Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
474290 | 2klz RC | 16405 | 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 -23.274 5.250 1.941
2 H2 GLY 1 HT2 GLY 1 -24.525 4.213 2.423
3 H3 GLY 1 HT3 GLY 1 -24.088 4.310 0.790
4 HA2 GLY 1 HA1 GLY 1 -22.356 3.290 2.972
5 HA3 GLY 1 HA2 GLY 1 -23.251 2.284 1.839
6 H SER 2 HN SER 2 -21.309 5.244 1.438
7 HA SER 2 HA SER 2 -20.082 4.170 -0.932
8 HB2 SER 2 HB2 SER 2 -20.643 6.582 -0.698
9 HB3 SER 2 HB1 SER 2 -19.431 6.716 0.574
10 HG SER 2 HG SER 2 -18.441 7.339 -1.310
11 H LEU 3 HN LEU 3 -18.721 2.538 -0.595
12 HA LEU 3 HA LEU 3 -16.917 2.464 1.652
13 HB2 LEU 3 HB2 LEU 3 -17.015 0.734 -0.823
14 HB3 LEU 3 HB1 LEU 3 -16.094 0.393 0.629
15 HG LEU 3 HG LEU 3 -19.107 0.517 0.472
16 HD11 LEU 3 HD11 LEU 3 -19.002 -1.906 0.785
17 HD12 LEU 3 HD12 LEU 3 -17.241 -1.840 0.686
18 HD13 LEU 3 HD13 LEU 3 -18.222 -1.407 -0.715
19 HD21 LEU 3 HD21 LEU 3 -19.024 -0.413 2.735
20 HD22 LEU 3 HD22 LEU 3 -18.262 1.176 2.655
21 HD23 LEU 3 HD23 LEU 3 -17.264 -0.279 2.723
22 H ASP 4 HN ASP 4 -16.858 3.350 -1.687
23 HA ASP 4 HA ASP 4 -14.113 3.446 -2.198
24 HB2 ASP 4 HB2 ASP 4 -16.303 5.242 -3.268
25 HB3 ASP 4 HB1 ASP 4 -14.703 5.051 -3.979
26 H GLU 5 HN GLU 5 -16.264 5.731 -0.627
27 HA GLU 5 HA GLU 5 -14.714 8.000 -0.498
28 HB2 GLU 5 HB2 GLU 5 -17.028 7.774 0.383
29 HB3 GLU 5 HB1 GLU 5 -16.392 6.867 1.747
30 HG2 GLU 5 HG2 GLU 5 -16.843 9.180 2.338
31 HG3 GLU 5 HG1 GLU 5 -15.125 8.803 2.471
32 H ASP 6 HN ASP 6 -14.700 5.305 1.827
33 HA ASP 6 HA ASP 6 -12.512 6.340 3.327
34 HB2 ASP 6 HB2 ASP 6 -13.690 3.555 3.210
35 HB3 ASP 6 HB1 ASP 6 -12.450 4.054 4.354
36 H GLU 7 HN GLU 7 -12.834 4.204 0.598
37 HA GLU 7 HA GLU 7 -10.197 3.169 0.650
38 HB2 GLU 7 HB2 GLU 7 -12.362 3.263 -1.429
39 HB3 GLU 7 HB1 GLU 7 -10.749 2.676 -1.831
40 HG2 GLU 7 HG2 GLU 7 -10.890 0.971 -0.152
41 HG3 GLU 7 HG1 GLU 7 -12.431 1.602 0.415
42 H GLU 8 HN GLU 8 -11.633 6.034 -0.785
43 HA GLU 8 HA GLU 8 -9.532 6.905 -2.383
44 HB2 GLU 8 HB2 GLU 8 -11.520 8.417 -0.700
45 HB3 GLU 8 HB1 GLU 8 -10.332 9.241 -1.699
46 HG2 GLU 8 HG2 GLU 8 -12.346 7.263 -2.745
47 HG3 GLU 8 HG1 GLU 8 -12.565 9.013 -2.749
48 H ASP 9 HN ASP 9 -10.088 7.469 1.075
49 HA ASP 9 HA ASP 9 -7.603 8.848 1.415
50 HB2 ASP 9 HB2 ASP 9 -9.584 9.259 2.861
51 HB3 ASP 9 HB1 ASP 9 -9.392 7.643 3.537
52 H LEU 10 HN LEU 10 -8.666 5.544 1.677
53 HA LEU 10 HA LEU 10 -6.478 4.525 3.149
54 HB2 LEU 10 HB2 LEU 10 -8.702 3.392 2.666
55 HB3 LEU 10 HB1 LEU 10 -8.082 3.034 1.069
56 HG LEU 10 HG LEU 10 -7.978 1.166 2.788
57 HD11 LEU 10 HD11 LEU 10 -5.779 0.387 2.053
58 HD12 LEU 10 HD12 LEU 10 -5.411 2.005 1.453
59 HD13 LEU 10 HD13 LEU 10 -6.713 1.068 0.719
60 HD21 LEU 10 HD21 LEU 10 -6.242 1.192 4.419
61 HD22 LEU 10 HD22 LEU 10 -7.205 2.658 4.628
62 HD23 LEU 10 HD23 LEU 10 -5.634 2.739 3.831
63 H GLN 11 HN GLN 11 -7.088 4.672 -0.375
64 HA GLN 11 HA GLN 11 -4.475 3.701 -0.998
65 HB2 GLN 11 HB2 GLN 11 -4.970 4.243 -3.300
66 HB3 GLN 11 HB1 GLN 11 -6.357 3.455 -2.567
67 HG2 GLN 11 HG2 GLN 11 -7.425 5.658 -2.291
68 HG3 GLN 11 HG1 GLN 11 -6.046 6.399 -3.105
69 HE21 GLN 11 HE21 GLN 11 -7.267 7.169 -4.814
70 HE22 GLN 11 HE22 GLN 11 -7.962 6.126 -6.011
71 H ARG 12 HN ARG 12 -5.819 6.798 -0.294
72 HA ARG 12 HA ARG 12 -3.705 8.444 -1.151
73 HB2 ARG 12 HB2 ARG 12 -5.893 9.291 -0.372
74 HB3 ARG 12 HB1 ARG 12 -5.532 8.733 1.251
75 HG2 ARG 12 HG2 ARG 12 -3.796 10.758 -0.121
76 HG3 ARG 12 HG1 ARG 12 -5.272 11.223 0.724
77 HD2 ARG 12 HD2 ARG 12 -2.817 9.901 1.867
78 HD3 ARG 12 HD1 ARG 12 -3.466 11.497 2.247
79 HE ARG 12 HE ARG 12 -5.355 9.441 2.833
80 HH11 ARG 12 HH11 ARG 12 -2.592 11.172 4.066
81 HH12 ARG 12 HH12 ARG 12 -2.832 10.663 5.712
82 HH21 ARG 12 HH21 ARG 12 -5.727 8.802 5.012
83 HH22 ARG 12 HH22 ARG 12 -4.604 9.307 6.240
84 H ALA 13 HN ALA 13 -4.295 6.871 1.987
85 HA ALA 13 HA ALA 13 -1.901 7.500 3.236
86 HB1 ALA 13 HB1 ALA 13 -2.328 5.516 4.643
87 HB2 ALA 13 HB2 ALA 13 -3.606 5.030 3.527
88 HB3 ALA 13 HB3 ALA 13 -3.755 6.530 4.438
89 H LEU 14 HN LEU 14 -2.681 4.798 1.078
90 HA LEU 14 HA LEU 14 -0.220 3.463 1.245
91 HB2 LEU 14 HB2 LEU 14 -2.172 3.642 -1.048
92 HB3 LEU 14 HB1 LEU 14 -0.806 2.539 -1.000
93 HG LEU 14 HG LEU 14 -3.124 2.528 0.938
94 HD11 LEU 14 HD11 LEU 14 -3.727 0.419 -0.170
95 HD12 LEU 14 HD12 LEU 14 -2.438 0.681 -1.345
96 HD13 LEU 14 HD13 LEU 14 -3.805 1.794 -1.274
97 HD21 LEU 14 HD21 LEU 14 -2.162 0.426 1.730
98 HD22 LEU 14 HD22 LEU 14 -1.036 1.766 1.955
99 HD23 LEU 14 HD23 LEU 14 -0.801 0.628 0.627
100 H ALA 15 HN ALA 15 -1.330 5.880 -1.130
101 HA ALA 15 HA ALA 15 1.102 6.097 -2.532
102 HB1 ALA 15 HB1 ALA 15 0.206 8.181 -3.416
103 HB2 ALA 15 HB2 ALA 15 -1.036 8.196 -2.164
104 HB3 ALA 15 HB3 ALA 15 -1.037 6.931 -3.396
105 H LEU 16 HN LEU 16 -0.132 7.687 0.327
106 HA LEU 16 HA LEU 16 1.806 9.654 0.680
107 HB2 LEU 16 HB2 LEU 16 -0.363 9.335 1.916
108 HB3 LEU 16 HB1 LEU 16 0.415 8.066 2.837
109 HG LEU 16 HG LEU 16 1.631 10.797 2.825
110 HD11 LEU 16 HD11 LEU 16 0.142 11.086 4.938
111 HD12 LEU 16 HD12 LEU 16 -0.923 9.934 4.110
112 HD13 LEU 16 HD13 LEU 16 -0.509 11.470 3.343
113 HD21 LEU 16 HD21 LEU 16 2.310 10.155 5.058
114 HD22 LEU 16 HD22 LEU 16 2.769 8.889 3.916
115 HD23 LEU 16 HD23 LEU 16 1.358 8.675 4.952
116 H SER 17 HN SER 17 1.680 6.332 1.972
117 HA SER 17 HA SER 17 4.256 6.416 3.143
118 HB2 SER 17 HB2 SER 17 2.605 4.025 2.294
119 HB3 SER 17 HB1 SER 17 4.010 3.974 3.362
120 HG SER 17 HG SER 17 2.775 5.538 4.685
121 H ARG 18 HN ARG 18 3.142 5.756 -0.081
122 HA ARG 18 HA ARG 18 5.376 4.406 -1.110
123 HB2 ARG 18 HB2 ARG 18 3.375 6.255 -2.382
124 HB3 ARG 18 HB1 ARG 18 4.706 5.574 -3.304
125 HG2 ARG 18 HG2 ARG 18 3.916 3.323 -2.749
126 HG3 ARG 18 HG1 ARG 18 2.558 4.031 -1.874
127 HD2 ARG 18 HD2 ARG 18 1.937 3.330 -4.146
128 HD3 ARG 18 HD1 ARG 18 1.744 5.067 -3.901
129 HE ARG 18 HE ARG 18 4.076 5.153 -5.012
130 HH11 ARG 18 HH11 ARG 18 1.501 2.912 -5.821
131 HH12 ARG 18 HH12 ARG 18 2.030 2.700 -7.470
132 HH21 ARG 18 HH21 ARG 18 4.752 4.896 -7.175
133 HH22 ARG 18 HH22 ARG 18 3.874 3.849 -8.250
134 H GLN 19 HN GLN 19 4.677 7.886 -0.877
135 HA GLN 19 HA GLN 19 7.295 8.541 -1.893
136 HB2 GLN 19 HB2 GLN 19 6.625 10.912 -1.386
137 HB3 GLN 19 HB1 GLN 19 5.594 10.064 -2.524
138 HG2 GLN 19 HG2 GLN 19 3.949 10.940 -1.290
139 HG3 GLN 19 HG1 GLN 19 4.278 9.575 -0.227
140 HE21 GLN 19 HE21 GLN 19 3.192 12.237 0.328
141 HE22 GLN 19 HE22 GLN 19 4.221 12.913 1.552
142 H GLU 20 HN GLU 20 5.867 8.059 1.238
143 HA GLU 20 HA GLU 20 7.793 9.300 2.851
144 HB2 GLU 20 HB2 GLU 20 6.186 6.783 3.259
145 HB3 GLU 20 HB1 GLU 20 7.277 7.410 4.486
146 HG2 GLU 20 HG2 GLU 20 5.952 9.552 4.386
147 HG3 GLU 20 HG1 GLU 20 4.774 8.669 3.411
148 H ILE 21 HN ILE 21 7.680 5.952 1.665
149 HA ILE 21 HA ILE 21 10.378 5.458 2.531
150 HB ILE 21 HB ILE 21 8.347 3.799 1.054
151 HG12 ILE 21 HG12 ILE 21 8.783 2.266 3.025
152 HG13 ILE 21 HG11 ILE 21 9.747 3.561 3.718
153 HG21 ILE 21 HG21 ILE 21 10.000 1.928 1.110
154 HG22 ILE 21 HG22 ILE 21 11.243 3.119 1.495
155 HG23 ILE 21 HG23 ILE 21 10.376 3.213 -0.037
156 HD11 ILE 21 HD11 ILE 21 6.815 3.705 3.062
157 HD12 ILE 21 HD12 ILE 21 7.785 5.004 3.751
158 HD13 ILE 21 HD13 ILE 21 7.522 3.521 4.669
159 H ASP 22 HN ASP 22 8.929 4.991 -0.675
160 HA ASP 22 HA ASP 22 9.996 4.771 -2.700
161 HB2 ASP 22 HB2 ASP 22 9.232 7.245 -2.278
162 HB3 ASP 22 HB1 ASP 22 10.961 7.573 -2.263
163 H MET 23 HN MET 23 11.589 3.327 -1.448
164 HA MET 23 HA MET 23 14.303 4.250 -1.974
165 HB2 MET 23 HB2 MET 23 13.582 4.698 0.469
166 HB3 MET 23 HB1 MET 23 13.637 2.952 0.664
167 HG2 MET 23 HG2 MET 23 15.687 3.921 1.439
168 HG3 MET 23 HG1 MET 23 15.998 2.976 -0.017
169 HE1 MET 23 HE1 MET 23 15.435 6.580 1.421
170 HE2 MET 23 HE2 MET 23 14.294 6.516 0.077
171 HE3 MET 23 HE3 MET 23 15.697 7.581 -0.008
172 H GLU 24 HN GLU 24 15.292 2.696 -3.096
173 HA GLU 24 HA GLU 24 13.885 0.153 -3.344
174 HB2 GLU 24 HB2 GLU 24 16.172 1.175 -5.016
175 HB3 GLU 24 HB1 GLU 24 15.051 -0.118 -5.417
176 HG2 GLU 24 HG2 GLU 24 14.372 2.803 -5.156
177 HG3 GLU 24 HG1 GLU 24 14.557 1.909 -6.661
178 H ASP 25 HN ASP 25 15.053 -0.077 -0.992
179 HA ASP 25 HA ASP 25 17.122 -2.052 -1.597
180 HB2 ASP 25 HB2 ASP 25 18.336 -1.363 0.556
181 HB3 ASP 25 HB1 ASP 25 18.544 -0.345 -0.862
182 H GLU 26 HN GLU 26 16.497 -1.261 1.720
183 HA GLU 26 HA GLU 26 15.312 -3.898 2.118
184 HB2 GLU 26 HB2 GLU 26 17.145 -2.702 3.564
185 HB3 GLU 26 HB1 GLU 26 15.784 -1.854 4.278
186 HG2 GLU 26 HG2 GLU 26 15.931 -4.843 4.170
187 HG3 GLU 26 HG1 GLU 26 16.651 -3.911 5.479
188 H GLU 27 HN GLU 27 14.587 -0.495 2.542
189 HA GLU 27 HA GLU 27 11.948 -0.704 3.444
190 HB2 GLU 27 HB2 GLU 27 13.278 1.434 1.777
191 HB3 GLU 27 HB1 GLU 27 11.690 1.599 2.517
192 HG2 GLU 27 HG2 GLU 27 12.704 1.276 4.725
193 HG3 GLU 27 HG1 GLU 27 14.290 1.178 3.961
194 H ALA 28 HN ALA 28 13.348 -1.234 0.345
195 HA ALA 28 HA ALA 28 11.166 -0.926 -1.357
196 HB1 ALA 28 HB1 ALA 28 13.271 -3.067 -1.581
197 HB2 ALA 28 HB2 ALA 28 13.518 -1.384 -2.034
198 HB3 ALA 28 HB3 ALA 28 12.315 -2.356 -2.883
199 H ASP 29 HN ASP 29 11.805 -3.366 1.035
200 HA ASP 29 HA ASP 29 9.928 -5.288 0.076
201 HB2 ASP 29 HB2 ASP 29 11.678 -5.856 1.745
202 HB3 ASP 29 HB1 ASP 29 10.851 -4.843 2.928
203 H LEU 30 HN LEU 30 9.759 -2.648 2.423
204 HA LEU 30 HA LEU 30 7.016 -2.908 3.046
205 HB2 LEU 30 HB2 LEU 30 8.823 -0.482 3.107
206 HB3 LEU 30 HB1 LEU 30 7.180 -0.485 3.714
207 HG LEU 30 HG LEU 30 7.917 -2.334 5.305
208 HD11 LEU 30 HD11 LEU 30 10.651 -1.341 4.525
209 HD12 LEU 30 HD12 LEU 30 9.993 -2.932 4.142
210 HD13 LEU 30 HD13 LEU 30 10.276 -2.476 5.823
211 HD21 LEU 30 HD21 LEU 30 7.510 -0.011 5.976
212 HD22 LEU 30 HD22 LEU 30 9.188 0.384 5.600
213 HD23 LEU 30 HD23 LEU 30 8.819 -0.749 6.901
214 H ARG 31 HN ARG 31 8.778 -1.088 0.610
215 HA ARG 31 HA ARG 31 6.697 0.227 -0.683
216 HB2 ARG 31 HB2 ARG 31 9.003 0.636 -1.250
217 HB3 ARG 31 HB1 ARG 31 9.229 -1.031 -1.754
218 HG2 ARG 31 HG2 ARG 31 8.937 -0.242 -3.810
219 HG3 ARG 31 HG1 ARG 31 7.220 -0.188 -3.405
220 HD2 ARG 31 HD2 ARG 31 7.206 2.064 -3.203
221 HD3 ARG 31 HD1 ARG 31 8.838 2.124 -2.547
222 HE ARG 31 HE ARG 31 9.056 1.372 -5.216
223 HH11 ARG 31 HH11 ARG 31 7.906 4.162 -3.433
224 HH12 ARG 31 HH12 ARG 31 8.465 5.312 -4.611
225 HH21 ARG 31 HH21 ARG 31 9.785 2.864 -6.771
226 HH22 ARG 31 HH22 ARG 31 9.531 4.570 -6.519
227 H ARG 32 HN ARG 32 7.924 -3.062 -1.147
228 HA ARG 32 HA ARG 32 6.135 -3.779 -3.214
229 HB2 ARG 32 HB2 ARG 32 8.325 -4.907 -2.516
230 HB3 ARG 32 HB1 ARG 32 7.379 -5.717 -1.277
231 HG2 ARG 32 HG2 ARG 32 5.946 -6.676 -3.023
232 HG3 ARG 32 HG1 ARG 32 6.939 -5.886 -4.250
233 HD2 ARG 32 HD2 ARG 32 8.910 -7.127 -3.301
234 HD3 ARG 32 HD1 ARG 32 7.766 -8.049 -2.325
235 HE ARG 32 HE ARG 32 7.407 -7.996 -5.231
236 HH11 ARG 32 HH11 ARG 32 8.341 -9.779 -2.359
237 HH12 ARG 32 HH12 ARG 32 8.259 -11.330 -3.136
238 HH21 ARG 32 HH21 ARG 32 7.306 -10.030 -6.266
239 HH22 ARG 32 HH22 ARG 32 7.670 -11.474 -5.362
240 H ALA 33 HN ALA 33 5.906 -3.764 0.266
241 HA ALA 33 HA ALA 33 3.610 -5.415 0.504
242 HB1 ALA 33 HB1 ALA 33 3.419 -4.493 2.764
243 HB2 ALA 33 HB2 ALA 33 4.624 -3.268 2.368
244 HB3 ALA 33 HB3 ALA 33 5.076 -4.972 2.401
245 H ILE 34 HN ILE 34 4.070 -1.956 -0.032
246 HA ILE 34 HA ILE 34 1.337 -1.233 0.224
247 HB ILE 34 HB ILE 34 3.732 0.068 -1.017
248 HG12 ILE 34 HG12 ILE 34 2.922 1.976 0.424
249 HG13 ILE 34 HG11 ILE 34 1.660 0.906 1.019
250 HG21 ILE 34 HG21 ILE 34 2.372 1.920 -1.876
251 HG22 ILE 34 HG22 ILE 34 0.908 1.008 -1.510
252 HG23 ILE 34 HG23 ILE 34 2.041 0.410 -2.722
253 HD11 ILE 34 HD11 ILE 34 4.628 0.579 1.364
254 HD12 ILE 34 HD12 ILE 34 3.431 -0.621 1.845
255 HD13 ILE 34 HD13 ILE 34 3.440 0.971 2.607
256 H GLN 35 HN GLN 35 3.374 -2.223 -2.478
257 HA GLN 35 HA GLN 35 1.449 -2.071 -4.516
258 HB2 GLN 35 HB2 GLN 35 3.860 -2.406 -4.936
259 HB3 GLN 35 HB1 GLN 35 3.751 -4.023 -4.254
260 HG2 GLN 35 HG2 GLN 35 2.154 -4.628 -6.039
261 HG3 GLN 35 HG1 GLN 35 2.383 -3.029 -6.743
262 HE21 GLN 35 HE21 GLN 35 5.230 -2.995 -6.033
263 HE22 GLN 35 HE22 GLN 35 6.011 -4.047 -7.160
264 H LEU 36 HN LEU 36 2.308 -4.687 -2.301
265 HA LEU 36 HA LEU 36 0.598 -6.667 -3.262
266 HB2 LEU 36 HB2 LEU 36 2.392 -7.158 -1.741
267 HB3 LEU 36 HB1 LEU 36 1.736 -6.089 -0.525
268 HG LEU 36 HG LEU 36 1.540 -8.598 -0.141
269 HD11 LEU 36 HD11 LEU 36 -1.031 -8.172 0.476
270 HD12 LEU 36 HD12 LEU 36 -0.494 -6.505 0.199
271 HD13 LEU 36 HD13 LEU 36 0.321 -7.516 1.399
272 HD21 LEU 36 HD21 LEU 36 0.789 -9.200 -2.390
273 HD22 LEU 36 HD22 LEU 36 -0.704 -8.294 -2.131
274 HD23 LEU 36 HD23 LEU 36 -0.354 -9.721 -1.153
275 H SER 37 HN SER 37 0.091 -4.207 -0.760
276 HA SER 37 HA SER 37 -2.546 -4.884 -0.117
277 HB2 SER 37 HB2 SER 37 -1.238 -2.158 0.001
278 HB3 SER 37 HB1 SER 37 -2.673 -2.664 0.894
279 HG SER 37 HG SER 37 -0.019 -3.646 1.167
280 H MET 38 HN MET 38 -1.229 -2.754 -2.615
281 HA MET 38 HA MET 38 -3.690 -1.677 -3.466
282 HB2 MET 38 HB2 MET 38 -1.394 -0.764 -3.950
283 HB3 MET 38 HB1 MET 38 -1.198 -2.056 -5.127
284 HG2 MET 38 HG2 MET 38 -3.090 -1.222 -6.394
285 HG3 MET 38 HG1 MET 38 -3.348 0.031 -5.183
286 HE1 MET 38 HE1 MET 38 -2.051 2.068 -8.264
287 HE2 MET 38 HE2 MET 38 -3.362 1.852 -7.102
288 HE3 MET 38 HE3 MET 38 -3.058 0.623 -8.330
289 H GLN 39 HN GLN 39 -2.063 -4.681 -4.105
290 HA GLN 39 HA GLN 39 -3.579 -5.392 -6.418
291 HB2 GLN 39 HB2 GLN 39 -2.074 -7.141 -4.474
292 HB3 GLN 39 HB1 GLN 39 -2.716 -7.670 -6.020
293 HG2 GLN 39 HG2 GLN 39 -1.232 -6.087 -7.163
294 HG3 GLN 39 HG1 GLN 39 -0.573 -5.596 -5.603
295 HE21 GLN 39 HE21 GLN 39 -0.701 -8.068 -8.019
296 HE22 GLN 39 HE22 GLN 39 0.602 -9.037 -7.403
297 H GLY 40 HN GLY 40 -4.487 -4.969 -3.283
298 HA2 GLY 40 HA2 GLY 40 -6.506 -5.343 -2.251
299 HA3 GLY 40 HA1 GLY 40 -7.061 -6.111 -3.730
300 H SER 41 HN SER 41 -4.167 -7.229 -2.187
301 HA SER 41 HA SER 41 -5.538 -9.759 -1.656
302 HB2 SER 41 HB2 SER 41 -2.573 -9.192 -1.876
303 HB3 SER 41 HB1 SER 41 -3.323 -10.783 -1.744
304 HG SER 41 HG SER 41 -4.379 -9.298 -3.775
305 H SER 42 HN SER 42 -6.195 -10.038 0.337
306 HA SER 42 HA SER 42 -4.563 -9.036 2.566
307 HB2 SER 42 HB2 SER 42 -7.398 -10.114 2.607
308 HB3 SER 42 HB1 SER 42 -6.559 -9.310 3.936
309 HG SER 42 HG SER 42 -6.532 -7.798 1.687
310 H ARG 43 HN ARG 43 -5.835 -11.044 4.391
311 HA ARG 43 HA ARG 43 -3.986 -13.187 3.926
312 HB2 ARG 43 HB2 ARG 43 -5.038 -14.191 5.975
313 HB3 ARG 43 HB1 ARG 43 -4.351 -12.591 6.192
314 HG2 ARG 43 HG2 ARG 43 -6.322 -12.402 7.335
315 HG3 ARG 43 HG1 ARG 43 -6.783 -11.781 5.751
316 HD2 ARG 43 HD2 ARG 43 -7.666 -14.028 5.180
317 HD3 ARG 43 HD1 ARG 43 -7.300 -14.555 6.823
318 HE ARG 43 HE ARG 43 -9.222 -12.411 6.166
319 HH11 ARG 43 HH11 ARG 43 -8.212 -15.151 8.103
320 HH12 ARG 43 HH12 ARG 43 -9.590 -15.091 9.152
321 HH21 ARG 43 HH21 ARG 43 -11.053 -12.335 7.515
322 HH22 ARG 43 HH22 ARG 43 -11.226 -13.487 8.813
323 H ASN 44 HN ASN 44 -6.571 -12.606 2.229
324 HA ASN 44 HA ASN 44 -7.896 -15.176 2.333
325 HB2 ASN 44 HB2 ASN 44 -8.219 -12.897 0.362
326 HB3 ASN 44 HB1 ASN 44 -9.248 -14.321 0.452
327 HD21 ASN 44 HD21 ASN 44 -9.957 -11.526 0.701
328 HD22 ASN 44 HD22 ASN 44 -10.690 -11.343 2.261
329 H LEU 45 HN LEU 45 -5.882 -16.365 1.935
330 HA LEU 45 HA LEU 45 -4.859 -16.214 -0.797
331 HB2 LEU 45 HB2 LEU 45 -3.973 -17.895 1.549
332 HB3 LEU 45 HB1 LEU 45 -3.180 -17.849 -0.014
333 HG LEU 45 HG LEU 45 -3.411 -15.531 1.913
334 HD11 LEU 45 HD11 LEU 45 -0.974 -15.800 2.115
335 HD12 LEU 45 HD12 LEU 45 -1.068 -17.253 1.122
336 HD13 LEU 45 HD13 LEU 45 -1.856 -17.211 2.698
337 HD21 LEU 45 HD21 LEU 45 -3.433 -14.778 -0.406
338 HD22 LEU 45 HD22 LEU 45 -1.994 -15.740 -0.743
339 HD23 LEU 45 HD23 LEU 45 -1.902 -14.374 0.371
340 H GLU 46 HN GLU 46 -6.311 -18.570 1.409
341 HA GLU 46 HA GLU 46 -6.959 -20.257 -0.913
342 HB2 GLU 46 HB2 GLU 46 -6.824 -20.999 2.016
343 HB3 GLU 46 HB1 GLU 46 -7.218 -22.096 0.701
344 HG2 GLU 46 HG2 GLU 46 -4.987 -21.772 -0.240
345 HG3 GLU 46 HG1 GLU 46 -4.590 -20.679 1.086
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 -20.468 5.879 -3.069
2 H2 GLY 1 HT2 GLY 1 -20.526 4.393 -3.878
3 H3 GLY 1 HT3 GLY 1 -19.364 4.655 -2.677
4 HA2 GLY 1 HA1 GLY 1 -22.294 4.551 -2.235
5 HA3 GLY 1 HA2 GLY 1 -21.160 3.256 -1.868
6 H SER 2 HN SER 2 -19.778 3.447 -0.108
7 HA SER 2 HA SER 2 -19.964 5.849 1.525
8 HB2 SER 2 HB2 SER 2 -21.861 4.429 2.255
9 HB3 SER 2 HB1 SER 2 -20.727 3.126 2.611
10 HG SER 2 HG SER 2 -20.710 4.033 4.510
11 H LEU 3 HN LEU 3 -18.641 2.575 1.147
12 HA LEU 3 HA LEU 3 -16.478 3.012 2.974
13 HB2 LEU 3 HB2 LEU 3 -16.812 0.909 0.831
14 HB3 LEU 3 HB1 LEU 3 -15.611 0.879 2.109
15 HG LEU 3 HG LEU 3 -18.600 0.721 2.500
16 HD11 LEU 3 HD11 LEU 3 -18.144 -1.587 3.192
17 HD12 LEU 3 HD12 LEU 3 -16.444 -1.373 2.772
18 HD13 LEU 3 HD13 LEU 3 -17.679 -1.307 1.514
19 HD21 LEU 3 HD21 LEU 3 -18.037 0.231 4.839
20 HD22 LEU 3 HD22 LEU 3 -17.515 1.847 4.363
21 HD23 LEU 3 HD23 LEU 3 -16.337 0.540 4.488
22 H ASP 4 HN ASP 4 -17.079 3.707 -0.306
23 HA ASP 4 HA ASP 4 -14.542 3.754 -1.458
24 HB2 ASP 4 HB2 ASP 4 -16.685 5.811 -2.004
25 HB3 ASP 4 HB1 ASP 4 -15.479 5.181 -3.124
26 H GLU 5 HN GLU 5 -16.184 6.027 0.603
27 HA GLU 5 HA GLU 5 -14.548 8.263 0.340
28 HB2 GLU 5 HB2 GLU 5 -16.734 8.195 1.505
29 HB3 GLU 5 HB1 GLU 5 -15.984 7.297 2.815
30 HG2 GLU 5 HG2 GLU 5 -14.509 9.202 3.256
31 HG3 GLU 5 HG1 GLU 5 -15.314 10.104 1.971
32 H ASP 6 HN ASP 6 -14.296 5.479 2.507
33 HA ASP 6 HA ASP 6 -11.887 6.454 3.743
34 HB2 ASP 6 HB2 ASP 6 -13.516 5.018 4.964
35 HB3 ASP 6 HB1 ASP 6 -13.103 3.686 3.889
36 H GLU 7 HN GLU 7 -12.756 4.177 1.211
37 HA GLU 7 HA GLU 7 -10.346 2.973 0.704
38 HB2 GLU 7 HB2 GLU 7 -12.784 3.508 -0.784
39 HB3 GLU 7 HB1 GLU 7 -11.365 3.521 -1.826
40 HG2 GLU 7 HG2 GLU 7 -12.289 1.314 -1.773
41 HG3 GLU 7 HG1 GLU 7 -10.733 1.323 -0.950
42 H GLU 8 HN GLU 8 -11.438 6.173 -0.388
43 HA GLU 8 HA GLU 8 -9.199 6.739 -1.988
44 HB2 GLU 8 HB2 GLU 8 -11.130 8.549 -0.545
45 HB3 GLU 8 HB1 GLU 8 -9.845 9.166 -1.572
46 HG2 GLU 8 HG2 GLU 8 -10.809 7.823 -3.446
47 HG3 GLU 8 HG1 GLU 8 -12.168 7.437 -2.388
48 H ASP 9 HN ASP 9 -9.751 7.169 1.462
49 HA ASP 9 HA ASP 9 -7.327 8.651 1.873
50 HB2 ASP 9 HB2 ASP 9 -9.271 8.884 3.389
51 HB3 ASP 9 HB1 ASP 9 -9.067 7.205 3.886
52 H LEU 10 HN LEU 10 -8.367 5.306 2.247
53 HA LEU 10 HA LEU 10 -5.989 4.312 3.385
54 HB2 LEU 10 HB2 LEU 10 -8.268 3.195 3.233
55 HB3 LEU 10 HB1 LEU 10 -7.864 2.784 1.581
56 HG LEU 10 HG LEU 10 -7.554 0.963 3.301
57 HD11 LEU 10 HD11 LEU 10 -5.438 0.165 2.364
58 HD12 LEU 10 HD12 LEU 10 -5.150 1.763 1.673
59 HD13 LEU 10 HD13 LEU 10 -6.518 0.794 1.122
60 HD21 LEU 10 HD21 LEU 10 -5.615 1.011 4.712
61 HD22 LEU 10 HD22 LEU 10 -6.602 2.438 5.038
62 HD23 LEU 10 HD23 LEU 10 -5.138 2.579 4.068
63 H GLN 11 HN GLN 11 -7.095 4.449 -0.000
64 HA GLN 11 HA GLN 11 -4.721 3.379 -1.105
65 HB2 GLN 11 HB2 GLN 11 -6.812 5.180 -2.336
66 HB3 GLN 11 HB1 GLN 11 -5.516 4.408 -3.240
67 HG2 GLN 11 HG2 GLN 11 -6.383 2.207 -2.513
68 HG3 GLN 11 HG1 GLN 11 -7.731 3.037 -1.736
69 HE21 GLN 11 HE21 GLN 11 -9.217 1.967 -3.048
70 HE22 GLN 11 HE22 GLN 11 -9.422 2.352 -4.722
71 H ARG 12 HN ARG 12 -5.706 6.647 -0.248
72 HA ARG 12 HA ARG 12 -3.530 8.036 -1.336
73 HB2 ARG 12 HB2 ARG 12 -5.446 9.220 -0.432
74 HB3 ARG 12 HB1 ARG 12 -5.117 8.595 1.178
75 HG2 ARG 12 HG2 ARG 12 -4.420 10.921 0.940
76 HG3 ARG 12 HG1 ARG 12 -3.050 9.862 1.274
77 HD2 ARG 12 HD2 ARG 12 -2.496 9.849 -1.116
78 HD3 ARG 12 HD1 ARG 12 -3.852 10.933 -1.432
79 HE ARG 12 HE ARG 12 -2.115 12.037 0.523
80 HH11 ARG 12 HH11 ARG 12 -2.421 11.499 -2.924
81 HH12 ARG 12 HH12 ARG 12 -1.331 12.780 -3.358
82 HH21 ARG 12 HH21 ARG 12 -0.726 13.748 -0.030
83 HH22 ARG 12 HH22 ARG 12 -0.382 14.089 -1.696
84 H ALA 13 HN ALA 13 -3.959 6.617 1.901
85 HA ALA 13 HA ALA 13 -1.443 7.194 2.931
86 HB1 ALA 13 HB1 ALA 13 -1.845 5.414 4.527
87 HB2 ALA 13 HB2 ALA 13 -3.136 4.768 3.511
88 HB3 ALA 13 HB3 ALA 13 -3.315 6.353 4.266
