -2.146 9.655 -0.929
287 HA THR 38 HA THR 38 -2.268 11.087 -3.375
288 HB THR 38 HB THR 38 -0.652 9.242 -4.110
289 HG1 THR 38 HG1 THR 38 0.150 7.964 -2.472
290 HG21 THR 38 HG21 THR 38 -0.093 11.032 -1.753
291 HG22 THR 38 HG22 THR 38 0.100 11.442 -3.459
292 HG23 THR 38 HG23 THR 38 1.156 10.238 -2.716
293 H ARG 39 HN ARG 39 -4.025 8.447 -2.170
294 HA ARG 39 HA ARG 39 -5.513 7.013 -3.061
295 HB2 ARG 39 HB2 ARG 39 -5.255 8.880 -5.345
296 HB3 ARG 39 HB1 ARG 39 -6.239 7.446 -5.473
297 HG2 ARG 39 HG2 ARG 39 -6.592 9.548 -3.365
298 HG3 ARG 39 HG1 ARG 39 -7.506 9.484 -4.883
299 HD2 ARG 39 HD2 ARG 39 -7.284 7.195 -2.998
300 HD3 ARG 39 HD1 ARG 39 -8.593 8.380 -2.874
301 HE ARG 39 HE ARG 39 -8.439 7.372 -5.512
302 HH11 ARG 39 HH11 ARG 39 -9.486 6.431 -2.293
303 HH12 ARG 39 HH12 ARG 39 -10.544 5.185 -2.871
304 HH21 ARG 39 HH21 ARG 39 -9.865 5.760 -6.262
305 HH22 ARG 39 HH22 ARG 39 -10.775 4.806 -5.127
306 H GLN 40 HN GLN 40 -3.027 6.040 -2.872
307 HA GLN 40 HA GLN 40 -2.591 4.634 -5.407
308 HB2 GLN 40 HB2 GLN 40 -0.618 5.138 -3.232
309 HB3 GLN 40 HB1 GLN 40 -0.270 4.431 -4.792
310 HG2 GLN 40 HG2 GLN 40 -0.823 6.538 -5.830
311 HG3 GLN 40 HG1 GLN 40 -1.158 7.242 -4.263
312 HE21 GLN 40 HE21 GLN 40 1.144 6.425 -6.578
313 HE22 GLN 40 HE22 GLN 40 2.536 6.987 -5.735
314 H THR 41 HN THR 41 -1.766 2.405 -5.094
315 HA THR 41 HA THR 41 -2.187 1.219 -2.523
316 HB THR 41 HB THR 41 -4.422 1.046 -3.045
317 HG1 THR 41 HG1 THR 41 -3.629 -1.039 -2.568
318 HG21 THR 41 HG21 THR 41 -4.312 1.917 -5.246
319 HG22 THR 41 HG22 THR 41 -5.264 0.428 -5.270
320 HG23 THR 41 HG23 THR 41 -3.600 0.428 -5.867
321 H GLN 42 HN GLN 42 -1.138 -0.747 -2.297
322 HA GLN 42 HA GLN 42 0.262 -1.727 -4.698
323 HB2 GLN 42 HB2 GLN 42 1.411 -1.673 -1.894
324 HB3 GLN 42 HB1 GLN 42 2.259 -2.067 -3.386
325 HG2 GLN 42 HG2 GLN 42 2.194 0.192 -4.115
326 HG3 GLN 42 HG1 GLN 42 1.073 0.635 -2.842
327 HE21 GLN 42 HE21 GLN 42 3.777 -1.441 -2.211
328 HE22 GLN 42 HE22 GLN 42 4.670 -0.286 -1.290
329 H TRP 43 HN TRP 43 -0.266 -3.762 -5.088
330 HA TRP 43 HA TRP 43 -1.433 -5.388 -2.969
331 HB2 TRP 43 HB2 TRP 43 -1.297 -5.800 -5.961
332 HB3 TRP 43 HB1 TRP 43 -2.077 -6.907 -4.835
333 HD1 TRP 43 HD1 TRP 43 -2.355 -3.065 -5.427
334 HE1 TRP 43 HE1 TRP 43 -4.849 -2.452 -5.476
335 HE3 TRP 43 HE3 TRP 43 -4.342 -7.721 -4.724
336 HZ2 TRP 43 HZ2 TRP 43 -7.333 -3.770 -5.272
337 HZ3 TRP 43 HZ3 TRP 43 -6.788 -7.957 -4.671
338 HH2 TRP 43 HH2 TRP 43 -8.252 -6.023 -4.939
339 H ASP 44 HN ASP 44 1.208 -5.375 -5.270
340 HA ASP 44 HA ASP 44 2.332 -7.752 -3.974
341 HB2 ASP 44 HB2 ASP 44 1.918 -8.049 -6.350
342 HB3 ASP 44 HB1 ASP 44 2.871 -6.612 -6.718
343 HA PRO 45 HA PRO 45 6.007 -4.493 -4.288
344 HB2 PRO 45 HB2 PRO 45 4.397 -2.008 -4.087
345 HB3 PRO 45 HB1 PRO 45 5.865 -2.328 -5.018
346 HG2 PRO 45 HG2 PRO 45 3.496 -2.136 -6.221
347 HG3 PRO 45 HG1 PRO 45 4.704 -3.319 -6.757
348 HD2 PRO 45 HD2 PRO 45 2.242 -3.734 -5.111
349 HD3 PRO 45 HD1 PRO 45 2.930 -4.755 -6.390
350 HA PRO 46 HA PRO 46 5.096 -4.414 0.113
351 HB2 PRO 46 HB2 PRO 46 7.816 -4.951 0.665
352 HB3 PRO 46 HB1 PRO 46 6.464 -6.082 0.704
