NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
473340 |
2jrs   |
15343 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA MET 1 HA MET 1 -31.530 17.807 14.828
2 H1 MET 1 1H MET 1 -30.696 18.933 12.875
3 H2 MET 1 2H MET 1 -31.004 17.577 11.919
4 H3 MET 1 3H MET 1 -29.844 17.500 13.145
5 HB2 MET 1 2HB MET 1 -33.443 17.727 12.480
6 HB3 MET 1 1HB MET 1 -33.915 17.729 14.176
7 HG2 MET 1 2HG MET 1 -34.146 19.940 13.156
8 HG3 MET 1 1HG MET 1 -32.974 19.940 14.472
9 HE1 MET 1 3HE MET 1 -31.938 22.275 13.670
10 HE2 MET 1 1HE MET 1 -33.182 22.310 12.421
11 HE3 MET 1 2HE MET 1 -31.495 22.602 11.994
12 H GLY 2 H GLY 2 -32.767 15.875 12.074
13 HA2 GLY 2 2HA GLY 2 -32.656 13.454 13.690
14 HA3 GLY 2 1HA GLY 2 -33.290 13.596 12.056
15 H HIS 3 H HIS 3 -32.202 12.029 10.969
16 HA HIS 3 HA HIS 3 -30.517 10.976 9.875
17 HD1 HIS 3 HD1 HIS 3 -28.831 10.831 7.808
18 HD2 HIS 3 HD2 HIS 3 -26.447 13.365 10.084
19 HE1 HIS 3 HE1 HIS 3 -26.471 10.360 7.094
20 HE2 HIS 3 HE2 HIS 3 -25.066 12.016 8.365
21 HB2 HIS 3 2HB HIS 3 -29.984 13.146 8.981
22 HB3 HIS 3 1HB HIS 3 -29.106 13.589 10.439
23 H HIS 4 H HIS 4 -30.256 9.296 11.337
24 HA HIS 4 HA HIS 4 -28.706 9.490 13.716
25 HD1 HIS 4 HD1 HIS 4 -28.395 5.103 12.485
26 HD2 HIS 4 HD2 HIS 4 -31.082 7.621 10.553
27 HE1 HIS 4 HE1 HIS 4 -28.961 3.957 10.328
28 HE2 HIS 4 HE2 HIS 4 -30.726 5.402 9.274
29 HB2 HIS 4 2HB HIS 4 -28.989 7.062 13.882
30 HB3 HIS 4 1HB HIS 4 -30.512 7.845 13.476
31 H HIS 5 H HIS 5 -26.583 9.413 13.991
32 HA HIS 5 HA HIS 5 -24.894 8.129 11.928
33 HD1 HIS 5 HD1 HIS 5 -22.455 9.123 10.748
34 HD2 HIS 5 HD2 HIS 5 -21.743 9.816 14.783
35 HE1 HIS 5 HE1 HIS 5 -20.000 8.725 11.077
36 HE2 HIS 5 HE2 HIS 5 -19.624 9.003 13.547
37 HB2 HIS 5 2HB HIS 5 -24.369 10.484 12.089
38 HB3 HIS 5 1HB HIS 5 -24.251 10.389 13.844
39 H HIS 6 H HIS 6 -24.319 6.139 12.574
40 HA HIS 6 HA HIS 6 -23.067 5.704 15.125
41 HD1 HIS 6 HD1 HIS 6 -23.941 4.823 17.847
42 HD2 HIS 6 HD2 HIS 6 -25.246 1.818 15.289
43 HE1 HIS 6 HE1 HIS 6 -23.622 2.680 19.107
44 HE2 HIS 6 HE2 HIS 6 -24.566 0.898 17.606
45 HB2 HIS 6 2HB HIS 6 -25.412 5.633 15.817
46 HB3 HIS 6 1HB HIS 6 -25.768 4.439 14.575
47 H HIS 7 H HIS 7 -21.356 4.568 14.435
48 HA HIS 7 HA HIS 7 -21.831 2.249 12.660
49 HD1 HIS 7 HD1 HIS 7 -17.374 2.720 11.835
50 HD2 HIS 7 HD2 HIS 7 -20.958 1.263 10.316
51 HE1 HIS 7 HE1 HIS 7 -16.740 0.827 10.315
52 HE2 HIS 7 HE2 HIS 7 -18.925 -0.090 9.469
53 HB2 HIS 7 2HB HIS 7 -20.578 4.094 11.542
54 HB3 HIS 7 1HB HIS 7 -19.319 3.944 12.762
55 H HIS 8 H HIS 8 -21.266 2.977 15.749
56 HA HIS 8 HA HIS 8 -19.116 1.388 16.583
57 HD1 HIS 8 HD1 HIS 8 -18.136 2.393 19.125
58 HD2 HIS 8 HD2 HIS 8 -21.316 -0.116 20.043
59 HE1 HIS 8 HE1 HIS 8 -17.429 1.135 21.179
60 HE2 HIS 8 HE2 HIS 8 -19.447 -0.216 21.826
61 HB2 HIS 8 2HB HIS 8 -20.461 3.004 17.988
62 HB3 HIS 8 1HB HIS 8 -21.715 1.775 18.090
63 H SER 9 H SER 9 -22.215 0.497 15.376
64 HA SER 9 HA SER 9 -22.287 -2.201 16.264
65 HG SER 9 HG SER 9 -25.408 -0.983 15.164
66 HB2 SER 9 2HB SER 9 -23.503 -1.009 13.749
67 HB3 SER 9 1HB SER 9 -23.955 -2.539 14.503
68 H HIS 10 H HIS 10 -20.416 -3.329 15.935
69 HA HIS 10 HA HIS 10 -18.651 -3.079 13.798
70 HD1 HIS 10 HD1 HIS 10 -17.294 -3.223 17.140
71 HD2 HIS 10 HD2 HIS 10 -15.849 -5.105 13.726
72 HE1 HIS 10 HE1 HIS 10 -14.839 -2.726 17.086
73 HE2 HIS 10 HE2 HIS 10 -13.959 -4.039 15.132
74 HB2 HIS 10 2HB HIS 10 -18.970 -4.854 16.068
75 HB3 HIS 10 1HB HIS 10 -18.435 -5.762 14.660
76 H MET 11 H MET 11 -19.551 -3.079 11.799
77 HA MET 11 HA MET 11 -20.150 -3.917 9.785
78 HB2 MET 11 2HB MET 11 -19.953 -6.628 11.112
79 HB3 MET 11 1HB MET 11 -20.107 -6.349 9.381
80 HG2 MET 11 2HG MET 11 -17.961 -5.150 9.398
81 HG3 MET 11 1HG MET 11 -17.805 -5.479 11.124
82 HE1 MET 11 3HE MET 11 -15.469 -6.231 9.176
83 HE2 MET 11 1HE MET 11 -15.090 -7.871 9.698
84 HE3 MET 11 2HE MET 11 -15.459 -6.630 10.894
85 H ALA 12 H ALA 12 -21.883 -5.566 8.774
86 HA ALA 12 HA ALA 12 -24.061 -6.108 8.444
87 HB1 ALA 12 3HB ALA 12 -25.576 -6.470 10.304
88 HB2 ALA 12 1HB ALA 12 -24.475 -5.629 11.397
89 HB3 ALA 12 2HB ALA 12 -23.994 -7.161 10.668
90 H ALA 13 H ALA 13 -23.889 -3.339 10.713
91 HA ALA 13 HA ALA 13 -26.216 -2.035 9.903
92 HB1 ALA 13 3HB ALA 13 -23.666 -0.815 10.962
93 HB2 ALA 13 1HB ALA 13 -25.011 -1.430 11.924
94 HB3 ALA 13 2HB ALA 13 -25.236 -0.012 10.898
95 H ALA 14 H ALA 14 -22.973 -1.877 8.503
96 HA ALA 14 HA ALA 14 -23.478 0.278 6.716
97 HB1 ALA 14 3HB ALA 14 -21.215 -0.395 7.400
98 HB2 ALA 14 1HB ALA 14 -21.390 -0.369 5.644
99 HB3 ALA 14 2HB ALA 14 -21.402 -1.906 6.509
100 H MET 15 H MET 15 -23.062 -3.205 5.962
101 HA MET 15 HA MET 15 -24.514 -2.852 3.465
102 HB2 MET 15 2HB MET 15 -22.499 -4.265 3.497
103 HB3 MET 15 1HB MET 15 -23.257 -5.334 4.669
104 HG2 MET 15 2HG MET 15 -24.932 -5.986 3.042
105 HG3 MET 15 1HG MET 15 -24.275 -4.843 1.871
106 HE1 MET 15 3HE MET 15 -24.191 -6.832 0.097
107 HE2 MET 15 1HE MET 15 -24.776 -7.995 1.289
108 HE3 MET 15 2HE MET 15 -23.321 -8.342 0.355
109 H ALA 16 H ALA 16 -26.579 -2.336 4.267
110 HA ALA 16 HA ALA 16 -28.049 -4.565 5.543
111 HB1 ALA 16 3HB ALA 16 -29.488 -2.912 6.602
112 HB2 ALA 16 1HB ALA 16 -28.597 -1.607 5.817
113 HB3 ALA 16 2HB ALA 16 -27.800 -2.621 7.022
114 H ASN 17 H ASN 17 -28.045 -2.162 2.990
115 HA ASN 17 HA ASN 17 -30.764 -2.680 2.165