89 H LEU 14 HN LEU 14 -2.430 4.623 0.751
90 HA LEU 14 HA LEU 14 -0.067 3.061 0.965
91 HB2 LEU 14 HB2 LEU 14 -2.020 3.317 -1.326
92 HB3 LEU 14 HB1 LEU 14 -0.793 2.071 -1.180
93 HG LEU 14 HG LEU 14 -3.112 2.459 0.719
94 HD11 LEU 14 HD11 LEU 14 -4.028 0.445 -0.267
95 HD12 LEU 14 HD12 LEU 14 -2.664 0.341 -1.381
96 HD13 LEU 14 HD13 LEU 14 -3.806 1.679 -1.508
97 HD21 LEU 14 HD21 LEU 14 -2.426 0.312 1.647
98 HD22 LEU 14 HD22 LEU 14 -1.134 1.503 1.794
99 HD23 LEU 14 HD23 LEU 14 -1.051 0.261 0.545
100 H ALA 15 HN ALA 15 -1.116 5.414 -1.507
101 HA ALA 15 HA ALA 15 1.335 5.474 -2.904
102 HB1 ALA 15 HB1 ALA 15 0.507 7.533 -3.911
103 HB2 ALA 15 HB2 ALA 15 -0.756 7.638 -2.685
104 HB3 ALA 15 HB3 ALA 15 -0.765 6.312 -3.850
105 H LEU 16 HN LEU 16 0.056 7.284 -0.207
106 HA LEU 16 HA LEU 16 2.016 9.211 0.164
107 HB2 LEU 16 HB2 LEU 16 -0.213 8.884 1.354
108 HB3 LEU 16 HB1 LEU 16 0.595 7.707 2.366
109 HG LEU 16 HG LEU 16 1.563 10.553 2.186
110 HD11 LEU 16 HD11 LEU 16 -0.364 9.473 4.231
111 HD12 LEU 16 HD12 LEU 16 -0.874 10.394 2.817
112 HD13 LEU 16 HD13 LEU 16 0.179 11.139 4.022
113 HD21 LEU 16 HD21 LEU 16 2.616 10.083 4.266
114 HD22 LEU 16 HD22 LEU 16 2.997 8.736 3.190
115 HD23 LEU 16 HD23 LEU 16 1.757 8.555 4.431
116 H SER 17 HN SER 17 1.806 5.948 1.570
117 HA SER 17 HA SER 17 4.210 5.934 2.972
118 HB2 SER 17 HB2 SER 17 2.428 4.228 3.214
119 HB3 SER 17 HB1 SER 17 2.839 3.590 1.621
120 HG SER 17 HG SER 17 4.108 3.263 4.046
121 H ARG 18 HN ARG 18 3.566 5.296 -0.421
122 HA ARG 18 HA ARG 18 6.155 4.235 -0.985
123 HB2 ARG 18 HB2 ARG 18 4.013 5.324 -2.807
124 HB3 ARG 18 HB1 ARG 18 5.501 4.576 -3.375
125 HG2 ARG 18 HG2 ARG 18 4.881 2.499 -2.230
126 HG3 ARG 18 HG1 ARG 18 3.372 3.251 -1.708
127 HD2 ARG 18 HD2 ARG 18 3.037 1.857 -3.685
128 HD3 ARG 18 HD1 ARG 18 2.704 3.555 -4.027
129 HE ARG 18 HE ARG 18 5.403 2.788 -4.650
130 HH11 ARG 18 HH11 ARG 18 2.113 2.821 -5.839
131 HH12 ARG 18 HH12 ARG 18 2.577 2.808 -7.510
132 HH21 ARG 18 HH21 ARG 18 6.022 2.768 -6.840
133 HH22 ARG 18 HH22 ARG 18 4.806 2.764 -8.083
134 H GLN 19 HN GLN 19 4.696 7.450 -1.292
135 HA GLN 19 HA GLN 19 7.068 8.567 -2.478
136 HB2 GLN 19 HB2 GLN 19 5.922 10.733 -2.267
137 HB3 GLN 19 HB1 GLN 19 4.902 9.530 -3.040
138 HG2 GLN 19 HG2 GLN 19 3.697 9.198 -0.951
139 HG3 GLN 19 HG1 GLN 19 4.732 10.385 -0.161
140 HE21 GLN 19 HE21 GLN 19 4.812 12.142 -2.482
141 HE22 GLN 19 HE22 GLN 19 3.263 12.912 -2.548
142 H GLU 20 HN GLU 20 6.034 7.834 0.669
143 HA GLU 20 HA GLU 20 7.528 9.681 2.176
144 HB2 GLU 20 HB2 GLU 20 6.667 6.836 2.695
145 HB3 GLU 20 HB1 GLU 20 7.617 7.742 3.869
146 HG2 GLU 20 HG2 GLU 20 4.919 8.540 2.804
147 HG3 GLU 20 HG1 GLU 20 5.231 7.789 4.369
148 H ILE 21 HN ILE 21 8.363 6.348 1.258
149 HA ILE 21 HA ILE 21 11.190 7.149 1.166
150 HB ILE 21 HB ILE 21 10.241 4.534 2.324
151 HG12 ILE 21 HG12 ILE 21 9.696 6.506 3.764
152 HG13 ILE 21 HG11 ILE 21 10.801 5.355 4.510
153 HG21 ILE 21 HG21 ILE 21 12.976 5.793 2.297
154 HG22 ILE 21 HG22 ILE 21 12.448 4.502 1.219
155 HG23 ILE 21 HG23 ILE 21 12.556 4.210 2.955
156 HD11 ILE 21 HD11 ILE 21 11.394 7.726 4.885
157 HD12 ILE 21 HD12 ILE 21 11.645 7.889 3.146
158 HD13 ILE 21 HD13 ILE 21 12.663 6.798 4.083
159 H ASP 22 HN ASP 22 11.491 7.031 -1.021
160 HA ASP 22 HA ASP 22 10.410 4.739 -2.473
161 HB2 ASP 22 HB2 ASP 22 11.000 5.912 -4.509
162 HB3 ASP 22 HB1 ASP 22 10.142 7.014 -3.441
163 H MET 23 HN MET 23 12.771 4.799 -0.559
164 HA MET 23 HA MET 23 15.093 4.176 -2.110
165 HB2 MET 23 HB2 MET 23 15.249 5.067 0.179
166 HB3 MET 23 HB1 MET 23 14.468 3.620 0.797
167 HG2 MET 23 HG2 MET 23 16.851 3.512 1.160
168 HG3 MET 23 HG1 MET 23 16.342 2.264 0.028
169 HE1 MET 23 HE1 MET 23 19.886 3.083 -1.326
170 HE2 MET 23 HE2 MET 23 18.769 1.818 -0.815
171 HE3 MET 23 HE3 MET 23 19.372 2.991 0.358
172 H GLU 24 HN GLU 24 15.428 2.343 -3.193
173 HA GLU 24 HA GLU 24 13.705 0.065 -2.691
174 HB2 GLU 24 HB2 GLU 24 15.844 0.429 -4.795
175 HB3 GLU 24 HB1 GLU 24 14.670 -0.879 -4.730
176 HG2 GLU 24 HG2 GLU 24 12.893 0.949 -4.826
177 HG3 GLU 24 HG1 GLU 24 14.206 2.021 -5.309
178 H ASP 25 HN ASP 25 14.690 -0.211 -0.546
179 HA ASP 25 HA ASP 25 16.742 -2.297 -0.736
180 HB2 ASP 25 HB2 ASP 25 17.778 -0.082 0.014
181 HB3 ASP 25 HB1 ASP 25 16.785 -0.210 1.462
182 H GLU 26 HN GLU 26 16.537 -2.180 2.407
183 HA GLU 26 HA GLU 26 14.426 -4.011 2.734
184 HB2 GLU 26 HB2 GLU 26 15.855 -2.245 4.718
185 HB3 GLU 26 HB1 GLU 26 14.606 -3.388 5.198
186 HG2 GLU 26 HG2 GLU 26 17.221 -4.027 3.860
187 HG3 GLU 26 HG1 GLU 26 16.768 -4.374 5.530
188 H GLU 27 HN GLU 27 14.537 -0.551 2.763
189 HA GLU 27 HA GLU 27 12.005 0.025 3.818
190 HB2 GLU 27 HB2 GLU 27 13.692 1.452 1.763
191 HB3 GLU 27 HB1 GLU 27 12.196 2.113 2.408
192 HG2 GLU 27 HG2 GLU 27 14.607 1.376 4.037
193 HG3 GLU 27 HG1 GLU 27 14.199 3.008 3.507
194 H ALA 28 HN ALA 28 13.032 -1.130 0.697
195 HA ALA 28 HA ALA 28 10.713 -0.392 -0.757
196 HB1 ALA 28 HB1 ALA 28 11.532 -1.874 -2.495
197 HB2 ALA 28 HB2 ALA 28 12.693 -2.582 -1.371
198 HB3 ALA 28 HB3 ALA 28 12.849 -0.893 -1.854
199 H ASP 29 HN ASP 29 11.514 -3.084 1.302
200 HA ASP 29 HA ASP 29 9.586 -4.938 0.482
201 HB2 ASP 29 HB2 ASP 29 11.243 -5.626 2.074
202 HB3 ASP 29 HB1 ASP 29 10.756 -4.375 3.213
203 H LEU 30 HN LEU 30 9.372 -2.287 2.809
204 HA LEU 30 HA LEU 30 6.692 -2.745 3.561
205 HB2 LEU 30 HB2 LEU 30 8.448 -0.301 3.689
206 HB3 LEU 30 HB1 LEU 30 6.784 -0.275 4.236
207 HG LEU 30 HG LEU 30 7.357 -2.103 5.853
208 HD11 LEU 30 HD11 LEU 30 10.189 -1.461 5.044
209 HD12 LEU 30 HD12 LEU 30 9.339 -2.970 4.711
210 HD13 LEU 30 HD13 LEU 30 9.697 -2.507 6.377
211 HD21 LEU 30 HD21 LEU 30 7.209 0.200 6.582
212 HD22 LEU 30 HD22 LEU 30 8.876 0.488 6.085
213 HD23 LEU 30 HD23 LEU 30 8.533 -0.615 7.418
214 H ARG 31 HN ARG 31 8.170 -0.754 1.055
215 HA ARG 31 HA ARG 31 5.718 0.498 0.269
216 HB2 ARG 31 HB2 ARG 31 8.091 0.263 -1.561
217 HB3 ARG 31 HB1 ARG 31 6.956 1.594 -1.389
218 HG2 ARG 31 HG2 ARG 31 9.118 0.817 0.558
219 HG3 ARG 31 HG1 ARG 31 9.119 2.214 -0.517
220 HD2 ARG 31 HD2 ARG 31 7.488 3.319 0.718
221 HD3 ARG 31 HD1 ARG 31 6.920 1.833 1.481
222 HE ARG 31 HE ARG 31 9.634 2.537 2.145
223 HH11 ARG 31 HH11 ARG 31 6.279 3.054 2.966
224 HH12 ARG 31 HH12 ARG 31 6.595 3.336 4.649
225 HH21 ARG 31 HH21 ARG 31 10.071 2.927 4.377
226 HH22 ARG 31 HH22 ARG 31 8.741 3.285 5.445
227 H ARG 32 HN ARG 32 7.448 -2.376 -0.599
228 HA ARG 32 HA ARG 32 6.038 -2.962 -3.010
229 HB2 ARG 32 HB2 ARG 32 8.304 -3.825 -2.408
230 HB3 ARG 32 HB1 ARG 32 7.555 -4.831 -1.180
231 HG2 ARG 32 HG2 ARG 32 6.368 -6.079 -2.873
232 HG3 ARG 32 HG1 ARG 32 7.003 -5.016 -4.136
233 HD2 ARG 32 HD2 ARG 32 9.290 -5.693 -3.510
234 HD3 ARG 32 HD1 ARG 32 8.620 -6.798 -2.314
235 HE ARG 32 HE ARG 32 7.445 -7.720 -4.495
236 HH11 ARG 32 HH11 ARG 32 10.744 -6.674 -4.005
237 HH12 ARG 32 HH12 ARG 32 11.414 -7.768 -5.169
238 HH21 ARG 32 HH21 ARG 32 8.308 -9.182 -6.037
239 HH22 ARG 32 HH22 ARG 32 10.027 -9.207 -6.328
240 H ALA 33 HN ALA 33 5.732 -3.970 0.376
241 HA ALA 33 HA ALA 33 3.536 -5.698 0.035
242 HB1 ALA 33 HB1 ALA 33 4.176 -3.966 2.426
243 HB2 ALA 33 HB2 ALA 33 4.830 -5.576 2.117
244 HB3 ALA 33 HB3 ALA 33 3.103 -5.365 2.407
245 H ILE 34 HN ILE 34 3.778 -2.218 0.426
246 HA ILE 34 HA ILE 34 0.982 -1.706 0.513
247 HB ILE 34 HB ILE 34 3.439 -0.061 0.224
248 HG12 ILE 34 HG12 ILE 34 2.449 1.207 2.001
249 HG13 ILE 34 HG11 ILE 34 0.884 0.465 1.714
250 HG21 ILE 34 HG21 ILE 34 0.823 1.259 -0.359
251 HG22 ILE 34 HG22 ILE 34 1.785 0.570 -1.652
252 HG23 ILE 34 HG23 ILE 34 2.459 1.850 -0.651
253 HD11 ILE 34 HD11 ILE 34 2.025 -0.373 3.737
254 HD12 ILE 34 HD12 ILE 34 3.311 -1.003 2.708
255 HD13 ILE 34 HD13 ILE 34 1.676 -1.639 2.561
256 H GLN 35 HN GLN 35 3.382 -1.940 -2.040
257 HA GLN 35 HA GLN 35 1.849 -1.034 -4.207
258 HB2 GLN 35 HB2 GLN 35 4.308 -1.440 -4.234
259 HB3 GLN 35 HB1 GLN 35 3.994 -3.168 -4.214
260 HG2 GLN 35 HG2 GLN 35 4.491 -2.555 -6.448
261 HG3 GLN 35 HG1 GLN 35 2.765 -2.899 -6.361
262 HE21 GLN 35 HE21 GLN 35 4.327 -1.274 -8.257
263 HE22 GLN 35 HE22 GLN 35 3.593 0.297 -8.220
264 H LEU 36 HN LEU 36 2.118 -4.187 -2.687
265 HA LEU 36 HA LEU 36 0.430 -5.543 -4.543
266 HB2 LEU 36 HB2 LEU 36 2.081 -6.772 -3.306
267 HB3 LEU 36 HB1 LEU 36 1.459 -6.195 -1.777
268 HG LEU 36 HG LEU 36 0.996 -8.625 -2.423
269 HD11 LEU 36 HD11 LEU 36 -1.480 -8.329 -1.636
270 HD12 LEU 36 HD12 LEU 36 -0.975 -6.645 -1.404
271 HD13 LEU 36 HD13 LEU 36 -0.138 -7.952 -0.559
272 HD21 LEU 36 HD21 LEU 36 0.314 -8.264 -4.727
273 HD22 LEU 36 HD22 LEU 36 -1.048 -7.282 -4.189
274 HD23 LEU 36 HD23 LEU 36 -0.998 -9.003 -3.804
275 H SER 37 HN SER 37 -0.010 -4.260 -1.262
276 HA SER 37 HA SER 37 -2.742 -4.930 -1.040
277 HB2 SER 37 HB2 SER 37 -1.259 -4.467 0.892
278 HB3 SER 37 HB1 SER 37 -1.201 -2.770 0.421
279 HG SER 37 HG SER 37 -3.666 -3.080 0.536
280 H MET 38 HN MET 38 -1.257 -2.549 -2.922
281 HA MET 38 HA MET 38 -3.312 -0.569 -2.801
282 HB2 MET 38 HB2 MET 38 -1.011 0.005 -3.408
283 HB3 MET 38 HB1 MET 38 -1.113 -1.031 -4.826
284 HG2 MET 38 HG2 MET 38 -2.922 0.386 -5.681
285 HG3 MET 38 HG1 MET 38 -2.708 1.463 -4.306
286 HE1 MET 38 HE1 MET 38 -0.070 -0.447 -6.540
287 HE2 MET 38 HE2 MET 38 0.368 0.821 -7.683
288 HE3 MET 38 HE3 MET 38 -1.267 0.160 -7.686
289 H GLN 39 HN GLN 39 -2.780 -3.503 -4.531
290 HA GLN 39 HA GLN 39 -5.024 -2.869 -6.320
291 HB2 GLN 39 HB2 GLN 39 -4.172 -4.697 -7.763
292 HB3 GLN 39 HB1 GLN 39 -3.025 -3.378 -7.576
293 HG2 GLN 39 HG2 GLN 39 -1.838 -4.709 -5.870
294 HG3 GLN 39 HG1 GLN 39 -2.950 -6.041 -6.181
295 HE21 GLN 39 HE21 GLN 39 -1.757 -3.913 -8.676
296 HE22 GLN 39 HE22 GLN 39 -0.776 -5.089 -9.476
297 H GLY 40 HN GLY 40 -6.315 -4.897 -6.937
298 HA2 GLY 40 HA2 GLY 40 -7.061 -7.091 -6.130
299 HA3 GLY 40 HA1 GLY 40 -6.702 -6.533 -4.502
300 H SER 41 HN SER 41 -8.046 -4.074 -6.347
301 HA SER 41 HA SER 41 -10.575 -4.320 -4.933
302 HB2 SER 41 HB2 SER 41 -9.604 -2.111 -6.761
303 HB3 SER 41 HB1 SER 41 -10.988 -2.042 -5.670
304 HG SER 41 HG SER 41 -9.535 -2.273 -3.924
305 H SER 42 HN SER 42 -10.028 -6.224 -6.948
306 HA SER 42 HA SER 42 -12.276 -5.698 -8.749
307 HB2 SER 42 HB2 SER 42 -9.648 -6.978 -9.544
308 HB3 SER 42 HB1 SER 42 -11.072 -6.840 -10.576
309 HG SER 42 HG SER 42 -10.430 -4.917 -11.071
310 H ARG 43 HN ARG 43 -13.783 -7.219 -8.550
311 HA ARG 43 HA ARG 43 -13.194 -9.567 -6.954
312 HB2 ARG 43 HB2 ARG 43 -15.419 -7.923 -7.248
313 HB3 ARG 43 HB1 ARG 43 -15.889 -9.423 -8.032
314 HG2 ARG 43 HG2 ARG 43 -14.918 -9.109 -5.199
315 HG3 ARG 43 HG1 ARG 43 -16.566 -9.463 -5.723
316 HD2 ARG 43 HD2 ARG 43 -15.795 -11.581 -6.687
317 HD3 ARG 43 HD1 ARG 43 -14.152 -11.227 -6.152
318 HE ARG 43 HE ARG 43 -15.948 -11.133 -3.964
319 HH11 ARG 43 HH11 ARG 43 -14.237 -13.347 -6.067
320 HH12 ARG 43 HH12 ARG 43 -14.350 -14.690 -4.971
321 HH21 ARG 43 HH21 ARG 43 -16.089 -12.877 -2.495
322 HH22 ARG 43 HH22 ARG 43 -15.387 -14.416 -2.907
323 H ASN 44 HN ASN 44 -12.119 -9.377 -9.687
324 HA ASN 44 HA ASN 44 -12.650 -12.048 -10.487
325 HB2 ASN 44 HB2 ASN 44 -14.670 -10.924 -11.448
326 HB3 ASN 44 HB1 ASN 44 -13.602 -9.908 -12.411
327 HD21 ASN 44 HD21 ASN 44 -14.932 -13.068 -11.983
328 HD22 ASN 44 HD22 ASN 44 -14.385 -13.731 -13.484
329 H LEU 45 HN LEU 45 -11.820 -9.048 -12.205
330 HA LEU 45 HA LEU 45 -9.014 -9.546 -12.160
331 HB2 LEU 45 HB2 LEU 45 -9.610 -11.216 -13.830
332 HB3 LEU 45 HB1 LEU 45 -10.507 -10.022 -14.744
333 HG LEU 45 HG LEU 45 -8.399 -8.815 -15.207
334 HD11 LEU 45 HD11 LEU 45 -7.105 -11.161 -13.827
335 HD12 LEU 45 HD12 LEU 45 -7.132 -9.495 -13.248
336 HD13 LEU 45 HD13 LEU 45 -6.262 -9.901 -14.727
337 HD21 LEU 45 HD21 LEU 45 -8.373 -11.731 -15.976
338 HD22 LEU 45 HD22 LEU 45 -7.490 -10.439 -16.789
339 HD23 LEU 45 HD23 LEU 45 -9.254 -10.446 -16.804
340 H GLU 46 HN GLU 46 -11.550 -8.066 -14.149
341 HA GLU 46 HA GLU 46 -9.965 -5.631 -14.377
342 HB2 GLU 46 HB2 GLU 46 -12.612 -6.358 -15.650
343 HB3 GLU 46 HB1 GLU 46 -11.620 -4.961 -16.045
344 HG2 GLU 46 HG2 GLU 46 -9.880 -6.373 -16.911
345 HG3 GLU 46 HG1 GLU 46 -10.744 -7.817 -16.391
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 -22.799 -0.173 7.004
2 H2 GLY 1 HT2 GLY 1 -22.449 0.595 5.532
3 H3 GLY 1 HT3 GLY 1 -22.437 1.482 6.975
4 HA2 GLY 1 HA1 GLY 1 -20.553 0.213 7.782
5 HA3 GLY 1 HA2 GLY 1 -20.565 -0.717 6.289
6 H SER 2 HN SER 2 -18.250 0.229 6.516
7 HA SER 2 HA SER 2 -18.183 2.858 5.175
8 HB2 SER 2 HB2 SER 2 -16.030 1.660 6.930
9 HB3 SER 2 HB1 SER 2 -16.073 3.293 6.259
10 HG SER 2 HG SER 2 -18.082 3.542 7.517
11 H LEU 3 HN LEU 3 -17.911 2.382 3.061
12 HA LEU 3 HA LEU 3 -15.807 0.445 2.357
13 HB2 LEU 3 HB2 LEU 3 -17.914 1.629 0.542
14 HB3 LEU 3 HB1 LEU 3 -16.800 0.335 0.149
15 HG LEU 3 HG LEU 3 -18.012 -0.838 2.187
16 HD11 LEU 3 HD11 LEU 3 -20.108 1.045 1.128
17 HD12 LEU 3 HD12 LEU 3 -19.437 1.031 2.759
18 HD13 LEU 3 HD13 LEU 3 -20.406 -0.330 2.193
19 HD21 LEU 3 HD21 LEU 3 -19.469 -1.943 0.573
20 HD22 LEU 3 HD22 LEU 3 -17.851 -1.702 -0.088
21 HD23 LEU 3 HD23 LEU 3 -19.175 -0.648 -0.587
22 H ASP 4 HN ASP 4 -17.201 3.414 1.086
23 HA ASP 4 HA ASP 4 -14.855 4.178 -0.346
24 HB2 ASP 4 HB2 ASP 4 -17.185 5.929 0.473
25 HB3 ASP 4 HB1 ASP 4 -16.060 6.219 -0.850
26 H GLU 5 HN GLU 5 -16.246 4.915 2.750
27 HA GLU 5 HA GLU 5 -14.985 7.165 3.599
28 HB2 GLU 5 HB2 GLU 5 -15.103 4.803 5.434
29 HB3 GLU 5 HB1 GLU 5 -15.430 6.495 5.786
30 HG2 GLU 5 HG2 GLU 5 -17.157 4.783 4.043
31 HG3 GLU 5 HG1 GLU 5 -17.432 5.010 5.768
32 H ASP 6 HN ASP 6 -13.733 3.867 3.886
33 HA ASP 6 HA ASP 6 -11.149 4.835 4.776
34 HB2 ASP 6 HB2 ASP 6 -12.158 2.022 4.306
35 HB3 ASP 6 HB1 ASP 6 -10.589 2.431 4.993
36 H GLU 7 HN GLU 7 -12.661 3.753 1.875
37 HA GLU 7 HA GLU 7 -10.545 2.695 0.419
38 HB2 GLU 7 HB2 GLU 7 -13.200 3.317 -0.061
39 HB3 GLU 7 HB1 GLU 7 -12.342 4.389 -1.157
40 HG2 GLU 7 HG2 GLU 7 -11.739 1.460 -1.050
41 HG3 GLU 7 HG1 GLU 7 -13.063 2.099 -2.022
42 H GLU 8 HN GLU 8 -11.671 6.053 0.569
43 HA GLU 8 HA GLU 8 -9.816 7.149 -1.207
44 HB2 GLU 8 HB2 GLU 8 -11.120 8.488 1.160
45 HB3 GLU 8 HB1 GLU 8 -10.441 9.295 -0.250
46 HG2 GLU 8 HG2 GLU 8 -12.140 8.383 -1.662
47 HG3 GLU 8 HG1 GLU 8 -12.750 7.369 -0.355
48 H ASP 9 HN ASP 9 -9.669 6.729 2.304
49 HA ASP 9 HA ASP 9 -7.191 8.162 2.527
50 HB2 ASP 9 HB2 ASP 9 -8.873 8.123 4.356
51 HB3 ASP 9 HB1 ASP 9 -8.546 6.407 4.586
52 H LEU 10 HN LEU 10 -8.135 4.849 2.081
53 HA LEU 10 HA LEU 10 -5.678 3.641 2.843
54 HB2 LEU 10 HB2 LEU 10 -7.983 2.545 2.434
55 HB3 LEU 10 HB1 LEU 10 -7.543 2.557 0.741
56 HG LEU 10 HG LEU 10 -7.162 0.381 1.941
57 HD11 LEU 10 HD11 LEU 10 -4.710 1.663 0.753
58 HD12 LEU 10 HD12 LEU 10 -6.018 0.903 -0.153
59 HD13 LEU 10 HD13 LEU 10 -5.007 -0.068 0.918
60 HD21 LEU 10 HD21 LEU 10 -5.279 0.163 3.415
61 HD22 LEU 10 HD22 LEU 10 -6.370 1.399 4.047
62 HD23 LEU 10 HD23 LEU 10 -4.884 1.870 3.225
63 H GLN 11 HN GLN 11 -7.011 4.637 -0.305
64 HA GLN 11 HA GLN 11 -4.735 4.125 -1.856
65 HB2 GLN 11 HB2 GLN 11 -6.807 6.306 -2.165
66 HB3 GLN 11 HB1 GLN 11 -5.648 5.840 -3.402
67 HG2 GLN 11 HG2 GLN 11 -7.749 4.028 -2.239
68 HG3 GLN 11 HG1 GLN 11 -7.893 4.902 -3.764
69 HE21 GLN 11 HE21 GLN 11 -6.439 2.229 -2.121
70 HE22 GLN 11 HE22 GLN 11 -5.751 1.482 -3.519
71 H ARG 12 HN ARG 12 -5.732 6.989 -0.067
72 HA ARG 12 HA ARG 12 -3.588 8.669 -0.621
73 HB2 ARG 12 HB2 ARG 12 -5.607 9.447 0.471
74 HB3 ARG 12 HB1 ARG 12 -5.299 8.415 1.856
75 HG2 ARG 12 HG2 ARG 12 -3.355 10.561 1.097
76 HG3 ARG 12 HG1 ARG 12 -4.810 10.938 2.026
77 HD2 ARG 12 HD2 ARG 12 -4.123 9.158 3.645
78 HD3 ARG 12 HD1 ARG 12 -2.606 9.028 2.755
79 HE ARG 12 HE ARG 12 -2.112 11.310 3.429
80 HH11 ARG 12 HH11 ARG 12 -4.785 9.743 5.055
81 HH12 ARG 12 HH12 ARG 12 -4.612 10.663 6.518
82 HH21 ARG 12 HH21 ARG 12 -1.838 12.507 5.374
83 HH22 ARG 12 HH22 ARG 12 -2.938 12.241 6.700
84 H ALA 13 HN ALA 13 -3.947 6.298 2.007
85 HA ALA 13 HA ALA 13 -1.487 6.750 3.248
86 HB1 ALA 13 HB1 ALA 13 -1.773 4.563 4.273
87 HB2 ALA 13 HB2 ALA 13 -3.017 4.156 3.090
88 HB3 ALA 13 HB3 ALA 13 -3.301 5.446 4.258
89 H LEU 14 HN LEU 14 -2.343 4.516 0.624
90 HA LEU 14 HA LEU 14 0.171 3.291 0.365
91 HB2 LEU 14 HB2 LEU 14 -1.910 3.842 -1.756
92 HB3 LEU 14 HB1 LEU 14 -0.538 2.768 -1.957
93 HG LEU 14 HG LEU 14 -2.820 2.386 -0.018
94 HD11 LEU 14 HD11 LEU 14 -2.067 0.904 -2.532
95 HD12 LEU 14 HD12 LEU 14 -3.454 1.974 -2.330
96 HD13 LEU 14 HD13 LEU 14 -3.369 0.463 -1.425
97 HD21 LEU 14 HD21 LEU 14 -1.795 0.223 0.460
98 HD22 LEU 14 HD22 LEU 14 -0.716 1.549 0.892
99 HD23 LEU 14 HD23 LEU 14 -0.434 0.631 -0.587
100 H ALA 15 HN ALA 15 -1.204 6.067 -1.397
101 HA ALA 15 HA ALA 15 1.152 6.620 -2.874
102 HB1 ALA 15 HB1 ALA 15 0.058 8.714 -3.473
103 HB2 ALA 15 HB2 ALA 15 -1.148 8.458 -2.213
104 HB3 ALA 15 HB3 ALA 15 -1.069 7.363 -3.592
105 H LEU 16 HN LEU 16 0.086 7.446 0.306
106 HA LEU 16 HA LEU 16 1.665 9.687 0.844
107 HB2 LEU 16 HB2 LEU 16 -0.206 8.621 2.224
108 HB3 LEU 16 HB1 LEU 16 1.000 7.494 2.803
109 HG LEU 16 HG LEU 16 1.284 10.471 3.173
110 HD11 LEU 16 HD11 LEU 16 0.156 8.522 5.168
111 HD12 LEU 16 HD12 LEU 16 -0.855 9.534 4.139
112 HD13 LEU 16 HD13 LEU 16 0.249 10.278 5.303
113 HD21 LEU 16 HD21 LEU 16 2.847 9.878 4.881
114 HD22 LEU 16 HD22 LEU 16 3.278 8.961 3.432
115 HD23 LEU 16 HD23 LEU 16 2.420 8.172 4.754
116 H SER 17 HN SER 17 2.322 6.252 1.586
117 HA SER 17 HA SER 17 5.005 6.662 2.350
118 HB2 SER 17 HB2 SER 17 3.703 4.145 1.279
119 HB3 SER 17 HB1 SER 17 5.220 4.226 2.178
120 HG SER 17 HG SER 17 4.107 4.921 3.982
121 H ARG 18 HN ARG 18 3.476 6.157 -0.724
122 HA ARG 18 HA ARG 18 5.750 5.461 -2.234
123 HB2 ARG 18 HB2 ARG 18 3.130 6.728 -3.024
124 HB3 ARG 18 HB1 ARG 18 4.377 6.315 -4.194
125 HG2 ARG 18 HG2 ARG 18 4.192 4.003 -3.711
126 HG3 ARG 18 HG1 ARG 18 3.185 4.310 -2.296
127 HD2 ARG 18 HD2 ARG 18 1.807 3.525 -4.117
128 HD3 ARG 18 HD1 ARG 18 1.432 5.212 -3.774
129 HE ARG 18 HE ARG 18 3.333 5.251 -5.783
130 HH11 ARG 18 HH11 ARG 18 0.092 3.976 -5.361
131 HH12 ARG 18 HH12 ARG 18 -0.329 4.112 -7.041
132 HH21 ARG 18 HH21 ARG 18 2.786 5.451 -7.982
133 HH22 ARG 18 HH22 ARG 18 1.225 4.926 -8.542
134 H GLN 19 HN GLN 19 4.191 8.622 -1.682
135 HA GLN 19 HA GLN 19 6.156 10.029 -3.216
136 HB2 GLN 19 HB2 GLN 19 5.075 12.053 -2.417
137 HB3 GLN 19 HB1 GLN 19 3.870 10.882 -2.935
138 HG2 GLN 19 HG2 GLN 19 3.483 10.270 -0.589
139 HG3 GLN 19 HG1 GLN 19 4.665 11.483 -0.095
140 HE21 GLN 19 HE21 GLN 19 1.497 10.923 -1.386
141 HE22 GLN 19 HE22 GLN 19 0.900 12.530 -1.160
142 H GLU 20 HN GLU 20 6.244 8.659 -0.179
143 HA GLU 20 HA GLU 20 8.183 10.499 0.954
144 HB2 GLU 20 HB2 GLU 20 7.062 7.843 1.841
145 HB3 GLU 20 HB1 GLU 20 8.337 8.680 2.725
146 HG2 GLU 20 HG2 GLU 20 6.818 10.597 3.025
147 HG3 GLU 20 HG1 GLU 20 5.551 9.681 2.207
148 H ILE 21 HN ILE 21 8.119 7.821 -1.130
149 HA ILE 21 HA ILE 21 9.590 6.294 -1.887
150 HB ILE 21 HB ILE 21 11.571 8.514 -1.329
151 HG12 ILE 21 HG12 ILE 21 11.517 8.731 -3.826
152 HG13 ILE 21 HG11 ILE 21 10.220 7.546 -3.862
153 HG21 ILE 21 HG21 ILE 21 12.003 6.022 -2.979
154 HG22 ILE 21 HG22 ILE 21 12.672 6.282 -1.370
155 HG23 ILE 21 HG23 ILE 21 13.164 7.322 -2.709
156 HD11 ILE 21 HD11 ILE 21 10.119 10.270 -2.591
157 HD12 ILE 21 HD12 ILE 21 8.822 9.074 -2.561
158 HD13 ILE 21 HD13 ILE 21 9.342 9.772 -4.096
159 H ASP 22 HN ASP 22 9.047 4.966 -0.112
160 HA ASP 22 HA ASP 22 10.812 4.808 2.154
161 HB2 ASP 22 HB2 ASP 22 9.439 2.749 2.666
162 HB3 ASP 22 HB1 ASP 22 8.528 4.249 2.554
163 H MET 23 HN MET 23 12.800 4.538 1.057
164 HA MET 23 HA MET 23 13.223 1.817 0.042
165 HB2 MET 23 HB2 MET 23 13.062 3.312 -1.881
166 HB3 MET 23 HB1 MET 23 14.285 4.366 -1.187
167 HG2 MET 23 HG2 MET 23 15.168 2.932 -2.970
168 HG3 MET 23 HG1 MET 23 15.963 2.658 -1.420
169 HE1 MET 23 HE1 MET 23 16.046 -0.899 -3.010
170 HE2 MET 23 HE2 MET 23 16.988 0.411 -2.296
171 HE3 MET 23 HE3 MET 23 16.216 0.635 -3.865
172 H GLU 24 HN GLU 24 14.753 0.802 1.089
173 HA GLU 24 HA GLU 24 17.345 1.824 1.451
174 HB2 GLU 24 HB2 GLU 24 16.277 3.019 3.352
175 HB3 GLU 24 HB1 GLU 24 15.787 1.470 4.022