353 HG2 PRO 46 HG2 PRO 46 8.573 -6.099 -1.098
354 HG3 PRO 46 HG1 PRO 46 7.060 -6.992 -1.272
355 HD2 PRO 46 HD2 PRO 46 7.938 -4.465 -2.562
356 HD3 PRO 46 HD1 PRO 46 6.840 -5.723 -3.165
357 H THR 47 HN THR 47 5.673 -3.061 1.845
358 HA THR 47 HA THR 47 6.011 -1.078 2.751
359 HB THR 47 HB THR 47 8.626 -0.535 2.314
360 HG1 THR 47 HG1 THR 47 8.784 -2.403 0.926
361 HG21 THR 47 HG21 THR 47 7.222 -1.012 4.370
362 HG22 THR 47 HG22 THR 47 8.935 -1.411 4.450
363 HG23 THR 47 HG23 THR 47 7.738 -2.683 4.188
364 H TRP 48 HN TRP 48 7.573 0.960 2.426
365 HA TRP 48 HA TRP 48 6.645 2.454 0.182
366 HB2 TRP 48 HB2 TRP 48 8.890 3.698 1.385
367 HB3 TRP 48 HB1 TRP 48 7.202 4.111 1.588
368 HD1 TRP 48 HD1 TRP 48 5.993 3.290 3.826
369 HE1 TRP 48 HE1 TRP 48 6.913 2.456 6.084
370 HE3 TRP 48 HE3 TRP 48 10.830 2.345 2.429
371 HZ2 TRP 48 HZ2 TRP 48 9.365 1.525 7.122
372 HZ3 TRP 48 HZ3 TRP 48 12.395 1.485 4.120
373 HH2 TRP 48 HH2 TRP 48 11.677 1.084 6.420
374 H GLU 49 HN GLU 49 9.618 0.974 1.241
375 HA GLU 49 HA GLU 49 10.819 1.472 -1.397
376 HB2 GLU 49 HB2 GLU 49 12.100 0.974 1.282
377 HB3 GLU 49 HB1 GLU 49 12.985 0.996 -0.237
378 HG2 GLU 49 HG2 GLU 49 12.062 3.269 -0.609
379 HG3 GLU 49 HG1 GLU 49 11.521 3.245 1.068
380 H SER 50 HN SER 50 11.898 -0.137 -2.463
381 HA SER 50 HA SER 50 11.498 -2.884 -1.481
382 HB2 SER 50 HB2 SER 50 12.158 -1.961 -4.294
383 HB3 SER 50 HB1 SER 50 11.707 -3.591 -3.792
384 HG SER 50 HG SER 50 9.850 -1.820 -2.973
385 HA PRO 51 HA PRO 51 15.784 -3.135 -0.572
386 HB2 PRO 51 HB2 PRO 51 16.360 -5.719 -1.284
387 HB3 PRO 51 HB1 PRO 51 15.532 -5.262 0.209
388 HG2 PRO 51 HG2 PRO 51 14.384 -6.232 -2.376
389 HG3 PRO 51 HG1 PRO 51 13.935 -6.668 -0.716
390 HD2 PRO 51 HD2 PRO 51 12.481 -4.934 -2.158
391 HD3 PRO 51 HD1 PRO 51 12.706 -4.728 -0.407
392 H GLY 52 HN GLY 52 17.951 -3.759 -1.484
393 HA2 GLY 52 HA2 GLY 52 18.285 -2.576 -4.008
394 HA3 GLY 52 HA1 GLY 52 19.515 -3.478 -3.135
395 H ASP 53 HN ASP 53 18.022 -5.965 -3.042
396 HA ASP 53 HA ASP 53 18.897 -7.015 -5.526
397 HB2 ASP 53 HB2 ASP 53 17.964 -9.163 -4.731
398 HB3 ASP 53 HB1 ASP 53 18.991 -8.390 -3.531
399 H ASP 54 HN ASP 54 15.748 -6.011 -4.328
400 HA ASP 54 HA ASP 54 14.407 -7.019 -6.690
401 HB2 ASP 54 HB2 ASP 54 13.500 -5.487 -4.271
402 HB3 ASP 54 HB1 ASP 54 12.473 -5.584 -5.696
403 H ALA 55 HN ALA 55 15.400 -3.896 -5.363
404 HA ALA 55 HA ALA 55 14.840 -2.699 -7.997
405 HB1 ALA 55 HB1 ALA 55 14.340 -0.597 -6.862
406 HB2 ALA 55 HB2 ALA 55 14.626 -1.364 -5.299
407 HB3 ALA 55 HB3 ALA 55 13.274 -1.886 -6.304
408 H SER 56 HN SER 56 16.965 -3.094 -8.699
409 HA SER 56 HA SER 56 19.116 -1.728 -7.286
410 HB2 SER 56 HB2 SER 56 19.205 -3.279 -9.891
411 HB3 SER 56 HB1 SER 56 20.589 -2.755 -8.930
412 HG SER 56 HG SER 56 19.063 -4.097 -7.284
Start of MODEL 15
1 H1 GLY 1 HT1 GLY 1 -8.635 3.243 2.824
2 H2 GLY 1 HT2 GLY 1 -6.957 3.290 3.040
3 H3 GLY 1 HT3 GLY 1 -7.986 3.533 4.368
4 HA2 GLY 1 HA1 GLY 1 -7.681 1.014 2.811
5 HA3 GLY 1 HA2 GLY 1 -7.059 1.310 4.430
6 H SER 2 HN SER 2 -8.328 0.857 6.120
7 HA SER 2 HA SER 2 -10.943 -0.194 5.820