116 HB2 ASN 17 2HB ASN 17 -29.677 -0.471 1.828
117 HB3 ASN 17 1HB ASN 17 -28.554 -1.216 0.697
118 HD21 ASN 17 1HD2 ASN 17 -31.819 -0.182 1.221
119 HD22 ASN 17 2HD2 ASN 17 -32.332 -0.312 -0.422
120 H ASN 18 H ASN 18 -31.441 -4.244 0.809
121 HA ASN 18 HA ASN 18 -29.756 -6.359 0.045
122 HB2 ASN 18 2HB ASN 18 -31.716 -7.222 -1.200
123 HB3 ASN 18 1HB ASN 18 -32.116 -6.717 0.438
124 HD21 ASN 18 1HD2 ASN 18 -33.716 -6.968 -2.075
125 HD22 ASN 18 2HD2 ASN 18 -34.495 -5.435 -2.250
126 H LEU 19 H LEU 19 -30.618 -3.454 -1.693
127 HA LEU 19 HA LEU 19 -29.537 -4.522 -4.200
128 HG LEU 19 HG LEU 19 -32.519 -3.526 -3.436
129 HB2 LEU 19 2HB LEU 19 -30.781 -1.825 -3.631
130 HB3 LEU 19 1HB LEU 19 -30.324 -2.434 -5.212
131 HD11 LEU 19 1HD1 LEU 19 -32.632 -2.130 -6.112
132 HD12 LEU 19 2HD1 LEU 19 -33.089 -1.429 -4.559
133 HD13 LEU 19 3HD1 LEU 19 -34.009 -2.781 -5.219
134 HD21 LEU 19 3HD2 LEU 19 -31.422 -5.352 -4.614
135 HD22 LEU 19 1HD2 LEU 19 -31.575 -4.486 -6.143
136 HD23 LEU 19 2HD2 LEU 19 -33.018 -5.049 -5.298
137 H GLN 20 H GLN 20 -28.532 -2.664 -1.528
138 HA GLN 20 HA GLN 20 -26.700 -1.437 -1.002
139 HB2 GLN 20 2HB GLN 20 -25.643 -3.585 -1.750
140 HB3 GLN 20 1HB GLN 20 -25.401 -2.869 -3.333
141 HG2 GLN 20 2HG GLN 20 -23.398 -2.885 -1.820
142 HG3 GLN 20 1HG GLN 20 -23.822 -1.318 -2.502
143 HE21 GLN 20 1HE2 GLN 20 -24.340 0.322 -1.157
144 HE22 GLN 20 2HE2 GLN 20 -24.332 0.218 0.566
145 H LYS 21 H LYS 21 -27.402 0.618 -1.422
146 HA LYS 21 HA LYS 21 -27.952 1.664 -3.972
147 HB2 LYS 21 2HB LYS 21 -27.392 3.164 -1.404
148 HB3 LYS 21 1HB LYS 21 -28.161 3.841 -2.835
149 HG2 LYS 21 2HG LYS 21 -30.026 2.264 -2.579
150 HG3 LYS 21 1HG LYS 21 -29.254 1.592 -1.141
151 HD2 LYS 21 2HD LYS 21 -30.223 4.441 -1.476
152 HD3 LYS 21 1HD LYS 21 -31.017 3.176 -0.536
153 HE2 LYS 21 2HE LYS 21 -29.044 3.042 0.925
154 HE3 LYS 21 1HE LYS 21 -28.275 4.331 -0.002
155 HZ1 LYS 21 3HZ LYS 21 -29.256 5.250 1.955
156 HZ2 LYS 21 1HZ LYS 21 -30.757 4.545 1.616
157 HZ3 LYS 21 2HZ LYS 21 -30.159 5.776 0.625
158 H GLY 22 H GLY 22 -25.015 1.846 -2.032
159 HA2 GLY 22 2HA GLY 22 -23.583 2.822 -4.402
160 HA3 GLY 22 1HA GLY 22 -23.453 3.768 -2.926
161 H SER 23 H SER 23 -21.148 3.360 -3.114
162 HA SER 23 HA SER 23 -19.230 2.391 -2.370
163 HG SER 23 HG SER 23 -18.482 1.232 -0.127
164 HB2 SER 23 2HB SER 23 -20.570 1.861 -0.322
165 HB3 SER 23 1HB SER 23 -20.991 0.307 -1.039
166 H ALA 24 H ALA 24 -18.377 -0.215 -2.116
167 HA ALA 24 HA ALA 24 -17.804 -2.145 -3.161
168 HB1 ALA 24 3HB ALA 24 -19.277 -3.187 -4.779
169 HB2 ALA 24 1HB ALA 24 -20.175 -1.681 -4.962
170 HB3 ALA 24 2HB ALA 24 -20.206 -2.543 -3.425
171 H GLY 25 H GLY 25 -17.838 0.819 -4.819
172 HA2 GLY 25 2HA GLY 25 -16.639 -0.144 -7.279
173 HA3 GLY 25 1HA GLY 25 -16.892 1.532 -6.828
174 HA PRO 26 HA PRO 26 -12.463 1.586 -6.109
175 HB2 PRO 26 2HB PRO 26 -12.221 4.064 -5.080
176 HB3 PRO 26 1HB PRO 26 -12.601 3.793 -6.785
177 HG2 PRO 26 2HG PRO 26 -14.449 4.476 -4.520
178 HG3 PRO 26 1HG PRO 26 -14.394 5.148 -6.161
179 HD2 PRO 26 2HD PRO 26 -16.164 3.208 -5.396
180 HD3 PRO 26 1HD PRO 26 -15.568 3.378 -7.059
181 H MET 27 H MET 27 -10.898 1.818 -4.335
182 HA MET 27 HA MET 27 -11.955 1.712 -1.614
183 HB2 MET 27 2HB MET 27 -12.141 -0.606 -2.415
184 HB3 MET 27 1HB MET 27 -10.440 -0.602 -2.853
185 HG2 MET 27 2HG MET 27 -9.811 -0.388 -0.518
186 HG3 MET 27 1HG MET 27 -11.512 -0.310 -0.050
187 HE1 MET 27 3HE MET 27 -11.198 -2.319 1.687
188 HE2 MET 27 1HE MET 27 -9.485 -2.353 1.266
189 HE3 MET 27 2HE MET 27 -10.420 -3.845 1.262
190 H ARG 28 H ARG 28 -10.461 2.314 -0.051
191 HA ARG 28 HA ARG 28 -7.774 3.063 -1.040
192 HE ARG 28 HE ARG 28 -8.430 6.447 2.973
193 HB2 ARG 28 2HB ARG 28 -9.256 4.981 -0.494
194 HB3 ARG 28 1HB ARG 28 -9.388 4.390 1.157
195 HG2 ARG 28 2HG ARG 28 -7.046 4.784 1.549
196 HG3 ARG 28 1HG ARG 28 -6.788 5.191 -0.151
197 HD2 ARG 28 2HD ARG 28 -6.898 7.214 1.185
198 HD3 ARG 28 1HD ARG 28 -8.287 7.128 0.103
199 HH11 ARG 28 1HH1 ARG 28 -9.754 7.962 0.163
200 HH12 ARG 28 2HH1 ARG 28 -11.166 8.503 1.006
201 HH21 ARG 28 1HH2 ARG 28 -10.222 7.201 4.029
202 HH22 ARG 28 2HH2 ARG 28 -11.423 8.086 3.154
203 H LEU 29 H LEU 29 -6.052 2.201 -0.043
204 HA LEU 29 HA LEU 29 -6.503 0.520 2.332
205 HG LEU 29 HG LEU 29 -6.238 -0.376 -0.731
206 HB2 LEU 29 2HB LEU 29 -4.214 0.492 0.353
207 HB3 LEU 29 1HB LEU 29 -4.433 -0.629 1.686
208 HD11 LEU 29 1HD1 LEU 29 -4.094 -1.410 -1.257
209 HD12 LEU 29 2HD1 LEU 29 -5.391 -2.603 -1.303
210 HD13 LEU 29 3HD1 LEU 29 -4.297 -2.545 0.080
211 HD21 LEU 29 3HD2 LEU 29 -6.375 -2.285 1.610
212 HD22 LEU 29 1HD2 LEU 29 -7.374 -2.362 0.157
213 HD23 LEU 29 2HD2 LEU 29 -7.516 -0.988 1.253
214 H TYR 30 H TYR 30 -5.103 0.569 4.095
215 HA TYR 30 HA TYR 30 -3.447 2.993 4.380
216 HD1 TYR 30 HD2 TYR 30 -3.406 4.688 6.530
217 HD2 TYR 30 HD1 TYR 30 -3.365 0.777 8.220
218 HE1 TYR 30 HE2 TYR 30 -1.948 5.487 8.341
219 HE2 TYR 30 HE1 TYR 30 -1.907 1.566 10.031
220 HH TYR 30 HH TYR 30 -1.334 4.894 10.606
221 HB2 TYR 30 2HB TYR 30 -5.208 2.894 6.028
222 HB3 TYR 30 1HB TYR 30 -4.808 1.230 6.431
223 H VAL 31 H VAL 31 -1.371 2.536 3.889
224 HA VAL 31 HA VAL 31 -0.238 -0.079 4.664
225 HB VAL 31 HB VAL 31 0.823 1.922 2.650
226 HG11 VAL 31 1HG1 VAL 31 1.692 -0.916 3.239
227 HG12 VAL 31 2HG1 VAL 31 2.590 0.551 3.633