176 HG2 GLU 24 HG2 GLU 24 17.738 2.253 5.170
177 HG3 GLU 24 HG1 GLU 24 18.161 0.835 4.214
178 H ASP 25 HN ASP 25 15.653 -0.316 3.724
179 HA ASP 25 HA ASP 25 16.711 -2.648 2.292
180 HB2 ASP 25 HB2 ASP 25 17.273 -1.978 5.175
181 HB3 ASP 25 HB1 ASP 25 17.368 -3.626 4.567
182 H GLU 26 HN GLU 26 15.214 -2.184 5.481
183 HA GLU 26 HA GLU 26 13.505 -4.443 4.983
184 HB2 GLU 26 HB2 GLU 26 13.713 -2.601 7.366
185 HB3 GLU 26 HB1 GLU 26 12.694 -4.033 7.299
186 HG2 GLU 26 HG2 GLU 26 15.695 -3.958 7.106
187 HG3 GLU 26 HG1 GLU 26 14.737 -4.515 8.477
188 H GLU 27 HN GLU 27 13.164 -0.961 5.075
189 HA GLU 27 HA GLU 27 10.328 -0.926 5.053
190 HB2 GLU 27 HB2 GLU 27 10.632 1.407 4.063
191 HB3 GLU 27 HB1 GLU 27 11.294 1.118 5.662
192 HG2 GLU 27 HG2 GLU 27 12.995 0.903 3.208
193 HG3 GLU 27 HG1 GLU 27 12.684 2.452 3.991
194 H ALA 28 HN ALA 28 12.705 -1.521 2.628
195 HA ALA 28 HA ALA 28 11.152 -1.049 0.327
196 HB1 ALA 28 HB1 ALA 28 12.722 -2.507 -0.824
197 HB2 ALA 28 HB2 ALA 28 13.323 -3.109 0.721
198 HB3 ALA 28 HB3 ALA 28 13.582 -1.424 0.268
199 H ASP 29 HN ASP 29 11.045 -3.542 2.729
200 HA ASP 29 HA ASP 29 9.505 -5.373 1.135
201 HB2 ASP 29 HB2 ASP 29 10.818 -6.233 3.002
202 HB3 ASP 29 HB1 ASP 29 9.895 -5.245 4.132
203 H LEU 30 HN LEU 30 8.852 -2.738 3.349
204 HA LEU 30 HA LEU 30 6.039 -3.095 3.486
205 HB2 LEU 30 HB2 LEU 30 7.803 -0.675 3.850
206 HB3 LEU 30 HB1 LEU 30 6.057 -0.570 3.954
207 HG LEU 30 HG LEU 30 6.162 -2.271 5.814
208 HD11 LEU 30 HD11 LEU 30 9.105 -1.632 5.721
209 HD12 LEU 30 HD12 LEU 30 8.375 -3.186 5.319
210 HD13 LEU 30 HD13 LEU 30 8.279 -2.566 6.967
211 HD21 LEU 30 HD21 LEU 30 5.835 0.090 6.248
212 HD22 LEU 30 HD22 LEU 30 7.578 0.360 6.204
213 HD23 LEU 30 HD23 LEU 30 6.871 -0.624 7.485
214 H ARG 31 HN ARG 31 8.180 -1.227 1.387
215 HA ARG 31 HA ARG 31 6.367 -0.103 -0.369
216 HB2 ARG 31 HB2 ARG 31 8.863 0.202 -0.354
217 HB3 ARG 31 HB1 ARG 31 9.008 -1.366 -1.135
218 HG2 ARG 31 HG2 ARG 31 9.201 0.349 -2.785
219 HG3 ARG 31 HG1 ARG 31 7.669 -0.495 -3.023
220 HD2 ARG 31 HD2 ARG 31 6.476 1.288 -1.912
221 HD3 ARG 31 HD1 ARG 31 7.991 2.112 -1.544
222 HE ARG 31 HE ARG 31 7.350 1.627 -4.353
223 HH11 ARG 31 HH11 ARG 31 7.551 3.865 -1.652
224 HH12 ARG 31 HH12 ARG 31 7.503 5.279 -2.673
225 HH21 ARG 31 HH21 ARG 31 7.281 3.482 -5.685
226 HH22 ARG 31 HH22 ARG 31 7.337 5.068 -4.961
227 H ARG 32 HN ARG 32 7.836 -3.310 -0.471
228 HA ARG 32 HA ARG 32 6.629 -4.366 -2.734
229 HB2 ARG 32 HB2 ARG 32 8.437 -5.424 -1.408
230 HB3 ARG 32 HB1 ARG 32 7.278 -5.778 -0.140
231 HG2 ARG 32 HG2 ARG 32 6.051 -7.235 -1.688
232 HG3 ARG 32 HG1 ARG 32 7.255 -6.894 -2.937
233 HD2 ARG 32 HD2 ARG 32 9.004 -7.760 -1.396
234 HD3 ARG 32 HD1 ARG 32 7.729 -8.224 -0.273
235 HE ARG 32 HE ARG 32 6.999 -9.480 -2.546
236 HH11 ARG 32 HH11 ARG 32 10.005 -9.312 -0.752
237 HH12 ARG 32 HH12 ARG 32 10.542 -10.891 -1.250
238 HH21 ARG 32 HH21 ARG 32 7.701 -11.562 -3.209
239 HH22 ARG 32 HH22 ARG 32 9.226 -12.175 -2.639
240 H ALA 33 HN ALA 33 5.429 -4.116 0.570
241 HA ALA 33 HA ALA 33 3.042 -5.602 0.153
242 HB1 ALA 33 HB1 ALA 33 3.669 -3.555 2.278
243 HB2 ALA 33 HB2 ALA 33 4.017 -5.281 2.373
244 HB3 ALA 33 HB3 ALA 33 2.345 -4.722 2.317
245 H ILE 34 HN ILE 34 3.880 -2.186 -0.150
246 HA ILE 34 HA ILE 34 1.241 -1.208 -0.499
247 HB ILE 34 HB ILE 34 3.973 -0.142 -1.013
248 HG12 ILE 34 HG12 ILE 34 2.965 1.843 0.169
249 HG13 ILE 34 HG11 ILE 34 1.477 0.916 0.319
250 HG21 ILE 34 HG21 ILE 34 3.152 1.817 -2.212
251 HG22 ILE 34 HG22 ILE 34 1.542 1.104 -2.291
252 HG23 ILE 34 HG23 ILE 34 2.886 0.342 -3.142
253 HD11 ILE 34 HD11 ILE 34 4.146 0.239 1.526
254 HD12 ILE 34 HD12 ILE 34 2.709 -0.779 1.610
255 HD13 ILE 34 HD13 ILE 34 2.706 0.811 2.370
256 H GLN 35 HN GLN 35 3.692 -2.450 -2.675
257 HA GLN 35 HA GLN 35 2.359 -2.033 -5.116
258 HB2 GLN 35 HB2 GLN 35 4.730 -2.669 -4.963
259 HB3 GLN 35 HB1 GLN 35 4.271 -4.245 -4.335
260 HG2 GLN 35 HG2 GLN 35 3.045 -4.640 -6.485
261 HG3 GLN 35 HG1 GLN 35 3.775 -3.156 -7.092
262 HE21 GLN 35 HE21 GLN 35 5.413 -5.351 -4.935
263 HE22 GLN 35 HE22 GLN 35 6.572 -5.937 -6.080
264 H LEU 36 HN LEU 36 2.188 -4.626 -2.745
265 HA LEU 36 HA LEU 36 0.488 -6.302 -4.315
266 HB2 LEU 36 HB2 LEU 36 1.954 -7.281 -2.681
267 HB3 LEU 36 HB1 LEU 36 1.294 -6.285 -1.405
268 HG LEU 36 HG LEU 36 0.662 -8.756 -1.437
269 HD11 LEU 36 HD11 LEU 36 -1.842 -8.069 -1.008
270 HD12 LEU 36 HD12 LEU 36 -1.157 -6.436 -1.114
271 HD13 LEU 36 HD13 LEU 36 -0.545 -7.581 0.086
272 HD21 LEU 36 HD21 LEU 36 -1.141 -7.796 -3.654
273 HD22 LEU 36 HD22 LEU 36 -1.252 -9.357 -2.840
274 HD23 LEU 36 HD23 LEU 36 0.170 -8.965 -3.809
275 H SER 37 HN SER 37 -0.015 -4.152 -1.539
276 HA SER 37 HA SER 37 -2.787 -4.517 -1.307
277 HB2 SER 37 HB2 SER 37 -1.400 -3.533 0.475
278 HB3 SER 37 HB1 SER 37 -1.110 -2.114 -0.530
279 HG SER 37 HG SER 37 -3.629 -2.183 -0.518
280 H MET 38 HN MET 38 -1.055 -2.981 -3.766
281 HA MET 38 HA MET 38 -2.863 -0.917 -4.446
282 HB2 MET 38 HB2 MET 38 -0.586 -0.887 -5.268
283 HB3 MET 38 HB1 MET 38 -0.824 -2.423 -6.092
284 HG2 MET 38 HG2 MET 38 -2.473 -1.376 -7.545
285 HG3 MET 38 HG1 MET 38 -2.206 0.168 -6.741
286 HE1 MET 38 HE1 MET 38 -2.022 -0.087 -9.877
287 HE2 MET 38 HE2 MET 38 -0.549 0.828 -10.200
288 HE3 MET 38 HE3 MET 38 -1.695 1.403 -8.990
289 H GLN 39 HN GLN 39 -2.737 -4.349 -5.086
290 HA GLN 39 HA GLN 39 -5.045 -4.099 -6.894
291 HB2 GLN 39 HB2 GLN 39 -4.553 -6.314 -7.687
292 HB3 GLN 39 HB1 GLN 39 -3.061 -5.386 -7.715
293 HG2 GLN 39 HG2 GLN 39 -2.331 -6.458 -5.663
294 HG3 GLN 39 HG1 GLN 39 -3.846 -7.356 -5.577
295 HE21 GLN 39 HE21 GLN 39 -1.134 -8.359 -5.717
296 HE22 GLN 39 HE22 GLN 39 -1.055 -9.365 -7.124
297 H GLY 40 HN GLY 40 -6.869 -5.502 -6.584
298 HA2 GLY 40 HA2 GLY 40 -7.665 -5.768 -3.866
299 HA3 GLY 40 HA1 GLY 40 -8.539 -6.383 -5.263
300 H SER 41 HN SER 41 -6.824 -7.212 -2.531
301 HA SER 41 HA SER 41 -5.514 -9.566 -3.437
302 HB2 SER 41 HB2 SER 41 -5.529 -9.931 -0.806
303 HB3 SER 41 HB1 SER 41 -4.479 -8.737 -1.567
304 HG SER 41 HG SER 41 -5.726 -7.961 0.272
305 H SER 42 HN SER 42 -7.741 -10.098 -4.510
306 HA SER 42 HA SER 42 -8.807 -12.324 -2.929
307 HB2 SER 42 HB2 SER 42 -10.487 -10.359 -4.509
308 HB3 SER 42 HB1 SER 42 -11.090 -11.864 -3.817
309 HG SER 42 HG SER 42 -9.764 -10.008 -2.170
310 H ARG 43 HN ARG 43 -7.734 -10.959 -5.872
311 HA ARG 43 HA ARG 43 -7.832 -13.562 -7.156
312 HB2 ARG 43 HB2 ARG 43 -8.725 -12.601 -9.258
313 HB3 ARG 43 HB1 ARG 43 -9.891 -12.558 -7.946
314 HG2 ARG 43 HG2 ARG 43 -9.485 -10.206 -7.603
315 HG3 ARG 43 HG1 ARG 43 -8.203 -10.222 -8.814
316 HD2 ARG 43 HD2 ARG 43 -11.090 -10.889 -9.367
317 HD3 ARG 43 HD1 ARG 43 -10.361 -9.309 -9.647
318 HE ARG 43 HE ARG 43 -8.747 -10.972 -11.044
319 HH11 ARG 43 HH11 ARG 43 -12.234 -10.665 -10.957
320 HH12 ARG 43 HH12 ARG 43 -12.434 -11.026 -12.648
321 HH21 ARG 43 HH21 ARG 43 -9.011 -11.407 -13.281
322 HH22 ARG 43 HH22 ARG 43 -10.610 -11.419 -13.962
323 H ASN 44 HN ASN 44 -6.609 -13.416 -9.308
324 HA ASN 44 HA ASN 44 -4.621 -13.125 -10.342
325 HB2 ASN 44 HB2 ASN 44 -5.608 -10.896 -10.821
326 HB3 ASN 44 HB1 ASN 44 -4.842 -10.268 -9.366
327 HD21 ASN 44 HD21 ASN 44 -2.677 -9.838 -9.366
328 HD22 ASN 44 HD22 ASN 44 -1.700 -9.869 -10.800
329 H LEU 45 HN LEU 45 -3.863 -14.545 -8.603
330 HA LEU 45 HA LEU 45 -2.195 -13.355 -6.568
331 HB2 LEU 45 HB2 LEU 45 -1.709 -15.583 -5.845
332 HB3 LEU 45 HB1 LEU 45 -3.425 -15.482 -6.175
333 HG LEU 45 HG LEU 45 -1.443 -16.669 -8.118
334 HD11 LEU 45 HD11 LEU 45 -1.383 -17.935 -6.052
335 HD12 LEU 45 HD12 LEU 45 -2.214 -18.851 -7.309
336 HD13 LEU 45 HD13 LEU 45 -3.143 -18.044 -6.044
337 HD21 LEU 45 HD21 LEU 45 -4.441 -16.937 -7.903
338 HD22 LEU 45 HD22 LEU 45 -3.406 -17.681 -9.122
339 HD23 LEU 45 HD23 LEU 45 -3.590 -15.928 -9.072
340 H GLU 46 HN GLU 46 -1.928 -14.202 -9.799
341 HA GLU 46 HA GLU 46 -0.271 -14.176 -11.324
342 HB2 GLU 46 HB2 GLU 46 0.386 -12.091 -10.013
343 HB3 GLU 46 HB1 GLU 46 1.577 -13.096 -9.200
344 HG2 GLU 46 HG2 GLU 46 2.620 -13.599 -11.351
345 HG3 GLU 46 HG1 GLU 46 1.430 -12.580 -12.159
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 -24.128 2.508 -1.018
2 H2 GLY 1 HT2 GLY 1 -24.320 2.001 0.587
3 H3 GLY 1 HT3 GLY 1 -24.207 0.850 -0.657
4 HA2 GLY 1 HA1 GLY 1 -22.138 0.996 0.580
5 HA3 GLY 1 HA2 GLY 1 -21.941 1.473 -1.100
6 H SER 2 HN SER 2 -20.894 2.224 1.823
7 HA SER 2 HA SER 2 -20.627 5.078 1.150
8 HB2 SER 2 HB2 SER 2 -20.838 3.985 3.963
9 HB3 SER 2 HB1 SER 2 -20.805 5.678 3.476
10 HG SER 2 HG SER 2 -22.877 3.814 3.341
11 H LEU 3 HN LEU 3 -18.941 2.655 0.699
12 HA LEU 3 HA LEU 3 -16.775 2.803 2.568
13 HB2 LEU 3 HB2 LEU 3 -15.685 1.175 1.009
14 HB3 LEU 3 HB1 LEU 3 -17.211 0.671 1.704
15 HG LEU 3 HG LEU 3 -18.242 1.545 -0.496
16 HD11 LEU 3 HD11 LEU 3 -16.566 1.104 -2.393
17 HD12 LEU 3 HD12 LEU 3 -15.334 1.406 -1.160
18 HD13 LEU 3 HD13 LEU 3 -16.511 2.657 -1.559
19 HD21 LEU 3 HD21 LEU 3 -18.226 -0.783 0.166
20 HD22 LEU 3 HD22 LEU 3 -16.566 -0.954 -0.400
21 HD23 LEU 3 HD23 LEU 3 -17.861 -0.636 -1.554
22 H ASP 4 HN ASP 4 -17.648 4.644 -0.049
23 HA ASP 4 HA ASP 4 -15.204 5.219 -1.316
24 HB2 ASP 4 HB2 ASP 4 -17.536 7.097 -0.878
25 HB3 ASP 4 HB1 ASP 4 -16.311 7.220 -2.140
26 H GLU 5 HN GLU 5 -16.691 6.409 1.601
27 HA GLU 5 HA GLU 5 -15.176 8.636 2.206
28 HB2 GLU 5 HB2 GLU 5 -17.122 7.701 3.498
29 HB3 GLU 5 HB1 GLU 5 -16.024 6.512 4.182
30 HG2 GLU 5 HG2 GLU 5 -16.301 8.267 5.762
31 HG3 GLU 5 HG1 GLU 5 -14.670 8.379 5.103
32 H ASP 6 HN ASP 6 -14.495 5.272 3.138
33 HA ASP 6 HA ASP 6 -11.890 5.909 4.149
34 HB2 ASP 6 HB2 ASP 6 -13.201 3.250 3.564
35 HB3 ASP 6 HB1 ASP 6 -11.613 3.421 4.301
36 H GLU 7 HN GLU 7 -13.203 4.737 1.140
37 HA GLU 7 HA GLU 7 -11.046 3.462 0.011
38 HB2 GLU 7 HB2 GLU 7 -13.560 4.369 -0.856
39 HB3 GLU 7 HB1 GLU 7 -12.395 5.049 -1.986
40 HG2 GLU 7 HG2 GLU 7 -12.455 2.143 -1.241
41 HG3 GLU 7 HG1 GLU 7 -13.343 2.811 -2.609
42 H GLU 8 HN GLU 8 -11.876 6.890 -0.546
43 HA GLU 8 HA GLU 8 -9.596 7.471 -2.058
44 HB2 GLU 8 HB2 GLU 8 -11.241 9.354 -0.369
45 HB3 GLU 8 HB1 GLU 8 -10.140 9.821 -1.662
46 HG2 GLU 8 HG2 GLU 8 -11.575 8.398 -3.192
47 HG3 GLU 8 HG1 GLU 8 -12.747 8.349 -1.878
48 H ASP 9 HN ASP 9 -10.135 7.577 1.410
49 HA ASP 9 HA ASP 9 -7.722 8.985 2.014
50 HB2 ASP 9 HB2 ASP 9 -9.669 9.003 3.526
51 HB3 ASP 9 HB1 ASP 9 -9.467 7.275 3.800
52 H LEU 10 HN LEU 10 -8.705 5.583 2.150
53 HA LEU 10 HA LEU 10 -6.270 4.594 3.175
54 HB2 LEU 10 HB2 LEU 10 -8.535 3.449 3.124
55 HB3 LEU 10 HB1 LEU 10 -8.222 3.081 1.444
56 HG LEU 10 HG LEU 10 -7.794 1.225 3.105
57 HD11 LEU 10 HD11 LEU 10 -5.737 0.458 2.020
58 HD12 LEU 10 HD12 LEU 10 -5.494 2.074 1.354
59 HD13 LEU 10 HD13 LEU 10 -6.888 1.117 0.856
60 HD21 LEU 10 HD21 LEU 10 -5.737 1.278 4.369
61 HD22 LEU 10 HD22 LEU 10 -6.767 2.640 4.817
62 HD23 LEU 10 HD23 LEU 10 -5.378 2.896 3.762
63 H GLN 11 HN GLN 11 -7.499 4.869 -0.163
64 HA GLN 11 HA GLN 11 -5.257 3.682 -1.388
65 HB2 GLN 11 HB2 GLN 11 -6.068 4.564 -3.455
66 HB3 GLN 11 HB1 GLN 11 -7.466 4.107 -2.496
67 HG2 GLN 11 HG2 GLN 11 -7.688 6.499 -1.825
68 HG3 GLN 11 HG1 GLN 11 -6.417 6.879 -2.984
69 HE21 GLN 11 HE21 GLN 11 -8.883 4.433 -3.458
70 HE22 GLN 11 HE22 GLN 11 -9.710 5.245 -4.744
71 H ARG 12 HN ARG 12 -5.923 6.995 -0.378
72 HA ARG 12 HA ARG 12 -3.586 8.141 -1.487
73 HB2 ARG 12 HB2 ARG 12 -5.450 9.535 -0.762
74 HB3 ARG 12 HB1 ARG 12 -5.230 9.004 0.900
75 HG2 ARG 12 HG2 ARG 12 -4.332 11.248 0.513
76 HG3 ARG 12 HG1 ARG 12 -3.080 10.105 1.002
77 HD2 ARG 12 HD2 ARG 12 -2.429 9.838 -1.354
78 HD3 ARG 12 HD1 ARG 12 -3.656 11.020 -1.815
79 HE ARG 12 HE ARG 12 -1.798 12.009 0.136
80 HH11 ARG 12 HH11 ARG 12 -2.330 11.503 -3.292
81 HH12 ARG 12 HH12 ARG 12 -1.234 12.762 -3.773
82 HH21 ARG 12 HH21 ARG 12 -0.366 13.659 -0.486
83 HH22 ARG 12 HH22 ARG 12 -0.103 13.985 -2.175
84 H ALA 13 HN ALA 13 -4.293 6.740 1.694
85 HA ALA 13 HA ALA 13 -1.856 7.227 2.942
86 HB1 ALA 13 HB1 ALA 13 -2.422 5.394 4.439
87 HB2 ALA 13 HB2 ALA 13 -3.657 4.837 3.310
88 HB3 ALA 13 HB3 ALA 13 -3.836 6.396 4.114
89 H LEU 14 HN LEU 14 -2.766 4.636 0.717
90 HA LEU 14 HA LEU 14 -0.393 3.118 0.964
91 HB2 LEU 14 HB2 LEU 14 -2.240 3.420 -1.409
92 HB3 LEU 14 HB1 LEU 14 -0.988 2.196 -1.251
93 HG LEU 14 HG LEU 14 -3.321 2.442 0.648
94 HD11 LEU 14 HD11 LEU 14 -4.292 0.548 -0.544
95 HD12 LEU 14 HD12 LEU 14 -2.983 0.613 -1.722
96 HD13 LEU 14 HD13 LEU 14 -4.127 1.949 -1.602
97 HD21 LEU 14 HD21 LEU 14 -2.677 0.167 1.280
98 HD22 LEU 14 HD22 LEU 14 -1.362 1.308 1.561
99 HD23 LEU 14 HD23 LEU 14 -1.318 0.240 0.159
100 H ALA 15 HN ALA 15 -1.343 5.590 -1.418
101 HA ALA 15 HA ALA 15 1.111 5.766 -2.766
102 HB1 ALA 15 HB1 ALA 15 -0.555 8.204 -2.372
103 HB2 ALA 15 HB2 ALA 15 -1.245 6.832 -3.225
104 HB3 ALA 15 HB3 ALA 15 0.223 7.595 -3.837
105 H LEU 16 HN LEU 16 -0.152 7.421 0.037
106 HA LEU 16 HA LEU 16 1.850 9.240 0.603
107 HB2 LEU 16 HB2 LEU 16 -0.386 8.894 1.736
108 HB3 LEU 16 HB1 LEU 16 0.346 7.580 2.627
109 HG LEU 16 HG LEU 16 1.371 10.413 2.794
110 HD11 LEU 16 HD11 LEU 16 -0.493 9.081 4.743
111 HD12 LEU 16 HD12 LEU 16 -1.069 10.117 3.436
112 HD13 LEU 16 HD13 LEU 16 0.001 10.774 4.680
113 HD21 LEU 16 HD21 LEU 16 2.414 9.670 4.825
114 HD22 LEU 16 HD22 LEU 16 2.857 8.545 3.540
115 HD23 LEU 16 HD23 LEU 16 1.620 8.099 4.716
116 H SER 17 HN SER 17 1.566 5.904 1.814
117 HA SER 17 HA SER 17 4.022 5.874 3.172
118 HB2 SER 17 HB2 SER 17 2.536 3.512 1.994
119 HB3 SER 17 HB1 SER 17 3.717 3.464 3.303
120 HG SER 17 HG SER 17 1.126 4.617 3.315
121 H ARG 18 HN ARG 18 3.197 5.291 -0.156
122 HA ARG 18 HA ARG 18 5.587 4.023 -0.974
123 HB2 ARG 18 HB2 ARG 18 3.464 5.585 -2.413
124 HB3 ARG 18 HB1 ARG 18 4.906 5.042 -3.258
125 HG2 ARG 18 HG2 ARG 18 4.378 2.759 -2.851
126 HG3 ARG 18 HG1 ARG 18 3.070 3.200 -1.751
127 HD2 ARG 18 HD2 ARG 18 2.317 2.497 -4.025
128 HD3 ARG 18 HD1 ARG 18 1.769 4.098 -3.533
129 HE ARG 18 HE ARG 18 3.979 4.699 -4.910
130 HH11 ARG 18 HH11 ARG 18 1.359 2.502 -5.687
131 HH12 ARG 18 HH12 ARG 18 1.425 2.824 -7.397
132 HH21 ARG 18 HH21 ARG 18 4.092 5.091 -7.167
133 HH22 ARG 18 HH22 ARG 18 2.972 4.293 -8.234
134 H GLN 19 HN GLN 19 4.532 7.412 -1.316
135 HA GLN 19 HA GLN 19 7.006 8.315 -2.339
136 HB2 GLN 19 HB2 GLN 19 6.129 10.579 -1.959
137 HB3 GLN 19 HB1 GLN 19 4.940 9.542 -2.731
138 HG2 GLN 19 HG2 GLN 19 3.775 9.250 -0.642
139 HG3 GLN 19 HG1 GLN 19 5.007 10.180 0.208
140 HE21 GLN 19 HE21 GLN 19 2.144 10.633 -0.011
141 HE22 GLN 19 HE22 GLN 19 1.952 12.206 -0.693
142 H GLU 20 HN GLU 20 5.832 7.858 0.893
143 HA GLU 20 HA GLU 20 7.702 9.536 2.203
144 HB2 GLU 20 HB2 GLU 20 5.929 7.288 3.093
145 HB3 GLU 20 HB1 GLU 20 7.102 8.003 4.199
146 HG2 GLU 20 HG2 GLU 20 4.811 9.384 2.824
147 HG3 GLU 20 HG1 GLU 20 4.980 9.041 4.546
148 H ILE 21 HN ILE 21 7.740 6.070 1.392
149 HA ILE 21 HA ILE 21 10.255 5.662 2.699
150 HB ILE 21 HB ILE 21 8.947 3.924 0.608
151 HG12 ILE 21 HG12 ILE 21 7.580 4.226 2.644
152 HG13 ILE 21 HG11 ILE 21 8.170 2.574 2.485
153 HG21 ILE 21 HG21 ILE 21 10.984 3.041 2.620
154 HG22 ILE 21 HG22 ILE 21 11.489 3.737 1.079
155 HG23 ILE 21 HG23 ILE 21 10.507 2.264 1.108
156 HD11 ILE 21 HD11 ILE 21 9.224 4.716 4.312
157 HD12 ILE 21 HD12 ILE 21 9.974 3.139 4.082
158 HD13 ILE 21 HD13 ILE 21 8.353 3.251 4.769
159 H ASP 22 HN ASP 22 9.446 5.309 -0.738
160 HA ASP 22 HA ASP 22 10.524 5.811 -2.664
161 HB2 ASP 22 HB2 ASP 22 10.655 8.090 -1.940
162 HB3 ASP 22 HB1 ASP 22 12.011 7.737 -0.875
163 H MET 23 HN MET 23 12.651 5.284 0.067
164 HA MET 23 HA MET 23 15.021 4.579 -1.156
165 HB2 MET 23 HB2 MET 23 14.408 4.885 1.330
166 HB3 MET 23 HB1 MET 23 13.963 3.190 1.288
167 HG2 MET 23 HG2 MET 23 16.218 3.492 2.141
168 HG3 MET 23 HG1 MET 23 16.213 2.574 0.636
169 HE1 MET 23 HE1 MET 23 19.579 4.529 0.371
170 HE2 MET 23 HE2 MET 23 18.797 2.948 0.323
171 HE3 MET 23 HE3 MET 23 18.862 3.856 1.834
172 H GLU 24 HN GLU 24 15.197 3.159 -2.793
173 HA GLU 24 HA GLU 24 13.649 0.698 -2.789
174 HB2 GLU 24 HB2 GLU 24 15.674 1.758 -4.762
175 HB3 GLU 24 HB1 GLU 24 14.739 0.286 -4.980
176 HG2 GLU 24 HG2 GLU 24 12.672 1.708 -4.819
177 HG3 GLU 24 HG1 GLU 24 13.733 3.114 -4.894
178 H ASP 25 HN ASP 25 15.298 0.729 -0.621
179 HA ASP 25 HA ASP 25 17.486 -1.098 -1.366
180 HB2 ASP 25 HB2 ASP 25 18.070 1.051 -0.135
181 HB3 ASP 25 HB1 ASP 25 17.223 0.387 1.258
182 H GLU 26 HN GLU 26 16.909 -1.189 1.936
183 HA GLU 26 HA GLU 26 15.621 -3.779 1.746
184 HB2 GLU 26 HB2 GLU 26 17.484 -3.371 3.327
185 HB3 GLU 26 HB1 GLU 26 16.494 -2.189 4.168
186 HG2 GLU 26 HG2 GLU 26 14.927 -3.912 4.815
187 HG3 GLU 26 HG1 GLU 26 15.847 -5.115 3.910
188 H GLU 27 HN GLU 27 14.914 -0.526 2.836
189 HA GLU 27 HA GLU 27 12.352 -0.916 3.879
190 HB2 GLU 27 HB2 GLU 27 13.429 1.476 2.378
191 HB3 GLU 27 HB1 GLU 27 11.958 1.465 3.339
192 HG2 GLU 27 HG2 GLU 27 13.363 0.838 5.316
193 HG3 GLU 27 HG1 GLU 27 14.781 1.121 4.308
194 H ALA 28 HN ALA 28 13.498 -1.003 0.639
195 HA ALA 28 HA ALA 28 11.172 -0.414 -0.801
196 HB1 ALA 28 HB1 ALA 28 12.201 -1.579 -2.656
197 HB2 ALA 28 HB2 ALA 28 13.353 -2.348 -1.564
198 HB3 ALA 28 HB3 ALA 28 13.404 -0.603 -1.811
199 H ASP 29 HN ASP 29 11.934 -3.163 1.132
200 HA ASP 29 HA ASP 29 10.151 -4.981 -0.160
201 HB2 ASP 29 HB2 ASP 29 12.003 -5.699 1.361
202 HB3 ASP 29 HB1 ASP 29 11.083 -5.044 2.714
203 H LEU 30 HN LEU 30 9.876 -2.619 2.424
204 HA LEU 30 HA LEU 30 7.155 -3.215 3.058
205 HB2 LEU 30 HB2 LEU 30 8.825 -0.736 3.523
206 HB3 LEU 30 HB1 LEU 30 7.174 -0.908 4.084
207 HG LEU 30 HG LEU 30 8.532 -1.354 5.952
208 HD11 LEU 30 HD11 LEU 30 8.073 -3.682 6.494
209 HD12 LEU 30 HD12 LEU 30 7.747 -4.023 4.793
210 HD13 LEU 30 HD13 LEU 30 6.694 -2.928 5.689
211 HD21 LEU 30 HD21 LEU 30 10.663 -1.654 4.837
212 HD22 LEU 30 HD22 LEU 30 10.146 -3.224 4.220
213 HD23 LEU 30 HD23 LEU 30 10.368 -2.985 5.954
214 H ARG 31 HN ARG 31 8.826 -1.038 0.878
215 HA ARG 31 HA ARG 31 6.676 0.297 -0.287
216 HB2 ARG 31 HB2 ARG 31 8.944 0.901 -0.832
217 HB3 ARG 31 HB1 ARG 31 9.279 -0.708 -1.450
218 HG2 ARG 31 HG2 ARG 31 9.060 0.608 -3.350
219 HG3 ARG 31 HG1 ARG 31 7.499 -0.202 -3.212
220 HD2 ARG 31 HD2 ARG 31 6.530 1.786 -2.214
221 HD3 ARG 31 HD1 ARG 31 8.098 2.595 -2.255
222 HE ARG 31 HE ARG 31 6.911 1.661 -4.772
223 HH11 ARG 31 HH11 ARG 31 7.939 4.319 -2.728
224 HH12 ARG 31 HH12 ARG 31 7.774 5.506 -3.982
225 HH21 ARG 31 HH21 ARG 31 6.740 3.235 -6.428
226 HH22 ARG 31 HH22 ARG 31 7.105 4.897 -6.066
227 H ARG 32 HN ARG 32 8.129 -2.821 -1.081
228 HA ARG 32 HA ARG 32 6.470 -3.588 -3.190
229 HB2 ARG 32 HB2 ARG 32 8.607 -4.677 -2.488
230 HB3 ARG 32 HB1 ARG 32 7.759 -5.373 -1.117
231 HG2 ARG 32 HG2 ARG 32 6.271 -6.564 -2.694
232 HG3 ARG 32 HG1 ARG 32 7.239 -5.928 -4.029
233 HD2 ARG 32 HD2 ARG 32 9.242 -6.978 -2.928
234 HD3 ARG 32 HD1 ARG 32 8.125 -7.784 -1.826
235 HE ARG 32 HE ARG 32 7.354 -8.280 -4.492
236 HH11 ARG 32 HH11 ARG 32 9.798 -9.171 -2.146
237 HH12 ARG 32 HH12 ARG 32 10.197 -10.669 -2.933
238 HH21 ARG 32 HH21 ARG 32 7.884 -10.224 -5.546
239 HH22 ARG 32 HH22 ARG 32 9.109 -11.266 -4.877
240 H ALA 33 HN ALA 33 6.170 -4.166 0.293
241 HA ALA 33 HA ALA 33 3.865 -5.754 0.236
242 HB1 ALA 33 HB1 ALA 33 4.726 -3.857 2.418
243 HB2 ALA 33 HB2 ALA 33 5.339 -5.496 2.196
244 HB3 ALA 33 HB3 ALA 33 3.641 -5.236 2.588
245 H ILE 34 HN ILE 34 4.246 -2.240 0.296
246 HA ILE 34 HA ILE 34 1.494 -1.671 0.710
247 HB ILE 34 HB ILE 34 3.898 -0.083 0.062
248 HG12 ILE 34 HG12 ILE 34 2.988 1.373 1.794
249 HG13 ILE 34 HG11 ILE 34 1.474 0.479 1.781
250 HG21 ILE 34 HG21 ILE 34 2.610 1.915 -0.581
251 HG22 ILE 34 HG22 ILE 34 1.158 0.923 -0.690
252 HG23 ILE 34 HG23 ILE 34 2.507 0.633 -1.786
253 HD11 ILE 34 HD11 ILE 34 2.995 -0.045 3.679
254 HD12 ILE 34 HD12 ILE 34 4.117 -0.736 2.509
255 HD13 ILE 34 HD13 ILE 34 2.517 -1.441 2.714
256 H GLN 35 HN GLN 35 3.531 -2.057 -2.138
257 HA GLN 35 HA GLN 35 1.591 -1.286 -4.050
258 HB2 GLN 35 HB2 GLN 35 3.917 -3.197 -4.349
259 HB3 GLN 35 HB1 GLN 35 2.988 -2.522 -5.679
260 HG2 GLN 35 HG2 GLN 35 4.639 -0.937 -3.723
261 HG3 GLN 35 HG1 GLN 35 5.138 -1.399 -5.348