8 HB2 SER 2 HB2 SER 2 -9.749 0.936 8.358
9 HB3 SER 2 HB1 SER 2 -10.921 -0.380 8.195
10 HG SER 2 HG SER 2 -9.352 -1.741 7.781
11 H ASP 3 HN ASP 3 -9.602 2.926 6.314
12 HA ASP 3 HA ASP 3 -12.055 4.192 7.172
13 HB2 ASP 3 HB2 ASP 3 -10.633 6.233 7.214
14 HB3 ASP 3 HB1 ASP 3 -9.964 4.913 8.166
15 H LEU 4 HN LEU 4 -9.854 4.380 4.397
16 HA LEU 4 HA LEU 4 -12.014 5.629 2.838
17 HB2 LEU 4 HB2 LEU 4 -9.016 5.936 2.658
18 HB3 LEU 4 HB1 LEU 4 -10.095 6.446 1.365
19 HG LEU 4 HG LEU 4 -10.043 7.516 4.187
20 HD11 LEU 4 HD11 LEU 4 -8.240 8.335 2.762
21 HD12 LEU 4 HD12 LEU 4 -9.406 9.608 3.116
22 HD13 LEU 4 HD13 LEU 4 -9.419 8.813 1.543
23 HD21 LEU 4 HD21 LEU 4 -11.786 9.051 3.490
24 HD22 LEU 4 HD22 LEU 4 -12.336 7.385 3.325
25 HD23 LEU 4 HD23 LEU 4 -11.840 8.293 1.898
26 HA PRO 5 HA PRO 5 -12.449 2.050 0.491
27 HB2 PRO 5 HB2 PRO 5 -13.091 3.086 -1.961
28 HB3 PRO 5 HB1 PRO 5 -14.201 3.039 -0.588
29 HG2 PRO 5 HG2 PRO 5 -12.488 5.296 -1.562
30 HG3 PRO 5 HG1 PRO 5 -14.183 5.324 -1.035
31 HD2 PRO 5 HD2 PRO 5 -12.215 6.132 0.579
32 HD3 PRO 5 HD1 PRO 5 -13.613 5.236 1.210
33 HA PRO 6 HA PRO 6 -8.786 0.807 -1.513
34 HB2 PRO 6 HB2 PRO 6 -10.425 -0.904 -3.279
35 HB3 PRO 6 HB1 PRO 6 -9.191 -1.358 -2.100
36 HG2 PRO 6 HG2 PRO 6 -11.776 -1.802 -1.615
37 HG3 PRO 6 HG1 PRO 6 -10.676 -1.287 -0.321
38 HD2 PRO 6 HD2 PRO 6 -12.651 0.338 -1.883
39 HD3 PRO 6 HD1 PRO 6 -12.309 0.355 -0.140
40 HA PRO 7 HA PRO 7 -8.333 3.064 -5.304
41 HB2 PRO 7 HB2 PRO 7 -5.680 1.921 -5.452
42 HB3 PRO 7 HB1 PRO 7 -6.129 3.561 -5.022
43 HG2 PRO 7 HG2 PRO 7 -5.058 1.844 -3.241
44 HG3 PRO 7 HG1 PRO 7 -6.241 3.081 -2.773
45 HD2 PRO 7 HD2 PRO 7 -6.686 0.168 -3.355
46 HD3 PRO 7 HD1 PRO 7 -7.278 1.140 -1.987
47 H SER 8 HN SER 8 -8.270 2.727 -7.517
48 HA SER 8 HA SER 8 -7.803 0.046 -8.549
49 HB2 SER 8 HB2 SER 8 -8.222 2.675 -10.017
50 HB3 SER 8 HB1 SER 8 -8.322 1.060 -10.712
51 HG SER 8 HG SER 8 -9.946 1.294 -8.562
52 HA PRO 9 HA PRO 9 -3.618 0.423 -8.314
53 HB2 PRO 9 HB2 PRO 9 -2.583 -0.680 -10.600
54 HB3 PRO 9 HB1 PRO 9 -3.282 -1.614 -9.276
55 HG2 PRO 9 HG2 PRO 9 -4.520 -0.787 -11.872
56 HG3 PRO 9 HG1 PRO 9 -4.641 -2.336 -11.016
57 HD2 PRO 9 HD2 PRO 9 -6.612 -0.500 -10.942
58 HD3 PRO 9 HD1 PRO 9 -6.241 -1.543 -9.552
59 HA PRO 10 HA PRO 10 -2.175 4.018 -10.552
60 HB2 PRO 10 HB2 PRO 10 -0.396 4.606 -8.487
61 HB3 PRO 10 HB1 PRO 10 -2.062 5.172 -8.617
62 HG2 PRO 10 HG2 PRO 10 -1.009 3.405 -6.676
63 HG3 PRO 10 HG1 PRO 10 -2.711 3.811 -6.938
64 HD2 PRO 10 HD2 PRO 10 -1.164 1.445 -7.863
65 HD3 PRO 10 HD1 PRO 10 -2.883 1.574 -7.427
66 H ALA 11 HN ALA 11 -0.347 4.585 -11.693
67 HA ALA 11 HA ALA 11 1.892 2.781 -11.842
68 HB1 ALA 11 HB1 ALA 11 1.188 4.082 -13.794
69 HB2 ALA 11 HB2 ALA 11 2.858 4.441 -13.353
70 HB3 ALA 11 HB3 ALA 11 1.572 5.577 -12.942
71 H ALA 12 HN ALA 12 1.030 5.699 -10.209
72 HA ALA 12 HA ALA 12 3.532 6.529 -9.252
73 HB1 ALA 12 HB1 ALA 12 0.810 6.986 -8.058
74 HB2 ALA 12 HB2 ALA 12 1.579 7.978 -9.296
75 HB3 ALA 12 HB3 ALA 12 2.273 7.892 -7.676
76 H ALA 13 HN ALA 13 1.747 3.822 -8.401
77 HA ALA 13 HA ALA 13 1.667 3.840 -5.626
78 HB1 ALA 13 HB1 ALA 13 0.384 2.314 -7.049