228 HG13 VAL 31 3HG1 VAL 31 2.321 0.111 1.947
229 HG21 VAL 31 3HG2 VAL 31 0.049 0.347 0.935
230 HG22 VAL 31 1HG2 VAL 31 -1.295 0.945 1.909
231 HG23 VAL 31 2HG2 VAL 31 -0.656 -0.675 2.187
232 H GLY 32 H GLY 32 1.203 -0.171 6.294
233 HA2 GLY 32 2HA GLY 32 2.690 2.290 7.017
234 HA3 GLY 32 1HA GLY 32 1.964 1.251 8.230
235 H SER 33 H SER 33 4.636 1.693 6.065
236 HA SER 33 HA SER 33 6.330 0.049 7.720
237 HG SER 33 HG SER 33 5.183 -1.393 4.177
238 HB2 SER 33 2HB SER 33 7.060 -1.523 5.979
239 HB3 SER 33 1HB SER 33 5.326 -1.688 6.256
240 H LEU 34 H LEU 34 5.999 2.797 6.265
241 HA LEU 34 HA LEU 34 8.250 2.879 4.440
242 HG LEU 34 HG LEU 34 4.933 3.741 4.790
243 HB2 LEU 34 2HB LEU 34 6.731 5.297 5.369
244 HB3 LEU 34 1HB LEU 34 7.504 5.010 3.823
245 HD11 LEU 34 1HD1 LEU 34 3.902 5.053 2.982
246 HD12 LEU 34 2HD1 LEU 34 5.459 5.822 2.670
247 HD13 LEU 34 3HD1 LEU 34 4.644 6.073 4.213
248 HD21 LEU 34 3HD2 LEU 34 6.329 3.440 2.130
249 HD22 LEU 34 1HD2 LEU 34 4.752 2.779 2.563
250 HD23 LEU 34 2HD2 LEU 34 6.203 2.199 3.379
251 H HIS 35 H HIS 35 9.988 2.404 6.045
252 HA HIS 35 HA HIS 35 10.403 4.388 8.100
253 HD1 HIS 35 HD1 HIS 35 12.376 0.010 8.460
254 HD2 HIS 35 HD2 HIS 35 13.108 2.696 5.373
255 HE1 HIS 35 HE1 HIS 35 13.748 -1.247 6.785
256 HE2 HIS 35 HE2 HIS 35 14.389 0.468 5.070
257 HB2 HIS 35 2HB HIS 35 12.431 3.147 8.722
258 HB3 HIS 35 1HB HIS 35 11.006 2.134 8.657
259 H PHE 36 H PHE 36 10.369 6.134 6.488
260 HA PHE 36 HA PHE 36 11.427 7.963 5.668
261 HD1 PHE 36 HD2 PHE 36 12.388 10.054 7.517
262 HD2 PHE 36 HD1 PHE 36 12.794 6.102 9.062
263 HE1 PHE 36 HE2 PHE 36 11.511 10.812 9.686
264 HE2 PHE 36 HE1 PHE 36 11.918 6.858 11.230
265 HZ PHE 36 HZ PHE 36 11.275 9.215 11.543
266 HB2 PHE 36 2HB PHE 36 13.850 6.729 6.991
267 HB3 PHE 36 1HB PHE 36 13.770 8.378 6.385
268 H ASN 37 H ASN 37 11.821 5.132 4.136
269 HA ASN 37 HA ASN 37 13.477 6.382 2.062
270 HB2 ASN 37 2HB ASN 37 14.885 4.900 3.617
271 HB3 ASN 37 1HB ASN 37 14.060 3.534 2.868
272 HD21 ASN 37 1HD2 ASN 37 15.942 2.747 1.912
273 HD22 ASN 37 2HD2 ASN 37 16.720 3.555 0.603
274 H ILE 38 H ILE 38 10.734 4.553 2.781
275 HA ILE 38 HA ILE 38 10.633 3.262 0.162
276 HB ILE 38 HB ILE 38 8.607 3.176 2.417
277 HG12 ILE 38 2HG1 ILE 38 9.331 0.746 2.537
278 HG13 ILE 38 1HG1 ILE 38 10.664 1.157 1.465
279 HG21 ILE 38 1HG2 ILE 38 8.659 1.670 -0.200
280 HG22 ILE 38 2HG2 ILE 38 7.515 2.930 0.260
281 HG23 ILE 38 3HG2 ILE 38 7.522 1.390 1.120
282 HD11 ILE 38 3HD1 ILE 38 10.186 2.309 4.209
283 HD12 ILE 38 1HD1 ILE 38 11.538 2.696 3.145
284 HD13 ILE 38 2HD1 ILE 38 11.365 1.066 3.793
285 H THR 39 H THR 39 9.936 4.379 -1.528
286 HA THR 39 HA THR 39 8.414 6.845 -1.111
287 HB THR 39 HB THR 39 9.029 7.378 -3.453
288 HG1 THR 39 HG1 THR 39 10.933 5.714 -4.018
289 HG21 THR 39 3HG2 THR 39 11.401 7.758 -3.057
290 HG22 THR 39 1HG2 THR 39 11.399 6.568 -1.754
291 HG23 THR 39 2HG2 THR 39 10.486 8.068 -1.582
292 H GLU 40 H GLU 40 6.889 7.462 -2.893
293 HA GLU 40 HA GLU 40 4.641 5.857 -3.043
294 HB2 GLU 40 2HB GLU 40 5.539 7.958 -5.036
295 HB3 GLU 40 1HB GLU 40 3.897 7.359 -4.855
296 HG2 GLU 40 2HG GLU 40 3.648 8.385 -2.740
297 HG3 GLU 40 1HG GLU 40 5.377 8.702 -2.610
298 H ASP 41 H ASP 41 7.279 6.166 -5.392
299 HA ASP 41 HA ASP 41 6.137 4.606 -7.442
300 HB2 ASP 41 2HB ASP 41 9.058 5.137 -6.848
301 HB3 ASP 41 1HB ASP 41 8.410 4.545 -8.378
302 H MET 42 H MET 42 8.258 3.708 -4.731
303 HA MET 42 HA MET 42 8.760 1.041 -5.525
304 HB2 MET 42 2HB MET 42 8.633 2.242 -2.746
305 HB3 MET 42 1HB MET 42 9.268 0.644 -3.115
306 HG2 MET 42 2HG MET 42 10.375 3.258 -4.122
307 HG3 MET 42 1HG MET 42 11.051 2.273 -2.825
308 HE1 MET 42 3HE MET 42 12.836 3.232 -5.262
309 HE2 MET 42 1HE MET 42 13.707 1.741 -5.631
310 HE3 MET 42 2HE MET 42 13.422 2.204 -3.952
311 H LEU 43 H LEU 43 6.379 2.332 -3.216
312 HA LEU 43 HA LEU 43 4.938 0.018 -2.686
313 HG LEU 43 HG LEU 43 5.755 2.498 -1.215
314 HB2 LEU 43 2HB LEU 43 3.919 2.854 -2.938
315 HB3 LEU 43 1HB LEU 43 3.053 1.543 -2.160
316 HD11 LEU 43 1HD1 LEU 43 4.565 3.735 0.530
317 HD12 LEU 43 2HD1 LEU 43 3.028 3.341 -0.242
318 HD13 LEU 43 3HD1 LEU 43 4.202 4.359 -1.080
319 HD21 LEU 43 3HD2 LEU 43 5.084 1.357 0.865
320 HD22 LEU 43 1HD2 LEU 43 5.176 0.251 -0.507
321 HD23 LEU 43 2HD2 LEU 43 3.605 0.810 0.072
322 H ARG 44 H ARG 44 4.210 2.495 -5.156
323 HA ARG 44 HA ARG 44 2.007 1.256 -6.309
324 HE ARG 44 HE ARG 44 1.493 3.289 -11.211
325 HB2 ARG 44 2HB ARG 44 2.711 3.585 -6.765
326 HB3 ARG 44 1HB ARG 44 4.067 2.978 -7.710
327 HG2 ARG 44 2HG ARG 44 2.566 1.990 -9.314
328 HG3 ARG 44 1HG ARG 44 1.172 2.430 -8.331
329 HD2 ARG 44 2HD ARG 44 1.665 4.804 -8.686
330 HD3 ARG 44 1HD ARG 44 3.073 4.367 -9.659
331 HH11 ARG 44 1HH1 ARG 44 0.364 5.822 -9.168
332 HH12 ARG 44 2HH1 ARG 44 -1.066 6.076 -10.104
333 HH21 ARG 44 1HH2 ARG 44 -0.315 3.632 -12.403
334 HH22 ARG 44 2HH2 ARG 44 -1.435 4.868 -11.932
335 H GLY 45 H GLY 45 5.446 0.886 -7.150
336 HA2 GLY 45 2HA GLY 45 5.146 -0.782 -9.386
337 HA3 GLY 45 1HA GLY 45 6.560 -0.721 -8.349
338 H ILE 46 H ILE 46 5.064 -1.576 -5.957
339 HA ILE 46 HA ILE 46 5.096 -4.436 -6.435
340 HB ILE 46 HB ILE 46 4.468 -2.892 -3.906
341 HG12 ILE 46 2HG1 ILE 46 7.024 -4.262 -4.803
342 HG13 ILE 46 1HG1 ILE 46 6.762 -2.523 -4.742
343 HG21 ILE 46 1HG2 ILE 46 4.863 -5.007 -2.731
344 HG22 ILE 46 2HG2 ILE 46 5.070 -5.831 -4.276