262 HE21 GLN 35 HE21 GLN 35 5.390 0.679 -6.055
263 HE22 GLN 35 HE22 GLN 35 4.055 1.749 -6.330
264 H LEU 36 HN LEU 36 2.323 -4.313 -2.446
265 HA LEU 36 HA LEU 36 0.582 -5.942 -3.988
266 HB2 LEU 36 HB2 LEU 36 2.412 -6.910 -2.749
267 HB3 LEU 36 HB1 LEU 36 1.825 -6.235 -1.248
268 HG LEU 36 HG LEU 36 1.531 -8.735 -1.616
269 HD11 LEU 36 HD11 LEU 36 -0.957 -8.504 -0.766
270 HD12 LEU 36 HD12 LEU 36 -0.500 -6.793 -0.683
271 HD13 LEU 36 HD13 LEU 36 0.417 -8.001 0.220
272 HD21 LEU 36 HD21 LEU 36 0.729 -8.690 -3.904
273 HD22 LEU 36 HD22 LEU 36 -0.676 -7.741 -3.416
274 HD23 LEU 36 HD23 LEU 36 -0.493 -9.401 -2.848
275 H SER 37 HN SER 37 0.281 -4.343 -0.827
276 HA SER 37 HA SER 37 -2.386 -5.037 -0.321
277 HB2 SER 37 HB2 SER 37 -0.743 -4.071 1.324
278 HB3 SER 37 HB1 SER 37 -1.003 -2.499 0.566
279 HG SER 37 HG SER 37 -3.348 -2.998 1.040
280 H MET 38 HN MET 38 -0.995 -2.347 -2.143
281 HA MET 38 HA MET 38 -3.300 -0.853 -2.588
282 HB2 MET 38 HB2 MET 38 -0.926 -0.219 -3.154
283 HB3 MET 38 HB1 MET 38 -1.049 -1.266 -4.562
284 HG2 MET 38 HG2 MET 38 -2.812 0.085 -5.473
285 HG3 MET 38 HG1 MET 38 -2.845 1.073 -4.011
286 HE1 MET 38 HE1 MET 38 -2.680 3.247 -5.549
287 HE2 MET 38 HE2 MET 38 -2.600 2.246 -6.999
288 HE3 MET 38 HE3 MET 38 -1.402 3.513 -6.732
289 H GLN 39 HN GLN 39 -2.054 -3.712 -4.205
290 HA GLN 39 HA GLN 39 -4.123 -3.850 -6.171
291 HB2 GLN 39 HB2 GLN 39 -2.216 -5.918 -5.081
292 HB3 GLN 39 HB1 GLN 39 -3.324 -6.219 -6.412
293 HG2 GLN 39 HG2 GLN 39 -2.193 -4.755 -7.835
294 HG3 GLN 39 HG1 GLN 39 -1.338 -3.978 -6.502
295 HE21 GLN 39 HE21 GLN 39 0.457 -4.942 -5.636
296 HE22 GLN 39 HE22 GLN 39 1.271 -6.277 -6.389
297 H GLY 40 HN GLY 40 -3.451 -5.977 -3.367
298 HA2 GLY 40 HA2 GLY 40 -4.867 -7.210 -2.028
299 HA3 GLY 40 HA1 GLY 40 -5.964 -5.845 -2.180
300 H SER 41 HN SER 41 -4.821 -8.044 -4.695
301 HA SER 41 HA SER 41 -7.576 -9.000 -5.050
302 HB2 SER 41 HB2 SER 41 -7.109 -8.852 -7.545
303 HB3 SER 41 HB1 SER 41 -7.285 -7.307 -6.714
304 HG SER 41 HG SER 41 -5.165 -8.288 -8.079
305 H SER 42 HN SER 42 -5.005 -10.139 -3.897
306 HA SER 42 HA SER 42 -4.576 -12.348 -5.782
307 HB2 SER 42 HB2 SER 42 -2.896 -11.446 -3.435
308 HB3 SER 42 HB1 SER 42 -2.507 -12.785 -4.516
309 HG SER 42 HG SER 42 -2.836 -10.075 -5.308
310 H ARG 43 HN ARG 43 -6.554 -13.354 -5.187
311 HA ARG 43 HA ARG 43 -6.967 -14.171 -2.454
312 HB2 ARG 43 HB2 ARG 43 -8.724 -13.621 -4.367
313 HB3 ARG 43 HB1 ARG 43 -8.535 -15.332 -4.718
314 HG2 ARG 43 HG2 ARG 43 -9.269 -14.271 -1.999
315 HG3 ARG 43 HG1 ARG 43 -10.453 -14.740 -3.217
316 HD2 ARG 43 HD2 ARG 43 -8.330 -16.561 -2.087
317 HD3 ARG 43 HD1 ARG 43 -10.002 -16.503 -1.532
318 HE ARG 43 HE ARG 43 -10.117 -16.921 -4.260
319 HH11 ARG 43 HH11 ARG 43 -8.816 -18.592 -1.468
320 HH12 ARG 43 HH12 ARG 43 -8.974 -20.172 -2.181
321 HH21 ARG 43 HH21 ARG 43 -10.342 -18.998 -5.182
322 HH22 ARG 43 HH22 ARG 43 -9.851 -20.401 -4.280
323 H ASN 44 HN ASN 44 -4.790 -15.239 -2.484
324 HA ASN 44 HA ASN 44 -5.400 -18.074 -2.593
325 HB2 ASN 44 HB2 ASN 44 -4.163 -17.463 -4.753
326 HB3 ASN 44 HB1 ASN 44 -2.756 -17.161 -3.735
327 HD21 ASN 44 HD21 ASN 44 -1.608 -18.857 -4.734
328 HD22 ASN 44 HD22 ASN 44 -1.961 -20.518 -4.377
329 H LEU 45 HN LEU 45 -4.720 -15.637 -0.816
330 HA LEU 45 HA LEU 45 -2.624 -16.880 0.807
331 HB2 LEU 45 HB2 LEU 45 -3.774 -14.096 0.751
332 HB3 LEU 45 HB1 LEU 45 -2.810 -14.664 2.097
333 HG LEU 45 HG LEU 45 -0.938 -15.095 0.477
334 HD11 LEU 45 HD11 LEU 45 -1.012 -13.965 -1.688
335 HD12 LEU 45 HD12 LEU 45 -2.703 -13.542 -1.411
336 HD13 LEU 45 HD13 LEU 45 -2.230 -15.232 -1.580
337 HD21 LEU 45 HD21 LEU 45 -0.983 -13.120 1.889
338 HD22 LEU 45 HD22 LEU 45 -1.956 -12.267 0.691
339 HD23 LEU 45 HD23 LEU 45 -0.301 -12.740 0.307
340 H GLU 46 HN GLU 46 -4.233 -18.531 1.296
341 HA GLU 46 HA GLU 46 -6.451 -17.756 3.000
342 HB2 GLU 46 HB2 GLU 46 -6.889 -20.277 2.944
343 HB3 GLU 46 HB1 GLU 46 -7.052 -19.401 1.427
344 HG2 GLU 46 HG2 GLU 46 -4.800 -20.137 0.781
345 HG3 GLU 46 HG1 GLU 46 -4.686 -21.052 2.283
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 -14.138 -2.761 0.359
2 H2 GLY 1 HT2 GLY 1 -12.763 -2.305 -0.527
3 H3 GLY 1 HT3 GLY 1 -13.931 -1.145 -0.117
4 HA2 GLY 1 HA1 GLY 1 -12.194 -2.612 1.796
5 HA3 GLY 1 HA2 GLY 1 -11.989 -0.937 1.300
6 H SER 2 HN SER 2 -14.310 0.225 1.435
7 HA SER 2 HA SER 2 -15.856 -0.564 3.722
8 HB2 SER 2 HB2 SER 2 -13.955 0.498 4.850
9 HB3 SER 2 HB1 SER 2 -14.167 1.951 3.880
10 HG SER 2 HG SER 2 -15.615 2.585 5.246
11 H LEU 3 HN LEU 3 -15.388 2.792 2.699
12 HA LEU 3 HA LEU 3 -17.873 2.561 1.133
13 HB2 LEU 3 HB2 LEU 3 -16.879 4.801 2.877
14 HB3 LEU 3 HB1 LEU 3 -17.997 5.116 1.566
15 HG LEU 3 HG LEU 3 -19.570 3.456 2.649
16 HD11 LEU 3 HD11 LEU 3 -17.676 3.767 4.971
17 HD12 LEU 3 HD12 LEU 3 -17.940 2.289 4.045
18 HD13 LEU 3 HD13 LEU 3 -19.250 2.973 5.007
19 HD21 LEU 3 HD21 LEU 3 -19.917 5.844 2.819
20 HD22 LEU 3 HD22 LEU 3 -18.805 5.932 4.186
21 HD23 LEU 3 HD23 LEU 3 -20.330 5.059 4.344
22 H ASP 4 HN ASP 4 -15.992 5.464 1.158
23 HA ASP 4 HA ASP 4 -14.411 4.717 -1.157
24 HB2 ASP 4 HB2 ASP 4 -16.439 6.964 -1.201
25 HB3 ASP 4 HB1 ASP 4 -15.140 6.813 -2.375
26 H GLU 5 HN GLU 5 -15.440 7.432 0.904
27 HA GLU 5 HA GLU 5 -13.139 8.981 0.615
28 HB2 GLU 5 HB2 GLU 5 -15.248 9.774 1.633
29 HB3 GLU 5 HB1 GLU 5 -14.930 8.771 3.042
30 HG2 GLU 5 HG2 GLU 5 -12.910 10.059 3.505
31 HG3 GLU 5 HG1 GLU 5 -13.232 11.065 2.092
32 H ASP 6 HN ASP 6 -13.930 6.499 2.998
33 HA ASP 6 HA ASP 6 -11.451 6.644 4.376
34 HB2 ASP 6 HB2 ASP 6 -12.196 4.275 5.155
35 HB3 ASP 6 HB1 ASP 6 -13.120 5.679 5.666
36 H GLU 7 HN GLU 7 -12.677 4.761 1.701
37 HA GLU 7 HA GLU 7 -10.407 3.120 1.388
38 HB2 GLU 7 HB2 GLU 7 -12.602 3.971 -0.505
39 HB3 GLU 7 HB1 GLU 7 -11.271 2.924 -1.021
40 HG2 GLU 7 HG2 GLU 7 -11.884 1.448 0.964
41 HG3 GLU 7 HG1 GLU 7 -13.369 2.391 1.053
42 H GLU 8 HN GLU 8 -11.224 6.298 0.051
43 HA GLU 8 HA GLU 8 -8.878 6.604 -1.499
44 HB2 GLU 8 HB2 GLU 8 -10.744 8.622 -0.250
45 HB3 GLU 8 HB1 GLU 8 -9.389 9.079 -1.273
46 HG2 GLU 8 HG2 GLU 8 -10.353 7.772 -3.110
47 HG3 GLU 8 HG1 GLU 8 -11.727 7.369 -2.081
48 H ASP 9 HN ASP 9 -9.618 7.146 1.877
49 HA ASP 9 HA ASP 9 -7.216 8.475 2.570
50 HB2 ASP 9 HB2 ASP 9 -9.049 8.548 4.115
51 HB3 ASP 9 HB1 ASP 9 -9.118 6.791 4.206
52 H LEU 10 HN LEU 10 -8.173 5.073 2.657
53 HA LEU 10 HA LEU 10 -5.728 4.044 3.599
54 HB2 LEU 10 HB2 LEU 10 -8.011 2.899 3.437
55 HB3 LEU 10 HB1 LEU 10 -7.636 2.609 1.752
56 HG LEU 10 HG LEU 10 -7.234 0.688 3.351
57 HD11 LEU 10 HD11 LEU 10 -5.143 -0.000 2.289
58 HD12 LEU 10 HD12 LEU 10 -4.898 1.649 1.712
59 HD13 LEU 10 HD13 LEU 10 -6.265 0.703 1.123
60 HD21 LEU 10 HD21 LEU 10 -5.261 0.709 4.710
61 HD22 LEU 10 HD22 LEU 10 -6.256 2.105 5.133
62 HD23 LEU 10 HD23 LEU 10 -4.826 2.316 4.126
63 H GLN 11 HN GLN 11 -6.999 4.374 0.282
64 HA GLN 11 HA GLN 11 -4.692 3.463 -1.045
65 HB2 GLN 11 HB2 GLN 11 -6.849 5.377 -1.957
66 HB3 GLN 11 HB1 GLN 11 -5.614 4.710 -3.016
67 HG2 GLN 11 HG2 GLN 11 -7.465 2.965 -1.428
68 HG3 GLN 11 HG1 GLN 11 -7.889 3.584 -3.021
69 HE21 GLN 11 HE21 GLN 11 -8.019 1.436 -3.763
70 HE22 GLN 11 HE22 GLN 11 -6.585 0.531 -4.126
71 H ARG 12 HN ARG 12 -5.563 6.601 0.235
72 HA ARG 12 HA ARG 12 -3.478 8.105 -0.909
73 HB2 ARG 12 HB2 ARG 12 -5.362 9.194 0.197
74 HB3 ARG 12 HB1 ARG 12 -4.901 8.477 1.735
75 HG2 ARG 12 HG2 ARG 12 -4.257 10.831 1.578
76 HG3 ARG 12 HG1 ARG 12 -2.858 9.771 1.763
77 HD2 ARG 12 HD2 ARG 12 -2.354 11.434 0.107
78 HD3 ARG 12 HD1 ARG 12 -2.518 9.871 -0.689
79 HE ARG 12 HE ARG 12 -5.008 11.023 -0.864
80 HH11 ARG 12 HH11 ARG 12 -1.751 11.802 -1.880
81 HH12 ARG 12 HH12 ARG 12 -2.254 12.790 -3.221
82 HH21 ARG 12 HH21 ARG 12 -5.689 12.317 -2.630
83 HH22 ARG 12 HH22 ARG 12 -4.511 13.106 -3.629
84 H ALA 13 HN ALA 13 -3.712 6.566 2.298
85 HA ALA 13 HA ALA 13 -1.127 7.005 3.172
86 HB1 ALA 13 HB1 ALA 13 -1.438 5.032 4.602
87 HB2 ALA 13 HB2 ALA 13 -2.863 4.584 3.661
88 HB3 ALA 13 HB3 ALA 13 -2.860 6.077 4.602
89 H LEU 14 HN LEU 14 -2.349 4.497 1.005
90 HA LEU 14 HA LEU 14 0.051 3.008 0.850
91 HB2 LEU 14 HB2 LEU 14 -2.152 3.275 -1.200
92 HB3 LEU 14 HB1 LEU 14 -0.898 2.047 -1.207
93 HG LEU 14 HG LEU 14 -3.127 2.344 0.805
94 HD11 LEU 14 HD11 LEU 14 -2.482 0.225 -1.235
95 HD12 LEU 14 HD12 LEU 14 -3.816 1.374 -1.306
96 HD13 LEU 14 HD13 LEU 14 -3.783 0.138 -0.049
97 HD21 LEU 14 HD21 LEU 14 -2.240 0.322 1.845
98 HD22 LEU 14 HD22 LEU 14 -1.070 1.638 1.923
99 HD23 LEU 14 HD23 LEU 14 -0.867 0.347 0.739
100 H ALA 15 HN ALA 15 -1.338 5.443 -1.365
101 HA ALA 15 HA ALA 15 0.877 5.489 -3.130
102 HB1 ALA 15 HB1 ALA 15 -0.124 7.538 -4.018
103 HB2 ALA 15 HB2 ALA 15 -1.209 7.618 -2.631
104 HB3 ALA 15 HB3 ALA 15 -1.342 6.286 -3.782
105 H LEU 16 HN LEU 16 0.083 7.226 -0.218
106 HA LEU 16 HA LEU 16 2.079 9.187 -0.227
107 HB2 LEU 16 HB2 LEU 16 0.062 8.791 1.334
108 HB3 LEU 16 HB1 LEU 16 1.119 7.712 2.215
109 HG LEU 16 HG LEU 16 1.856 10.592 1.749
110 HD11 LEU 16 HD11 LEU 16 0.476 9.530 4.202
111 HD12 LEU 16 HD12 LEU 16 -0.416 10.260 2.868
112 HD13 LEU 16 HD13 LEU 16 0.782 11.209 3.754
113 HD21 LEU 16 HD21 LEU 16 3.353 10.265 3.547
114 HD22 LEU 16 HD22 LEU 16 3.532 8.837 2.521
115 HD23 LEU 16 HD23 LEU 16 2.588 8.746 4.009
116 H SER 17 HN SER 17 2.056 5.967 1.260
117 HA SER 17 HA SER 17 4.713 5.842 2.062
118 HB2 SER 17 HB2 SER 17 2.905 3.598 1.136
119 HB3 SER 17 HB1 SER 17 4.395 3.390 2.058
120 HG SER 17 HG SER 17 1.987 4.657 2.876
121 H ARG 18 HN ARG 18 3.309 5.469 -1.093
122 HA ARG 18 HA ARG 18 5.499 4.144 -2.339
123 HB2 ARG 18 HB2 ARG 18 3.331 5.874 -3.547
124 HB3 ARG 18 HB1 ARG 18 4.467 4.903 -4.469
125 HG2 ARG 18 HG2 ARG 18 2.435 3.842 -2.518
126 HG3 ARG 18 HG1 ARG 18 2.288 3.830 -4.276
127 HD2 ARG 18 HD2 ARG 18 4.351 2.381 -2.620
128 HD3 ARG 18 HD1 ARG 18 3.009 1.662 -3.509
129 HE ARG 18 HE ARG 18 4.252 2.832 -5.507
130 HH11 ARG 18 HH11 ARG 18 5.604 0.970 -2.856
131 HH12 ARG 18 HH12 ARG 18 7.052 0.552 -3.728
132 HH21 ARG 18 HH21 ARG 18 6.156 2.287 -6.637
133 HH22 ARG 18 HH22 ARG 18 7.369 1.314 -5.862
134 H GLN 19 HN GLN 19 4.429 7.544 -2.372
135 HA GLN 19 HA GLN 19 6.687 8.423 -3.851
136 HB2 GLN 19 HB2 GLN 19 5.923 10.721 -3.195
137 HB3 GLN 19 HB1 GLN 19 4.708 9.736 -3.996
138 HG2 GLN 19 HG2 GLN 19 3.634 9.276 -1.887
139 HG3 GLN 19 HG1 GLN 19 4.903 10.150 -1.025
140 HE21 GLN 19 HE21 GLN 19 2.147 10.446 -3.145
141 HE22 GLN 19 HE22 GLN 19 1.913 12.148 -2.910
142 H GLU 20 HN GLU 20 6.084 7.992 -0.443
143 HA GLU 20 HA GLU 20 8.144 9.560 0.613
144 HB2 GLU 20 HB2 GLU 20 6.819 7.034 1.539
145 HB3 GLU 20 HB1 GLU 20 8.176 7.704 2.433
146 HG2 GLU 20 HG2 GLU 20 6.856 9.858 2.548
147 HG3 GLU 20 HG1 GLU 20 5.480 8.926 1.955
148 H ILE 21 HN ILE 21 8.218 6.111 -0.287
149 HA ILE 21 HA ILE 21 11.156 6.286 -0.193
150 HB ILE 21 HB ILE 21 9.468 3.870 0.461
151 HG12 ILE 21 HG12 ILE 21 9.410 5.646 2.187
152 HG13 ILE 21 HG11 ILE 21 10.208 4.181 2.753
153 HG21 ILE 21 HG21 ILE 21 12.455 4.252 0.594
154 HG22 ILE 21 HG22 ILE 21 11.591 3.269 -0.590
155 HG23 ILE 21 HG23 ILE 21 11.573 2.818 1.116
156 HD11 ILE 21 HD11 ILE 21 11.491 6.760 1.904
157 HD12 ILE 21 HD12 ILE 21 12.380 5.273 2.225
158 HD13 ILE 21 HD13 ILE 21 11.461 6.045 3.519
159 H ASP 22 HN ASP 22 8.890 3.829 -1.402
160 HA ASP 22 HA ASP 22 9.023 2.451 -3.195
161 HB2 ASP 22 HB2 ASP 22 8.170 4.417 -4.368
162 HB3 ASP 22 HB1 ASP 22 9.811 5.006 -4.608
163 H MET 23 HN MET 23 10.656 1.142 -2.524
164 HA MET 23 HA MET 23 13.119 1.186 -3.959
165 HB2 MET 23 HB2 MET 23 13.249 2.884 -1.912
166 HB3 MET 23 HB1 MET 23 13.497 1.410 -0.992
167 HG2 MET 23 HG2 MET 23 15.441 0.871 -2.320
168 HG3 MET 23 HG1 MET 23 15.168 2.291 -3.329
169 HE1 MET 23 HE1 MET 23 15.806 5.217 -0.790
170 HE2 MET 23 HE2 MET 23 14.251 4.446 -1.103
171 HE3 MET 23 HE3 MET 23 15.348 4.791 -2.440
172 H GLU 24 HN GLU 24 14.602 -0.646 -2.656
173 HA GLU 24 HA GLU 24 12.712 -2.723 -1.808
174 HB2 GLU 24 HB2 GLU 24 14.724 -2.896 -4.025
175 HB3 GLU 24 HB1 GLU 24 14.215 -4.341 -3.159
176 HG2 GLU 24 HG2 GLU 24 11.944 -4.026 -3.812
177 HG3 GLU 24 HG1 GLU 24 12.302 -2.435 -4.478
178 H ASP 25 HN ASP 25 13.781 -1.635 0.164
179 HA ASP 25 HA ASP 25 15.976 -3.414 0.979
180 HB2 ASP 25 HB2 ASP 25 16.477 -1.767 2.773
181 HB3 ASP 25 HB1 ASP 25 16.710 -1.112 1.156
182 H GLU 26 HN GLU 26 15.661 -3.015 3.763
183 HA GLU 26 HA GLU 26 13.862 -5.096 4.282
184 HB2 GLU 26 HB2 GLU 26 15.033 -3.096 6.221
185 HB3 GLU 26 HB1 GLU 26 14.264 -4.615 6.663
186 HG2 GLU 26 HG2 GLU 26 16.794 -4.294 5.062
187 HG3 GLU 26 HG1 GLU 26 16.667 -4.824 6.738
188 H GLU 27 HN GLU 27 13.517 -1.604 5.020
189 HA GLU 27 HA GLU 27 10.802 -2.054 5.936
190 HB2 GLU 27 HB2 GLU 27 12.466 0.443 5.681
191 HB3 GLU 27 HB1 GLU 27 10.781 0.460 6.188
192 HG2 GLU 27 HG2 GLU 27 11.410 -1.098 8.033
193 HG3 GLU 27 HG1 GLU 27 13.095 -0.856 7.574
194 H ALA 28 HN ALA 28 12.467 -0.901 3.133
195 HA ALA 28 HA ALA 28 10.281 0.249 1.789
196 HB1 ALA 28 HB1 ALA 28 12.564 0.641 1.113
197 HB2 ALA 28 HB2 ALA 28 11.655 -0.067 -0.212
198 HB3 ALA 28 HB3 ALA 28 12.764 -1.062 0.711
199 H ASP 29 HN ASP 29 11.230 -3.049 2.326
200 HA ASP 29 HA ASP 29 9.744 -4.337 0.328
201 HB2 ASP 29 HB2 ASP 29 11.286 -5.618 1.657
202 HB3 ASP 29 HB1 ASP 29 10.437 -5.199 3.143
203 H LEU 30 HN LEU 30 8.808 -3.042 3.465
204 HA LEU 30 HA LEU 30 6.132 -3.952 3.421
205 HB2 LEU 30 HB2 LEU 30 7.445 -1.615 4.797
206 HB3 LEU 30 HB1 LEU 30 5.728 -1.926 4.937
207 HG LEU 30 HG LEU 30 6.315 -4.201 5.870
208 HD11 LEU 30 HD11 LEU 30 9.067 -2.989 6.041
209 HD12 LEU 30 HD12 LEU 30 8.593 -4.359 5.039
210 HD13 LEU 30 HD13 LEU 30 8.551 -4.498 6.797
211 HD21 LEU 30 HD21 LEU 30 5.589 -2.374 7.293
212 HD22 LEU 30 HD22 LEU 30 7.240 -1.761 7.379
213 HD23 LEU 30 HD23 LEU 30 6.841 -3.321 8.098
214 H ARG 31 HN ARG 31 7.727 -1.067 2.189
215 HA ARG 31 HA ARG 31 5.399 0.272 1.293
216 HB2 ARG 31 HB2 ARG 31 8.143 0.488 0.049
217 HB3 ARG 31 HB1 ARG 31 6.873 1.702 0.067
218 HG2 ARG 31 HG2 ARG 31 8.320 0.727 2.518
219 HG3 ARG 31 HG1 ARG 31 8.755 2.174 1.609
220 HD2 ARG 31 HD2 ARG 31 6.553 3.124 2.058
221 HD3 ARG 31 HD1 ARG 31 6.103 1.671 2.947
222 HE ARG 31 HE ARG 31 8.119 2.328 4.410
223 HH11 ARG 31 HH11 ARG 31 5.942 4.567 2.854
224 HH12 ARG 31 HH12 ARG 31 6.160 5.827 4.030
225 HH21 ARG 31 HH21 ARG 31 8.433 3.965 5.976
226 HH22 ARG 31 HH22 ARG 31 7.604 5.488 5.799
227 H ARG 32 HN ARG 32 7.463 -2.186 -0.083
228 HA ARG 32 HA ARG 32 6.351 -2.158 -2.702
229 HB2 ARG 32 HB2 ARG 32 8.559 -3.115 -2.246
230 HB3 ARG 32 HB1 ARG 32 7.834 -4.340 -1.213
231 HG2 ARG 32 HG2 ARG 32 6.759 -5.372 -3.085
232 HG3 ARG 32 HG1 ARG 32 7.243 -4.050 -4.151
233 HD2 ARG 32 HD2 ARG 32 8.645 -6.056 -4.428
234 HD3 ARG 32 HD1 ARG 32 9.568 -4.650 -3.905
235 HE ARG 32 HE ARG 32 8.855 -6.033 -1.612
236 HH11 ARG 32 HH11 ARG 32 10.732 -6.668 -4.497
237 HH12 ARG 32 HH12 ARG 32 11.864 -7.711 -3.685
238 HH21 ARG 32 HH21 ARG 32 10.326 -7.412 -0.538
239 HH22 ARG 32 HH22 ARG 32 11.624 -8.149 -1.439
240 H ALA 33 HN ALA 33 5.583 -3.845 0.294
241 HA ALA 33 HA ALA 33 3.577 -5.540 -0.763
242 HB1 ALA 33 HB1 ALA 33 3.793 -4.415 2.029
243 HB2 ALA 33 HB2 ALA 33 4.582 -5.882 1.450
244 HB3 ALA 33 HB3 ALA 33 2.821 -5.802 1.533
245 H ILE 34 HN ILE 34 3.626 -2.226 0.315
246 HA ILE 34 HA ILE 34 0.845 -1.721 0.269
247 HB ILE 34 HB ILE 34 3.319 -0.087 0.328
248 HG12 ILE 34 HG12 ILE 34 2.066 1.096 2.110
249 HG13 ILE 34 HG11 ILE 34 0.669 0.085 1.774
250 HG21 ILE 34 HG21 ILE 34 2.166 2.013 -0.125
251 HG22 ILE 34 HG22 ILE 34 0.715 1.121 -0.582
252 HG23 ILE 34 HG23 ILE 34 2.186 0.964 -1.543
253 HD11 ILE 34 HD11 ILE 34 3.335 -0.842 2.802
254 HD12 ILE 34 HD12 ILE 34 1.967 -1.888 2.429
255 HD13 ILE 34 HD13 ILE 34 1.841 -0.699 3.725
256 H GLN 35 HN GLN 35 3.387 -1.631 -2.146
257 HA GLN 35 HA GLN 35 1.809 -0.597 -4.271
258 HB2 GLN 35 HB2 GLN 35 4.306 -0.660 -4.251
259 HB3 GLN 35 HB1 GLN 35 4.229 -2.403 -4.456
260 HG2 GLN 35 HG2 GLN 35 2.990 -2.016 -6.587
261 HG3 GLN 35 HG1 GLN 35 3.311 -0.295 -6.389
262 HE21 GLN 35 HE21 GLN 35 4.530 -0.162 -8.244
263 HE22 GLN 35 HE22 GLN 35 6.116 -0.857 -8.375
264 H LEU 36 HN LEU 36 2.452 -3.820 -3.043
265 HA LEU 36 HA LEU 36 1.249 -5.282 -5.122
266 HB2 LEU 36 HB2 LEU 36 2.782 -6.334 -3.614
267 HB3 LEU 36 HB1 LEU 36 1.824 -5.888 -2.223
268 HG LEU 36 HG LEU 36 1.807 -8.332 -2.939
269 HD11 LEU 36 HD11 LEU 36 -0.829 -8.314 -2.682
270 HD12 LEU 36 HD12 LEU 36 -0.505 -6.623 -2.254
271 HD13 LEU 36 HD13 LEU 36 0.257 -7.933 -1.344
272 HD21 LEU 36 HD21 LEU 36 0.212 -8.958 -4.677
273 HD22 LEU 36 HD22 LEU 36 1.527 -7.988 -5.342
274 HD23 LEU 36 HD23 LEU 36 -0.052 -7.256 -5.058
275 H SER 37 HN SER 37 -0.008 -4.114 -2.001
276 HA SER 37 HA SER 37 -2.583 -5.183 -2.280
277 HB2 SER 37 HB2 SER 37 -3.185 -3.362 -0.572
278 HB3 SER 37 HB1 SER 37 -1.963 -4.546 -0.109
279 HG SER 37 HG SER 37 -1.182 -2.121 -1.309
280 H MET 38 HN MET 38 -1.165 -2.618 -3.991
281 HA MET 38 HA MET 38 -3.582 -1.156 -4.515
282 HB2 MET 38 HB2 MET 38 -0.858 -1.172 -5.793
283 HB3 MET 38 HB1 MET 38 -2.187 -0.245 -6.472
284 HG2 MET 38 HG2 MET 38 -2.391 0.936 -4.298
285 HG3 MET 38 HG1 MET 38 -0.946 0.081 -3.755
286 HE1 MET 38 HE1 MET 38 -0.051 2.585 -3.199
287 HE2 MET 38 HE2 MET 38 -1.462 3.328 -3.952
288 HE3 MET 38 HE3 MET 38 0.162 3.831 -4.428
289 H GLN 39 HN GLN 39 -1.971 -3.921 -5.848
290 HA GLN 39 HA GLN 39 -4.065 -4.119 -7.907
291 HB2 GLN 39 HB2 GLN 39 -1.151 -4.829 -8.188
292 HB3 GLN 39 HB1 GLN 39 -2.383 -5.229 -9.374
293 HG2 GLN 39 HG2 GLN 39 -2.785 -2.908 -9.818
294 HG3 GLN 39 HG1 GLN 39 -1.697 -2.426 -8.517
295 HE21 GLN 39 HE21 GLN 39 -0.420 -1.229 -9.923
296 HE22 GLN 39 HE22 GLN 39 0.680 -1.988 -11.033
297 H GLY 40 HN GLY 40 -5.211 -5.413 -6.406
298 HA2 GLY 40 HA2 GLY 40 -4.084 -7.862 -5.402
299 HA3 GLY 40 HA1 GLY 40 -5.769 -7.368 -5.297
300 H SER 41 HN SER 41 -3.389 -8.381 -7.728
301 HA SER 41 HA SER 41 -5.327 -10.291 -8.772
302 HB2 SER 41 HB2 SER 41 -5.602 -8.150 -10.062
303 HB3 SER 41 HB1 SER 41 -3.925 -8.306 -10.582
304 HG SER 41 HG SER 41 -4.612 -9.570 -12.090
305 H SER 42 HN SER 42 -3.439 -11.242 -7.356
306 HA SER 42 HA SER 42 -1.027 -11.797 -8.835
307 HB2 SER 42 HB2 SER 42 -2.108 -13.195 -6.373
308 HB3 SER 42 HB1 SER 42 -0.440 -13.193 -6.947
309 HG SER 42 HG SER 42 -0.214 -11.108 -6.328
310 H ARG 43 HN ARG 43 -1.353 -12.941 -10.685
311 HA ARG 43 HA ARG 43 -2.711 -15.517 -10.496
312 HB2 ARG 43 HB2 ARG 43 -4.143 -15.017 -12.451
313 HB3 ARG 43 HB1 ARG 43 -4.529 -14.016 -11.055
314 HG2 ARG 43 HG2 ARG 43 -3.286 -12.155 -12.046
315 HG3 ARG 43 HG1 ARG 43 -2.888 -13.165 -13.437
316 HD2 ARG 43 HD2 ARG 43 -5.671 -12.398 -12.570
317 HD3 ARG 43 HD1 ARG 43 -4.772 -11.656 -13.893
318 HE ARG 43 HE ARG 43 -4.750 -14.062 -14.810
319 HH11 ARG 43 HH11 ARG 43 -7.372 -12.654 -12.952
320 HH12 ARG 43 HH12 ARG 43 -8.589 -13.636 -13.713
321 HH21 ARG 43 HH21 ARG 43 -6.340 -15.341 -15.793
322 HH22 ARG 43 HH22 ARG 43 -8.004 -15.171 -15.313
323 H ASN 44 HN ASN 44 0.051 -14.382 -11.124
324 HA ASN 44 HA ASN 44 0.498 -16.058 -13.458
325 HB2 ASN 44 HB2 ASN 44 0.049 -13.801 -14.398
326 HB3 ASN 44 HB1 ASN 44 1.402 -13.170 -13.464
327 HD21 ASN 44 HD21 ASN 44 0.453 -15.227 -16.113
328 HD22 ASN 44 HD22 ASN 44 2.016 -15.309 -16.865
329 H LEU 45 HN LEU 45 2.381 -13.553 -11.745
330 HA LEU 45 HA LEU 45 4.648 -15.314 -11.587
331 HB2 LEU 45 HB2 LEU 45 4.198 -12.635 -10.261
332 HB3 LEU 45 HB1 LEU 45 5.733 -13.470 -10.405
333 HG LEU 45 HG LEU 45 4.117 -12.398 -12.719
334 HD11 LEU 45 HD11 LEU 45 5.872 -10.726 -12.902
335 HD12 LEU 45 HD12 LEU 45 6.665 -11.385 -11.471
336 HD13 LEU 45 HD13 LEU 45 5.078 -10.626 -11.330
337 HD21 LEU 45 HD21 LEU 45 6.872 -13.616 -12.619
338 HD22 LEU 45 HD22 LEU 45 6.099 -12.915 -14.042
339 HD23 LEU 45 HD23 LEU 45 5.432 -14.370 -13.302
340 H GLU 46 HN GLU 46 2.752 -13.597 -9.120
341 HA GLU 46 HA GLU 46 3.446 -15.690 -7.199
342 HB2 GLU 46 HB2 GLU 46 2.409 -12.887 -6.897
343 HB3 GLU 46 HB1 GLU 46 2.330 -14.040 -5.570
344 HG2 GLU 46 HG2 GLU 46 4.821 -13.108 -6.982