79 HB2 ALA 13 HB2 ALA 13 1.234 1.470 -5.754
80 HB3 ALA 13 HB3 ALA 13 1.863 1.419 -7.400
81 H THR 14 HN THR 14 4.361 2.995 -7.685
82 HA THR 14 HA THR 14 5.673 1.328 -5.791
83 HB THR 14 HB THR 14 6.081 1.116 -8.212
84 HG1 THR 14 HG1 THR 14 8.144 1.508 -6.348
85 HG21 THR 14 HG21 THR 14 7.540 3.744 -7.911
86 HG22 THR 14 HG22 THR 14 6.073 3.465 -8.852
87 HG23 THR 14 HG23 THR 14 7.591 2.707 -9.336
88 H ILE 15 HN ILE 15 5.486 4.730 -6.171
89 HA ILE 15 HA ILE 15 7.976 5.615 -5.331
90 HB ILE 15 HB ILE 15 5.940 6.886 -6.303
91 HG12 ILE 15 HG12 ILE 15 6.775 9.026 -5.395
92 HG13 ILE 15 HG11 ILE 15 7.666 8.144 -4.156
93 HG21 ILE 15 HG21 ILE 15 4.323 6.434 -4.613
94 HG22 ILE 15 HG22 ILE 15 4.681 8.159 -4.592
95 HG23 ILE 15 HG23 ILE 15 5.366 7.105 -3.358
96 HD11 ILE 15 HD11 ILE 15 9.090 8.848 -6.007
97 HD12 ILE 15 HD12 ILE 15 8.097 7.902 -7.118
98 HD13 ILE 15 HD13 ILE 15 9.026 7.094 -5.856
99 H VAL 16 HN VAL 16 7.575 7.282 -3.191
100 HA VAL 16 HA VAL 16 8.400 5.561 -1.066
101 HB VAL 16 HB VAL 16 7.739 8.486 -0.808
102 HG11 VAL 16 HG11 VAL 16 10.056 7.113 0.453
103 HG12 VAL 16 HG12 VAL 16 8.447 6.861 1.120
104 HG13 VAL 16 HG13 VAL 16 9.117 8.492 1.029
105 HG21 VAL 16 HG21 VAL 16 9.941 9.027 -1.601
106 HG22 VAL 16 HG22 VAL 16 9.116 8.071 -2.834
107 HG23 VAL 16 HG23 VAL 16 10.330 7.319 -1.803
108 H LEU 17 HN LEU 17 7.528 5.649 1.129
109 HA LEU 17 HA LEU 17 4.580 5.631 1.075
110 HB2 LEU 17 HB2 LEU 17 6.611 3.703 2.058
111 HB3 LEU 17 HB1 LEU 17 5.142 3.838 2.998
112 HG LEU 17 HG LEU 17 3.906 3.386 0.780
113 HD11 LEU 17 HD11 LEU 17 6.659 2.443 0.003
114 HD12 LEU 17 HD12 LEU 17 5.781 3.793 -0.718
115 HD13 LEU 17 HD13 LEU 17 5.170 2.148 -0.893
116 HD21 LEU 17 HD21 LEU 17 4.062 1.764 2.594
117 HD22 LEU 17 HD22 LEU 17 5.626 1.222 1.982
118 HD23 LEU 17 HD23 LEU 17 4.167 0.978 1.020
119 HA PRO 18 HA PRO 18 4.955 7.855 4.993
120 HB2 PRO 18 HB2 PRO 18 2.799 9.382 4.619
121 HB3 PRO 18 HB1 PRO 18 4.283 9.670 3.703
122 HG2 PRO 18 HG2 PRO 18 1.710 8.569 2.789
123 HG3 PRO 18 HG1 PRO 18 3.008 9.321 1.849
124 HD2 PRO 18 HD2 PRO 18 2.489 6.492 2.307
125 HD3 PRO 18 HD1 PRO 18 3.655 7.247 1.199
126 HA PRO 19 HA PRO 19 2.169 5.829 7.800
127 HB2 PRO 19 HB2 PRO 19 1.063 8.494 8.448
128 HB3 PRO 19 HB1 PRO 19 1.650 7.254 9.529
129 HG2 PRO 19 HG2 PRO 19 3.146 9.304 9.104
130 HG3 PRO 19 HG1 PRO 19 3.889 7.696 8.988
131 HD2 PRO 19 HD2 PRO 19 2.940 9.495 6.785
132 HD3 PRO 19 HD1 PRO 19 4.458 8.595 6.916
133 H ASN 20 HN ASN 20 0.755 8.095 5.619
134 HA ASN 20 HA ASN 20 -1.966 7.676 6.134
135 HB2 ASN 20 HB2 ASN 20 -0.743 8.436 3.482
136 HB3 ASN 20 HB1 ASN 20 -2.426 8.592 3.921
137 HD21 ASN 20 HD21 ASN 20 -2.441 10.742 3.568
138 HD22 ASN 20 HD22 ASN 20 -1.683 11.866 4.615
139 H TRP 21 HN TRP 21 0.259 5.498 4.797
140 HA TRP 21 HA TRP 21 -1.631 4.112 3.143
141 HB2 TRP 21 HB2 TRP 21 1.161 4.023 3.559
142 HB3 TRP 21 HB1 TRP 21 0.557 2.450 4.043
143 HD1 TRP 21 HD1 TRP 21 -0.990 1.185 2.088
144 HE1 TRP 21 HE1 TRP 21 -0.587 1.114 -0.451
145 HE3 TRP 21 HE3 TRP 21 2.114 5.211 1.646
146 HZ2 TRP 21 HZ2 TRP 21 0.867 2.555 -2.382