345 HG23 ILE 46 3HG2 ILE 46 3.505 -5.137 -3.849
346 HD11 ILE 46 3HD1 ILE 46 6.808 -4.405 -2.393
347 HD12 ILE 46 1HD1 ILE 46 6.495 -2.670 -2.304
348 HD13 ILE 46 2HD1 ILE 46 8.065 -3.257 -2.853
349 H PHE 47 H PHE 47 2.652 -1.964 -5.891
350 HA PHE 47 HA PHE 47 0.546 -3.898 -5.401
351 HD1 PHE 47 HD1 PHE 47 2.500 -1.913 -3.747
352 HD2 PHE 47 HD2 PHE 47 -1.717 -1.882 -3.177
353 HE1 PHE 47 HE1 PHE 47 2.834 -2.012 -1.314
354 HE2 PHE 47 HE2 PHE 47 -1.392 -1.987 -0.741
355 HZ PHE 47 HZ PHE 47 0.885 -2.048 0.194
356 HB2 PHE 47 2HB PHE 47 0.601 -0.886 -5.483
357 HB3 PHE 47 1HB PHE 47 -0.900 -1.785 -5.326
358 H GLU 48 H GLU 48 1.575 -1.912 -8.153
359 HA GLU 48 HA GLU 48 -0.837 -2.059 -9.601
360 HB2 GLU 48 2HB GLU 48 1.985 -1.614 -10.546
361 HB3 GLU 48 1HB GLU 48 0.615 -1.626 -11.649
362 HG2 GLU 48 2HG GLU 48 -0.411 0.157 -10.149
363 HG3 GLU 48 1HG GLU 48 1.178 0.290 -9.404
364 HA PRO 49 HA PRO 49 1.163 -6.260 -11.569
365 HB2 PRO 49 2HB PRO 49 1.685 -7.130 -8.738
366 HB3 PRO 49 1HB PRO 49 2.429 -7.696 -10.241
367 HG2 PRO 49 2HG PRO 49 3.716 -5.967 -8.694
368 HG3 PRO 49 1HG PRO 49 3.753 -5.792 -10.460
369 HD2 PRO 49 2HD PRO 49 2.275 -4.187 -8.430
370 HD3 PRO 49 1HD PRO 49 2.929 -3.696 -10.004
371 H PHE 50 H PHE 50 -0.635 -5.537 -8.611
372 HA PHE 50 HA PHE 50 -2.536 -7.686 -8.964
373 HD1 PHE 50 HD2 PHE 50 -0.278 -5.716 -6.414
374 HD2 PHE 50 HD1 PHE 50 -3.401 -8.598 -6.081
375 HE1 PHE 50 HE2 PHE 50 1.064 -6.984 -4.789
376 HE2 PHE 50 HE1 PHE 50 -2.061 -9.865 -4.457
377 HZ PHE 50 HZ PHE 50 0.173 -9.061 -3.806
378 HB2 PHE 50 2HB PHE 50 -2.583 -5.236 -7.181
379 HB3 PHE 50 1HB PHE 50 -3.807 -6.501 -7.154
380 H GLY 51 H GLY 51 -2.592 -4.151 -9.422
381 HA2 GLY 51 2HA GLY 51 -4.441 -4.407 -11.635
382 HA3 GLY 51 1HA GLY 51 -5.154 -3.670 -10.210
383 H ARG 52 H ARG 52 -4.767 -1.539 -9.791
384 HA ARG 52 HA ARG 52 -2.563 -0.088 -10.920
385 HE ARG 52 HE ARG 52 -3.044 3.674 -14.434
386 HB2 ARG 52 2HB ARG 52 -4.015 -0.315 -12.912
387 HB3 ARG 52 1HB ARG 52 -5.331 0.453 -12.036
388 HG2 ARG 52 2HG ARG 52 -4.003 2.518 -11.871
389 HG3 ARG 52 1HG ARG 52 -2.697 1.741 -12.772
390 HD2 ARG 52 2HD ARG 52 -4.191 1.442 -14.682
391 HD3 ARG 52 1HD ARG 52 -5.508 2.194 -13.787
392 HH11 ARG 52 1HH1 ARG 52 -6.478 3.397 -14.426
393 HH12 ARG 52 2HH1 ARG 52 -6.716 4.954 -15.135
394 HH21 ARG 52 1HH2 ARG 52 -3.356 5.660 -15.367
395 HH22 ARG 52 2HH2 ARG 52 -4.963 6.226 -15.657
396 H ILE 53 H ILE 53 -2.337 1.982 -10.022
397 HA ILE 53 HA ILE 53 -4.204 2.579 -7.810
398 HB ILE 53 HB ILE 53 -1.278 3.312 -8.100
399 HG12 ILE 53 2HG1 ILE 53 -1.150 2.017 -5.887
400 HG13 ILE 53 1HG1 ILE 53 -2.765 1.424 -6.255
401 HG21 ILE 53 1HG2 ILE 53 -2.442 5.173 -7.089
402 HG22 ILE 53 2HG2 ILE 53 -1.487 4.338 -5.865
403 HG23 ILE 53 3HG2 ILE 53 -3.232 4.095 -5.938
404 HD11 ILE 53 3HD1 ILE 53 -1.092 -0.193 -6.878
405 HD12 ILE 53 1HD1 ILE 53 -0.282 0.994 -7.900
406 HD13 ILE 53 2HD1 ILE 53 -1.897 0.422 -8.321
407 H GLU 54 H GLU 54 -5.315 4.448 -7.804
408 HA GLU 54 HA GLU 54 -5.091 6.259 -10.044
409 HB2 GLU 54 2HB GLU 54 -6.889 6.243 -7.610
410 HB3 GLU 54 1HB GLU 54 -6.984 7.457 -8.880
411 HG2 GLU 54 2HG GLU 54 -7.351 4.491 -9.312
412 HG3 GLU 54 1HG GLU 54 -8.664 5.646 -9.096
413 H SER 55 H SER 55 -4.693 6.574 -6.505
414 HA SER 55 HA SER 55 -2.656 8.609 -6.925
415 HG SER 55 HG SER 55 -6.123 9.775 -5.191
416 HB2 SER 55 2HB SER 55 -3.707 10.253 -5.423
417 HB3 SER 55 1HB SER 55 -4.729 9.940 -6.825
418 H ILE 56 H ILE 56 -1.184 8.768 -5.277
419 HA ILE 56 HA ILE 56 -1.563 6.958 -2.964
420 HB ILE 56 HB ILE 56 1.043 7.809 -4.256
421 HG12 ILE 56 2HG1 ILE 56 -0.378 5.130 -4.281
422 HG13 ILE 56 1HG1 ILE 56 -0.246 6.233 -5.645
423 HG21 ILE 56 1HG2 ILE 56 2.101 6.189 -2.752
424 HG22 ILE 56 2HG2 ILE 56 0.541 5.855 -2.001
425 HG23 ILE 56 3HG2 ILE 56 1.273 7.452 -1.842
426 HD11 ILE 56 3HD1 ILE 56 2.191 5.934 -5.622
427 HD12 ILE 56 1HD1 ILE 56 1.322 4.420 -5.868
428 HD13 ILE 56 2HD1 ILE 56 2.021 4.788 -4.291
429 H GLN 57 H GLN 57 -1.936 8.046 -1.135
430 HA GLN 57 HA GLN 57 -0.724 10.719 -0.760
431 HB2 GLN 57 2HB GLN 57 -3.159 9.521 0.592
432 HB3 GLN 57 1HB GLN 57 -2.535 11.147 0.852
433 HG2 GLN 57 2HG GLN 57 -3.587 10.083 -1.766
434 HG3 GLN 57 1HG GLN 57 -4.489 11.096 -0.640
435 HE21 GLN 57 1HE2 GLN 57 -3.649 11.551 -3.443
436 HE22 GLN 57 2HE2 GLN 57 -2.776 13.037 -3.422
437 H LEU 58 H LEU 58 1.129 10.492 0.384
438 HA LEU 58 HA LEU 58 1.276 8.455 2.501
439 HG LEU 58 HG LEU 58 2.752 8.540 -0.391
440 HB2 LEU 58 2HB LEU 58 3.468 10.146 1.278
441 HB3 LEU 58 1HB LEU 58 3.700 8.870 2.460
442 HD11 LEU 58 1HD1 LEU 58 5.277 7.642 1.003
443 HD12 LEU 58 2HD1 LEU 58 5.145 8.941 -0.184
444 HD13 LEU 58 3HD1 LEU 58 4.831 7.273 -0.664
445 HD21 LEU 58 3HD2 LEU 58 3.092 6.454 1.770
446 HD22 LEU 58 1HD2 LEU 58 2.771 6.121 0.067
447 HD23 LEU 58 2HD2 LEU 58 1.570 6.968 1.041
448 H MET 59 H MET 59 1.855 8.952 4.625
449 HA MET 59 HA MET 59 1.328 11.717 5.433
450 HB2 MET 59 2HB MET 59 1.735 9.323 7.237
451 HB3 MET 59 1HB MET 59 1.004 10.866 7.655
452 HG2 MET 59 2HG MET 59 -0.136 8.764 5.823
453 HG3 MET 59 1HG MET 59 -0.708 9.192 7.431
454 HE1 MET 59 3HE MET 59 -2.038 12.862 6.771
455 HE2 MET 59 1HE MET 59 -0.401 12.423 7.251
456 HE3 MET 59 2HE MET 59 -1.783 11.618 7.995
457 H MET 60 H MET 60 3.039 13.029 5.540
458 HA MET 60 HA MET 60 5.599 11.945 6.519