345 HG3 GLU 46 HG1 GLU 46 4.295 -12.649 -5.363
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 -19.063 7.542 0.305
2 H2 GLY 1 HT2 GLY 1 -20.681 7.693 -0.180
3 H3 GLY 1 HT3 GLY 1 -19.917 6.180 -0.236
4 HA2 GLY 1 HA1 GLY 1 -20.436 7.728 2.242
5 HA3 GLY 1 HA2 GLY 1 -21.445 6.408 1.664
6 H SER 2 HN SER 2 -20.237 4.324 1.246
7 HA SER 2 HA SER 2 -18.267 3.945 3.408
8 HB2 SER 2 HB2 SER 2 -20.595 2.949 3.758
9 HB3 SER 2 HB1 SER 2 -20.215 1.846 2.435
10 HG SER 2 HG SER 2 -18.657 2.155 4.800
11 H LEU 3 HN LEU 3 -17.250 1.586 2.975
12 HA LEU 3 HA LEU 3 -15.731 0.408 1.791
13 HB2 LEU 3 HB2 LEU 3 -17.723 1.052 -0.356
14 HB3 LEU 3 HB1 LEU 3 -16.240 0.207 -0.750
15 HG LEU 3 HG LEU 3 -16.872 -1.571 0.868
16 HD11 LEU 3 HD11 LEU 3 -18.356 -0.234 2.291
17 HD12 LEU 3 HD12 LEU 3 -19.145 -1.695 1.697
18 HD13 LEU 3 HD13 LEU 3 -19.515 -0.134 0.967
19 HD21 LEU 3 HD21 LEU 3 -17.313 -1.814 -1.514
20 HD22 LEU 3 HD22 LEU 3 -18.872 -1.012 -1.315
21 HD23 LEU 3 HD23 LEU 3 -18.580 -2.577 -0.555
22 H ASP 4 HN ASP 4 -16.284 2.350 -1.038
23 HA ASP 4 HA ASP 4 -13.612 2.792 -1.607
24 HB2 ASP 4 HB2 ASP 4 -15.873 4.657 -2.376
25 HB3 ASP 4 HB1 ASP 4 -14.337 4.469 -3.207
26 H GLU 5 HN GLU 5 -15.843 4.795 0.225
27 HA GLU 5 HA GLU 5 -14.523 7.200 0.284
28 HB2 GLU 5 HB2 GLU 5 -16.742 6.192 1.471
29 HB3 GLU 5 HB1 GLU 5 -15.678 6.347 2.863
30 HG2 GLU 5 HG2 GLU 5 -16.942 8.345 2.690
31 HG3 GLU 5 HG1 GLU 5 -15.282 8.706 2.207
32 H ASP 6 HN ASP 6 -14.262 4.675 2.756
33 HA ASP 6 HA ASP 6 -12.012 5.867 4.033
34 HB2 ASP 6 HB2 ASP 6 -13.000 3.015 4.275
35 HB3 ASP 6 HB1 ASP 6 -11.960 3.871 5.409
36 H GLU 7 HN GLU 7 -12.457 3.497 1.516
37 HA GLU 7 HA GLU 7 -9.885 2.328 1.633
38 HB2 GLU 7 HB2 GLU 7 -11.991 2.422 -0.523
39 HB3 GLU 7 HB1 GLU 7 -10.430 1.637 -0.774
40 HG2 GLU 7 HG2 GLU 7 -10.868 0.213 1.192
41 HG3 GLU 7 HG1 GLU 7 -12.465 0.947 1.329
42 H GLU 8 HN GLU 8 -11.162 5.033 -0.274
43 HA GLU 8 HA GLU 8 -8.866 5.511 -1.819
44 HB2 GLU 8 HB2 GLU 8 -10.957 7.431 -0.794
45 HB3 GLU 8 HB1 GLU 8 -9.725 7.856 -1.974
46 HG2 GLU 8 HG2 GLU 8 -10.617 6.311 -3.558
47 HG3 GLU 8 HG1 GLU 8 -11.742 5.663 -2.362
48 H ASP 9 HN ASP 9 -9.797 6.567 1.397
49 HA ASP 9 HA ASP 9 -7.621 8.310 1.856
50 HB2 ASP 9 HB2 ASP 9 -9.639 8.359 3.238
51 HB3 ASP 9 HB1 ASP 9 -9.303 6.729 3.812
52 H LEU 10 HN LEU 10 -8.113 4.867 2.526
53 HA LEU 10 HA LEU 10 -5.631 4.403 3.771
54 HB2 LEU 10 HB2 LEU 10 -7.465 2.564 2.284
55 HB3 LEU 10 HB1 LEU 10 -6.036 2.027 3.145
56 HG LEU 10 HG LEU 10 -8.490 3.318 4.333
57 HD11 LEU 10 HD11 LEU 10 -7.456 0.752 5.293
58 HD12 LEU 10 HD12 LEU 10 -8.025 0.766 3.631
59 HD13 LEU 10 HD13 LEU 10 -9.112 1.253 4.933
60 HD21 LEU 10 HD21 LEU 10 -6.564 4.180 5.500
61 HD22 LEU 10 HD22 LEU 10 -5.869 2.564 5.617
62 HD23 LEU 10 HD23 LEU 10 -7.340 2.957 6.507
63 H GLN 11 HN GLN 11 -6.651 4.020 0.387
64 HA GLN 11 HA GLN 11 -4.122 3.126 -0.528
65 HB2 GLN 11 HB2 GLN 11 -6.364 4.460 -2.054
66 HB3 GLN 11 HB1 GLN 11 -4.976 3.668 -2.789
67 HG2 GLN 11 HG2 GLN 11 -5.660 1.554 -1.707
68 HG3 GLN 11 HG1 GLN 11 -7.099 2.367 -1.099
69 HE21 GLN 11 HE21 GLN 11 -5.697 2.956 -4.252
70 HE22 GLN 11 HE22 GLN 11 -6.988 2.258 -5.167
71 H ARG 12 HN ARG 12 -5.482 6.294 0.036
72 HA ARG 12 HA ARG 12 -3.520 7.800 -1.315
73 HB2 ARG 12 HB2 ARG 12 -5.610 8.788 -0.440
74 HB3 ARG 12 HB1 ARG 12 -5.025 8.541 1.199
75 HG2 ARG 12 HG2 ARG 12 -4.745 10.858 0.455
76 HG3 ARG 12 HG1 ARG 12 -3.197 10.090 0.817
77 HD2 ARG 12 HD2 ARG 12 -3.172 11.452 -1.260
78 HD3 ARG 12 HD1 ARG 12 -2.748 9.759 -1.521
79 HE ARG 12 HE ARG 12 -5.501 10.699 -1.997
80 HH11 ARG 12 HH11 ARG 12 -2.490 9.375 -3.224
81 HH12 ARG 12 HH12 ARG 12 -3.195 8.821 -4.717
82 HH21 ARG 12 HH21 ARG 12 -6.431 9.963 -3.953
83 HH22 ARG 12 HH22 ARG 12 -5.443 9.110 -5.104
84 H ALA 13 HN ALA 13 -3.705 6.634 2.034
85 HA ALA 13 HA ALA 13 -1.233 7.565 2.930
86 HB1 ALA 13 HB1 ALA 13 -1.359 5.709 4.579
87 HB2 ALA 13 HB2 ALA 13 -2.754 5.073 3.702
88 HB3 ALA 13 HB3 ALA 13 -2.841 6.659 4.472
89 H LEU 14 HN LEU 14 -2.074 4.661 1.118
90 HA LEU 14 HA LEU 14 0.429 3.395 1.107
91 HB2 LEU 14 HB2 LEU 14 -2.006 3.331 -0.586
92 HB3 LEU 14 HB1 LEU 14 -0.534 2.735 -1.327
93 HG LEU 14 HG LEU 14 -0.328 0.976 0.243
94 HD11 LEU 14 HD11 LEU 14 -2.532 2.320 1.792
95 HD12 LEU 14 HD12 LEU 14 -0.849 2.110 2.279
96 HD13 LEU 14 HD13 LEU 14 -1.905 0.707 2.128
97 HD21 LEU 14 HD21 LEU 14 -2.465 -0.203 -0.014
98 HD22 LEU 14 HD22 LEU 14 -1.949 0.579 -1.507
99 HD23 LEU 14 HD23 LEU 14 -3.221 1.306 -0.527
100 H ALA 15 HN ALA 15 -0.977 5.622 -1.302
101 HA ALA 15 HA ALA 15 1.416 5.732 -2.848
102 HB1 ALA 15 HB1 ALA 15 0.300 7.478 -4.121
103 HB2 ALA 15 HB2 ALA 15 -0.948 7.609 -2.881
104 HB3 ALA 15 HB3 ALA 15 -0.797 6.129 -3.830
105 H LEU 16 HN LEU 16 0.122 7.591 -0.198
106 HA LEU 16 HA LEU 16 1.839 9.797 -0.292
107 HB2 LEU 16 HB2 LEU 16 -0.196 9.490 1.142
108 HB3 LEU 16 HB1 LEU 16 0.732 8.401 2.148
109 HG LEU 16 HG LEU 16 1.653 11.228 1.743
110 HD11 LEU 16 HD11 LEU 16 0.357 11.596 3.954
111 HD12 LEU 16 HD12 LEU 16 -0.601 10.206 3.423
112 HD13 LEU 16 HD13 LEU 16 -0.524 11.659 2.427
113 HD21 LEU 16 HD21 LEU 16 2.600 10.884 3.968
114 HD22 LEU 16 HD22 LEU 16 3.155 9.630 2.858
115 HD23 LEU 16 HD23 LEU 16 1.889 9.271 4.031
116 H SER 17 HN SER 17 2.139 6.719 1.473
117 HA SER 17 HA SER 17 4.706 7.250 2.500
118 HB2 SER 17 HB2 SER 17 3.067 5.497 3.315
119 HB3 SER 17 HB1 SER 17 3.549 4.515 1.932
120 HG SER 17 HG SER 17 5.293 5.499 3.957
121 H ARG 18 HN ARG 18 3.618 6.016 -0.577
122 HA ARG 18 HA ARG 18 6.137 4.850 -1.291
123 HB2 ARG 18 HB2 ARG 18 5.136 4.119 -3.228
124 HB3 ARG 18 HB1 ARG 18 3.709 4.343 -2.224
125 HG2 ARG 18 HG2 ARG 18 3.244 6.455 -3.284
126 HG3 ARG 18 HG1 ARG 18 4.735 6.348 -4.222
127 HD2 ARG 18 HD2 ARG 18 3.894 4.341 -5.332
128 HD3 ARG 18 HD1 ARG 18 2.414 4.430 -4.382
129 HE ARG 18 HE ARG 18 2.416 6.819 -5.582
130 HH11 ARG 18 HH11 ARG 18 2.918 3.586 -6.856
131 HH12 ARG 18 HH12 ARG 18 2.316 3.995 -8.438
132 HH21 ARG 18 HH21 ARG 18 1.562 7.314 -7.654
133 HH22 ARG 18 HH22 ARG 18 1.552 6.082 -8.881
134 H GLN 19 HN GLN 19 4.651 7.996 -1.668
135 HA GLN 19 HA GLN 19 6.762 8.879 -3.469
136 HB2 GLN 19 HB2 GLN 19 5.576 11.022 -3.506
137 HB3 GLN 19 HB1 GLN 19 4.489 9.691 -3.868
138 HG2 GLN 19 HG2 GLN 19 3.636 9.764 -1.581
139 HG3 GLN 19 HG1 GLN 19 4.730 11.094 -1.218
140 HE21 GLN 19 HE21 GLN 19 4.317 13.130 -2.045
141 HE22 GLN 19 HE22 GLN 19 2.768 13.560 -2.700
142 H GLU 20 HN GLU 20 5.960 8.912 -0.136
143 HA GLU 20 HA GLU 20 7.780 10.997 0.623
144 HB2 GLU 20 HB2 GLU 20 6.150 8.957 2.120
145 HB3 GLU 20 HB1 GLU 20 7.331 9.970 2.956
146 HG2 GLU 20 HG2 GLU 20 4.990 10.961 1.342
147 HG3 GLU 20 HG1 GLU 20 5.059 10.859 3.100
148 H ILE 21 HN ILE 21 7.855 7.489 0.420
149 HA ILE 21 HA ILE 21 10.668 7.567 1.272
150 HB ILE 21 HB ILE 21 8.563 5.457 1.682
151 HG12 ILE 21 HG12 ILE 21 9.570 5.495 4.007
152 HG13 ILE 21 HG11 ILE 21 10.504 6.895 3.500
153 HG21 ILE 21 HG21 ILE 21 10.309 3.915 2.445
154 HG22 ILE 21 HG22 ILE 21 11.539 5.052 1.893
155 HG23 ILE 21 HG23 ILE 21 10.456 4.290 0.728
156 HD11 ILE 21 HD11 ILE 21 7.506 6.703 3.613
157 HD12 ILE 21 HD12 ILE 21 8.427 8.108 3.073
158 HD13 ILE 21 HD13 ILE 21 8.548 7.561 4.747
159 H ASP 22 HN ASP 22 11.942 7.486 -0.469
160 HA ASP 22 HA ASP 22 11.348 5.462 -2.526
161 HB2 ASP 22 HB2 ASP 22 13.154 7.888 -2.593
162 HB3 ASP 22 HB1 ASP 22 13.158 6.651 -3.845
163 H MET 23 HN MET 23 12.058 4.411 -0.254
164 HA MET 23 HA MET 23 14.971 4.044 -0.214
165 HB2 MET 23 HB2 MET 23 13.889 4.957 1.823
166 HB3 MET 23 HB1 MET 23 12.902 3.513 1.930
167 HG2 MET 23 HG2 MET 23 14.851 2.164 2.362
168 HG3 MET 23 HG1 MET 23 15.901 3.565 2.133
169 HE1 MET 23 HE1 MET 23 16.021 2.851 6.039
170 HE2 MET 23 HE2 MET 23 16.970 2.929 4.554
171 HE3 MET 23 HE3 MET 23 15.806 1.623 4.790
172 H GLU 24 HN GLU 24 15.817 2.063 -0.587
173 HA GLU 24 HA GLU 24 13.915 -0.150 -0.999
174 HB2 GLU 24 HB2 GLU 24 15.014 0.739 -3.065
175 HB3 GLU 24 HB1 GLU 24 16.567 0.280 -2.385
176 HG2 GLU 24 HG2 GLU 24 15.752 -1.338 -4.024
177 HG3 GLU 24 HG1 GLU 24 15.939 -2.050 -2.423
178 H ASP 25 HN ASP 25 14.525 -0.035 1.484
179 HA ASP 25 HA ASP 25 16.919 -1.691 1.953
180 HB2 ASP 25 HB2 ASP 25 15.970 0.559 3.273
181 HB3 ASP 25 HB1 ASP 25 15.457 -0.763 4.316
182 H GLU 26 HN GLU 26 15.758 -2.567 4.562
183 HA GLU 26 HA GLU 26 14.342 -4.876 3.621
184 HB2 GLU 26 HB2 GLU 26 15.897 -4.750 5.644
185 HB3 GLU 26 HB1 GLU 26 14.575 -3.954 6.490
186 HG2 GLU 26 HG2 GLU 26 14.563 -6.266 7.065
187 HG3 GLU 26 HG1 GLU 26 13.164 -5.947 6.039
188 H GLU 27 HN GLU 27 13.476 -1.730 4.613
189 HA GLU 27 HA GLU 27 10.810 -2.393 5.470
190 HB2 GLU 27 HB2 GLU 27 10.557 0.174 5.394
191 HB3 GLU 27 HB1 GLU 27 11.618 -0.528 6.603
192 HG2 GLU 27 HG2 GLU 27 12.683 1.400 5.697
193 HG3 GLU 27 HG1 GLU 27 13.552 -0.021 5.124
194 H ALA 28 HN ALA 28 12.442 -1.596 2.581
195 HA ALA 28 HA ALA 28 10.431 -0.604 0.963
196 HB1 ALA 28 HB1 ALA 28 12.806 -0.679 0.378
197 HB2 ALA 28 HB2 ALA 28 11.790 -1.377 -0.874
198 HB3 ALA 28 HB3 ALA 28 12.698 -2.428 0.198
199 H ASP 29 HN ASP 29 10.982 -3.817 2.146
200 HA ASP 29 HA ASP 29 9.377 -5.310 0.417
201 HB2 ASP 29 HB2 ASP 29 10.755 -6.363 2.136
202 HB3 ASP 29 HB1 ASP 29 9.798 -5.601 3.402
203 H LEU 30 HN LEU 30 8.566 -3.392 3.273
204 HA LEU 30 HA LEU 30 5.775 -3.950 3.193
205 HB2 LEU 30 HB2 LEU 30 7.368 -1.789 4.567
206 HB3 LEU 30 HB1 LEU 30 5.630 -1.931 4.722
207 HG LEU 30 HG LEU 30 6.020 -4.266 5.637
208 HD11 LEU 30 HD11 LEU 30 8.857 -3.269 5.829
209 HD12 LEU 30 HD12 LEU 30 8.292 -4.611 4.835
210 HD13 LEU 30 HD13 LEU 30 8.225 -4.725 6.594
211 HD21 LEU 30 HD21 LEU 30 5.421 -2.404 7.060
212 HD22 LEU 30 HD22 LEU 30 7.109 -1.901 7.149
213 HD23 LEU 30 HD23 LEU 30 6.606 -3.429 7.871
214 H ARG 31 HN ARG 31 7.853 -1.460 1.821
215 HA ARG 31 HA ARG 31 5.785 0.229 0.863
216 HB2 ARG 31 HB2 ARG 31 8.353 -0.156 -0.648
217 HB3 ARG 31 HB1 ARG 31 7.407 1.307 -0.435
218 HG2 ARG 31 HG2 ARG 31 8.996 -0.028 1.735
219 HG3 ARG 31 HG1 ARG 31 9.555 1.331 0.764
220 HD2 ARG 31 HD2 ARG 31 7.730 2.706 1.616
221 HD3 ARG 31 HD1 ARG 31 7.134 1.338 2.559
222 HE ARG 31 HE ARG 31 9.886 1.967 3.112
223 HH11 ARG 31 HH11 ARG 31 6.582 2.868 3.904
224 HH12 ARG 31 HH12 ARG 31 6.997 3.467 5.482
225 HH21 ARG 31 HH21 ARG 31 10.430 2.768 5.128
226 HH22 ARG 31 HH22 ARG 31 9.217 3.436 6.180
227 H ARG 32 HN ARG 32 7.421 -2.600 -0.423
228 HA ARG 32 HA ARG 32 6.119 -2.675 -2.931
229 HB2 ARG 32 HB2 ARG 32 8.192 -3.925 -2.414
230 HB3 ARG 32 HB1 ARG 32 7.280 -4.954 -1.315
231 HG2 ARG 32 HG2 ARG 32 5.972 -5.820 -3.142
232 HG3 ARG 32 HG1 ARG 32 6.762 -4.715 -4.270
233 HD2 ARG 32 HD2 ARG 32 8.916 -5.799 -3.794
234 HD3 ARG 32 HD1 ARG 32 8.098 -6.920 -2.706
235 HE ARG 32 HE ARG 32 6.897 -7.778 -4.644
236 HH11 ARG 32 HH11 ARG 32 9.798 -5.884 -5.259
237 HH12 ARG 32 HH12 ARG 32 10.031 -6.566 -6.841
238 HH21 ARG 32 HH21 ARG 32 7.216 -8.646 -6.707
239 HH22 ARG 32 HH22 ARG 32 8.560 -8.112 -7.682
240 H ALA 33 HN ALA 33 5.310 -3.912 0.263
241 HA ALA 33 HA ALA 33 3.007 -5.366 -0.479
242 HB1 ALA 33 HB1 ALA 33 3.557 -3.974 2.141
243 HB2 ALA 33 HB2 ALA 33 4.099 -5.596 1.711
244 HB3 ALA 33 HB3 ALA 33 2.375 -5.256 1.861
245 H ILE 34 HN ILE 34 3.600 -1.972 0.079
246 HA ILE 34 HA ILE 34 0.903 -1.092 0.086
247 HB ILE 34 HB ILE 34 3.567 0.176 -0.208
248 HG12 ILE 34 HG12 ILE 34 2.701 1.702 1.423
249 HG13 ILE 34 HG11 ILE 34 1.055 1.170 1.107
250 HG21 ILE 34 HG21 ILE 34 1.212 1.828 -1.024
251 HG22 ILE 34 HG22 ILE 34 2.131 0.923 -2.210
252 HG23 ILE 34 HG23 ILE 34 2.935 2.152 -1.243
253 HD11 ILE 34 HD11 ILE 34 1.955 0.320 3.227
254 HD12 ILE 34 HD12 ILE 34 3.213 -0.531 2.331
255 HD13 ILE 34 HD13 ILE 34 1.521 -0.972 2.110
256 H GLN 35 HN GLN 35 3.318 -1.624 -2.415
257 HA GLN 35 HA GLN 35 1.732 -0.782 -4.612
258 HB2 GLN 35 HB2 GLN 35 4.062 -2.710 -4.520
259 HB3 GLN 35 HB1 GLN 35 3.374 -2.027 -5.986
260 HG2 GLN 35 HG2 GLN 35 4.021 0.200 -5.290
261 HG3 GLN 35 HG1 GLN 35 4.642 -0.437 -3.768
262 HE21 GLN 35 HE21 GLN 35 6.700 0.363 -4.186
263 HE22 GLN 35 HE22 GLN 35 7.748 -0.366 -5.351
264 H LEU 36 HN LEU 36 2.172 -3.839 -2.960
265 HA LEU 36 HA LEU 36 0.659 -5.435 -4.748
266 HB2 LEU 36 HB2 LEU 36 2.260 -6.451 -3.282
267 HB3 LEU 36 HB1 LEU 36 1.507 -5.749 -1.870
268 HG LEU 36 HG LEU 36 1.196 -8.245 -2.248
269 HD11 LEU 36 HD11 LEU 36 -1.385 -7.941 -1.751
270 HD12 LEU 36 HD12 LEU 36 -0.893 -6.243 -1.606
271 HD13 LEU 36 HD13 LEU 36 -0.146 -7.476 -0.585
272 HD21 LEU 36 HD21 LEU 36 -0.671 -8.878 -3.732
273 HD22 LEU 36 HD22 LEU 36 0.708 -8.231 -4.621
274 HD23 LEU 36 HD23 LEU 36 -0.717 -7.227 -4.350
275 H SER 37 HN SER 37 -0.124 -3.775 -1.702
276 HA SER 37 HA SER 37 -2.820 -4.473 -1.564
277 HB2 SER 37 HB2 SER 37 -1.564 -3.359 0.261
278 HB3 SER 37 HB1 SER 37 -1.547 -1.868 -0.679
279 HG SER 37 HG SER 37 -4.036 -2.512 -0.638
280 H MET 38 HN MET 38 -1.182 -2.174 -3.589
281 HA MET 38 HA MET 38 -3.570 -0.841 -4.462
282 HB2 MET 38 HB2 MET 38 -1.486 0.384 -4.452
283 HB3 MET 38 HB1 MET 38 -0.726 -0.822 -5.480
284 HG2 MET 38 HG2 MET 38 -2.222 -0.230 -7.293
285 HG3 MET 38 HG1 MET 38 -2.989 0.988 -6.277
286 HE1 MET 38 HE1 MET 38 -1.802 1.670 -9.160
287 HE2 MET 38 HE2 MET 38 -0.992 3.197 -8.811
288 HE3 MET 38 HE3 MET 38 -2.566 2.852 -8.095
289 H GLN 39 HN GLN 39 -1.316 -3.236 -5.829
290 HA GLN 39 HA GLN 39 -3.364 -3.906 -7.842
291 HB2 GLN 39 HB2 GLN 39 -0.377 -4.256 -7.906
292 HB3 GLN 39 HB1 GLN 39 -1.454 -4.983 -9.083
293 HG2 GLN 39 HG2 GLN 39 -2.218 -2.724 -9.719
294 HG3 GLN 39 HG1 GLN 39 -1.037 -2.044 -8.600
295 HE21 GLN 39 HE21 GLN 39 1.140 -2.161 -9.093
296 HE22 GLN 39 HE22 GLN 39 1.719 -2.551 -10.677
297 H GLY 40 HN GLY 40 -4.514 -5.366 -6.627
298 HA2 GLY 40 HA2 GLY 40 -3.480 -7.398 -5.004
299 HA3 GLY 40 HA1 GLY 40 -5.057 -7.426 -5.780
300 H SER 41 HN SER 41 -4.354 -7.463 -8.440
301 HA SER 41 HA SER 41 -3.259 -10.132 -8.738
302 HB2 SER 41 HB2 SER 41 -4.279 -8.190 -10.832
303 HB3 SER 41 HB1 SER 41 -3.890 -9.886 -11.101
304 HG SER 41 HG SER 41 -5.543 -10.399 -9.547
305 H SER 42 HN SER 42 -1.270 -10.615 -9.521
306 HA SER 42 HA SER 42 0.716 -8.567 -9.532
307 HB2 SER 42 HB2 SER 42 1.006 -11.447 -10.410
308 HB3 SER 42 HB1 SER 42 2.284 -10.367 -9.847
309 HG SER 42 HG SER 42 1.817 -11.412 -8.032
310 H ARG 43 HN ARG 43 -0.642 -7.475 -11.341
311 HA ARG 43 HA ARG 43 -0.085 -8.530 -13.987
312 HB2 ARG 43 HB2 ARG 43 -1.395 -6.461 -14.718
313 HB3 ARG 43 HB1 ARG 43 -2.272 -7.696 -13.829
314 HG2 ARG 43 HG2 ARG 43 -1.951 -6.335 -11.765
315 HG3 ARG 43 HG1 ARG 43 -1.263 -5.064 -12.776
316 HD2 ARG 43 HD2 ARG 43 -3.617 -4.634 -12.328
317 HD3 ARG 43 HD1 ARG 43 -3.355 -4.942 -14.044
318 HE ARG 43 HE ARG 43 -4.118 -7.306 -13.471
319 HH11 ARG 43 HH11 ARG 43 -5.238 -4.461 -11.747
320 HH12 ARG 43 HH12 ARG 43 -6.767 -5.170 -11.328
321 HH21 ARG 43 HH21 ARG 43 -6.117 -8.227 -12.929
322 HH22 ARG 43 HH22 ARG 43 -7.278 -7.311 -12.010
323 H ASN 44 HN ASN 44 0.298 -5.225 -12.630
324 HA ASN 44 HA ASN 44 2.706 -4.986 -14.293
325 HB2 ASN 44 HB2 ASN 44 0.785 -2.938 -13.208
326 HB3 ASN 44 HB1 ASN 44 2.389 -2.477 -13.771
327 HD21 ASN 44 HD21 ASN 44 2.579 -4.346 -15.891
328 HD22 ASN 44 HD22 ASN 44 1.458 -3.864 -17.122
329 H LEU 45 HN LEU 45 3.384 -6.442 -12.375
330 HA LEU 45 HA LEU 45 4.911 -4.712 -10.562
331 HB2 LEU 45 HB2 LEU 45 3.535 -7.312 -9.861
332 HB3 LEU 45 HB1 LEU 45 4.729 -6.534 -8.842
333 HG LEU 45 HG LEU 45 2.085 -5.295 -9.616
334 HD11 LEU 45 HD11 LEU 45 2.929 -6.651 -7.057
335 HD12 LEU 45 HD12 LEU 45 1.742 -7.255 -8.214
336 HD13 LEU 45 HD13 LEU 45 1.419 -5.777 -7.307
337 HD21 LEU 45 HD21 LEU 45 2.608 -3.683 -7.863
338 HD22 LEU 45 HD22 LEU 45 3.852 -3.674 -9.113
339 HD23 LEU 45 HD23 LEU 45 4.153 -4.480 -7.573
340 H GLU 46 HN GLU 46 6.987 -5.640 -9.962
341 HA GLU 46 HA GLU 46 7.977 -7.432 -12.053
342 HB2 GLU 46 HB2 GLU 46 9.489 -5.855 -9.956
343 HB3 GLU 46 HB1 GLU 46 10.219 -6.801 -11.246
344 HG2 GLU 46 HG2 GLU 46 9.108 -5.332 -12.894
345 HG3 GLU 46 HG1 GLU 46 8.504 -4.348 -11.562
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 -18.270 8.187 -2.598
2 H2 GLY 1 HT2 GLY 1 -19.706 8.688 -3.338
3 H3 GLY 1 HT3 GLY 1 -18.214 9.020 -4.071
4 HA2 GLY 1 HA1 GLY 1 -19.337 7.178 -5.178
5 HA3 GLY 1 HA2 GLY 1 -17.823 6.674 -4.439
6 H SER 2 HN SER 2 -18.809 4.480 -4.540
7 HA SER 2 HA SER 2 -20.981 3.842 -2.793
8 HB2 SER 2 HB2 SER 2 -19.038 1.690 -3.270
9 HB3 SER 2 HB1 SER 2 -20.752 1.762 -3.679
10 HG SER 2 HG SER 2 -18.514 2.646 -5.162
11 H LEU 3 HN LEU 3 -17.564 2.998 -2.599
12 HA LEU 3 HA LEU 3 -17.373 4.106 0.086
13 HB2 LEU 3 HB2 LEU 3 -17.925 1.735 0.446
14 HB3 LEU 3 HB1 LEU 3 -16.601 1.263 -0.604
15 HG LEU 3 HG LEU 3 -15.028 2.344 1.008
16 HD11 LEU 3 HD11 LEU 3 -17.478 2.488 2.752
17 HD12 LEU 3 HD12 LEU 3 -16.591 3.859 2.089
18 HD13 LEU 3 HD13 LEU 3 -15.823 2.800 3.271
19 HD21 LEU 3 HD21 LEU 3 -16.744 0.127 2.111
20 HD22 LEU 3 HD22 LEU 3 -15.104 0.522 2.624
21 HD23 LEU 3 HD23 LEU 3 -15.398 -0.069 0.989
22 H ASP 4 HN ASP 4 -16.437 3.774 -2.945
23 HA ASP 4 HA ASP 4 -13.661 3.352 -2.950
24 HB2 ASP 4 HB2 ASP 4 -15.112 5.006 -5.000
25 HB3 ASP 4 HB1 ASP 4 -13.795 3.857 -5.240
26 H GLU 5 HN GLU 5 -15.651 6.218 -2.688
27 HA GLU 5 HA GLU 5 -13.671 8.162 -3.088
28 HB2 GLU 5 HB2 GLU 5 -16.197 8.454 -3.005
29 HB3 GLU 5 HB1 GLU 5 -16.051 8.432 -1.255
30 HG2 GLU 5 HG2 GLU 5 -14.699 10.414 -1.291
31 HG3 GLU 5 HG1 GLU 5 -14.661 10.397 -3.056
32 H ASP 6 HN ASP 6 -14.762 6.458 -0.207
33 HA ASP 6 HA ASP 6 -12.970 7.748 1.594
34 HB2 ASP 6 HB2 ASP 6 -14.336 5.054 1.801
35 HB3 ASP 6 HB1 ASP 6 -13.557 5.909 3.127
36 H GLU 7 HN GLU 7 -12.962 4.749 -0.247
37 HA GLU 7 HA GLU 7 -10.558 3.648 0.595
38 HB2 GLU 7 HB2 GLU 7 -12.060 3.505 -2.002
39 HB3 GLU 7 HB1 GLU 7 -10.530 2.660 -1.787
40 HG2 GLU 7 HG2 GLU 7 -12.582 2.288 0.287
41 HG3 GLU 7 HG1 GLU 7 -12.880 1.539 -1.282
42 H GLU 8 HN GLU 8 -11.151 6.238 -1.698
43 HA GLU 8 HA GLU 8 -8.643 6.334 -2.939
44 HB2 GLU 8 HB2 GLU 8 -10.655 8.500 -2.331
45 HB3 GLU 8 HB1 GLU 8 -9.183 8.806 -3.241
46 HG2 GLU 8 HG2 GLU 8 -11.363 6.876 -4.006
47 HG3 GLU 8 HG1 GLU 8 -11.079 8.467 -4.715
48 H ASP 9 HN ASP 9 -9.698 7.606 0.181
49 HA ASP 9 HA ASP 9 -7.233 9.042 0.584
50 HB2 ASP 9 HB2 ASP 9 -9.338 9.811 1.634
51 HB3 ASP 9 HB1 ASP 9 -9.373 8.337 2.602
52 H LEU 10 HN LEU 10 -8.616 5.961 1.619
53 HA LEU 10 HA LEU 10 -6.475 5.162 3.278
54 HB2 LEU 10 HB2 LEU 10 -8.351 3.478 1.635
55 HB3 LEU 10 HB1 LEU 10 -7.293 2.875 2.896
56 HG LEU 10 HG LEU 10 -9.658 4.713 3.229
57 HD11 LEU 10 HD11 LEU 10 -10.355 2.803 4.727
58 HD12 LEU 10 HD12 LEU 10 -9.027 1.897 4.000
59 HD13 LEU 10 HD13 LEU 10 -10.352 2.475 2.993
60 HD21 LEU 10 HD21 LEU 10 -7.934 5.470 4.729
61 HD22 LEU 10 HD22 LEU 10 -7.588 3.817 5.232
62 HD23 LEU 10 HD23 LEU 10 -9.129 4.565 5.657
63 H GLN 11 HN GLN 11 -7.183 4.558 -0.136
64 HA GLN 11 HA GLN 11 -4.796 3.290 -0.852
65 HB2 GLN 11 HB2 GLN 11 -6.608 3.210 -2.363
66 HB3 GLN 11 HB1 GLN 11 -6.835 4.950 -2.322
67 HG2 GLN 11 HG2 GLN 11 -5.929 4.286 -4.435
68 HG3 GLN 11 HG1 GLN 11 -4.757 5.241 -3.536
69 HE21 GLN 11 HE21 GLN 11 -3.033 4.409 -4.730
70 HE22 GLN 11 HE22 GLN 11 -2.462 2.793 -4.523
71 H ARG 12 HN ARG 12 -5.632 6.704 -0.562
72 HA ARG 12 HA ARG 12 -3.242 7.789 -1.587
73 HB2 ARG 12 HB2 ARG 12 -5.342 9.065 -1.181
74 HB3 ARG 12 HB1 ARG 12 -5.054 8.940 0.544
75 HG2 ARG 12 HG2 ARG 12 -2.995 10.197 -1.216
76 HG3 ARG 12 HG1 ARG 12 -4.421 11.111 -0.727
77 HD2 ARG 12 HD2 ARG 12 -2.432 9.793 1.118
78 HD3 ARG 12 HD1 ARG 12 -2.543 11.520 0.781
79 HE ARG 12 HE ARG 12 -4.961 10.304 1.828
80 HH11 ARG 12 HH11 ARG 12 -2.008 12.063 2.545
81 HH12 ARG 12 HH12 ARG 12 -2.573 12.600 4.099
82 HH21 ARG 12 HH21 ARG 12 -5.701 11.008 3.844
83 HH22 ARG 12 HH22 ARG 12 -4.657 11.977 4.858
84 H ALA 13 HN ALA 13 -4.189 6.869 1.714
85 HA ALA 13 HA ALA 13 -1.826 7.574 3.023
86 HB1 ALA 13 HB1 ALA 13 -2.501 5.992 4.761
87 HB2 ALA 13 HB2 ALA 13 -3.688 5.284 3.660
88 HB3 ALA 13 HB3 ALA 13 -3.873 6.954 4.204
89 H LEU 14 HN LEU 14 -2.670 4.660 1.211