147 HZ3 TRP 21 HZ3 TRP 21 2.981 5.788 -0.583
148 HH2 TRP 21 HH2 TRP 21 2.370 4.488 -2.552
149 H LYS 22 HN LYS 22 -2.582 2.194 3.656
150 HA LYS 22 HA LYS 22 -2.864 1.637 6.529
151 HB2 LYS 22 HB2 LYS 22 -5.046 1.908 4.480
152 HB3 LYS 22 HB1 LYS 22 -5.286 1.209 6.064
153 HG2 LYS 22 HG2 LYS 22 -4.270 3.997 5.583
154 HG3 LYS 22 HG1 LYS 22 -5.948 3.578 5.949
155 HD2 LYS 22 HD2 LYS 22 -3.937 2.448 7.769
156 HD3 LYS 22 HD1 LYS 22 -4.104 4.192 7.821
157 HE2 LYS 22 HE2 LYS 22 -6.457 4.002 8.254
158 HE3 LYS 22 HE1 LYS 22 -6.378 2.250 8.086
159 HZ1 LYS 22 HZ1 LYS 22 -4.900 3.791 10.154
160 HZ2 LYS 22 HZ2 LYS 22 -5.062 2.108 10.045
161 HZ3 LYS 22 HZ3 LYS 22 -6.411 3.061 10.415
162 H THR 23 HN THR 23 -4.165 -0.391 6.843
163 HA THR 23 HA THR 23 -3.402 -2.462 4.909
164 HB THR 23 HB THR 23 -3.259 -3.951 7.026
165 HG1 THR 23 HG1 THR 23 -2.331 -1.686 8.354
166 HG21 THR 23 HG21 THR 23 -1.348 -2.037 5.899
167 HG22 THR 23 HG22 THR 23 -1.277 -3.797 5.941
168 HG23 THR 23 HG23 THR 23 -0.860 -2.858 7.379
169 H ALA 24 HN ALA 24 -4.986 -3.658 4.228
170 HA ALA 24 HA ALA 24 -7.148 -4.521 5.886
171 HB1 ALA 24 HB1 ALA 24 -8.967 -3.454 4.888
172 HB2 ALA 24 HB2 ALA 24 -8.009 -2.911 3.520
173 HB3 ALA 24 HB3 ALA 24 -7.794 -2.150 5.096
174 H ARG 25 HN ARG 25 -8.816 -5.644 4.305
175 HA ARG 25 HA ARG 25 -7.243 -7.070 2.274
176 HB2 ARG 25 HB2 ARG 25 -9.093 -8.194 4.340
177 HB3 ARG 25 HB1 ARG 25 -8.465 -9.118 3.014
178 HG2 ARG 25 HG2 ARG 25 -6.215 -8.816 3.890
179 HG3 ARG 25 HG1 ARG 25 -6.868 -7.854 5.218
180 HD2 ARG 25 HD2 ARG 25 -8.136 -9.758 6.012
181 HD3 ARG 25 HD1 ARG 25 -7.591 -10.724 4.642
182 HE ARG 25 HE ARG 25 -5.552 -9.634 6.427
183 HH11 ARG 25 HH11 ARG 25 -7.506 -12.367 5.464
184 HH12 ARG 25 HH12 ARG 25 -6.414 -13.553 6.119
185 HH21 ARG 25 HH21 ARG 25 -4.114 -11.183 7.324
186 HH22 ARG 25 HH22 ARG 25 -4.474 -12.883 7.158
187 H ASP 26 HN ASP 26 -8.466 -7.976 0.567
188 HA ASP 26 HA ASP 26 -11.075 -6.742 0.117
189 HB2 ASP 26 HB2 ASP 26 -9.156 -8.206 -1.692
190 HB3 ASP 26 HB1 ASP 26 -10.830 -7.957 -2.159
191 HA PRO 27 HA PRO 27 -13.893 -9.934 0.815
192 HB2 PRO 27 HB2 PRO 27 -14.379 -10.871 -1.822
193 HB3 PRO 27 HB1 PRO 27 -15.320 -9.707 -0.907
194 HG2 PRO 27 HG2 PRO 27 -13.164 -9.227 -2.869
195 HG3 PRO 27 HG1 PRO 27 -14.653 -8.306 -2.588
196 HD2 PRO 27 HD2 PRO 27 -12.376 -7.359 -1.710
197 HD3 PRO 27 HD1 PRO 27 -13.784 -7.323 -0.631
198 H GLU 28 HN GLU 28 -11.399 -10.839 -1.550
199 HA GLU 28 HA GLU 28 -11.827 -13.649 -0.953
200 HB2 GLU 28 HB2 GLU 28 -10.134 -12.265 -3.017
201 HB3 GLU 28 HB1 GLU 28 -10.190 -14.014 -2.808
202 HG2 GLU 28 HG2 GLU 28 -12.597 -12.315 -3.328
203 HG3 GLU 28 HG1 GLU 28 -11.673 -13.116 -4.601
204 H GLY 29 HN GLY 29 -10.765 -12.185 1.165
205 HA2 GLY 29 HA2 GLY 29 -9.340 -12.662 2.885
206 HA3 GLY 29 HA1 GLY 29 -8.936 -14.127 2.021
207 H LYS 30 HN LYS 30 -8.132 -11.547 0.044
208 HA LYS 30 HA LYS 30 -5.341 -11.796 0.822
209 HB2 LYS 30 HB2 LYS 30 -6.729 -10.696 -1.596
210 HB3 LYS 30 HB1 LYS 30 -5.073 -10.223 -1.251
211 HG2 LYS 30 HG2 LYS 30 -4.453 -12.028 -2.373
212 HG3 LYS 30 HG1 LYS 30 -5.026 -12.971 -0.998