459 HB2 MET 60 2HB MET 60 6.747 13.425 4.845
460 HB3 MET 60 1HB MET 60 5.861 12.075 4.152
461 HG2 MET 60 2HG MET 60 4.014 13.589 3.592
462 HG3 MET 60 1HG MET 60 4.931 14.938 4.265
463 HE1 MET 60 3HE MET 60 4.483 16.149 1.843
464 HE2 MET 60 1HE MET 60 3.682 14.684 1.270
465 HE3 MET 60 2HE MET 60 4.969 15.416 0.315
466 H ASP 61 H ASP 61 6.849 13.273 7.784
467 HA ASP 61 HA ASP 61 5.582 15.357 9.209
468 HB2 ASP 61 2HB ASP 61 8.529 14.658 9.066
469 HB3 ASP 61 1HB ASP 61 7.774 15.679 10.287
470 H SER 62 H SER 62 4.920 16.893 7.594
471 HA SER 62 HA SER 62 6.646 18.271 5.858
472 HG SER 62 HG SER 62 4.243 20.512 5.058
473 HB2 SER 62 2HB SER 62 4.200 18.479 5.716
474 HB3 SER 62 1HB SER 62 4.169 19.325 7.263
475 H GLU 63 H GLU 63 6.527 18.279 9.230
476 HA GLU 63 HA GLU 63 7.427 20.833 9.939
477 HB2 GLU 63 2HB GLU 63 6.614 19.088 11.519
478 HB3 GLU 63 1HB GLU 63 8.095 18.181 11.247
479 HG2 GLU 63 2HG GLU 63 8.398 19.309 13.284
480 HG3 GLU 63 1HG GLU 63 9.350 20.201 12.099
481 H THR 64 H THR 64 9.226 17.956 8.899
482 HA THR 64 HA THR 64 11.652 19.623 8.634
483 HB THR 64 HB THR 64 11.875 18.264 10.670
484 HG1 THR 64 HG1 THR 64 13.820 16.975 9.732
485 HG21 THR 64 3HG2 THR 64 11.601 15.889 8.817
486 HG22 THR 64 1HG2 THR 64 10.443 16.379 10.057
487 HG23 THR 64 2HG2 THR 64 12.049 15.815 10.521
488 H GLY 65 H GLY 65 9.495 17.560 7.114
489 HA2 GLY 65 2HA GLY 65 9.458 16.947 4.874
490 HA3 GLY 65 1HA GLY 65 11.135 17.447 4.730
491 H ARG 66 H ARG 66 9.434 14.982 6.703
492 HA ARG 66 HA ARG 66 11.061 12.892 5.399
493 HE ARG 66 HE ARG 66 14.694 14.790 9.186
494 HB2 ARG 66 2HB ARG 66 10.696 13.143 8.396
495 HB3 ARG 66 1HB ARG 66 11.478 11.801 7.575
496 HG2 ARG 66 2HG ARG 66 13.188 13.384 6.712
497 HG3 ARG 66 1HG ARG 66 12.436 14.654 7.680
498 HD2 ARG 66 2HD ARG 66 12.857 13.352 9.712
499 HD3 ARG 66 1HD ARG 66 13.612 12.084 8.745
500 HH11 ARG 66 1HH1 ARG 66 15.127 11.540 8.119
501 HH12 ARG 66 2HH1 ARG 66 16.852 11.663 8.129
502 HH21 ARG 66 1HH2 ARG 66 16.895 14.926 9.175
503 HH22 ARG 66 2HH2 ARG 66 17.838 13.542 8.731
504 H SER 67 H SER 67 10.191 10.668 5.765
505 HA SER 67 HA SER 67 7.285 10.682 5.644
506 HG SER 67 HG SER 67 7.944 8.940 3.105
507 HB2 SER 67 2HB SER 67 9.252 8.388 5.338
508 HB3 SER 67 1HB SER 67 7.516 8.279 5.047
509 H LYS 68 H LYS 68 5.920 10.122 7.269
510 HA LYS 68 HA LYS 68 6.962 9.662 9.886
511 HB2 LYS 68 2HB LYS 68 4.091 9.414 8.955
512 HB3 LYS 68 1HB LYS 68 4.637 9.559 10.622
513 HG2 LYS 68 2HG LYS 68 5.594 11.801 10.017
514 HG3 LYS 68 1HG LYS 68 4.800 11.644 8.450
515 HD2 LYS 68 2HD LYS 68 3.365 12.950 9.835
516 HD3 LYS 68 1HD LYS 68 2.627 11.354 9.692
517 HE2 LYS 68 2HE LYS 68 2.472 12.074 11.982
518 HE3 LYS 68 1HE LYS 68 3.630 10.750 11.885
519 HZ1 LYS 68 3HZ LYS 68 4.475 12.487 13.292
520 HZ2 LYS 68 1HZ LYS 68 4.284 13.642 12.074
521 HZ3 LYS 68 2HZ LYS 68 5.423 12.408 11.896
522 H GLY 69 H GLY 69 5.634 7.531 7.418
523 HA2 GLY 69 2HA GLY 69 6.769 5.253 7.714
524 HA3 GLY 69 1HA GLY 69 5.967 5.249 9.273
525 H TYR 70 H TYR 70 3.653 6.673 7.632
526 HA TYR 70 HA TYR 70 2.576 4.236 6.393
527 HD1 TYR 70 HD2 TYR 70 0.028 7.303 8.152
528 HD2 TYR 70 HD1 TYR 70 2.750 4.865 10.344
529 HE1 TYR 70 HE2 TYR 70 0.094 8.985 9.944
530 HE2 TYR 70 HE1 TYR 70 2.817 6.542 12.132
531 HH TYR 70 HH TYR 70 2.404 8.864 12.489
532 HB2 TYR 70 2HB TYR 70 0.347 4.886 7.616
533 HB3 TYR 70 1HB TYR 70 1.579 3.958 8.460
534 H GLY 71 H GLY 71 0.914 4.528 4.872
535 HA2 GLY 71 2HA GLY 71 0.029 7.233 4.216
536 HA3 GLY 71 1HA GLY 71 0.984 6.407 2.994
537 H PHE 72 H PHE 72 -1.703 7.302 2.649
538 HA PHE 72 HA PHE 72 -3.266 4.814 2.541
539 HD1 PHE 72 HD2 PHE 72 -3.177 8.388 4.311
540 HD2 PHE 72 HD1 PHE 72 -5.980 5.194 3.996
541 HE1 PHE 72 HE2 PHE 72 -3.610 8.533 6.728
542 HE2 PHE 72 HE1 PHE 72 -6.417 5.337 6.413
543 HZ PHE 72 HZ PHE 72 -5.235 7.006 7.780
544 HB2 PHE 72 2HB PHE 72 -4.099 7.699 2.141
545 HB3 PHE 72 1HB PHE 72 -5.184 6.317 2.027
546 H ILE 73 H ILE 73 -3.470 3.748 0.672
547 HA ILE 73 HA ILE 73 -2.817 5.131 -1.860
548 HB ILE 73 HB ILE 73 -2.625 2.184 -1.186
549 HG12 ILE 73 2HG1 ILE 73 -0.461 4.237 -1.745
550 HG13 ILE 73 1HG1 ILE 73 -0.866 3.595 -0.160
551 HG21 ILE 73 1HG2 ILE 73 -1.931 3.631 -3.748
552 HG22 ILE 73 2HG2 ILE 73 -3.263 2.496 -3.517
553 HG23 ILE 73 3HG2 ILE 73 -1.595 1.934 -3.408
554 HD11 ILE 73 3HD1 ILE 73 0.262 2.044 -2.481
555 HD12 ILE 73 1HD1 ILE 73 -0.197 1.354 -0.924
556 HD13 ILE 73 2HD1 ILE 73 1.117 2.525 -1.017
557 H THR 74 H THR 74 -4.420 5.425 -3.278
558 HA THR 74 HA THR 74 -7.003 4.118 -2.750
559 HB THR 74 HB THR 74 -6.359 6.605 -4.354
560 HG1 THR 74 HG1 THR 74 -8.108 6.948 -2.342
561 HG21 THR 74 3HG2 THR 74 -8.268 5.438 -5.367
562 HG22 THR 74 1HG2 THR 74 -8.794 6.911 -4.553
563 HG23 THR 74 2HG2 THR 74 -9.057 5.343 -3.791
564 H PHE 75 H PHE 75 -7.582 2.453 -3.941
565 HA PHE 75 HA PHE 75 -6.639 2.158 -6.713
566 HD1 PHE 75 HD1 PHE 75 -5.887 0.801 -3.373
567 HD2 PHE 75 HD2 PHE 75 -5.679 -1.062 -7.198
568 HE1 PHE 75 HE1 PHE 75 -3.636 -0.034 -2.844
569 HE2 PHE 75 HE2 PHE 75 -3.428 -1.895 -6.673
570 HZ PHE 75 HZ PHE 75 -2.409 -1.384 -4.492
571 HB2 PHE 75 2HB PHE 75 -7.949 0.228 -4.789
572 HB3 PHE 75 1HB PHE 75 -7.692 -0.149 -6.487
573 H SER 76 H SER 76 -8.093 1.802 -8.435
574 HA SER 76 HA SER 76 -10.704 3.016 -8.196