90 HA LEU 14 HA LEU 14 -0.324 3.200 1.782
91 HB2 LEU 14 HB2 LEU 14 -2.144 3.136 -0.626
92 HB3 LEU 14 HB1 LEU 14 -0.846 1.988 -0.351
93 HG LEU 14 HG LEU 14 -3.196 2.375 1.509
94 HD11 LEU 14 HD11 LEU 14 -2.692 0.232 -0.555
95 HD12 LEU 14 HD12 LEU 14 -3.929 1.487 -0.643
96 HD13 LEU 14 HD13 LEU 14 -4.013 0.253 0.615
97 HD21 LEU 14 HD21 LEU 14 -2.424 0.318 2.538
98 HD22 LEU 14 HD22 LEU 14 -1.139 1.525 2.570
99 HD23 LEU 14 HD23 LEU 14 -1.092 0.217 1.391
100 H ALA 15 HN ALA 15 -1.146 5.264 -1.008
101 HA ALA 15 HA ALA 15 1.358 5.200 -2.265
102 HB1 ALA 15 HB1 ALA 15 0.658 7.245 -3.397
103 HB2 ALA 15 HB2 ALA 15 -0.641 7.462 -2.225
104 HB3 ALA 15 HB3 ALA 15 -0.671 6.087 -3.328
105 H LEU 16 HN LEU 16 0.064 7.270 0.264
106 HA LEU 16 HA LEU 16 2.168 9.041 0.628
107 HB2 LEU 16 HB2 LEU 16 -0.061 9.168 1.682
108 HB3 LEU 16 HB1 LEU 16 0.334 7.790 2.681
109 HG LEU 16 HG LEU 16 1.933 10.329 2.856
110 HD11 LEU 16 HD11 LEU 16 0.340 10.731 4.862
111 HD12 LEU 16 HD12 LEU 16 -0.770 9.680 3.967
112 HD13 LEU 16 HD13 LEU 16 -0.187 11.180 3.241
113 HD21 LEU 16 HD21 LEU 16 2.312 9.531 5.149
114 HD22 LEU 16 HD22 LEU 16 2.846 8.345 3.956
115 HD23 LEU 16 HD23 LEU 16 1.323 8.107 4.814
116 H SER 17 HN SER 17 1.608 5.885 2.178
117 HA SER 17 HA SER 17 3.967 5.844 3.707
118 HB2 SER 17 HB2 SER 17 2.450 3.469 2.597
119 HB3 SER 17 HB1 SER 17 3.531 3.469 3.991
120 HG SER 17 HG SER 17 1.262 5.156 3.888
121 H ARG 18 HN ARG 18 3.410 5.266 0.362
122 HA ARG 18 HA ARG 18 5.841 3.763 -0.050
123 HB2 ARG 18 HB2 ARG 18 4.519 2.996 -1.687
124 HB3 ARG 18 HB1 ARG 18 3.418 4.355 -1.538
125 HG2 ARG 18 HG2 ARG 18 4.915 5.690 -2.954
126 HG3 ARG 18 HG1 ARG 18 5.963 4.282 -3.146
127 HD2 ARG 18 HD2 ARG 18 4.126 3.045 -4.169
128 HD3 ARG 18 HD1 ARG 18 3.058 4.430 -3.954
129 HE ARG 18 HE ARG 18 5.389 5.112 -5.459
130 HH11 ARG 18 HH11 ARG 18 2.231 3.591 -5.708
131 HH12 ARG 18 HH12 ARG 18 2.084 3.907 -7.406
132 HH21 ARG 18 HH21 ARG 18 5.193 5.492 -7.708
133 HH22 ARG 18 HH22 ARG 18 3.746 4.983 -8.532
134 H GLN 19 HN GLN 19 4.747 7.065 -0.306
135 HA GLN 19 HA GLN 19 7.143 7.856 -1.775
136 HB2 GLN 19 HB2 GLN 19 6.122 10.052 -1.959
137 HB3 GLN 19 HB1 GLN 19 4.971 8.818 -2.453
138 HG2 GLN 19 HG2 GLN 19 3.858 8.973 -0.296
139 HG3 GLN 19 HG1 GLN 19 5.022 10.191 0.225
140 HE21 GLN 19 HE21 GLN 19 3.441 11.734 0.562
141 HE22 GLN 19 HE22 GLN 19 2.624 12.519 -0.754
142 H GLU 20 HN GLU 20 5.928 7.686 1.404
143 HA GLU 20 HA GLU 20 7.278 9.556 2.861
144 HB2 GLU 20 HB2 GLU 20 6.746 6.636 3.350
145 HB3 GLU 20 HB1 GLU 20 7.633 7.590 4.536
146 HG2 GLU 20 HG2 GLU 20 4.848 8.155 3.542
147 HG3 GLU 20 HG1 GLU 20 5.265 7.404 5.082
148 H ILE 21 HN ILE 21 8.593 6.329 2.215
149 HA ILE 21 HA ILE 21 11.243 7.503 1.773
150 HB ILE 21 HB ILE 21 10.736 5.159 3.617
151 HG12 ILE 21 HG12 ILE 21 10.250 7.381 4.623
152 HG13 ILE 21 HG11 ILE 21 11.591 6.548 5.404
153 HG21 ILE 21 HG21 ILE 21 13.337 6.447 2.802
154 HG22 ILE 21 HG22 ILE 21 12.758 4.864 2.279
155 HG23 ILE 21 HG23 ILE 21 13.151 5.142 3.976
156 HD11 ILE 21 HD11 ILE 21 11.966 8.965 5.059
157 HD12 ILE 21 HD12 ILE 21 11.898 8.680 3.319
158 HD13 ILE 21 HD13 ILE 21 13.178 7.945 4.284
159 H ASP 22 HN ASP 22 11.162 7.033 -0.392
160 HA ASP 22 HA ASP 22 10.263 4.614 -1.512
161 HB2 ASP 22 HB2 ASP 22 10.580 6.653 -2.852
162 HB3 ASP 22 HB1 ASP 22 12.321 6.550 -2.604
163 H MET 23 HN MET 23 13.607 5.737 -1.225
164 HA MET 23 HA MET 23 15.587 4.582 -1.302
165 HB2 MET 23 HB2 MET 23 14.834 4.802 1.102
166 HB3 MET 23 HB1 MET 23 14.350 3.113 1.014
167 HG2 MET 23 HG2 MET 23 16.551 3.372 2.022
168 HG3 MET 23 HG1 MET 23 16.625 2.455 0.518
169 HE1 MET 23 HE1 MET 23 19.234 2.793 0.335
170 HE2 MET 23 HE2 MET 23 19.209 3.665 1.869
171 HE3 MET 23 HE3 MET 23 20.033 4.361 0.475
172 H GLU 24 HN GLU 24 15.600 3.444 -3.175
173 HA GLU 24 HA GLU 24 14.037 1.096 -3.578
174 HB2 GLU 24 HB2 GLU 24 15.243 1.069 -5.790
175 HB3 GLU 24 HB1 GLU 24 14.350 2.538 -5.421
176 HG2 GLU 24 HG2 GLU 24 16.552 3.486 -4.588
177 HG3 GLU 24 HG1 GLU 24 17.315 2.098 -5.365
178 H ASP 25 HN ASP 25 15.606 0.409 -1.431
179 HA ASP 25 HA ASP 25 17.066 -1.786 -2.703
180 HB2 ASP 25 HB2 ASP 25 18.804 -1.780 -1.004
181 HB3 ASP 25 HB1 ASP 25 18.757 -0.236 -1.835
182 H GLU 26 HN GLU 26 16.144 -0.916 0.649
183 HA GLU 26 HA GLU 26 14.768 -3.523 0.762
184 HB2 GLU 26 HB2 GLU 26 16.293 -2.059 2.910
185 HB3 GLU 26 HB1 GLU 26 15.196 -3.389 3.261
186 HG2 GLU 26 HG2 GLU 26 17.622 -3.543 1.483
187 HG3 GLU 26 HG1 GLU 26 17.526 -4.124 3.145
188 H GLU 27 HN GLU 27 14.626 -0.108 1.612
189 HA GLU 27 HA GLU 27 12.127 -0.153 2.907
190 HB2 GLU 27 HB2 GLU 27 13.507 1.974 1.277
191 HB3 GLU 27 HB1 GLU 27 11.956 2.241 2.063
192 HG2 GLU 27 HG2 GLU 27 14.428 1.370 3.528
193 HG3 GLU 27 HG1 GLU 27 13.959 3.057 3.318
194 H ALA 28 HN ALA 28 13.059 -0.063 -0.466
195 HA ALA 28 HA ALA 28 10.576 0.361 -1.662
196 HB1 ALA 28 HB1 ALA 28 12.801 -1.384 -2.706
197 HB2 ALA 28 HB2 ALA 28 12.746 0.372 -2.849
198 HB3 ALA 28 HB3 ALA 28 11.527 -0.615 -3.653
199 H ASP 29 HN ASP 29 11.954 -2.499 -0.221
200 HA ASP 29 HA ASP 29 10.182 -4.425 -1.277
201 HB2 ASP 29 HB2 ASP 29 12.349 -4.853 -0.022
202 HB3 ASP 29 HB1 ASP 29 11.471 -4.493 1.459
203 H LEU 30 HN LEU 30 10.092 -2.400 1.604
204 HA LEU 30 HA LEU 30 7.619 -3.383 2.600
205 HB2 LEU 30 HB2 LEU 30 9.233 -0.906 3.140
206 HB3 LEU 30 HB1 LEU 30 7.654 -1.131 3.863
207 HG LEU 30 HG LEU 30 8.483 -3.203 4.951
208 HD11 LEU 30 HD11 LEU 30 11.159 -2.346 3.862
209 HD12 LEU 30 HD12 LEU 30 10.259 -3.790 3.398
210 HD13 LEU 30 HD13 LEU 30 10.887 -3.632 5.038
211 HD21 LEU 30 HD21 LEU 30 8.474 -1.111 6.170
212 HD22 LEU 30 HD22 LEU 30 10.058 -0.696 5.511
213 HD23 LEU 30 HD23 LEU 30 9.891 -2.066 6.612
214 H ARG 31 HN ARG 31 8.531 -0.735 0.462
215 HA ARG 31 HA ARG 31 5.944 0.432 0.302
216 HB2 ARG 31 HB2 ARG 31 8.052 0.524 -1.859
217 HB3 ARG 31 HB1 ARG 31 6.784 1.700 -1.546
218 HG2 ARG 31 HG2 ARG 31 9.219 1.144 0.132
219 HG3 ARG 31 HG1 ARG 31 8.852 2.607 -0.784
220 HD2 ARG 31 HD2 ARG 31 7.228 3.293 0.719
221 HD3 ARG 31 HD1 ARG 31 6.992 1.666 1.357
222 HE ARG 31 HE ARG 31 9.594 2.872 1.851
223 HH11 ARG 31 HH11 ARG 31 6.364 2.307 3.043
224 HH12 ARG 31 HH12 ARG 31 6.803 2.430 4.719
225 HH21 ARG 31 HH21 ARG 31 10.209 3.017 4.076
226 HH22 ARG 31 HH22 ARG 31 8.991 2.820 5.297
227 H ARG 32 HN ARG 32 7.593 -2.128 -1.426
228 HA ARG 32 HA ARG 32 5.632 -2.632 -3.391
229 HB2 ARG 32 HB2 ARG 32 7.975 -3.544 -3.344
230 HB3 ARG 32 HB1 ARG 32 7.466 -4.644 -2.072
231 HG2 ARG 32 HG2 ARG 32 5.738 -5.517 -3.684
232 HG3 ARG 32 HG1 ARG 32 6.564 -4.581 -4.934
233 HD2 ARG 32 HD2 ARG 32 7.397 -6.831 -4.995
234 HD3 ARG 32 HD1 ARG 32 8.665 -5.781 -4.360
235 HE ARG 32 HE ARG 32 6.942 -7.449 -2.635
236 HH11 ARG 32 HH11 ARG 32 10.103 -6.220 -3.551
237 HH12 ARG 32 HH12 ARG 32 10.905 -6.929 -2.175
238 HH21 ARG 32 HH21 ARG 32 8.013 -8.414 -0.860
239 HH22 ARG 32 HH22 ARG 32 9.724 -8.165 -0.658
240 H ALA 33 HN ALA 33 5.988 -3.624 -0.037
241 HA ALA 33 HA ALA 33 3.860 -5.487 0.033
242 HB1 ALA 33 HB1 ALA 33 5.592 -5.401 1.761
243 HB2 ALA 33 HB2 ALA 33 3.980 -5.254 2.461
244 HB3 ALA 33 HB3 ALA 33 4.997 -3.824 2.281
245 H ILE 34 HN ILE 34 4.018 -2.009 0.286
246 HA ILE 34 HA ILE 34 1.351 -1.588 1.174
247 HB ILE 34 HB ILE 34 3.491 0.101 0.002
248 HG12 ILE 34 HG12 ILE 34 2.792 1.611 1.849
249 HG13 ILE 34 HG11 ILE 34 1.509 0.479 2.254
250 HG21 ILE 34 HG21 ILE 34 1.998 2.006 -0.390
251 HG22 ILE 34 HG22 ILE 34 0.607 0.955 -0.128
252 HG23 ILE 34 HG23 ILE 34 1.678 0.672 -1.500
253 HD11 ILE 34 HD11 ILE 34 4.459 -0.092 2.363
254 HD12 ILE 34 HD12 ILE 34 3.168 -1.215 2.789
255 HD13 ILE 34 HD13 ILE 34 3.410 0.250 3.740
256 H GLN 35 HN GLN 35 2.884 -1.862 -1.989
257 HA GLN 35 HA GLN 35 0.450 -1.482 -3.453
258 HB2 GLN 35 HB2 GLN 35 3.108 -2.639 -4.310
259 HB3 GLN 35 HB1 GLN 35 1.771 -2.303 -5.401
260 HG2 GLN 35 HG2 GLN 35 1.898 0.091 -4.612
261 HG3 GLN 35 HG1 GLN 35 3.416 -0.345 -3.828
262 HE21 GLN 35 HE21 GLN 35 2.369 -1.746 -6.841
263 HE22 GLN 35 HE22 GLN 35 3.551 -0.981 -7.844
264 H LEU 36 HN LEU 36 1.875 -4.082 -1.798
265 HA LEU 36 HA LEU 36 0.593 -6.225 -3.165
266 HB2 LEU 36 HB2 LEU 36 2.575 -6.641 -1.873
267 HB3 LEU 36 HB1 LEU 36 1.864 -5.939 -0.442
268 HG LEU 36 HG LEU 36 2.129 -8.460 -0.504
269 HD11 LEU 36 HD11 LEU 36 -0.352 -8.695 0.374
270 HD12 LEU 36 HD12 LEU 36 -0.288 -6.926 0.257
271 HD13 LEU 36 HD13 LEU 36 0.878 -7.794 1.261
272 HD21 LEU 36 HD21 LEU 36 0.333 -9.721 -1.596
273 HD22 LEU 36 HD22 LEU 36 1.344 -8.868 -2.764
274 HD23 LEU 36 HD23 LEU 36 -0.248 -8.234 -2.347
275 H SER 37 HN SER 37 -0.116 -4.385 -0.207
276 HA SER 37 HA SER 37 -2.527 -5.519 0.511
277 HB2 SER 37 HB2 SER 37 -1.803 -2.581 0.631
278 HB3 SER 37 HB1 SER 37 -3.038 -3.386 1.598
279 HG SER 37 HG SER 37 -1.422 -4.605 2.593
280 H MET 38 HN MET 38 -1.898 -3.058 -1.950
281 HA MET 38 HA MET 38 -4.722 -3.171 -2.751
282 HB2 MET 38 HB2 MET 38 -4.158 -1.091 -4.080
283 HB3 MET 38 HB1 MET 38 -4.118 -0.925 -2.333
284 HG2 MET 38 HG2 MET 38 -2.236 0.221 -2.954
285 HG3 MET 38 HG1 MET 38 -1.578 -1.376 -2.606
286 HE1 MET 38 HE1 MET 38 -2.720 1.117 -5.415
287 HE2 MET 38 HE2 MET 38 -3.668 -0.325 -5.777
288 HE3 MET 38 HE3 MET 38 -2.392 0.188 -6.879
289 H GLN 39 HN GLN 39 -3.086 -5.348 -3.402
290 HA GLN 39 HA GLN 39 -1.807 -5.159 -5.882
291 HB2 GLN 39 HB2 GLN 39 -1.949 -7.624 -5.972
292 HB3 GLN 39 HB1 GLN 39 -1.352 -7.024 -4.433
293 HG2 GLN 39 HG2 GLN 39 -3.446 -7.471 -3.370
294 HG3 GLN 39 HG1 GLN 39 -4.201 -7.861 -4.914
295 HE21 GLN 39 HE21 GLN 39 -3.698 -9.826 -5.922
296 HE22 GLN 39 HE22 GLN 39 -2.985 -11.133 -5.047
297 H GLY 40 HN GLY 40 -2.899 -4.219 -7.496
298 HA2 GLY 40 HA2 GLY 40 -5.441 -5.389 -8.360
299 HA3 GLY 40 HA1 GLY 40 -4.676 -3.951 -9.035
300 H SER 41 HN SER 41 -2.083 -5.137 -9.267
301 HA SER 41 HA SER 41 -2.546 -6.804 -11.619
302 HB2 SER 41 HB2 SER 41 0.026 -5.496 -10.695
303 HB3 SER 41 HB1 SER 41 -0.295 -6.207 -12.275
304 HG SER 41 HG SER 41 -0.817 -3.712 -11.395
305 H SER 42 HN SER 42 -2.625 -8.914 -11.139
306 HA SER 42 HA SER 42 -0.681 -9.966 -9.189
307 HB2 SER 42 HB2 SER 42 -3.290 -11.212 -10.102
308 HB3 SER 42 HB1 SER 42 -2.231 -11.815 -8.826
309 HG SER 42 HG SER 42 -3.134 -9.186 -8.617
310 H ARG 43 HN ARG 43 0.224 -9.395 -11.692
311 HA ARG 43 HA ARG 43 -0.016 -11.737 -13.405
312 HB2 ARG 43 HB2 ARG 43 -0.014 -9.318 -14.218
313 HB3 ARG 43 HB1 ARG 43 1.700 -9.293 -13.836
314 HG2 ARG 43 HG2 ARG 43 1.937 -11.281 -15.379
315 HG3 ARG 43 HG1 ARG 43 0.285 -10.943 -15.902
316 HD2 ARG 43 HD2 ARG 43 2.734 -9.233 -16.202
317 HD3 ARG 43 HD1 ARG 43 1.640 -9.822 -17.454
318 HE ARG 43 HE ARG 43 -0.056 -8.279 -16.413
319 HH11 ARG 43 HH11 ARG 43 3.395 -7.679 -16.161
320 HH12 ARG 43 HH12 ARG 43 3.204 -5.960 -15.960
321 HH21 ARG 43 HH21 ARG 43 -0.293 -6.003 -16.144
322 HH22 ARG 43 HH22 ARG 43 1.128 -5.023 -15.931
323 H ASN 44 HN ASN 44 2.425 -9.995 -11.530
324 HA ASN 44 HA ASN 44 4.238 -12.302 -11.859
325 HB2 ASN 44 HB2 ASN 44 4.964 -9.434 -11.199
326 HB3 ASN 44 HB1 ASN 44 6.098 -10.763 -11.403
327 HD21 ASN 44 HD21 ASN 44 5.903 -8.225 -12.819
328 HD22 ASN 44 HD22 ASN 44 5.719 -8.618 -14.494
329 H LEU 45 HN LEU 45 2.551 -12.948 -10.078
330 HA LEU 45 HA LEU 45 3.599 -12.090 -7.456
331 HB2 LEU 45 HB2 LEU 45 1.284 -11.353 -7.879
332 HB3 LEU 45 HB1 LEU 45 0.809 -13.019 -8.140
333 HG LEU 45 HG LEU 45 1.430 -13.519 -5.783
334 HD11 LEU 45 HD11 LEU 45 3.046 -11.751 -5.419
335 HD12 LEU 45 HD12 LEU 45 1.741 -11.635 -4.239
336 HD13 LEU 45 HD13 LEU 45 1.787 -10.531 -5.613
337 HD21 LEU 45 HD21 LEU 45 -0.517 -12.430 -4.792
338 HD22 LEU 45 HD22 LEU 45 -0.880 -13.046 -6.406
339 HD23 LEU 45 HD23 LEU 45 -0.600 -11.322 -6.162
340 H GLU 46 HN GLU 46 2.634 -14.739 -9.495
341 HA GLU 46 HA GLU 46 2.886 -16.732 -7.446
342 HB2 GLU 46 HB2 GLU 46 2.555 -18.341 -9.295
343 HB3 GLU 46 HB1 GLU 46 1.315 -17.096 -9.253
344 HG2 GLU 46 HG2 GLU 46 2.836 -15.898 -10.984
345 HG3 GLU 46 HG1 GLU 46 3.520 -17.507 -11.216
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 -18.672 9.006 -4.456
2 H2 GLY 1 HT2 GLY 1 -19.192 8.652 -6.029
3 H3 GLY 1 HT3 GLY 1 -18.494 7.435 -5.078
4 HA2 GLY 1 HA1 GLY 1 -21.093 8.785 -4.616
5 HA3 GLY 1 HA2 GLY 1 -20.858 7.125 -5.145
6 H SER 2 HN SER 2 -20.200 5.558 -3.647
7 HA SER 2 HA SER 2 -20.740 6.385 -0.880
8 HB2 SER 2 HB2 SER 2 -20.857 3.580 -1.990
9 HB3 SER 2 HB1 SER 2 -21.565 4.182 -0.491
10 HG SER 2 HG SER 2 -22.733 4.009 -2.819
11 H LEU 3 HN LEU 3 -18.680 4.155 -2.754
12 HA LEU 3 HA LEU 3 -17.049 3.636 -0.413
13 HB2 LEU 3 HB2 LEU 3 -16.771 2.676 -3.260
14 HB3 LEU 3 HB1 LEU 3 -15.811 2.114 -1.904
15 HG LEU 3 HG LEU 3 -18.798 1.781 -2.155
16 HD11 LEU 3 HD11 LEU 3 -18.274 -0.592 -2.530
17 HD12 LEU 3 HD12 LEU 3 -16.558 -0.190 -2.583
18 HD13 LEU 3 HD13 LEU 3 -17.650 0.442 -3.815
19 HD21 LEU 3 HD21 LEU 3 -18.529 0.248 -0.261
20 HD22 LEU 3 HD22 LEU 3 -18.051 1.894 0.157
21 HD23 LEU 3 HD23 LEU 3 -16.821 0.671 -0.168
22 H ASP 4 HN ASP 4 -16.956 5.627 -3.234
23 HA ASP 4 HA ASP 4 -14.263 5.868 -3.776
24 HB2 ASP 4 HB2 ASP 4 -16.307 8.094 -3.909
25 HB3 ASP 4 HB1 ASP 4 -14.780 8.038 -4.781
26 H GLU 5 HN GLU 5 -16.116 7.683 -1.356
27 HA GLU 5 HA GLU 5 -14.104 9.516 -0.695
28 HB2 GLU 5 HB2 GLU 5 -16.264 8.419 1.105
29 HB3 GLU 5 HB1 GLU 5 -15.357 9.904 1.360
30 HG2 GLU 5 HG2 GLU 5 -17.219 9.338 -0.925
31 HG3 GLU 5 HG1 GLU 5 -17.566 10.362 0.470
32 H ASP 6 HN ASP 6 -14.787 6.277 0.483
33 HA ASP 6 HA ASP 6 -12.663 6.347 2.442
34 HB2 ASP 6 HB2 ASP 6 -14.777 4.968 2.657
35 HB3 ASP 6 HB1 ASP 6 -14.141 3.925 1.391
36 H GLU 7 HN GLU 7 -13.181 5.188 -0.815
37 HA GLU 7 HA GLU 7 -10.840 3.677 -1.158
38 HB2 GLU 7 HB2 GLU 7 -12.600 5.172 -3.099
39 HB3 GLU 7 HB1 GLU 7 -11.192 4.248 -3.626
40 HG2 GLU 7 HG2 GLU 7 -12.146 2.235 -2.633
41 HG3 GLU 7 HG1 GLU 7 -13.562 3.157 -2.126
42 H GLU 8 HN GLU 8 -11.491 7.108 -1.867
43 HA GLU 8 HA GLU 8 -8.994 7.762 -2.916
44 HB2 GLU 8 HB2 GLU 8 -10.922 9.461 -1.326
45 HB3 GLU 8 HB1 GLU 8 -9.501 10.100 -2.142
46 HG2 GLU 8 HG2 GLU 8 -11.901 8.799 -3.400
47 HG3 GLU 8 HG1 GLU 8 -11.392 10.483 -3.531
48 H ASP 9 HN ASP 9 -10.118 7.907 0.440
49 HA ASP 9 HA ASP 9 -7.698 8.853 1.521
50 HB2 ASP 9 HB2 ASP 9 -9.755 8.984 2.802
51 HB3 ASP 9 HB1 ASP 9 -9.887 7.226 2.826
52 H LEU 10 HN LEU 10 -8.917 5.587 0.971
53 HA LEU 10 HA LEU 10 -6.893 4.210 2.351
54 HB2 LEU 10 HB2 LEU 10 -9.095 3.282 1.561
55 HB3 LEU 10 HB1 LEU 10 -8.432 3.227 -0.056
56 HG LEU 10 HG LEU 10 -8.479 1.051 1.268
57 HD11 LEU 10 HD11 LEU 10 -6.308 0.303 0.429
58 HD12 LEU 10 HD12 LEU 10 -5.841 1.980 0.150
59 HD13 LEU 10 HD13 LEU 10 -7.171 1.272 -0.766
60 HD21 LEU 10 HD21 LEU 10 -6.756 0.668 2.886
61 HD22 LEU 10 HD22 LEU 10 -7.685 2.088 3.373
62 HD23 LEU 10 HD23 LEU 10 -6.098 2.283 2.630
63 H GLN 11 HN GLN 11 -7.220 4.903 -1.161
64 HA GLN 11 HA GLN 11 -4.650 3.843 -1.743
65 HB2 GLN 11 HB2 GLN 11 -4.911 4.751 -3.968
66 HB3 GLN 11 HB1 GLN 11 -6.411 4.000 -3.447
67 HG2 GLN 11 HG2 GLN 11 -7.412 6.136 -3.042
68 HG3 GLN 11 HG1 GLN 11 -5.884 6.959 -3.357
69 HE21 GLN 11 HE21 GLN 11 -8.476 7.263 -4.680
70 HE22 GLN 11 HE22 GLN 11 -8.182 6.950 -6.351
71 H ARG 12 HN ARG 12 -5.763 7.050 -0.837
72 HA ARG 12 HA ARG 12 -3.356 8.417 -1.391
73 HB2 ARG 12 HB2 ARG 12 -5.361 9.679 -0.871
74 HB3 ARG 12 HB1 ARG 12 -5.446 8.952 0.727
75 HG2 ARG 12 HG2 ARG 12 -4.597 11.235 0.821
76 HG3 ARG 12 HG1 ARG 12 -3.390 10.078 1.379
77 HD2 ARG 12 HD2 ARG 12 -2.369 10.156 -0.901
78 HD3 ARG 12 HD1 ARG 12 -3.500 11.450 -1.308
79 HE ARG 12 HE ARG 12 -1.797 11.847 1.029
80 HH11 ARG 12 HH11 ARG 12 -2.439 12.583 -2.342
81 HH12 ARG 12 HH12 ARG 12 -1.376 13.960 -2.368
82 HH21 ARG 12 HH21 ARG 12 -0.384 13.622 0.984
83 HH22 ARG 12 HH22 ARG 12 -0.182 14.541 -0.482
84 H ALA 13 HN ALA 13 -4.513 6.699 1.495
85 HA ALA 13 HA ALA 13 -2.281 7.122 3.122
86 HB1 ALA 13 HB1 ALA 13 -3.038 5.177 4.389
87 HB2 ALA 13 HB2 ALA 13 -4.119 4.729 3.069
88 HB3 ALA 13 HB3 ALA 13 -4.389 6.225 3.963
89 H LEU 14 HN LEU 14 -2.857 4.765 0.586
90 HA LEU 14 HA LEU 14 -0.593 3.146 1.043
91 HB2 LEU 14 HB2 LEU 14 -2.040 3.765 -1.534
92 HB3 LEU 14 HB1 LEU 14 -0.854 2.485 -1.331
93 HG LEU 14 HG LEU 14 -3.438 2.618 0.222
94 HD11 LEU 14 HD11 LEU 14 -2.789 1.023 -2.251
95 HD12 LEU 14 HD12 LEU 14 -3.870 2.415 -2.186
96 HD13 LEU 14 HD13 LEU 14 -4.281 0.936 -1.314
97 HD21 LEU 14 HD21 LEU 14 -2.946 0.272 0.692
98 HD22 LEU 14 HD22 LEU 14 -1.646 1.318 1.266
99 HD23 LEU 14 HD23 LEU 14 -1.444 0.396 -0.225
100 H ALA 15 HN ALA 15 -1.090 5.842 -1.239
101 HA ALA 15 HA ALA 15 1.613 5.979 -2.083
102 HB1 ALA 15 HB1 ALA 15 1.009 8.138 -3.050
103 HB2 ALA 15 HB2 ALA 15 -0.498 8.138 -2.133
104 HB3 ALA 15 HB3 ALA 15 -0.229 6.929 -3.391
105 H LEU 16 HN LEU 16 -0.183 7.429 0.520
106 HA LEU 16 HA LEU 16 1.651 9.297 1.481
107 HB2 LEU 16 HB2 LEU 16 -0.756 8.869 2.182
108 HB3 LEU 16 HB1 LEU 16 -0.156 7.531 3.134
109 HG LEU 16 HG LEU 16 0.818 10.342 3.585
110 HD11 LEU 16 HD11 LEU 16 -1.445 9.006 5.049
111 HD12 LEU 16 HD12 LEU 16 -1.699 10.127 3.713
112 HD13 LEU 16 HD13 LEU 16 -0.894 10.678 5.188
113 HD21 LEU 16 HD21 LEU 16 1.425 9.512 5.753
114 HD22 LEU 16 HD22 LEU 16 2.075 8.402 4.543
115 HD23 LEU 16 HD23 LEU 16 0.622 7.974 5.443
116 H SER 17 HN SER 17 1.174 5.893 2.409
117 HA SER 17 HA SER 17 3.385 5.692 4.113
118 HB2 SER 17 HB2 SER 17 2.108 3.507 2.452
119 HB3 SER 17 HB1 SER 17 3.127 3.266 3.871
120 HG SER 17 HG SER 17 0.549 4.449 3.740
121 H ARG 18 HN ARG 18 3.132 5.518 0.642
122 HA ARG 18 HA ARG 18 5.678 4.366 0.149
123 HB2 ARG 18 HB2 ARG 18 3.916 6.084 -1.602
124 HB3 ARG 18 HB1 ARG 18 5.395 5.316 -2.154
125 HG2 ARG 18 HG2 ARG 18 4.468 3.133 -1.747
126 HG3 ARG 18 HG1 ARG 18 3.015 3.848 -1.047
127 HD2 ARG 18 HD2 ARG 18 2.531 3.182 -3.297
128 HD3 ARG 18 HD1 ARG 18 2.569 4.941 -3.228
129 HE ARG 18 HE ARG 18 4.881 3.385 -4.197
130 HH11 ARG 18 HH11 ARG 18 2.513 5.928 -4.621
131 HH12 ARG 18 HH12 ARG 18 3.206 6.508 -6.102
132 HH21 ARG 18 HH21 ARG 18 5.766 4.100 -6.152
133 HH22 ARG 18 HH22 ARG 18 5.044 5.438 -7.000
134 H GLN 19 HN GLN 19 4.531 7.740 0.235
135 HA GLN 19 HA GLN 19 7.156 8.786 -0.241
136 HB2 GLN 19 HB2 GLN 19 6.186 10.975 0.214
137 HB3 GLN 19 HB1 GLN 19 5.165 10.061 -0.886
138 HG2 GLN 19 HG2 GLN 19 3.626 9.554 0.899
139 HG3 GLN 19 HG1 GLN 19 4.683 10.341 2.072
140 HE21 GLN 19 HE21 GLN 19 4.830 12.571 2.099
141 HE22 GLN 19 HE22 GLN 19 3.655 13.586 1.320
142 H GLU 20 HN GLU 20 5.610 7.503 2.467
143 HA GLU 20 HA GLU 20 7.071 8.920 4.469
144 HB2 GLU 20 HB2 GLU 20 5.612 6.279 4.499
145 HB3 GLU 20 HB1 GLU 20 6.452 6.915 5.909
146 HG2 GLU 20 HG2 GLU 20 4.085 8.094 4.485
147 HG3 GLU 20 HG1 GLU 20 4.156 7.462 6.129
148 H ILE 21 HN ILE 21 7.541 5.880 2.708
149 HA ILE 21 HA ILE 21 10.062 5.366 3.977
150 HB ILE 21 HB ILE 21 8.670 4.075 1.648
151 HG12 ILE 21 HG12 ILE 21 8.945 2.055 3.115
152 HG13 ILE 21 HG11 ILE 21 9.620 3.103 4.352
153 HG21 ILE 21 HG21 ILE 21 10.579 2.494 1.504
154 HG22 ILE 21 HG22 ILE 21 11.498 3.557 2.572
155 HG23 ILE 21 HG23 ILE 21 10.985 4.129 0.983
156 HD11 ILE 21 HD11 ILE 21 6.830 3.238 3.241
157 HD12 ILE 21 HD12 ILE 21 7.503 4.313 4.466
158 HD13 ILE 21 HD13 ILE 21 7.306 2.594 4.814
159 H ASP 22 HN ASP 22 11.473 6.938 3.736
160 HA ASP 22 HA ASP 22 12.085 7.903 1.025
161 HB2 ASP 22 HB2 ASP 22 11.391 9.572 2.791
162 HB3 ASP 22 HB1 ASP 22 12.858 9.161 3.669
163 H MET 23 HN MET 23 13.024 5.515 1.331
164 HA MET 23 HA MET 23 15.803 5.725 2.283
165 HB2 MET 23 HB2 MET 23 14.321 4.131 3.535
166 HB3 MET 23 HB1 MET 23 14.110 3.230 2.041
167 HG2 MET 23 HG2 MET 23 15.775 2.221 3.534
168 HG3 MET 23 HG1 MET 23 16.450 2.689 1.975
169 HE1 MET 23 HE1 MET 23 17.094 5.097 5.862
170 HE2 MET 23 HE2 MET 23 16.183 3.590 5.798
171 HE3 MET 23 HE3 MET 23 15.556 5.031 5.004
172 H GLU 24 HN GLU 24 17.434 4.701 0.982
173 HA GLU 24 HA GLU 24 16.604 4.481 -1.833
174 HB2 GLU 24 HB2 GLU 24 19.327 5.162 -0.715
175 HB3 GLU 24 HB1 GLU 24 18.888 5.130 -2.418
176 HG2 GLU 24 HG2 GLU 24 17.290 6.947 -2.032