213 HD2 LYS 30 HD2 LYS 30 -7.198 -13.230 -2.037
214 HD3 LYS 30 HD1 LYS 30 -6.711 -12.184 -3.375
215 HE2 LYS 30 HE2 LYS 30 -4.939 -13.804 -3.950
216 HE3 LYS 30 HE1 LYS 30 -5.511 -14.858 -2.659
217 HZ1 LYS 30 HZ1 LYS 30 -7.079 -14.025 -5.043
218 HZ2 LYS 30 HZ2 LYS 30 -7.638 -15.033 -3.796
219 HZ3 LYS 30 HZ3 LYS 30 -6.371 -15.545 -4.797
220 H ILE 31 HN ILE 31 -4.111 -10.196 1.644
221 HA ILE 31 HA ILE 31 -5.553 -7.811 2.614
222 HB ILE 31 HB ILE 31 -4.578 -9.105 4.385
223 HG12 ILE 31 HG12 ILE 31 -2.492 -7.252 4.698
224 HG13 ILE 31 HG11 ILE 31 -3.740 -6.427 3.788
225 HG21 ILE 31 HG21 ILE 31 -2.933 -10.399 3.229
226 HG22 ILE 31 HG22 ILE 31 -2.130 -9.512 4.524
227 HG23 ILE 31 HG23 ILE 31 -1.987 -8.956 2.857
228 HD11 ILE 31 HD11 ILE 31 -4.123 -7.816 6.419
229 HD12 ILE 31 HD12 ILE 31 -5.355 -6.957 5.496
230 HD13 ILE 31 HD13 ILE 31 -3.987 -6.075 6.174
231 H TYR 32 HN TYR 32 -4.821 -5.767 2.010
232 HA TYR 32 HA TYR 32 -2.380 -5.611 0.354
233 HB2 TYR 32 HB2 TYR 32 -5.000 -4.203 -0.236
234 HB3 TYR 32 HB1 TYR 32 -3.509 -4.049 -1.156
235 HD1 TYR 32 HD2 TYR 32 -6.302 -6.301 -0.322
236 HD2 TYR 32 HD1 TYR 32 -2.890 -5.671 -2.779
237 HE1 TYR 32 HE2 TYR 32 -6.998 -8.173 -1.759
238 HE2 TYR 32 HE1 TYR 32 -3.571 -7.537 -4.217
239 HH TYR 32 HH TYR 32 -4.942 -9.615 -3.982
240 H TYR 33 HN TYR 33 -1.961 -3.167 -0.074
241 HA TYR 33 HA TYR 33 -2.341 -1.653 2.418
242 HB2 TYR 33 HB2 TYR 33 -0.099 -1.577 0.392
243 HB3 TYR 33 HB1 TYR 33 -0.241 -0.483 1.754
244 HD1 TYR 33 HD1 TYR 33 0.437 -3.948 0.743
245 HD2 TYR 33 HD2 TYR 33 0.304 -1.205 3.990
246 HE1 TYR 33 HE1 TYR 33 1.641 -5.564 2.146
247 HE2 TYR 33 HE2 TYR 33 1.506 -2.818 5.406
248 HH TYR 33 HH TYR 33 2.920 -5.709 4.097
249 H TYR 34 HN TYR 34 -2.972 0.538 2.216
250 HA TYR 34 HA TYR 34 -3.697 1.440 -0.491
251 HB2 TYR 34 HB2 TYR 34 -5.634 1.677 1.804
252 HB3 TYR 34 HB1 TYR 34 -5.945 1.932 0.094
253 HD1 TYR 34 HD1 TYR 34 -6.126 -0.017 -1.427
254 HD2 TYR 34 HD2 TYR 34 -5.789 -0.502 2.781
255 HE1 TYR 34 HE1 TYR 34 -6.929 -2.329 -1.635
256 HE2 TYR 34 HE2 TYR 34 -6.591 -2.816 2.587
257 HH TYR 34 HH TYR 34 -7.789 -4.238 1.112
258 H HIS 35 HN HIS 35 -3.178 3.504 -0.866
259 HA HIS 35 HA HIS 35 -2.584 5.215 1.435
260 HB2 HIS 35 HB2 HIS 35 -1.067 5.052 -0.657
261 HB3 HIS 35 HB1 HIS 35 -2.303 5.985 -1.471
262 HD1 HIS 35 HD1 HIS 35 0.724 6.870 -0.840
263 HD2 HIS 35 HD2 HIS 35 -2.720 8.114 1.132
264 HE1 HIS 35 HE1 HIS 35 1.282 9.100 0.154
265 HE2 HIS 35 HE2 HIS 35 -0.881 9.944 1.116
266 H VAL 36 HN VAL 36 -3.995 6.629 2.136
267 HA VAL 36 HA VAL 36 -6.639 6.427 1.159
268 HB VAL 36 HB VAL 36 -6.979 8.207 3.017
269 HG11 VAL 36 HG11 VAL 36 -6.388 6.301 4.732
270 HG12 VAL 36 HG12 VAL 36 -6.144 5.361 3.258
271 HG13 VAL 36 HG13 VAL 36 -7.705 6.107 3.576
272 HG21 VAL 36 HG21 VAL 36 -4.810 9.081 3.290
273 HG22 VAL 36 HG22 VAL 36 -4.064 7.477 3.311
274 HG23 VAL 36 HG23 VAL 36 -5.043 8.024 4.685
275 H ILE 37 HN ILE 37 -4.332 9.170 1.172
276 HA ILE 37 HA ILE 37 -6.174 10.953 -0.009
277 HB ILE 37 HB ILE 37 -3.207 11.055 0.381
278 HG12 ILE 37 HG12 ILE 37 -4.086 13.216 1.554