575 HG SER 76 HG SER 76 -11.325 3.451 -11.090
576 HB2 SER 76 2HB SER 76 -9.404 3.350 -10.246
577 HB3 SER 76 1HB SER 76 -9.374 1.609 -10.535
578 H ASP 77 H ASP 77 -9.411 -0.237 -8.287
579 HA ASP 77 HA ASP 77 -12.136 -1.367 -8.362
580 HB2 ASP 77 2HB ASP 77 -10.413 -2.118 -10.061
581 HB3 ASP 77 1HB ASP 77 -9.525 -2.853 -8.729
582 H SER 78 H SER 78 -12.989 -1.898 -6.450
583 HA SER 78 HA SER 78 -11.646 -1.924 -3.996
584 HG SER 78 HG SER 78 -15.297 -3.057 -5.107
585 HB2 SER 78 2HB SER 78 -13.700 -2.914 -3.064
586 HB3 SER 78 1HB SER 78 -14.077 -1.610 -4.191
587 H GLU 79 H GLU 79 -12.810 -4.719 -5.885
588 HA GLU 79 HA GLU 79 -11.954 -6.747 -4.183
589 HB2 GLU 79 2HB GLU 79 -13.444 -7.053 -6.147
590 HB3 GLU 79 1HB GLU 79 -12.064 -6.837 -7.210
591 HG2 GLU 79 2HG GLU 79 -12.530 -9.169 -7.050
592 HG3 GLU 79 1HG GLU 79 -11.026 -8.855 -6.185
593 H CYS 80 H CYS 80 -10.178 -5.182 -6.829
594 HA CYS 80 HA CYS 80 -7.819 -6.718 -6.663
595 HG CYS 80 HG CYS 80 -5.788 -5.646 -9.048
596 HB2 CYS 80 2HB CYS 80 -8.306 -5.281 -8.586
597 HB3 CYS 80 1HB CYS 80 -8.172 -3.850 -7.569
598 H ALA 81 H ALA 81 -8.696 -3.621 -5.129
599 HA ALA 81 HA ALA 81 -6.307 -3.192 -3.706
600 HB1 ALA 81 3HB ALA 81 -7.596 -1.675 -2.312
601 HB2 ALA 81 1HB ALA 81 -9.103 -2.388 -2.891
602 HB3 ALA 81 2HB ALA 81 -8.069 -1.489 -4.001
603 H LYS 82 H LYS 82 -9.272 -4.902 -2.776
604 HA LYS 82 HA LYS 82 -8.536 -5.622 -0.161
605 HB2 LYS 82 2HB LYS 82 -10.831 -5.765 -1.053
606 HB3 LYS 82 1HB LYS 82 -10.336 -7.075 -2.114
607 HG2 LYS 82 2HG LYS 82 -9.826 -8.456 -0.132
608 HG3 LYS 82 1HG LYS 82 -10.398 -7.143 0.903
609 HD2 LYS 82 2HD LYS 82 -12.146 -8.832 0.578
610 HD3 LYS 82 1HD LYS 82 -12.616 -7.289 -0.139
611 HE2 LYS 82 2HE LYS 82 -11.799 -8.159 -2.342
612 HE3 LYS 82 1HE LYS 82 -11.563 -9.727 -1.575
613 HZ1 LYS 82 3HZ LYS 82 -13.919 -9.801 -1.086
614 HZ2 LYS 82 1HZ LYS 82 -13.666 -9.598 -2.746
615 HZ3 LYS 82 2HZ LYS 82 -14.145 -8.284 -1.797
616 H LYS 83 H LYS 83 -7.987 -7.211 -3.275
617 HA LYS 83 HA LYS 83 -6.770 -9.566 -2.288
618 HB2 LYS 83 2HB LYS 83 -7.595 -9.391 -4.581
619 HB3 LYS 83 1HB LYS 83 -6.395 -8.156 -4.942
620 HG2 LYS 83 2HG LYS 83 -4.604 -9.794 -4.590
621 HG3 LYS 83 1HG LYS 83 -5.809 -11.029 -4.219
622 HD2 LYS 83 2HD LYS 83 -5.558 -9.552 -6.849
623 HD3 LYS 83 1HD LYS 83 -4.990 -11.193 -6.537
624 HE2 LYS 83 2HE LYS 83 -7.858 -10.250 -6.394
625 HE3 LYS 83 1HE LYS 83 -7.148 -11.206 -7.693
626 HZ1 LYS 83 3HZ LYS 83 -8.382 -12.586 -6.146
627 HZ2 LYS 83 1HZ LYS 83 -7.411 -12.069 -4.863
628 HZ3 LYS 83 2HZ LYS 83 -6.740 -12.987 -6.113
629 H ALA 84 H ALA 84 -5.349 -6.494 -3.425
630 HA ALA 84 HA ALA 84 -2.656 -7.081 -2.983
631 HB1 ALA 84 3HB ALA 84 -4.031 -4.405 -2.655
632 HB2 ALA 84 1HB ALA 84 -3.420 -5.072 -4.170
633 HB3 ALA 84 2HB ALA 84 -2.299 -4.661 -2.872
634 H LEU 85 H LEU 85 -5.004 -5.583 -0.755
635 HA LEU 85 HA LEU 85 -3.429 -5.419 1.537
636 HG LEU 85 HG LEU 85 -4.855 -5.043 3.691
637 HB2 LEU 85 2HB LEU 85 -5.675 -4.439 1.293
638 HB3 LEU 85 1HB LEU 85 -6.387 -6.037 1.281
639 HD11 LEU 85 1HD1 LEU 85 -6.959 -4.275 4.648
640 HD12 LEU 85 2HD1 LEU 85 -7.796 -4.635 3.138
641 HD13 LEU 85 3HD1 LEU 85 -6.566 -3.370 3.186
642 HD21 LEU 85 3HD2 LEU 85 -6.302 -6.632 4.883
643 HD22 LEU 85 1HD2 LEU 85 -5.372 -7.441 3.623
644 HD23 LEU 85 2HD2 LEU 85 -7.077 -7.076 3.363
645 H GLU 86 H GLU 86 -5.445 -8.099 0.396
646 HA GLU 86 HA GLU 86 -5.155 -9.758 2.637
647 HB2 GLU 86 2HB GLU 86 -6.935 -9.879 0.910
648 HB3 GLU 86 1HB GLU 86 -5.768 -10.558 -0.213
649 HG2 GLU 86 2HG GLU 86 -5.513 -12.515 1.185
650 HG3 GLU 86 1HG GLU 86 -6.583 -11.819 2.401
651 H GLN 87 H GLN 87 -3.128 -9.447 -0.237
652 HA GLN 87 HA GLN 87 -1.552 -11.798 0.522
653 HB2 GLN 87 2HB GLN 87 -1.462 -10.007 -1.911
654 HB3 GLN 87 1HB GLN 87 -0.310 -11.305 -1.625
655 HG2 GLN 87 2HG GLN 87 -2.170 -12.921 -1.599
656 HG3 GLN 87 1HG GLN 87 -3.292 -11.609 -1.954
657 HE21 GLN 87 1HE2 GLN 87 -3.922 -12.612 -3.887
658 HE22 GLN 87 2HE2 GLN 87 -2.909 -12.614 -5.286
659 H LEU 88 H LEU 88 -1.215 -8.283 0.383
660 HA LEU 88 HA LEU 88 1.660 -8.428 0.810
661 HG LEU 88 HG LEU 88 -0.006 -7.348 -1.581
662 HB2 LEU 88 2HB LEU 88 -0.167 -6.046 0.508
663 HB3 LEU 88 1HB LEU 88 1.585 -5.971 0.596
664 HD11 LEU 88 1HD1 LEU 88 -0.200 -4.941 -1.730
665 HD12 LEU 88 2HD1 LEU 88 0.818 -5.559 -3.029
666 HD13 LEU 88 3HD1 LEU 88 1.553 -4.770 -1.632
667 HD21 LEU 88 3HD2 LEU 88 2.109 -8.477 -1.206
668 HD22 LEU 88 1HD2 LEU 88 2.974 -6.941 -1.293
669 HD23 LEU 88 2HD2 LEU 88 2.160 -7.581 -2.722
670 H ASN 89 H ASN 89 -1.165 -7.973 2.791
671 HA ASN 89 HA ASN 89 0.072 -6.576 4.918
672 HB2 ASN 89 2HB ASN 89 -2.401 -6.887 4.701
673 HB3 ASN 89 1HB ASN 89 -2.195 -8.573 5.164
674 HD21 ASN 89 1HD2 ASN 89 -3.621 -6.304 6.454
675 HD22 ASN 89 2HD2 ASN 89 -3.000 -6.245 8.065
676 H GLY 90 H GLY 90 1.899 -7.239 5.809
677 HA2 GLY 90 2HA GLY 90 2.893 -8.710 7.484
678 HA3 GLY 90 1HA GLY 90 2.150 -10.067 6.656
679 H PHE 91 H PHE 91 3.110 -8.326 4.154
680 HA PHE 91 HA PHE 91 5.371 -9.942 3.543
681 HD1 PHE 91 HD2 PHE 91 6.045 -10.491 1.011
682 HD2 PHE 91 HD1 PHE 91 5.811 -6.236 1.109
683 HE1 PHE 91 HE2 PHE 91 7.890 -10.352 -0.608
684 HE2 PHE 91 HE1 PHE 91 7.658 -6.097 -0.514
685 HZ PHE 91 HZ PHE 91 8.698 -8.158 -1.373
686 HB2 PHE 91 2HB PHE 91 3.941 -9.173 1.771
687 HB3 PHE 91 1HB PHE 91 4.191 -7.492 2.220