177 HG3 GLU 24 HG1 GLU 24 17.757 6.988 -0.331
178 H ASP 25 HN ASP 25 17.154 2.468 0.583
179 HA ASP 25 HA ASP 25 18.130 0.365 -1.180
180 HB2 ASP 25 HB2 ASP 25 20.157 1.204 -0.078
181 HB3 ASP 25 HB1 ASP 25 19.404 0.984 1.497
182 H GLU 26 HN GLU 26 17.187 -1.581 -0.781
183 HA GLU 26 HA GLU 26 15.792 -3.149 0.076
184 HB2 GLU 26 HB2 GLU 26 16.080 -1.583 2.634
185 HB3 GLU 26 HB1 GLU 26 15.224 -3.115 2.501
186 HG2 GLU 26 HG2 GLU 26 17.332 -4.150 1.692
187 HG3 GLU 26 HG1 GLU 26 18.152 -2.625 2.019
188 H GLU 27 HN GLU 27 15.045 0.142 0.173
189 HA GLU 27 HA GLU 27 12.447 0.325 1.013
190 HB2 GLU 27 HB2 GLU 27 12.248 2.252 -0.502
191 HB3 GLU 27 HB1 GLU 27 13.768 2.257 0.378
192 HG2 GLU 27 HG2 GLU 27 14.805 2.524 -1.557
193 HG3 GLU 27 HG1 GLU 27 14.306 0.889 -1.990
194 H ALA 28 HN ALA 28 13.627 -1.090 -1.951
195 HA ALA 28 HA ALA 28 11.360 -1.057 -3.538
196 HB1 ALA 28 HB1 ALA 28 12.293 -3.002 -4.665
197 HB2 ALA 28 HB2 ALA 28 13.396 -3.269 -3.314
198 HB3 ALA 28 HB3 ALA 28 13.552 -1.819 -4.307
199 H ASP 29 HN ASP 29 12.312 -3.450 -1.091
200 HA ASP 29 HA ASP 29 10.029 -5.094 -1.474
201 HB2 ASP 29 HB2 ASP 29 12.082 -4.909 0.721
202 HB3 ASP 29 HB1 ASP 29 10.716 -6.023 0.814
203 H LEU 30 HN LEU 30 10.673 -2.286 0.485
204 HA LEU 30 HA LEU 30 8.370 -2.543 2.145
205 HB2 LEU 30 HB2 LEU 30 10.210 -0.262 1.495
206 HB3 LEU 30 HB1 LEU 30 8.750 0.009 2.423
207 HG LEU 30 HG LEU 30 9.571 -1.661 4.095
208 HD11 LEU 30 HD11 LEU 30 12.123 -1.509 2.500
209 HD12 LEU 30 HD12 LEU 30 11.088 -2.924 2.687
210 HD13 LEU 30 HD13 LEU 30 11.937 -2.265 4.082
211 HD21 LEU 30 HD21 LEU 30 9.841 0.733 4.455
212 HD22 LEU 30 HD22 LEU 30 11.376 0.701 3.586
213 HD23 LEU 30 HD23 LEU 30 11.209 -0.163 5.115
214 H ARG 31 HN ARG 31 9.033 -0.967 -0.955
215 HA ARG 31 HA ARG 31 6.499 0.243 -1.296
216 HB2 ARG 31 HB2 ARG 31 7.967 -0.987 -3.613
217 HB3 ARG 31 HB1 ARG 31 7.015 0.483 -3.566
218 HG2 ARG 31 HG2 ARG 31 9.699 0.156 -2.270
219 HG3 ARG 31 HG1 ARG 31 9.422 0.866 -3.859
220 HD2 ARG 31 HD2 ARG 31 7.949 2.558 -2.751
221 HD3 ARG 31 HD1 ARG 31 8.469 1.903 -1.192
222 HE ARG 31 HE ARG 31 10.748 2.500 -2.718
223 HH11 ARG 31 HH11 ARG 31 8.154 4.128 -1.036
224 HH12 ARG 31 HH12 ARG 31 9.053 5.583 -0.768
225 HH21 ARG 31 HH21 ARG 31 11.947 4.409 -2.391
226 HH22 ARG 31 HH22 ARG 31 11.210 5.759 -1.562
227 H ARG 32 HN ARG 32 7.775 -2.951 -2.058
228 HA ARG 32 HA ARG 32 5.531 -4.073 -3.270
229 HB2 ARG 32 HB2 ARG 32 7.755 -5.320 -1.645
230 HB3 ARG 32 HB1 ARG 32 6.593 -6.236 -2.583
231 HG2 ARG 32 HG2 ARG 32 7.386 -5.319 -4.628
232 HG3 ARG 32 HG1 ARG 32 8.388 -4.146 -3.770
233 HD2 ARG 32 HD2 ARG 32 9.725 -6.000 -2.850
234 HD3 ARG 32 HD1 ARG 32 8.749 -7.143 -3.774
235 HE ARG 32 HE ARG 32 9.622 -5.489 -5.703
236 HH11 ARG 32 HH11 ARG 32 11.349 -7.117 -3.104
237 HH12 ARG 32 HH12 ARG 32 12.840 -7.202 -3.991
238 HH21 ARG 32 HH21 ARG 32 11.588 -5.589 -6.855
239 HH22 ARG 32 HH22 ARG 32 12.984 -6.332 -6.120
240 H ALA 33 HN ALA 33 6.335 -3.581 0.106
241 HA ALA 33 HA ALA 33 4.327 -5.224 1.228
242 HB1 ALA 33 HB1 ALA 33 5.582 -2.729 2.364
243 HB2 ALA 33 HB2 ALA 33 6.199 -4.369 2.538
244 HB3 ALA 33 HB3 ALA 33 4.659 -3.927 3.268
245 H ILE 34 HN ILE 34 4.366 -1.794 0.292
246 HA ILE 34 HA ILE 34 1.710 -1.218 1.105
247 HB ILE 34 HB ILE 34 3.636 0.085 -0.794
248 HG12 ILE 34 HG12 ILE 34 3.174 2.049 0.719
249 HG13 ILE 34 HG11 ILE 34 2.179 0.980 1.702
250 HG21 ILE 34 HG21 ILE 34 1.923 1.879 -1.202
251 HG22 ILE 34 HG22 ILE 34 0.709 0.746 -0.603
252 HG23 ILE 34 HG23 ILE 34 1.646 0.354 -2.043
253 HD11 ILE 34 HD11 ILE 34 5.128 0.698 1.177
254 HD12 ILE 34 HD12 ILE 34 4.148 -0.422 2.124
255 HD13 ILE 34 HD13 ILE 34 4.368 1.239 2.675
256 H GLN 35 HN GLN 35 3.122 -2.457 -1.848
257 HA GLN 35 HA GLN 35 0.765 -2.483 -3.415
258 HB2 GLN 35 HB2 GLN 35 3.227 -4.225 -3.614
259 HB3 GLN 35 HB1 GLN 35 1.986 -4.075 -4.850
260 HG2 GLN 35 HG2 GLN 35 2.530 -1.769 -5.203
261 HG3 GLN 35 HG1 GLN 35 3.657 -1.789 -3.847
262 HE21 GLN 35 HE21 GLN 35 4.120 -1.112 -6.616
263 HE22 GLN 35 HE22 GLN 35 5.355 -2.190 -7.184
264 H LEU 36 HN LEU 36 2.039 -4.625 -1.003
265 HA LEU 36 HA LEU 36 0.423 -6.882 -1.630
266 HB2 LEU 36 HB2 LEU 36 2.475 -7.210 -0.460
267 HB3 LEU 36 HB1 LEU 36 2.041 -6.053 0.773
268 HG LEU 36 HG LEU 36 2.026 -8.525 1.398
269 HD11 LEU 36 HD11 LEU 36 -0.276 -8.178 2.596
270 HD12 LEU 36 HD12 LEU 36 -0.106 -6.535 1.951
271 HD13 LEU 36 HD13 LEU 36 1.131 -7.204 3.020
272 HD21 LEU 36 HD21 LEU 36 0.874 -9.390 -0.554
273 HD22 LEU 36 HD22 LEU 36 -0.555 -8.436 -0.158
274 HD23 LEU 36 HD23 LEU 36 -0.043 -9.744 0.910
275 H SER 37 HN SER 37 0.208 -4.259 0.742
276 HA SER 37 HA SER 37 -2.123 -4.993 2.035
277 HB2 SER 37 HB2 SER 37 -1.286 -2.163 1.373
278 HB3 SER 37 HB1 SER 37 -2.289 -2.690 2.729
279 HG SER 37 HG SER 37 -0.506 -3.769 3.585
280 H MET 38 HN MET 38 -1.748 -3.242 -1.022
281 HA MET 38 HA MET 38 -4.628 -2.842 -1.170
282 HB2 MET 38 HB2 MET 38 -4.162 -1.508 -3.176
283 HB3 MET 38 HB1 MET 38 -3.238 -0.955 -1.789
284 HG2 MET 38 HG2 MET 38 -1.247 -2.009 -2.644
285 HG3 MET 38 HG1 MET 38 -2.155 -2.712 -3.979
286 HE1 MET 38 HE1 MET 38 -4.109 -0.193 -4.633
287 HE2 MET 38 HE2 MET 38 -3.360 -1.195 -5.875
288 HE3 MET 38 HE3 MET 38 -3.205 0.558 -5.949
289 H GLN 39 HN GLN 39 -2.115 -4.684 -2.853
290 HA GLN 39 HA GLN 39 -4.233 -5.846 -4.538
291 HB2 GLN 39 HB2 GLN 39 -1.299 -5.637 -5.205
292 HB3 GLN 39 HB1 GLN 39 -2.575 -6.218 -6.264
293 HG2 GLN 39 HG2 GLN 39 -3.572 -3.980 -6.270
294 HG3 GLN 39 HG1 GLN 39 -2.271 -3.404 -5.229
295 HE21 GLN 39 HE21 GLN 39 -1.502 -1.920 -6.688
296 HE22 GLN 39 HE22 GLN 39 -0.706 -2.365 -8.154
297 H GLY 40 HN GLY 40 -4.528 -7.975 -4.468
298 HA2 GLY 40 HA2 GLY 40 -2.956 -9.551 -2.600
299 HA3 GLY 40 HA1 GLY 40 -4.401 -10.071 -3.460
300 H SER 41 HN SER 41 -1.178 -8.913 -4.410
301 HA SER 41 HA SER 41 -1.123 -10.808 -6.598
302 HB2 SER 41 HB2 SER 41 -0.310 -8.404 -6.752
303 HB3 SER 41 HB1 SER 41 1.058 -8.888 -5.751
304 HG SER 41 HG SER 41 1.093 -10.657 -7.584
305 H SER 42 HN SER 42 0.539 -10.215 -3.542
306 HA SER 42 HA SER 42 2.228 -12.529 -3.795
307 HB2 SER 42 HB2 SER 42 2.950 -10.587 -2.466
308 HB3 SER 42 HB1 SER 42 1.578 -10.814 -1.382
309 HG SER 42 HG SER 42 2.565 -12.428 -0.433
310 H ARG 43 HN ARG 43 1.773 -14.558 -3.204
311 HA ARG 43 HA ARG 43 -0.845 -15.029 -1.938
312 HB2 ARG 43 HB2 ARG 43 -0.723 -17.278 -2.917
313 HB3 ARG 43 HB1 ARG 43 -0.608 -16.021 -4.140
314 HG2 ARG 43 HG2 ARG 43 1.844 -16.326 -4.181
315 HG3 ARG 43 HG1 ARG 43 1.669 -17.648 -3.024
316 HD2 ARG 43 HD2 ARG 43 1.858 -18.447 -5.347
317 HD3 ARG 43 HD1 ARG 43 0.324 -18.898 -4.602
318 HE ARG 43 HE ARG 43 0.179 -16.433 -6.067
319 HH11 ARG 43 HH11 ARG 43 0.111 -19.916 -6.406
320 HH12 ARG 43 HH12 ARG 43 -0.881 -19.880 -7.830
321 HH21 ARG 43 HH21 ARG 43 -1.132 -16.385 -7.919
322 HH22 ARG 43 HH22 ARG 43 -1.605 -17.875 -8.678
323 H ASN 44 HN ASN 44 2.416 -15.043 -1.235
324 HA ASN 44 HA ASN 44 2.061 -16.315 1.282
325 HB2 ASN 44 HB2 ASN 44 2.170 -18.324 -0.190
326 HB3 ASN 44 HB1 ASN 44 3.770 -17.817 -0.715
327 HD21 ASN 44 HD21 ASN 44 4.747 -19.663 0.064
328 HD22 ASN 44 HD22 ASN 44 4.960 -19.970 1.756
329 H LEU 45 HN LEU 45 4.465 -15.579 -1.216
330 HA LEU 45 HA LEU 45 6.380 -14.375 -1.205
331 HB2 LEU 45 HB2 LEU 45 5.130 -12.662 0.056
332 HB3 LEU 45 HB1 LEU 45 5.544 -13.473 1.554
333 HG LEU 45 HG LEU 45 7.929 -13.008 1.150
334 HD11 LEU 45 HD11 LEU 45 6.925 -11.474 -1.243
335 HD12 LEU 45 HD12 LEU 45 7.899 -12.943 -1.282
336 HD13 LEU 45 HD13 LEU 45 8.573 -11.454 -0.623
337 HD21 LEU 45 HD21 LEU 45 6.141 -10.579 1.036
338 HD22 LEU 45 HD22 LEU 45 7.831 -10.590 1.539
339 HD23 LEU 45 HD23 LEU 45 6.623 -11.454 2.491
340 H GLU 46 HN GLU 46 7.689 -16.102 -1.300
341 HA GLU 46 HA GLU 46 8.466 -17.507 1.121
342 HB2 GLU 46 HB2 GLU 46 9.251 -17.953 -1.765
343 HB3 GLU 46 HB1 GLU 46 9.662 -19.011 -0.422
344 HG2 GLU 46 HG2 GLU 46 7.353 -19.569 -0.084
345 HG3 GLU 46 HG1 GLU 46 6.850 -18.391 -1.297
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 -22.377 0.236 -1.641
2 H2 GLY 1 HT2 GLY 1 -23.069 -0.258 -0.170
3 H3 GLY 1 HT3 GLY 1 -21.386 -0.128 -0.313
4 HA2 GLY 1 HA1 GLY 1 -23.330 2.113 -0.443
5 HA3 GLY 1 HA2 GLY 1 -22.274 1.743 0.914
6 H SER 2 HN SER 2 -21.940 4.184 0.182
7 HA SER 2 HA SER 2 -19.884 4.332 -1.888
8 HB2 SER 2 HB2 SER 2 -21.761 5.988 -1.858
9 HB3 SER 2 HB1 SER 2 -21.166 6.578 -0.308
10 HG SER 2 HG SER 2 -19.268 6.447 -2.323
11 H LEU 3 HN LEU 3 -18.452 3.046 -0.451
12 HA LEU 3 HA LEU 3 -17.337 4.461 1.824
13 HB2 LEU 3 HB2 LEU 3 -16.049 2.500 2.264
14 HB3 LEU 3 HB1 LEU 3 -17.701 2.022 1.930
15 HG LEU 3 HG LEU 3 -15.573 1.935 -0.184
16 HD11 LEU 3 HD11 LEU 3 -15.263 -0.433 0.332
17 HD12 LEU 3 HD12 LEU 3 -16.351 -0.280 1.712
18 HD13 LEU 3 HD13 LEU 3 -14.809 0.575 1.708
19 HD21 LEU 3 HD21 LEU 3 -17.735 1.782 -1.110
20 HD22 LEU 3 HD22 LEU 3 -18.286 0.701 0.165
21 HD23 LEU 3 HD23 LEU 3 -17.128 0.126 -1.038
22 H ASP 4 HN ASP 4 -17.109 5.327 -1.022
23 HA ASP 4 HA ASP 4 -14.558 4.872 -2.076
24 HB2 ASP 4 HB2 ASP 4 -16.215 7.377 -2.428
25 HB3 ASP 4 HB1 ASP 4 -15.011 6.733 -3.540
26 H GLU 5 HN GLU 5 -15.711 7.353 0.169
27 HA GLU 5 HA GLU 5 -13.429 8.962 0.178
28 HB2 GLU 5 HB2 GLU 5 -15.653 9.430 1.315
29 HB3 GLU 5 HB1 GLU 5 -15.102 8.384 2.620
30 HG2 GLU 5 HG2 GLU 5 -13.064 9.898 2.750
31 HG3 GLU 5 HG1 GLU 5 -13.970 11.012 1.729
32 H ASP 6 HN ASP 6 -14.247 6.146 2.182
33 HA ASP 6 HA ASP 6 -11.830 6.129 3.671
34 HB2 ASP 6 HB2 ASP 6 -13.796 4.959 4.503
35 HB3 ASP 6 HB1 ASP 6 -13.809 3.912 3.088
36 H GLU 7 HN GLU 7 -12.931 4.551 0.721
37 HA GLU 7 HA GLU 7 -10.676 2.981 0.197
38 HB2 GLU 7 HB2 GLU 7 -12.752 4.243 -1.588
39 HB3 GLU 7 HB1 GLU 7 -11.396 3.341 -2.272
40 HG2 GLU 7 HG2 GLU 7 -12.066 1.384 -0.943
41 HG3 GLU 7 HG1 GLU 7 -13.453 2.291 -0.337
42 H GLU 8 HN GLU 8 -11.377 6.335 -0.743
43 HA GLU 8 HA GLU 8 -8.966 6.702 -2.164
44 HB2 GLU 8 HB2 GLU 8 -10.872 8.683 -0.930
45 HB3 GLU 8 HB1 GLU 8 -9.463 9.160 -1.868
46 HG2 GLU 8 HG2 GLU 8 -10.378 7.757 -3.745
47 HG3 GLU 8 HG1 GLU 8 -11.860 7.607 -2.802
48 H ASP 9 HN ASP 9 -9.859 7.440 1.204
49 HA ASP 9 HA ASP 9 -7.376 8.587 1.905
50 HB2 ASP 9 HB2 ASP 9 -9.599 7.349 3.479
51 HB3 ASP 9 HB1 ASP 9 -8.068 7.681 4.281
52 H LEU 10 HN LEU 10 -8.495 5.253 1.831
53 HA LEU 10 HA LEU 10 -6.246 4.118 3.115
54 HB2 LEU 10 HB2 LEU 10 -8.520 3.060 2.680
55 HB3 LEU 10 HB1 LEU 10 -7.966 2.763 1.046
56 HG LEU 10 HG LEU 10 -7.814 0.819 2.674
57 HD11 LEU 10 HD11 LEU 10 -5.216 1.640 1.394
58 HD12 LEU 10 HD12 LEU 10 -6.581 0.940 0.532
59 HD13 LEU 10 HD13 LEU 10 -5.752 0.002 1.773
60 HD21 LEU 10 HD21 LEU 10 -6.025 0.763 4.245
61 HD22 LEU 10 HD22 LEU 10 -6.957 2.232 4.547
62 HD23 LEU 10 HD23 LEU 10 -5.416 2.322 3.693
63 H GLN 11 HN GLN 11 -7.065 4.314 -0.382
64 HA GLN 11 HA GLN 11 -4.537 3.398 -1.234
65 HB2 GLN 11 HB2 GLN 11 -5.104 4.275 -3.439
66 HB3 GLN 11 HB1 GLN 11 -6.465 3.416 -2.734
67 HG2 GLN 11 HG2 GLN 11 -7.518 5.522 -2.153
68 HG3 GLN 11 HG1 GLN 11 -6.134 6.406 -2.798
69 HE21 GLN 11 HE21 GLN 11 -8.953 6.473 -3.576
70 HE22 GLN 11 HE22 GLN 11 -8.994 6.085 -5.265
71 H ARG 12 HN ARG 12 -5.668 6.585 -0.310
72 HA ARG 12 HA ARG 12 -3.462 8.095 -1.175
73 HB2 ARG 12 HB2 ARG 12 -5.391 9.264 -0.423
74 HB3 ARG 12 HB1 ARG 12 -5.359 8.449 1.134
75 HG2 ARG 12 HG2 ARG 12 -4.614 10.748 1.324
76 HG3 ARG 12 HG1 ARG 12 -3.318 9.626 1.729
77 HD2 ARG 12 HD2 ARG 12 -2.459 9.913 -0.603
78 HD3 ARG 12 HD1 ARG 12 -3.663 11.183 -0.830
79 HE ARG 12 HE ARG 12 -2.344 11.936 1.426
80 HH11 ARG 12 HH11 ARG 12 -1.349 11.121 -1.841
81 HH12 ARG 12 HH12 ARG 12 0.065 12.132 -1.807
82 HH21 ARG 12 HH21 ARG 12 -0.471 13.245 1.497
83 HH22 ARG 12 HH22 ARG 12 0.580 13.328 0.112
84 H ALA 13 HN ALA 13 -4.077 6.605 2.012
85 HA ALA 13 HA ALA 13 -1.652 7.149 3.217
86 HB1 ALA 13 HB1 ALA 13 -2.098 5.178 4.633
87 HB2 ALA 13 HB2 ALA 13 -3.388 4.698 3.526
88 HB3 ALA 13 HB3 ALA 13 -3.517 6.206 4.431
89 H LEU 14 HN LEU 14 -2.470 4.571 0.960
90 HA LEU 14 HA LEU 14 0.006 3.188 1.175
91 HB2 LEU 14 HB2 LEU 14 -2.007 3.227 -1.075
92 HB3 LEU 14 HB1 LEU 14 -0.678 2.089 -0.928
93 HG LEU 14 HG LEU 14 -3.031 2.327 0.947
94 HD11 LEU 14 HD11 LEU 14 -2.260 0.208 -1.055
95 HD12 LEU 14 HD12 LEU 14 -3.627 1.318 -1.174
96 HD13 LEU 14 HD13 LEU 14 -3.593 0.092 0.093
97 HD21 LEU 14 HD21 LEU 14 -2.105 0.306 2.008
98 HD22 LEU 14 HD22 LEU 14 -1.038 1.700 2.177
99 HD23 LEU 14 HD23 LEU 14 -0.672 0.447 0.990
100 H ALA 15 HN ALA 15 -1.251 5.514 -1.226
101 HA ALA 15 HA ALA 15 1.094 5.682 -2.774
102 HB1 ALA 15 HB1 ALA 15 0.155 7.795 -3.612
103 HB2 ALA 15 HB2 ALA 15 -1.051 7.754 -2.325
104 HB3 ALA 15 HB3 ALA 15 -1.048 6.506 -3.572
105 H LEU 16 HN LEU 16 0.002 7.415 0.057
106 HA LEU 16 HA LEU 16 1.959 9.399 0.212
107 HB2 LEU 16 HB2 LEU 16 -0.203 9.247 1.453
108 HB3 LEU 16 HB1 LEU 16 0.507 8.004 2.458
109 HG LEU 16 HG LEU 16 1.783 10.709 2.313
110 HD11 LEU 16 HD11 LEU 16 0.321 11.130 4.410
111 HD12 LEU 16 HD12 LEU 16 -0.742 9.894 3.715
112 HD13 LEU 16 HD13 LEU 16 -0.390 11.370 2.815
113 HD21 LEU 16 HD21 LEU 16 2.492 10.145 4.564
114 HD22 LEU 16 HD22 LEU 16 2.923 8.830 3.467
115 HD23 LEU 16 HD23 LEU 16 1.526 8.670 4.532
116 H SER 17 HN SER 17 1.849 6.147 1.669
117 HA SER 17 HA SER 17 4.404 6.396 2.891
118 HB2 SER 17 HB2 SER 17 4.177 3.857 3.104
119 HB3 SER 17 HB1 SER 17 2.934 4.838 3.878
120 HG SER 17 HG SER 17 1.488 4.194 2.448
121 H ARG 18 HN ARG 18 3.344 5.450 -0.283
122 HA ARG 18 HA ARG 18 5.713 4.237 -1.196
123 HB2 ARG 18 HB2 ARG 18 3.631 5.880 -2.629
124 HB3 ARG 18 HB1 ARG 18 5.016 5.193 -3.461
125 HG2 ARG 18 HG2 ARG 18 4.275 2.944 -2.712
126 HG3 ARG 18 HG1 ARG 18 2.822 3.695 -2.045
127 HD2 ARG 18 HD2 ARG 18 2.389 2.774 -4.267
128 HD3 ARG 18 HD1 ARG 18 2.230 4.530 -4.267
129 HE ARG 18 HE ARG 18 4.504 3.026 -5.396
130 HH11 ARG 18 HH11 ARG 18 2.471 5.874 -5.290
131 HH12 ARG 18 HH12 ARG 18 3.360 6.718 -6.527
132 HH21 ARG 18 HH21 ARG 18 5.633 4.083 -7.065
133 HH22 ARG 18 HH22 ARG 18 5.141 5.679 -7.568
134 H GLN 19 HN GLN 19 4.686 7.600 -0.997
135 HA GLN 19 HA GLN 19 7.042 8.766 -2.061
136 HB2 GLN 19 HB2 GLN 19 5.237 10.001 0.017
137 HB3 GLN 19 HB1 GLN 19 6.215 10.827 -1.186
138 HG2 GLN 19 HG2 GLN 19 3.882 9.054 -1.852
139 HG3 GLN 19 HG1 GLN 19 3.767 10.799 -1.640
140 HE21 GLN 19 HE21 GLN 19 6.366 11.306 -2.862
141 HE22 GLN 19 HE22 GLN 19 6.154 11.056 -4.565
142 H GLU 20 HN GLU 20 5.959 7.935 1.167
143 HA GLU 20 HA GLU 20 8.011 9.094 2.665
144 HB2 GLU 20 HB2 GLU 20 6.210 6.735 3.188
145 HB3 GLU 20 HB1 GLU 20 7.320 7.376 4.398
146 HG2 GLU 20 HG2 GLU 20 5.079 8.892 3.075
147 HG3 GLU 20 HG1 GLU 20 5.058 8.226 4.708
148 H ILE 21 HN ILE 21 7.830 5.975 1.052
149 HA ILE 21 HA ILE 21 10.387 5.163 2.177
150 HB ILE 21 HB ILE 21 8.532 3.768 0.253
151 HG12 ILE 21 HG12 ILE 21 7.772 3.853 2.577
152 HG13 ILE 21 HG11 ILE 21 8.190 2.208 2.108
153 HG21 ILE 21 HG21 ILE 21 10.139 1.782 0.848
154 HG22 ILE 21 HG22 ILE 21 11.312 3.084 1.080
155 HG23 ILE 21 HG23 ILE 21 10.510 2.882 -0.477
156 HD11 ILE 21 HD11 ILE 21 9.821 4.088 3.794
157 HD12 ILE 21 HD12 ILE 21 10.380 2.522 3.211
158 HD13 ILE 21 HD13 ILE 21 9.005 2.610 4.312
159 H ASP 22 HN ASP 22 9.236 5.018 -1.165
160 HA ASP 22 HA ASP 22 10.423 5.022 -3.112
161 HB2 ASP 22 HB2 ASP 22 9.758 7.465 -2.471
162 HB3 ASP 22 HB1 ASP 22 11.488 7.692 -2.237
163 H MET 23 HN MET 23 11.822 3.402 -1.611
164 HA MET 23 HA MET 23 14.597 4.134 -2.147
165 HB2 MET 23 HB2 MET 23 13.790 4.410 0.334
166 HB3 MET 23 HB1 MET 23 13.949 2.660 0.380
167 HG2 MET 23 HG2 MET 23 16.267 2.764 -0.069
168 HG3 MET 23 HG1 MET 23 16.174 4.465 -0.526
169 HE1 MET 23 HE1 MET 23 15.919 6.452 1.166
170 HE2 MET 23 HE2 MET 23 15.599 6.241 2.888
171 HE3 MET 23 HE3 MET 23 14.392 5.750 1.700
172 H GLU 24 HN GLU 24 15.752 1.586 -1.253
173 HA GLU 24 HA GLU 24 14.631 0.198 -3.594
174 HB2 GLU 24 HB2 GLU 24 16.998 -0.038 -4.424
175 HB3 GLU 24 HB1 GLU 24 16.283 1.567 -4.500
176 HG2 GLU 24 HG2 GLU 24 17.460 2.147 -2.404
177 HG3 GLU 24 HG1 GLU 24 18.244 0.567 -2.449
178 H ASP 25 HN ASP 25 16.431 -0.304 -0.570
179 HA ASP 25 HA ASP 25 16.973 -3.048 -1.476
180 HB2 ASP 25 HB2 ASP 25 18.853 -1.727 -0.501
181 HB3 ASP 25 HB1 ASP 25 18.009 -1.740 1.044
182 H GLU 26 HN GLU 26 16.652 -2.395 1.939
183 HA GLU 26 HA GLU 26 14.672 -4.498 2.144
184 HB2 GLU 26 HB2 GLU 26 15.930 -2.703 4.230
185 HB3 GLU 26 HB1 GLU 26 14.793 -3.994 4.594
186 HG2 GLU 26 HG2 GLU 26 17.475 -4.339 3.282
187 HG3 GLU 26 HG1 GLU 26 17.102 -4.678 4.972
188 H GLU 27 HN GLU 27 14.880 -1.071 2.339
189 HA GLU 27 HA GLU 27 12.383 -0.370 3.364
190 HB2 GLU 27 HB2 GLU 27 13.532 1.237 1.124
191 HB3 GLU 27 HB1 GLU 27 12.862 1.777 2.654
192 HG2 GLU 27 HG2 GLU 27 15.139 2.278 2.772
193 HG3 GLU 27 HG1 GLU 27 14.938 0.818 3.739
194 H ALA 28 HN ALA 28 13.380 -1.453 0.221
195 HA ALA 28 HA ALA 28 11.182 -0.637 -1.311
196 HB1 ALA 28 HB1 ALA 28 12.905 -3.075 -1.724
197 HB2 ALA 28 HB2 ALA 28 13.305 -1.443 -2.254
198 HB3 ALA 28 HB3 ALA 28 11.905 -2.270 -2.935
199 H ASP 29 HN ASP 29 11.671 -3.453 0.753
200 HA ASP 29 HA ASP 29 9.434 -4.931 -0.177
201 HB2 ASP 29 HB2 ASP 29 11.212 -6.026 1.070
202 HB3 ASP 29 HB1 ASP 29 10.851 -5.049 2.490
203 H LEU 30 HN LEU 30 9.805 -2.388 2.189
204 HA LEU 30 HA LEU 30 7.260 -2.645 3.394
205 HB2 LEU 30 HB2 LEU 30 9.132 -0.303 3.088
206 HB3 LEU 30 HB1 LEU 30 7.564 -0.129 3.852
207 HG LEU 30 HG LEU 30 8.259 -1.878 5.511
208 HD11 LEU 30 HD11 LEU 30 10.973 -1.469 4.273
209 HD12 LEU 30 HD12 LEU 30 10.017 -2.951 4.219
210 HD13 LEU 30 HD13 LEU 30 10.634 -2.356 5.760
211 HD21 LEU 30 HD21 LEU 30 8.328 0.474 6.076
212 HD22 LEU 30 HD22 LEU 30 9.927 0.627 5.350
213 HD23 LEU 30 HD23 LEU 30 9.706 -0.362 6.792
214 H ARG 31 HN ARG 31 8.403 -0.556 0.747
215 HA ARG 31 HA ARG 31 5.826 0.434 0.086
216 HB2 ARG 31 HB2 ARG 31 7.915 1.576 -0.578
217 HB3 ARG 31 HB1 ARG 31 8.297 0.241 -1.657
218 HG2 ARG 31 HG2 ARG 31 6.667 0.859 -3.157
219 HG3 ARG 31 HG1 ARG 31 5.756 1.770 -1.945
220 HD2 ARG 31 HD2 ARG 31 6.754 3.526 -2.917
221 HD3 ARG 31 HD1 ARG 31 8.068 3.094 -1.849
222 HE ARG 31 HE ARG 31 8.597 1.657 -4.084
223 HH11 ARG 31 HH11 ARG 31 7.942 5.058 -3.512
224 HH12 ARG 31 HH12 ARG 31 8.980 5.609 -4.794
225 HH21 ARG 31 HH21 ARG 31 9.927 2.368 -5.786
226 HH22 ARG 31 HH22 ARG 31 10.103 4.070 -6.107
227 H ARG 32 HN ARG 32 7.647 -2.389 -0.815
228 HA ARG 32 HA ARG 32 6.125 -3.355 -2.950
229 HB2 ARG 32 HB2 ARG 32 8.253 -4.352 -2.332
230 HB3 ARG 32 HB1 ARG 32 7.614 -4.828 -0.769
231 HG2 ARG 32 HG2 ARG 32 5.977 -6.286 -2.004
232 HG3 ARG 32 HG1 ARG 32 6.908 -5.943 -3.463
233 HD2 ARG 32 HD2 ARG 32 8.027 -7.149 -0.938
234 HD3 ARG 32 HD1 ARG 32 7.555 -8.065 -2.367
235 HE ARG 32 HE ARG 32 9.321 -6.318 -3.389
236 HH11 ARG 32 HH11 ARG 32 9.488 -8.249 -0.477
237 HH12 ARG 32 HH12 ARG 32 11.181 -8.614 -0.647
238 HH21 ARG 32 HH21 ARG 32 11.567 -6.752 -3.606
239 HH22 ARG 32 HH22 ARG 32 12.360 -7.768 -2.438
240 H ALA 33 HN ALA 33 5.755 -3.831 0.555
241 HA ALA 33 HA ALA 33 3.472 -5.479 0.433
242 HB1 ALA 33 HB1 ALA 33 3.152 -4.929 2.782
243 HB2 ALA 33 HB2 ALA 33 4.292 -3.591 2.640
244 HB3 ALA 33 HB3 ALA 33 4.855 -5.252 2.446
245 H ILE 34 HN ILE 34 3.872 -1.991 0.443
246 HA ILE 34 HA ILE 34 1.123 -1.345 0.735
247 HB ILE 34 HB ILE 34 3.584 0.139 -0.028
248 HG12 ILE 34 HG12 ILE 34 2.707 1.708 1.704
249 HG13 ILE 34 HG11 ILE 34 1.317 0.652 1.905
250 HG21 ILE 34 HG21 ILE 34 2.330 2.152 -0.625
251 HG22 ILE 34 HG22 ILE 34 0.833 1.220 -0.595
252 HG23 ILE 34 HG23 ILE 34 2.079 0.846 -1.785
253 HD11 ILE 34 HD11 ILE 34 4.187 -0.017 2.493
254 HD12 ILE 34 HD12 ILE 34 2.844 -1.152 2.607
255 HD13 ILE 34 HD13 ILE 34 2.896 0.261 3.661
256 H GLN 35 HN GLN 35 3.246 -1.853 -2.034
257 HA GLN 35 HA GLN 35 1.284 -1.229 -4.004
258 HB2 GLN 35 HB2 GLN 35 3.653 -1.196 -4.567
259 HB3 GLN 35 HB1 GLN 35 3.793 -2.911 -4.199
260 HG2 GLN 35 HG2 GLN 35 2.303 -3.448 -6.038
261 HG3 GLN 35 HG1 GLN 35 2.099 -1.735 -6.390
262 HE21 GLN 35 HE21 GLN 35 3.116 -3.936 -8.034
263 HE22 GLN 35 HE22 GLN 35 4.677 -3.422 -8.577