279 HG13 ILE 37 HG11 ILE 37 -5.643 12.416 1.393
280 HG21 ILE 37 HG21 ILE 37 -3.591 12.083 -1.809
281 HG22 ILE 37 HG22 ILE 37 -3.148 13.291 -0.603
282 HG23 ILE 37 HG23 ILE 37 -4.830 13.122 -1.103
283 HD11 ILE 37 HD11 ILE 37 -3.261 11.423 2.897
284 HD12 ILE 37 HD12 ILE 37 -4.722 10.487 2.605
285 HD13 ILE 37 HD13 ILE 37 -4.804 11.968 3.557
286 H THR 38 HN THR 38 -3.410 9.211 -1.355
287 HA THR 38 HA THR 38 -3.788 10.461 -3.902
288 HB THR 38 HB THR 38 -1.788 8.976 -4.488
289 HG1 THR 38 HG1 THR 38 -0.758 8.075 -2.690
290 HG21 THR 38 HG21 THR 38 -1.691 10.971 -2.233
291 HG22 THR 38 HG22 THR 38 -1.559 11.332 -3.957
292 HG23 THR 38 HG23 THR 38 -0.279 10.431 -3.144
293 H ARG 39 HN ARG 39 -4.906 7.558 -2.524
294 HA ARG 39 HA ARG 39 -5.911 5.702 -3.332
295 HB2 ARG 39 HB2 ARG 39 -6.122 7.519 -5.675
296 HB3 ARG 39 HB1 ARG 39 -6.367 5.812 -5.964
297 HG2 ARG 39 HG2 ARG 39 -8.495 6.721 -5.616
298 HG3 ARG 39 HG1 ARG 39 -8.083 5.886 -4.114
299 HD2 ARG 39 HD2 ARG 39 -7.192 8.088 -3.314
300 HD3 ARG 39 HD1 ARG 39 -7.999 8.826 -4.688
301 HE ARG 39 HE ARG 39 -9.898 7.268 -3.398
302 HH11 ARG 39 HH11 ARG 39 -7.959 10.090 -2.653
303 HH12 ARG 39 HH12 ARG 39 -9.135 10.764 -1.566
304 HH21 ARG 39 HH21 ARG 39 -11.431 8.140 -1.987
305 HH22 ARG 39 HH22 ARG 39 -11.128 9.651 -1.184
306 H GLN 40 HN GLN 40 -3.350 5.395 -2.881
307 HA GLN 40 HA GLN 40 -2.351 3.888 -5.190
308 HB2 GLN 40 HB2 GLN 40 -0.883 4.880 -2.780
309 HB3 GLN 40 HB1 GLN 40 -0.154 4.021 -4.115
310 HG2 GLN 40 HG2 GLN 40 -0.622 5.855 -5.553
311 HG3 GLN 40 HG1 GLN 40 -1.476 6.709 -4.290
312 HE21 GLN 40 HE21 GLN 40 1.553 5.802 -5.591
313 HE22 GLN 40 HE22 GLN 40 2.511 6.804 -4.582
314 H THR 41 HN THR 41 -1.212 1.855 -4.561
315 HA THR 41 HA THR 41 -2.092 0.669 -2.104
316 HB THR 41 HB THR 41 -4.086 0.153 -3.074
317 HG1 THR 41 HG1 THR 41 -3.242 -1.830 -2.502
318 HG21 THR 41 HG21 THR 41 -3.674 1.145 -5.201
319 HG22 THR 41 HG22 THR 41 -4.380 -0.459 -5.445
320 HG23 THR 41 HG23 THR 41 -2.650 -0.207 -5.694
321 H GLN 42 HN GLN 42 -0.937 -1.195 -1.540
322 HA GLN 42 HA GLN 42 1.138 -2.020 -3.462
323 HB2 GLN 42 HB2 GLN 42 1.391 -1.803 -0.457
324 HB3 GLN 42 HB1 GLN 42 2.650 -2.326 -1.566
325 HG2 GLN 42 HG2 GLN 42 1.395 0.382 -1.753
326 HG3 GLN 42 HG1 GLN 42 2.753 0.047 -0.688
327 HE21 GLN 42 HE21 GLN 42 4.149 1.384 -1.776
328 HE22 GLN 42 HE22 GLN 42 4.740 1.046 -3.360
329 H TRP 43 HN TRP 43 1.066 -4.090 -3.946
330 HA TRP 43 HA TRP 43 -0.300 -5.976 -2.174
331 HB2 TRP 43 HB2 TRP 43 -0.931 -6.104 -4.490
332 HB3 TRP 43 HB1 TRP 43 0.745 -6.175 -5.006
333 HD1 TRP 43 HD1 TRP 43 1.036 -8.472 -6.054
334 HE1 TRP 43 HE1 TRP 43 0.525 -10.902 -5.380
335 HE3 TRP 43 HE3 TRP 43 -1.487 -7.590 -1.682
336 HZ2 TRP 43 HZ2 TRP 43 -0.765 -12.261 -3.269
337 HZ3 TRP 43 HZ3 TRP 43 -2.319 -9.517 -0.400
338 HH2 TRP 43 HH2 TRP 43 -1.965 -11.802 -1.177
339 H ASP 44 HN ASP 44 2.842 -5.244 -3.546
340 HA ASP 44 HA ASP 44 3.986 -7.695 -2.445
341 HB2 ASP 44 HB2 ASP 44 4.402 -7.111 -4.801
342 HB3 ASP 44 HB1 ASP 44 5.206 -5.633 -4.288
343 HA PRO 45 HA PRO 45 6.737 -4.558 -0.219
344 HB2 PRO 45 HB2 PRO 45 6.063 -1.835 -0.628