688 H GLU 92 H GLU 92 7.501 -9.617 3.898
689 HA GLU 92 HA GLU 92 8.374 -7.127 5.142
690 HB2 GLU 92 2HB GLU 92 10.600 -8.328 5.321
691 HB3 GLU 92 1HB GLU 92 9.269 -9.025 6.225
692 HG2 GLU 92 2HG GLU 92 8.989 -10.756 4.547
693 HG3 GLU 92 1HG GLU 92 10.240 -10.019 3.548
694 H LEU 93 H LEU 93 8.647 -5.509 3.725
695 HA LEU 93 HA LEU 93 9.894 -5.982 1.137
696 HG LEU 93 HG LEU 93 10.581 -2.842 0.828
697 HB2 LEU 93 2HB LEU 93 8.037 -4.448 1.188
698 HB3 LEU 93 1HB LEU 93 8.807 -3.482 2.434
699 HD11 LEU 93 1HD1 LEU 93 10.282 -3.320 -1.562
700 HD12 LEU 93 2HD1 LEU 93 8.913 -4.365 -1.178
701 HD13 LEU 93 3HD1 LEU 93 10.532 -4.791 -0.623
702 HD21 LEU 93 3HD2 LEU 93 9.201 -1.353 -0.552
703 HD22 LEU 93 1HD2 LEU 93 8.646 -1.388 1.121
704 HD23 LEU 93 2HD2 LEU 93 7.766 -2.282 -0.119
705 H ALA 94 H ALA 94 10.520 -3.536 3.638
706 HA ALA 94 HA ALA 94 13.362 -3.532 2.904
707 HB1 ALA 94 3HB ALA 94 11.762 -1.582 4.576
708 HB2 ALA 94 1HB ALA 94 12.200 -1.382 2.878
709 HB3 ALA 94 2HB ALA 94 13.455 -1.399 4.117
710 H GLY 95 H GLY 95 12.701 -5.811 4.307
711 HA2 GLY 95 2HA GLY 95 13.377 -7.045 6.141
712 HA3 GLY 95 1HA GLY 95 14.350 -5.668 6.635
713 H ARG 96 H ARG 96 10.941 -5.402 6.102
714 HA ARG 96 HA ARG 96 10.241 -5.510 8.915
715 HE ARG 96 HE ARG 96 7.162 -1.302 9.831
716 HB2 ARG 96 2HB ARG 96 11.086 -3.266 8.810
717 HB3 ARG 96 1HB ARG 96 10.240 -2.946 7.303
718 HG2 ARG 96 2HG ARG 96 8.100 -3.025 8.472
719 HG3 ARG 96 1HG ARG 96 8.930 -3.399 9.985
720 HD2 ARG 96 2HD ARG 96 9.991 -1.260 10.023
721 HD3 ARG 96 1HD ARG 96 9.464 -0.898 8.379
722 HH11 ARG 96 1HH1 ARG 96 9.860 0.834 10.076
723 HH12 ARG 96 2HH1 ARG 96 8.905 2.136 10.700
724 HH21 ARG 96 1HH2 ARG 96 5.971 0.363 10.648
725 HH22 ARG 96 2HH2 ARG 96 6.738 1.857 11.057
726 HA PRO 97 HA PRO 97 6.526 -7.161 7.060
727 HB2 PRO 97 2HB PRO 97 5.260 -6.089 9.548
728 HB3 PRO 97 1HB PRO 97 5.165 -7.707 8.840
729 HG2 PRO 97 2HG PRO 97 6.693 -7.275 10.965
730 HG3 PRO 97 1HG PRO 97 7.263 -8.328 9.653
731 HD2 PRO 97 2HD PRO 97 8.028 -5.495 10.283
732 HD3 PRO 97 1HD PRO 97 9.045 -6.841 9.725
733 H MET 98 H MET 98 4.672 -6.494 6.026
734 HA MET 98 HA MET 98 4.352 -3.601 5.670
735 HB2 MET 98 2HB MET 98 4.718 -5.096 3.701
736 HB3 MET 98 1HB MET 98 3.200 -5.901 4.068
737 HG2 MET 98 2HG MET 98 2.649 -4.411 2.377
738 HG3 MET 98 1HG MET 98 2.139 -3.575 3.843
739 HE1 MET 98 3HE MET 98 5.771 -4.077 2.339
740 HE2 MET 98 1HE MET 98 5.913 -2.598 1.388
741 HE3 MET 98 2HE MET 98 4.711 -3.814 0.954
742 H LYS 99 H LYS 99 2.879 -2.734 7.065
743 HA LYS 99 HA LYS 99 0.558 -4.287 7.905
744 HB2 LYS 99 2HB LYS 99 1.605 -1.566 8.709
745 HB3 LYS 99 1HB LYS 99 0.084 -2.215 9.310
746 HG2 LYS 99 2HG LYS 99 2.815 -3.440 9.702
747 HG3 LYS 99 1HG LYS 99 1.873 -2.567 10.915
748 HD2 LYS 99 2HD LYS 99 0.110 -4.269 10.770
749 HD3 LYS 99 1HD LYS 99 1.051 -5.146 9.562
750 HE2 LYS 99 2HE LYS 99 2.850 -5.452 11.226
751 HE3 LYS 99 1HE LYS 99 1.859 -4.624 12.427
752 HZ1 LYS 99 3HZ LYS 99 0.174 -6.364 12.134
753 HZ2 LYS 99 1HZ LYS 99 1.648 -6.986 12.682
754 HZ3 LYS 99 2HZ LYS 99 1.203 -7.178 11.066
755 H VAL 100 H VAL 100 -0.930 -4.419 6.300
756 HA VAL 100 HA VAL 100 -1.881 -1.887 5.110
757 HB VAL 100 HB VAL 100 -1.987 -4.652 3.868
758 HG11 VAL 100 1HG1 VAL 100 -2.810 -1.959 2.745
759 HG12 VAL 100 2HG1 VAL 100 -3.896 -3.272 3.202
760 HG13 VAL 100 3HG1 VAL 100 -2.783 -3.479 1.850
761 HG21 VAL 100 3HG2 VAL 100 -0.277 -2.262 3.158
762 HG22 VAL 100 1HG2 VAL 100 -0.354 -3.778 2.259
763 HG23 VAL 100 2HG2 VAL 100 0.284 -3.759 3.904
764 H GLY 101 H GLY 101 -3.693 -1.312 6.181
765 HA2 GLY 101 2HA GLY 101 -5.792 -3.385 6.559
766 HA3 GLY 101 1HA GLY 101 -5.542 -2.057 7.679
767 H HIS 102 H HIS 102 -8.022 -2.698 6.347
768 HA HIS 102 HA HIS 102 -8.319 -0.812 4.166
769 HD1 HIS 102 HD1 HIS 102 -11.610 -1.286 6.773
770 HD2 HIS 102 HD2 HIS 102 -10.067 -4.955 5.575
771 HE1 HIS 102 HE1 HIS 102 -12.526 -2.961 8.393
772 HE2 HIS 102 HE2 HIS 102 -11.712 -5.188 7.558
773 HB2 HIS 102 2HB HIS 102 -10.710 -1.530 4.162
774 HB3 HIS 102 1HB HIS 102 -9.562 -2.843 3.958
775 H VAL 103 H VAL 103 -7.487 0.567 6.353
776 HA VAL 103 HA VAL 103 -7.819 2.502 7.468
777 HB VAL 103 HB VAL 103 -10.158 2.830 5.578
778 HG11 VAL 103 1HG1 VAL 103 -8.613 4.918 7.130
779 HG12 VAL 103 2HG1 VAL 103 -10.262 4.392 7.470
780 HG13 VAL 103 3HG1 VAL 103 -9.900 5.231 5.963
781 HG21 VAL 103 3HG2 VAL 103 -8.084 2.418 4.372
782 HG22 VAL 103 1HG2 VAL 103 -7.269 3.679 5.297
783 HG23 VAL 103 2HG2 VAL 103 -8.571 4.103 4.186
784 H THR 104 H THR 104 -11.277 1.800 6.889
785 HA THR 104 HA THR 104 -11.827 2.546 9.651
786 HB THR 104 HB THR 104 -13.262 3.572 8.032
787 HG1 THR 104 HG1 THR 104 -15.204 3.065 8.975
788 HG21 THR 104 3HG2 THR 104 -14.055 0.790 7.137
789 HG22 THR 104 1HG2 THR 104 -13.058 1.920 6.220
790 HG23 THR 104 2HG2 THR 104 -14.748 2.303 6.552
791 H GLU 105 H GLU 105 -12.266 1.196 11.253
792 HA GLU 105 HA GLU 105 -13.544 -1.387 10.719
793 HB2 GLU 105 2HB GLU 105 -11.054 -1.065 12.419
794 HB3 GLU 105 1HB GLU 105 -12.050 -2.512 12.383
795 HG2 GLU 105 2HG GLU 105 -11.569 -2.588 9.885
796 HG3 GLU 105 1HG GLU 105 -10.326 -1.379 10.197
797 H ARG 106 H ARG 106 -12.376 0.814 13.266
798 HA ARG 106 HA ARG 106 -14.896 0.389 14.741
799 HE ARG 106 HE ARG 106 -11.531 1.201 18.540
800 HB2 ARG 106 2HB ARG 106 -13.573 0.480 16.864