264 H LEU 36 HN LEU 36 2.063 -4.051 -2.154
265 HA LEU 36 HA LEU 36 0.713 -5.982 -3.699
266 HB2 LEU 36 HB2 LEU 36 2.351 -6.642 -2.072
267 HB3 LEU 36 HB1 LEU 36 1.487 -5.837 -0.783
268 HG LEU 36 HG LEU 36 1.414 -8.379 -0.844
269 HD11 LEU 36 HD11 LEU 36 -1.196 -8.259 -0.447
270 HD12 LEU 36 HD12 LEU 36 -0.861 -6.517 -0.505
271 HD13 LEU 36 HD13 LEU 36 -0.042 -7.541 0.679
272 HD21 LEU 36 HD21 LEU 36 1.006 -8.701 -3.207
273 HD22 LEU 36 HD22 LEU 36 -0.512 -7.811 -3.092
274 HD23 LEU 36 HD23 LEU 36 -0.335 -9.360 -2.270
275 H SER 37 HN SER 37 -0.295 -4.039 -0.890
276 HA SER 37 HA SER 37 -2.957 -4.964 -0.872
277 HB2 SER 37 HB2 SER 37 -3.322 -2.737 0.422
278 HB3 SER 37 HB1 SER 37 -2.297 -3.984 1.129
279 HG SER 37 HG SER 37 -1.159 -1.982 -0.498
280 H MET 38 HN MET 38 -1.362 -2.849 -3.008
281 HA MET 38 HA MET 38 -3.804 -1.578 -3.935
282 HB2 MET 38 HB2 MET 38 -0.948 -1.528 -4.900
283 HB3 MET 38 HB1 MET 38 -2.252 -0.838 -5.851
284 HG2 MET 38 HG2 MET 38 -2.789 0.660 -3.973
285 HG3 MET 38 HG1 MET 38 -1.411 0.004 -3.088
286 HE1 MET 38 HE1 MET 38 -0.647 2.616 -2.836
287 HE2 MET 38 HE2 MET 38 -1.979 3.147 -3.864
288 HE3 MET 38 HE3 MET 38 -0.331 3.661 -4.222
289 H GLN 39 HN GLN 39 -1.345 -3.669 -5.406
290 HA GLN 39 HA GLN 39 -3.467 -5.129 -6.791
291 HB2 GLN 39 HB2 GLN 39 -2.013 -5.192 -8.820
292 HB3 GLN 39 HB1 GLN 39 -2.602 -3.587 -8.411
293 HG2 GLN 39 HG2 GLN 39 -0.465 -2.994 -7.468
294 HG3 GLN 39 HG1 GLN 39 0.141 -4.627 -7.743
295 HE21 GLN 39 HE21 GLN 39 -0.716 -1.594 -9.206
296 HE22 GLN 39 HE22 GLN 39 0.020 -1.904 -10.741
297 H GLY 40 HN GLY 40 -3.307 -7.244 -6.434
298 HA2 GLY 40 HA2 GLY 40 -1.188 -8.914 -6.674
299 HA3 GLY 40 HA1 GLY 40 -1.017 -8.293 -5.039
300 H SER 41 HN SER 41 -1.302 -10.571 -4.433
301 HA SER 41 HA SER 41 -4.138 -11.365 -4.481
302 HB2 SER 41 HB2 SER 41 -1.731 -13.194 -4.317
303 HB3 SER 41 HB1 SER 41 -3.419 -13.680 -4.468
304 HG SER 41 HG SER 41 -3.470 -12.812 -6.529
305 H SER 42 HN SER 42 -4.774 -12.749 -2.643
306 HA SER 42 HA SER 42 -3.093 -12.601 -0.278
307 HB2 SER 42 HB2 SER 42 -5.978 -11.656 -0.301
308 HB3 SER 42 HB1 SER 42 -4.968 -11.830 1.137
309 HG SER 42 HG SER 42 -3.826 -10.320 -0.855
310 H ARG 43 HN ARG 43 -4.392 -13.932 1.546
311 HA ARG 43 HA ARG 43 -4.426 -16.562 0.580
312 HB2 ARG 43 HB2 ARG 43 -5.636 -15.495 3.130
313 HB3 ARG 43 HB1 ARG 43 -5.316 -17.187 2.785
314 HG2 ARG 43 HG2 ARG 43 -2.901 -16.614 2.558
315 HG3 ARG 43 HG1 ARG 43 -3.298 -14.987 3.119
316 HD2 ARG 43 HD2 ARG 43 -2.547 -16.269 4.997
317 HD3 ARG 43 HD1 ARG 43 -4.284 -15.996 5.160
318 HE ARG 43 HE ARG 43 -3.657 -18.473 3.858
319 HH11 ARG 43 HH11 ARG 43 -4.029 -16.894 6.972
320 HH12 ARG 43 HH12 ARG 43 -4.367 -18.377 7.820
321 HH21 ARG 43 HH21 ARG 43 -4.113 -20.424 4.965
322 HH22 ARG 43 HH22 ARG 43 -4.456 -20.375 6.674
323 H ASN 44 HN ASN 44 -7.265 -15.007 2.086
324 HA ASN 44 HA ASN 44 -8.936 -16.579 0.237
325 HB2 ASN 44 HB2 ASN 44 -9.218 -16.875 2.757
326 HB3 ASN 44 HB1 ASN 44 -9.847 -15.230 2.787
327 HD21 ASN 44 HD21 ASN 44 -11.860 -15.912 3.503
328 HD22 ASN 44 HD22 ASN 44 -12.988 -16.707 2.460
329 H LEU 45 HN LEU 45 -7.730 -14.380 -0.801
330 HA LEU 45 HA LEU 45 -10.016 -12.698 -1.422
331 HB2 LEU 45 HB2 LEU 45 -8.863 -11.524 0.415
332 HB3 LEU 45 HB1 LEU 45 -7.372 -11.553 -0.508
333 HG LEU 45 HG LEU 45 -8.479 -10.155 -2.247
334 HD11 LEU 45 HD11 LEU 45 -10.564 -9.030 -1.705
335 HD12 LEU 45 HD12 LEU 45 -10.685 -9.943 -0.202
336 HD13 LEU 45 HD13 LEU 45 -10.795 -10.778 -1.752
337 HD21 LEU 45 HD21 LEU 45 -8.415 -8.081 -0.935
338 HD22 LEU 45 HD22 LEU 45 -7.057 -9.144 -0.560
339 HD23 LEU 45 HD23 LEU 45 -8.424 -9.032 0.549
340 H GLU 46 HN GLU 46 -10.094 -12.298 -3.529
341 HA GLU 46 HA GLU 46 -7.692 -12.863 -5.125
342 HB2 GLU 46 HB2 GLU 46 -9.363 -13.562 -6.917
343 HB3 GLU 46 HB1 GLU 46 -9.196 -14.638 -5.536
344 HG2 GLU 46 HG2 GLU 46 -11.222 -13.648 -4.550
345 HG3 GLU 46 HG1 GLU 46 -11.402 -12.640 -5.984
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 -22.712 -1.388 -2.668
2 H2 GLY 1 HT2 GLY 1 -21.660 -1.836 -1.416
3 H3 GLY 1 HT3 GLY 1 -21.949 -2.901 -2.702
4 HA2 GLY 1 HA1 GLY 1 -19.794 -1.859 -2.950
5 HA3 GLY 1 HA2 GLY 1 -20.886 -1.404 -4.249
6 H SER 2 HN SER 2 -19.348 0.361 -4.493
7 HA SER 2 HA SER 2 -18.786 2.544 -4.373
8 HB2 SER 2 HB2 SER 2 -21.450 2.719 -2.953
9 HB3 SER 2 HB1 SER 2 -20.517 4.119 -3.483
10 HG SER 2 HG SER 2 -20.832 3.561 -5.574
11 H LEU 3 HN LEU 3 -17.260 1.269 -2.695
12 HA LEU 3 HA LEU 3 -17.400 2.754 -0.166
13 HB2 LEU 3 HB2 LEU 3 -15.858 0.298 -0.948
14 HB3 LEU 3 HB1 LEU 3 -15.556 1.177 0.546
15 HG LEU 3 HG LEU 3 -18.200 0.913 0.702
16 HD11 LEU 3 HD11 LEU 3 -18.228 -0.393 -1.421
17 HD12 LEU 3 HD12 LEU 3 -18.963 -1.194 -0.037
18 HD13 LEU 3 HD13 LEU 3 -17.355 -1.672 -0.574
19 HD21 LEU 3 HD21 LEU 3 -16.177 -1.150 1.571
20 HD22 LEU 3 HD22 LEU 3 -17.797 -0.956 2.242
21 HD23 LEU 3 HD23 LEU 3 -16.600 0.324 2.439
22 H ASP 4 HN ASP 4 -16.696 3.739 -2.745
23 HA ASP 4 HA ASP 4 -13.950 4.140 -3.147
24 HB2 ASP 4 HB2 ASP 4 -16.264 5.946 -3.889
25 HB3 ASP 4 HB1 ASP 4 -14.635 6.065 -4.548
26 H GLU 5 HN GLU 5 -16.293 5.900 -1.229
27 HA GLU 5 HA GLU 5 -14.868 8.203 -0.646
28 HB2 GLU 5 HB2 GLU 5 -16.698 6.708 1.239
29 HB3 GLU 5 HB1 GLU 5 -16.281 8.414 1.319
30 HG2 GLU 5 HG2 GLU 5 -17.789 7.101 -0.925
31 HG3 GLU 5 HG1 GLU 5 -18.515 8.022 0.391
32 H ASP 6 HN ASP 6 -14.706 5.009 0.829
33 HA ASP 6 HA ASP 6 -12.678 5.824 2.731
34 HB2 ASP 6 HB2 ASP 6 -13.906 3.155 2.039
35 HB3 ASP 6 HB1 ASP 6 -12.563 3.304 3.167
36 H GLU 7 HN GLU 7 -12.882 4.032 -0.292
37 HA GLU 7 HA GLU 7 -10.311 2.973 -0.351
38 HB2 GLU 7 HB2 GLU 7 -12.161 3.769 -2.592
39 HB3 GLU 7 HB1 GLU 7 -10.620 2.960 -2.865
40 HG2 GLU 7 HG2 GLU 7 -11.453 1.140 -1.325
41 HG3 GLU 7 HG1 GLU 7 -13.037 1.911 -1.430
42 H GLU 8 HN GLU 8 -11.450 6.143 -1.458
43 HA GLU 8 HA GLU 8 -9.108 6.952 -2.757
44 HB2 GLU 8 HB2 GLU 8 -11.160 8.600 -1.275
45 HB3 GLU 8 HB1 GLU 8 -9.920 9.269 -2.327
46 HG2 GLU 8 HG2 GLU 8 -11.976 7.276 -3.239
47 HG3 GLU 8 HG1 GLU 8 -12.185 9.022 -3.356
48 H ASP 9 HN ASP 9 -10.067 7.349 0.652
49 HA ASP 9 HA ASP 9 -7.637 8.678 1.368
50 HB2 ASP 9 HB2 ASP 9 -9.725 8.980 2.658
51 HB3 ASP 9 HB1 ASP 9 -9.646 7.294 3.164
52 H LEU 10 HN LEU 10 -8.728 5.369 1.282
53 HA LEU 10 HA LEU 10 -6.617 4.186 2.740
54 HB2 LEU 10 HB2 LEU 10 -8.865 3.212 1.811
55 HB3 LEU 10 HB1 LEU 10 -7.918 2.842 0.385
56 HG LEU 10 HG LEU 10 -8.105 0.890 1.796
57 HD11 LEU 10 HD11 LEU 10 -5.333 2.060 1.944
58 HD12 LEU 10 HD12 LEU 10 -6.006 1.114 0.617
59 HD13 LEU 10 HD13 LEU 10 -5.745 0.363 2.191
60 HD21 LEU 10 HD21 LEU 10 -8.545 1.597 3.928
61 HD22 LEU 10 HD22 LEU 10 -7.264 2.803 3.901
62 HD23 LEU 10 HD23 LEU 10 -6.859 1.094 4.081
63 H GLN 11 HN GLN 11 -7.082 4.720 -0.754
64 HA GLN 11 HA GLN 11 -4.522 3.838 -1.541
65 HB2 GLN 11 HB2 GLN 11 -6.346 5.841 -2.889
66 HB3 GLN 11 HB1 GLN 11 -4.952 5.075 -3.639
67 HG2 GLN 11 HG2 GLN 11 -6.018 2.895 -3.411
68 HG3 GLN 11 HG1 GLN 11 -7.406 3.654 -2.631
69 HE21 GLN 11 HE21 GLN 11 -8.868 3.027 -4.163
70 HE22 GLN 11 HE22 GLN 11 -8.905 3.681 -5.762
71 H ARG 12 HN ARG 12 -5.749 6.986 -0.514
72 HA ARG 12 HA ARG 12 -3.469 8.521 -0.991
73 HB2 ARG 12 HB2 ARG 12 -5.574 9.520 -0.240
74 HB3 ARG 12 HB1 ARG 12 -5.396 8.738 1.329
75 HG2 ARG 12 HG2 ARG 12 -4.710 11.007 1.560
76 HG3 ARG 12 HG1 ARG 12 -3.266 9.998 1.629
77 HD2 ARG 12 HD2 ARG 12 -2.581 11.667 0.191
78 HD3 ARG 12 HD1 ARG 12 -3.178 10.453 -0.939
79 HE ARG 12 HE ARG 12 -4.869 12.702 -0.050
80 HH11 ARG 12 HH11 ARG 12 -3.385 10.827 -2.621
81 HH12 ARG 12 HH12 ARG 12 -4.380 11.521 -3.869
82 HH21 ARG 12 HH21 ARG 12 -6.182 13.603 -1.696
83 HH22 ARG 12 HH22 ARG 12 -5.955 13.104 -3.347
84 H ALA 13 HN ALA 13 -4.332 6.582 1.860
85 HA ALA 13 HA ALA 13 -2.052 7.134 3.391
86 HB1 ALA 13 HB1 ALA 13 -2.617 5.082 4.627
87 HB2 ALA 13 HB2 ALA 13 -3.776 4.653 3.364
88 HB3 ALA 13 HB3 ALA 13 -4.029 6.099 4.342
89 H LEU 14 HN LEU 14 -2.657 4.677 0.938
90 HA LEU 14 HA LEU 14 -0.228 3.270 1.234
91 HB2 LEU 14 HB2 LEU 14 -1.986 3.598 -1.201
92 HB3 LEU 14 HB1 LEU 14 -0.691 2.422 -1.045
93 HG LEU 14 HG LEU 14 -3.174 2.501 0.674
94 HD11 LEU 14 HD11 LEU 14 -2.416 0.678 -1.603
95 HD12 LEU 14 HD12 LEU 14 -3.708 1.879 -1.607
96 HD13 LEU 14 HD13 LEU 14 -3.814 0.473 -0.547
97 HD21 LEU 14 HD21 LEU 14 -2.406 0.284 1.425
98 HD22 LEU 14 HD22 LEU 14 -1.284 1.570 1.868
99 HD23 LEU 14 HD23 LEU 14 -0.914 0.508 0.510
100 H ALA 15 HN ALA 15 -1.184 5.840 -1.043
101 HA ALA 15 HA ALA 15 1.371 6.098 -2.245
102 HB1 ALA 15 HB1 ALA 15 0.514 8.173 -3.182
103 HB2 ALA 15 HB2 ALA 15 -0.843 8.138 -2.056
104 HB3 ALA 15 HB3 ALA 15 -0.695 6.895 -3.298
105 H LEU 16 HN LEU 16 -0.172 7.587 0.522
106 HA LEU 16 HA LEU 16 1.650 9.592 1.127
107 HB2 LEU 16 HB2 LEU 16 -0.570 9.102 2.210
108 HB3 LEU 16 HB1 LEU 16 0.208 7.806 3.089
109 HG LEU 16 HG LEU 16 1.241 10.608 3.351
110 HD11 LEU 16 HD11 LEU 16 -0.335 10.626 5.406
111 HD12 LEU 16 HD12 LEU 16 -1.253 9.416 4.493
112 HD13 LEU 16 HD13 LEU 16 -0.990 11.023 3.818
113 HD21 LEU 16 HD21 LEU 16 1.911 9.823 5.544
114 HD22 LEU 16 HD22 LEU 16 2.505 8.704 4.313
115 HD23 LEU 16 HD23 LEU 16 1.089 8.286 5.279
116 H SER 17 HN SER 17 1.588 6.192 2.214
117 HA SER 17 HA SER 17 4.042 6.281 3.588
118 HB2 SER 17 HB2 SER 17 2.335 4.501 3.896
119 HB3 SER 17 HB1 SER 17 2.736 3.873 2.297
120 HG SER 17 HG SER 17 5.022 3.986 3.402
121 H ARG 18 HN ARG 18 3.268 5.838 0.209
122 HA ARG 18 HA ARG 18 5.740 4.770 -0.638
123 HB2 ARG 18 HB2 ARG 18 3.663 6.402 -2.092
124 HB3 ARG 18 HB1 ARG 18 5.097 5.765 -2.882
125 HG2 ARG 18 HG2 ARG 18 4.406 3.492 -2.306
126 HG3 ARG 18 HG1 ARG 18 2.961 4.136 -1.523
127 HD2 ARG 18 HD2 ARG 18 2.153 5.010 -3.613
128 HD3 ARG 18 HD1 ARG 18 3.654 4.573 -4.425
129 HE ARG 18 HE ARG 18 2.015 2.457 -3.234
130 HH11 ARG 18 HH11 ARG 18 3.244 4.076 -6.076
131 HH12 ARG 18 HH12 ARG 18 2.886 2.755 -7.148
132 HH21 ARG 18 HH21 ARG 18 1.511 0.718 -4.646
133 HH22 ARG 18 HH22 ARG 18 1.911 0.839 -6.332
134 H GLN 19 HN GLN 19 4.569 8.128 -0.474
135 HA GLN 19 HA GLN 19 7.072 9.218 -1.344
136 HB2 GLN 19 HB2 GLN 19 6.121 11.394 -0.788
137 HB3 GLN 19 HB1 GLN 19 4.966 10.433 -1.700
138 HG2 GLN 19 HG2 GLN 19 3.797 9.880 0.373
139 HG3 GLN 19 HG1 GLN 19 4.954 10.854 1.277
140 HE21 GLN 19 HE21 GLN 19 2.055 11.115 1.007
141 HE22 GLN 19 HE22 GLN 19 1.774 12.722 0.428
142 H GLU 20 HN GLU 20 5.945 7.967 1.572
143 HA GLU 20 HA GLU 20 7.720 9.443 3.294
144 HB2 GLU 20 HB2 GLU 20 6.019 6.986 3.700
145 HB3 GLU 20 HB1 GLU 20 7.095 7.604 4.945
146 HG2 GLU 20 HG2 GLU 20 4.777 9.064 3.703
147 HG3 GLU 20 HG1 GLU 20 4.840 8.372 5.325
148 H ILE 21 HN ILE 21 7.968 6.780 1.179
149 HA ILE 21 HA ILE 21 10.125 5.488 2.564
150 HB ILE 21 HB ILE 21 9.224 5.110 -0.295
151 HG12 ILE 21 HG12 ILE 21 7.472 4.601 1.349
152 HG13 ILE 21 HG11 ILE 21 8.040 3.148 0.530
153 HG21 ILE 21 HG21 ILE 21 11.000 3.404 1.442
154 HG22 ILE 21 HG22 ILE 21 11.511 4.350 0.042
155 HG23 ILE 21 HG23 ILE 21 10.423 2.976 -0.169
156 HD11 ILE 21 HD11 ILE 21 8.738 4.060 3.304
157 HD12 ILE 21 HD12 ILE 21 9.470 2.684 2.486
158 HD13 ILE 21 HD13 ILE 21 7.745 2.673 2.850
159 H ASP 22 HN ASP 22 10.215 6.616 -0.798
160 HA ASP 22 HA ASP 22 12.047 7.249 -2.037
161 HB2 ASP 22 HB2 ASP 22 10.880 9.336 -1.062
162 HB3 ASP 22 HB1 ASP 22 12.283 9.456 -0.002
163 H MET 23 HN MET 23 13.064 5.250 -0.871
164 HA MET 23 HA MET 23 15.400 6.098 0.714
165 HB2 MET 23 HB2 MET 23 13.573 4.876 1.956
166 HB3 MET 23 HB1 MET 23 13.894 3.482 0.938
167 HG2 MET 23 HG2 MET 23 16.102 3.257 1.841
168 HG3 MET 23 HG1 MET 23 15.936 4.766 2.736
169 HE1 MET 23 HE1 MET 23 12.964 4.585 3.797
170 HE2 MET 23 HE2 MET 23 14.315 5.087 4.814
171 HE3 MET 23 HE3 MET 23 13.202 3.845 5.380
172 H GLU 24 HN GLU 24 17.274 4.674 0.523
173 HA GLU 24 HA GLU 24 17.655 3.981 -2.275
174 HB2 GLU 24 HB2 GLU 24 19.278 5.443 -1.178
175 HB3 GLU 24 HB1 GLU 24 19.603 4.209 0.029
176 HG2 GLU 24 HG2 GLU 24 20.386 2.738 -1.864
177 HG3 GLU 24 HG1 GLU 24 20.298 4.168 -2.891
178 H ASP 25 HN ASP 25 17.741 2.443 0.908
179 HA ASP 25 HA ASP 25 17.949 -0.161 -0.460
180 HB2 ASP 25 HB2 ASP 25 20.040 0.495 0.798
181 HB3 ASP 25 HB1 ASP 25 19.090 0.420 2.280
182 H GLU 26 HN GLU 26 16.859 -1.924 0.542
183 HA GLU 26 HA GLU 26 15.231 -3.005 1.709
184 HB2 GLU 26 HB2 GLU 26 15.269 -0.543 3.441
185 HB3 GLU 26 HB1 GLU 26 14.295 -1.969 3.776
186 HG2 GLU 26 HG2 GLU 26 16.308 -3.320 3.966
187 HG3 GLU 26 HG1 GLU 26 17.297 -1.911 3.583
188 H GLU 27 HN GLU 27 14.728 0.068 0.358
189 HA GLU 27 HA GLU 27 12.056 0.567 0.771
190 HB2 GLU 27 HB2 GLU 27 12.122 1.914 -1.275
191 HB3 GLU 27 HB1 GLU 27 13.533 2.178 -0.267
192 HG2 GLU 27 HG2 GLU 27 14.452 2.088 -2.367
193 HG3 GLU 27 HG1 GLU 27 14.656 0.429 -1.814
194 H ALA 28 HN ALA 28 13.470 -1.837 -1.287
195 HA ALA 28 HA ALA 28 11.386 -2.318 -3.075
196 HB1 ALA 28 HB1 ALA 28 12.362 -4.543 -3.350
197 HB2 ALA 28 HB2 ALA 28 13.319 -4.311 -1.887
198 HB3 ALA 28 HB3 ALA 28 13.614 -3.304 -3.303
199 H ASP 29 HN ASP 29 11.993 -3.702 0.132
200 HA ASP 29 HA ASP 29 9.787 -5.480 0.085
201 HB2 ASP 29 HB2 ASP 29 11.663 -5.893 1.562
202 HB3 ASP 29 HB1 ASP 29 11.391 -4.365 2.397
203 H LEU 30 HN LEU 30 10.284 -2.300 1.548
204 HA LEU 30 HA LEU 30 7.734 -2.105 2.735
205 HB2 LEU 30 HB2 LEU 30 9.778 -0.038 1.949
206 HB3 LEU 30 HB1 LEU 30 8.243 0.412 2.663
207 HG LEU 30 HG LEU 30 8.825 -0.991 4.655
208 HD11 LEU 30 HD11 LEU 30 11.547 -1.112 3.372
209 HD12 LEU 30 HD12 LEU 30 10.445 -2.473 3.579
210 HD13 LEU 30 HD13 LEU 30 11.130 -1.671 4.993
211 HD21 LEU 30 HD21 LEU 30 9.141 1.419 4.670
212 HD22 LEU 30 HD22 LEU 30 10.749 1.222 3.973
213 HD23 LEU 30 HD23 LEU 30 10.409 0.608 5.590
214 H ARG 31 HN ARG 31 8.983 -1.083 -0.417
215 HA ARG 31 HA ARG 31 6.676 0.172 -1.374
216 HB2 ARG 31 HB2 ARG 31 9.159 -0.608 -2.413
217 HB3 ARG 31 HB1 ARG 31 7.945 -1.277 -3.487
218 HG2 ARG 31 HG2 ARG 31 8.459 0.819 -4.386
219 HG3 ARG 31 HG1 ARG 31 6.946 1.074 -3.511
220 HD2 ARG 31 HD2 ARG 31 8.224 1.938 -1.595
221 HD3 ARG 31 HD1 ARG 31 9.717 1.730 -2.512
222 HE ARG 31 HE ARG 31 7.550 3.552 -3.371
223 HH11 ARG 31 HH11 ARG 31 10.956 2.785 -3.042
224 HH12 ARG 31 HH12 ARG 31 11.486 4.381 -3.491
225 HH21 ARG 31 HH21 ARG 31 8.239 5.640 -3.949
226 HH22 ARG 31 HH22 ARG 31 9.938 6.013 -4.000
227 H ARG 32 HN ARG 32 7.751 -3.184 -1.535
228 HA ARG 32 HA ARG 32 5.623 -4.211 -3.037
229 HB2 ARG 32 HB2 ARG 32 7.765 -5.391 -2.605
230 HB3 ARG 32 HB1 ARG 32 7.258 -5.652 -0.940
231 HG2 ARG 32 HG2 ARG 32 5.318 -6.931 -1.770
232 HG3 ARG 32 HG1 ARG 32 5.920 -6.726 -3.414
233 HD2 ARG 32 HD2 ARG 32 8.025 -7.855 -2.707
234 HD3 ARG 32 HD1 ARG 32 7.266 -8.186 -1.149
235 HE ARG 32 HE ARG 32 5.898 -9.096 -3.573
236 HH11 ARG 32 HH11 ARG 32 7.747 -9.875 -0.693
237 HH12 ARG 32 HH12 ARG 32 7.411 -11.583 -0.795
238 HH21 ARG 32 HH21 ARG 32 5.465 -11.325 -3.711
239 HH22 ARG 32 HH22 ARG 32 6.125 -12.413 -2.520
240 H ALA 33 HN ALA 33 6.020 -3.787 0.452
241 HA ALA 33 HA ALA 33 3.747 -5.171 1.306
242 HB1 ALA 33 HB1 ALA 33 3.908 -3.867 3.349
243 HB2 ALA 33 HB2 ALA 33 4.978 -2.714 2.552
244 HB3 ALA 33 HB3 ALA 33 5.510 -4.375 2.817
245 H ILE 34 HN ILE 34 4.135 -1.781 0.335
246 HA ILE 34 HA ILE 34 1.438 -1.055 0.843
247 HB ILE 34 HB ILE 34 3.729 0.210 -0.584
248 HG12 ILE 34 HG12 ILE 34 3.298 2.035 0.942
249 HG13 ILE 34 HG11 ILE 34 1.774 1.314 1.443
250 HG21 ILE 34 HG21 ILE 34 2.294 2.092 -1.314
251 HG22 ILE 34 HG22 ILE 34 0.877 1.115 -0.921
252 HG23 ILE 34 HG23 ILE 34 1.986 0.590 -2.188
253 HD11 ILE 34 HD11 ILE 34 3.700 1.087 3.037
254 HD12 ILE 34 HD12 ILE 34 4.424 -0.013 1.863
255 HD13 ILE 34 HD13 ILE 34 2.878 -0.413 2.606
256 H GLN 35 HN GLN 35 3.172 -2.240 -1.967
257 HA GLN 35 HA GLN 35 1.042 -1.876 -3.823
258 HB2 GLN 35 HB2 GLN 35 3.470 -3.674 -3.955
259 HB3 GLN 35 HB1 GLN 35 2.389 -3.347 -5.303
260 HG2 GLN 35 HG2 GLN 35 2.966 -0.981 -5.203
261 HG3 GLN 35 HG1 GLN 35 4.030 -1.295 -3.835
262 HE21 GLN 35 HE21 GLN 35 3.725 -3.458 -6.555
263 HE22 GLN 35 HE22 GLN 35 5.293 -3.157 -7.221
264 H LEU 36 HN LEU 36 2.087 -4.582 -1.812
265 HA LEU 36 HA LEU 36 0.303 -6.504 -2.850
266 HB2 LEU 36 HB2 LEU 36 1.936 -7.468 -1.573
267 HB3 LEU 36 HB1 LEU 36 1.892 -6.210 -0.354
268 HG LEU 36 HG LEU 36 -0.544 -7.820 -0.482
269 HD11 LEU 36 HD11 LEU 36 2.081 -9.099 0.238
270 HD12 LEU 36 HD12 LEU 36 0.955 -9.591 -1.030
271 HD13 LEU 36 HD13 LEU 36 0.498 -9.753 0.665
272 HD21 LEU 36 HD21 LEU 36 -0.303 -7.769 1.920
273 HD22 LEU 36 HD22 LEU 36 -0.001 -6.155 1.267
274 HD23 LEU 36 HD23 LEU 36 1.351 -7.172 1.772
275 H SER 37 HN SER 37 -0.027 -4.109 -0.286
276 HA SER 37 HA SER 37 -2.571 -4.861 0.623
277 HB2 SER 37 HB2 SER 37 -1.324 -2.103 0.539
278 HB3 SER 37 HB1 SER 37 -2.706 -2.575 1.530
279 HG SER 37 HG SER 37 0.000 -3.357 1.751
280 H MET 38 HN MET 38 -1.655 -3.637 -2.381
281 HA MET 38 HA MET 38 -4.251 -2.437 -2.954
282 HB2 MET 38 HB2 MET 38 -1.807 -2.785 -4.702
283 HB3 MET 38 HB1 MET 38 -3.266 -1.915 -5.158
284 HG2 MET 38 HG2 MET 38 -2.871 -0.261 -3.462
285 HG3 MET 38 HG1 MET 38 -1.494 -1.173 -2.844
286 HE1 MET 38 HE1 MET 38 -2.896 0.891 -5.909
287 HE2 MET 38 HE2 MET 38 -2.464 -0.668 -6.608
288 HE3 MET 38 HE3 MET 38 -1.541 0.772 -7.034
289 H GLN 39 HN GLN 39 -2.981 -5.485 -2.850
290 HA GLN 39 HA GLN 39 -4.557 -6.444 -5.142
291 HB2 GLN 39 HB2 GLN 39 -2.551 -7.973 -3.486
292 HB3 GLN 39 HB1 GLN 39 -3.291 -8.495 -4.992
293 HG2 GLN 39 HG2 GLN 39 -2.137 -6.696 -6.177
294 HG3 GLN 39 HG1 GLN 39 -1.385 -6.187 -4.665
295 HE21 GLN 39 HE21 GLN 39 -1.933 -9.524 -5.548
296 HE22 GLN 39 HE22 GLN 39 -0.263 -9.947 -5.748
297 H GLY 40 HN GLY 40 -5.663 -8.602 -4.735
298 HA2 GLY 40 HA2 GLY 40 -6.171 -9.827 -2.389
299 HA3 GLY 40 HA1 GLY 40 -7.200 -8.412 -2.282
300 H SER 41 HN SER 41 -9.016 -8.258 -3.579
301 HA SER 41 HA SER 41 -10.075 -10.857 -4.250
302 HB2 SER 41 HB2 SER 41 -12.217 -9.457 -4.520
303 HB3 SER 41 HB1 SER 41 -11.513 -9.570 -2.907
304 HG SER 41 HG SER 41 -11.997 -7.390 -4.356
305 H SER 42 HN SER 42 -8.515 -10.895 -6.166
306 HA SER 42 HA SER 42 -9.036 -9.419 -8.494
307 HB2 SER 42 HB2 SER 42 -8.136 -12.306 -8.397
308 HB3 SER 42 HB1 SER 42 -7.782 -11.112 -9.648
309 HG SER 42 HG SER 42 -5.986 -11.223 -8.365
310 H ARG 43 HN ARG 43 -10.460 -12.386 -7.231
311 HA ARG 43 HA ARG 43 -12.886 -11.961 -8.706
312 HB2 ARG 43 HB2 ARG 43 -11.374 -13.090 -10.380
313 HB3 ARG 43 HB1 ARG 43 -11.289 -14.467 -9.293
314 HG2 ARG 43 HG2 ARG 43 -13.861 -14.474 -9.461
315 HG3 ARG 43 HG1 ARG 43 -13.608 -13.474 -10.893
316 HD2 ARG 43 HD2 ARG 43 -12.323 -15.179 -11.947
317 HD3 ARG 43 HD1 ARG 43 -12.258 -16.129 -10.462
318 HE ARG 43 HE ARG 43 -14.690 -15.689 -12.072
319 HH11 ARG 43 HH11 ARG 43 -12.779 -17.622 -9.872
320 HH12 ARG 43 HH12 ARG 43 -13.918 -18.931 -9.820
321 HH21 ARG 43 HH21 ARG 43 -16.200 -17.377 -12.009
322 HH22 ARG 43 HH22 ARG 43 -15.892 -18.788 -11.035
323 H ASN 44 HN ASN 44 -11.826 -12.343 -5.929
324 HA ASN 44 HA ASN 44 -13.572 -14.525 -5.102
325 HB2 ASN 44 HB2 ASN 44 -11.281 -15.474 -5.462
326 HB3 ASN 44 HB1 ASN 44 -10.675 -14.370 -4.233
327 HD21 ASN 44 HD21 ASN 44 -9.975 -16.082 -2.968
328 HD22 ASN 44 HD22 ASN 44 -11.079 -17.056 -2.050
329 H LEU 45 HN LEU 45 -14.594 -14.103 -3.237
330 HA LEU 45 HA LEU 45 -15.318 -13.030 -1.381
331 HB2 LEU 45 HB2 LEU 45 -12.455 -12.196 -1.325
332 HB3 LEU 45 HB1 LEU 45 -13.592 -11.355 -0.292
333 HG LEU 45 HG LEU 45 -12.513 -13.080 0.981
334 HD11 LEU 45 HD11 LEU 45 -14.873 -12.675 1.456
335 HD12 LEU 45 HD12 LEU 45 -14.433 -14.355 1.756
336 HD13 LEU 45 HD13 LEU 45 -15.325 -13.923 0.297
337 HD21 LEU 45 HD21 LEU 45 -11.825 -14.533 -0.855
338 HD22 LEU 45 HD22 LEU 45 -13.501 -15.028 -1.096
339 HD23 LEU 45 HD23 LEU 45 -12.665 -15.443 0.402
340 H GLU 46 HN GLU 46 -16.819 -11.982 -2.666
341 HA GLU 46 HA GLU 46 -18.039 -10.215 -3.347
342 HB2 GLU 46 HB2 GLU 46 -16.018 -8.660 -1.728
343 HB3 GLU 46 HB1 GLU 46 -17.482 -7.964 -2.411
344 HG2 GLU 46 HG2 GLU 46 -18.811 -9.583 -1.096
345 HG3 GLU 46 HG1 GLU 46 -17.320 -10.151 -0.350