345 HB3 PRO 45 HB1 PRO 45 7.429 -2.713 -1.315
346 HG2 PRO 45 HG2 PRO 45 5.275 -1.693 -2.755
347 HG3 PRO 45 HG1 PRO 45 6.412 -2.924 -3.329
348 HD2 PRO 45 HD2 PRO 45 3.671 -3.258 -2.185
349 HD3 PRO 45 HD1 PRO 45 4.469 -4.156 -3.496
350 HA PRO 46 HA PRO 46 3.928 -3.941 3.248
351 HB2 PRO 46 HB2 PRO 46 6.474 -3.585 4.683
352 HB3 PRO 46 HB1 PRO 46 5.158 -4.723 4.988
353 HG2 PRO 46 HG2 PRO 46 7.484 -5.523 3.969
354 HG3 PRO 46 HG1 PRO 46 5.953 -6.262 3.470
355 HD2 PRO 46 HD2 PRO 46 7.640 -4.231 2.047
356 HD3 PRO 46 HD1 PRO 46 6.769 -5.632 1.390
357 H THR 47 HN THR 47 3.657 -2.217 4.854
358 HA THR 47 HA THR 47 3.804 0.303 3.582
359 HB THR 47 HB THR 47 1.956 -0.362 5.087
360 HG1 THR 47 HG1 THR 47 2.052 1.718 6.372
361 HG21 THR 47 HG21 THR 47 3.469 -1.418 6.802
362 HG22 THR 47 HG22 THR 47 2.164 -0.425 7.442
363 HG23 THR 47 HG23 THR 47 3.808 0.212 7.377
364 H TRP 48 HN TRP 48 4.244 1.969 5.789
365 HA TRP 48 HA TRP 48 6.989 2.478 5.249
366 HB2 TRP 48 HB2 TRP 48 5.236 4.236 5.687
367 HB3 TRP 48 HB1 TRP 48 5.364 3.808 7.391
368 HD1 TRP 48 HD1 TRP 48 8.572 3.813 5.397
369 HE1 TRP 48 HE1 TRP 48 10.027 5.801 6.131
370 HE3 TRP 48 HE3 TRP 48 5.168 6.303 8.286
371 HZ2 TRP 48 HZ2 TRP 48 9.769 8.116 7.696
372 HZ3 TRP 48 HZ3 TRP 48 5.857 8.401 9.365
373 HH2 TRP 48 HH2 TRP 48 8.111 9.289 9.076
374 H GLU 49 HN GLU 49 5.250 1.433 8.169
375 HA GLU 49 HA GLU 49 7.818 0.676 9.348
376 HB2 GLU 49 HB2 GLU 49 5.135 1.268 10.558
377 HB3 GLU 49 HB1 GLU 49 6.347 0.351 11.438
378 HG2 GLU 49 HG2 GLU 49 6.694 2.485 12.186
379 HG3 GLU 49 HG1 GLU 49 7.897 2.272 10.920
380 H SER 50 HN SER 50 8.348 -1.356 9.547
381 HA SER 50 HA SER 50 6.299 -3.442 9.593
382 HB2 SER 50 HB2 SER 50 8.730 -3.544 7.779
383 HB3 SER 50 HB1 SER 50 7.460 -4.763 7.907
384 HG SER 50 HG SER 50 6.399 -2.338 7.386
385 HA PRO 51 HA PRO 51 8.834 -4.615 13.028
386 HB2 PRO 51 HB2 PRO 51 8.074 -7.257 13.195
387 HB3 PRO 51 HB1 PRO 51 7.148 -5.907 13.856
388 HG2 PRO 51 HG2 PRO 51 6.773 -7.385 11.283
389 HG3 PRO 51 HG1 PRO 51 5.552 -6.791 12.426
390 HD2 PRO 51 HD2 PRO 51 6.091 -5.490 10.137
391 HD3 PRO 51 HD1 PRO 51 5.679 -4.622 11.629
392 H GLY 52 HN GLY 52 10.541 -6.023 13.654
393 HA2 GLY 52 HA2 GLY 52 12.357 -6.643 11.587
394 HA3 GLY 52 HA1 GLY 52 12.516 -7.127 13.270
395 H ASP 53 HN ASP 53 9.832 -8.455 13.088
396 HA ASP 53 HA ASP 53 10.698 -11.054 12.372
397 HB2 ASP 53 HB2 ASP 53 8.996 -10.709 14.079
398 HB3 ASP 53 HB1 ASP 53 7.916 -9.981 12.897
399 H ASP 54 HN ASP 54 8.781 -8.608 10.712
400 HA ASP 54 HA ASP 54 8.244 -10.448 8.513
401 HB2 ASP 54 HB2 ASP 54 7.168 -7.749 9.274
402 HB3 ASP 54 HB1 ASP 54 6.934 -8.382 7.648
403 H ALA 55 HN ALA 55 9.874 -7.357 9.103
404 HA ALA 55 HA ALA 55 10.709 -7.252 6.309
405 HB1 ALA 55 HB1 ALA 55 9.802 -5.217 7.324
406 HB2 ALA 55 HB2 ALA 55 11.475 -4.997 6.811
407 HB3 ALA 55 HB3 ALA 55 11.099 -5.239 8.517
408 H SER 56 HN SER 56 12.903 -6.963 5.719
409 HA SER 56 HA SER 56 14.747 -8.429 7.413
410 HB2 SER 56 HB2 SER 56 15.059 -7.329 4.605
411 HB3 SER 56 HB1 SER 56 16.227 -8.358 5.434
412 HG SER 56 HG SER 56 14.410 -9.894 5.636