801 HB3 ARG 106 1HB ARG 106 -13.253 -0.944 15.885
802 HG2 ARG 106 2HG ARG 106 -11.191 0.106 15.048
803 HG3 ARG 106 1HG ARG 106 -11.509 1.511 16.067
804 HD2 ARG 106 2HD ARG 106 -11.115 -1.310 17.074
805 HD3 ARG 106 1HD ARG 106 -9.878 -0.055 17.072
806 HH11 ARG 106 1HH1 ARG 106 -11.352 -2.245 18.504
807 HH12 ARG 106 2HH1 ARG 106 -11.819 -2.381 20.166
808 HH21 ARG 106 1HH2 ARG 106 -12.115 1.004 20.659
809 HH22 ARG 106 2HH2 ARG 106 -12.232 -0.571 21.370
810 H THR 107 H THR 107 -14.663 2.488 13.070
811 HA THR 107 HA THR 107 -13.429 4.828 13.930
812 HB THR 107 HB THR 107 -15.169 6.042 12.574
813 HG1 THR 107 HG1 THR 107 -16.751 4.850 11.542
814 HG21 THR 107 3HG2 THR 107 -13.886 3.634 11.263
815 HG22 THR 107 1HG2 THR 107 -13.123 5.204 11.523
816 HG23 THR 107 2HG2 THR 107 -14.493 5.060 10.421
817 H ASP 108 H ASP 108 -16.918 4.162 14.269
818 HA ASP 108 HA ASP 108 -17.315 6.308 16.120
819 HB2 ASP 108 2HB ASP 108 -19.057 5.666 14.544
820 HB3 ASP 108 1HB ASP 108 -19.131 4.050 15.231
Start of MODEL 2
1 HA MET 1 HA MET 1 -13.150 24.903 -1.797
2 H1 MET 1 1H MET 1 -12.128 23.677 -4.295
3 H2 MET 1 2H MET 1 -12.432 25.321 -4.055
4 H3 MET 1 3H MET 1 -13.709 24.215 -4.024
5 HB2 MET 1 2HB MET 1 -12.300 22.054 -2.376
6 HB3 MET 1 1HB MET 1 -12.793 22.674 -0.805
7 HG2 MET 1 2HG MET 1 -14.586 21.425 -1.867
8 HG3 MET 1 1HG MET 1 -15.027 23.120 -1.664
9 HE1 MET 1 3HE MET 1 -17.047 22.776 -3.400
10 HE2 MET 1 1HE MET 1 -16.582 21.083 -3.580
11 HE3 MET 1 2HE MET 1 -16.829 22.087 -5.009
12 H GLY 2 H GLY 2 -10.401 23.215 -3.333
13 HA2 GLY 2 2HA GLY 2 -8.136 23.460 -3.071
14 HA3 GLY 2 1HA GLY 2 -8.470 25.042 -2.388
15 H HIS 3 H HIS 3 -9.487 21.891 -1.129
16 HA HIS 3 HA HIS 3 -9.209 20.874 0.885
17 HD1 HIS 3 HD1 HIS 3 -5.715 21.616 -1.379
18 HD2 HIS 3 HD2 HIS 3 -7.156 18.478 0.932
19 HE1 HIS 3 HE1 HIS 3 -5.036 19.526 -2.589
20 HE2 HIS 3 HE2 HIS 3 -6.046 17.653 -1.253
21 HB2 HIS 3 2HB HIS 3 -6.566 22.359 0.896
22 HB3 HIS 3 1HB HIS 3 -7.012 21.104 2.047
23 H HIS 4 H HIS 4 -9.198 21.235 3.254
24 HA HIS 4 HA HIS 4 -9.420 24.045 4.095
25 HD1 HIS 4 HD1 HIS 4 -11.529 21.743 6.993
26 HD2 HIS 4 HD2 HIS 4 -12.353 20.560 3.099
27 HE1 HIS 4 HE1 HIS 4 -12.478 19.430 7.182
28 HE2 HIS 4 HE2 HIS 4 -12.793 18.674 4.810
29 HB2 HIS 4 2HB HIS 4 -11.520 23.682 5.253
30 HB3 HIS 4 1HB HIS 4 -11.720 23.244 3.561
31 H HIS 5 H HIS 5 -7.319 22.220 4.537
32 HA HIS 5 HA HIS 5 -7.604 20.916 7.081
33 HD1 HIS 5 HD1 HIS 5 -3.300 21.228 7.344
34 HD2 HIS 5 HD2 HIS 5 -6.223 18.280 7.494
35 HE1 HIS 5 HE1 HIS 5 -2.479 19.555 9.023
36 HE2 HIS 5 HE2 HIS 5 -4.148 17.671 8.909
37 HB2 HIS 5 2HB HIS 5 -6.076 20.131 5.246
38 HB3 HIS 5 1HB HIS 5 -5.051 21.524 5.568
39 H HIS 6 H HIS 6 -8.396 22.944 8.144
40 HA HIS 6 HA HIS 6 -6.131 24.378 9.378
41 HD1 HIS 6 HD1 HIS 6 -8.530 25.896 5.989
42 HD2 HIS 6 HD2 HIS 6 -4.921 26.576 7.933
43 HE1 HIS 6 HE1 HIS 6 -6.929 26.630 4.202
44 HE2 HIS 6 HE2 HIS 6 -4.813 27.195 5.429
45 HB2 HIS 6 2HB HIS 6 -8.736 25.619 8.445
46 HB3 HIS 6 1HB HIS 6 -7.514 26.453 9.401
47 H HIS 7 H HIS 7 -7.951 22.101 10.118
48 HA HIS 7 HA HIS 7 -8.995 21.208 11.890
49 HD1 HIS 7 HD1 HIS 7 -9.280 24.253 14.666
50 HD2 HIS 7 HD2 HIS 7 -5.415 24.138 13.151
51 HE1 HIS 7 HE1 HIS 7 -8.272 26.472 15.236
52 HE2 HIS 7 HE2 HIS 7 -6.037 26.462 14.092
53 HB2 HIS 7 2HB HIS 7 -8.212 21.778 14.094
54 HB3 HIS 7 1HB HIS 7 -6.861 21.845 12.974
55 H HIS 8 H HIS 8 -10.996 21.161 12.665
56 HA HIS 8 HA HIS 8 -12.216 23.460 13.900
57 HD1 HIS 8 HD1 HIS 8 -15.868 22.184 11.629
58 HD2 HIS 8 HD2 HIS 8 -12.140 21.255 10.037
59 HE1 HIS 8 HE1 HIS 8 -16.279 20.336 9.984
60 HE2 HIS 8 HE2 HIS 8 -14.003 19.711 9.118
61 HB2 HIS 8 2HB HIS 8 -14.101 23.722 12.442
62 HB3 HIS 8 1HB HIS 8 -12.655 23.826 11.445
63 H SER 9 H SER 9 -14.841 22.665 14.037
64 HA SER 9 HA SER 9 -14.853 20.848 16.119
65 HG SER 9 HG SER 9 -17.269 22.810 16.463
66 HB2 SER 9 2HB SER 9 -17.182 21.329 14.241
67 HB3 SER 9 1HB SER 9 -17.268 20.789 15.917
68 H HIS 10 H HIS 10 -14.326 18.759 16.148
69 HA HIS 10 HA HIS 10 -15.028 17.029 13.861
70 HD1 HIS 10 HD1 HIS 10 -11.189 18.158 15.575
71 HD2 HIS 10 HD2 HIS 10 -12.695 16.272 12.199
72 HE1 HIS 10 HE1 HIS 10 -9.629 18.774 13.711
73 HE2 HIS 10 HE2 HIS 10 -10.425 17.418 11.749
74 HB2 HIS 10 2HB HIS 10 -13.056 16.621 16.125
75 HB3 HIS 10 1HB HIS 10 -13.434 15.398 14.917
76 H MET 11 H MET 11 -15.804 14.835 14.376
77 HA MET 11 HA MET 11 -17.101 13.281 15.402
78 HB2 MET 11 2HB MET 11 -16.520 14.840 17.929
79 HB3 MET 11 1HB MET 11 -17.237 13.236 17.866
80 HG2 MET 11 2HG MET 11 -15.221 12.305 16.950
81 HG3 MET 11 1HG MET 11 -14.502 13.908 16.802
82 HE1 MET 11 3HE MET 11 -14.007 14.922 20.555
83 HE2 MET 11 1HE MET 11 -15.427 15.262 19.567
84 HE3 MET 11 2HE MET 11 -13.814 15.414 18.873
85 H ALA 12 H ALA 12 -17.999 16.396 15.004
86 HA ALA 12 HA ALA 12 -20.572 16.321 16.326
87 HB1 ALA 12 3HB ALA 12 -19.466 18.284 14.310
88 HB2 ALA 12 1HB ALA 12 -19.380 18.443 16.064
89 HB3 ALA 12 2HB ALA 12 -20.944 18.488 15.250
90 H ALA 13 H ALA 13 -22.243 15.224 15.541
91 HA ALA 13 HA ALA 13 -23.773 14.274 14.160
92 HB1 ALA 13 3HB ALA 13 -22.622 16.060 12.015
93 HB2 ALA 13 1HB ALA 13 -23.913 16.495 13.133
94 HB3 ALA 13 2HB ALA 13 -24.167 15.213 11.949
95 H ALA 14 H ALA 14 -23.719 12.231 13.470
96 HA ALA 14 HA ALA 14 -21.848 11.414 11.375
97 HB1 ALA 14 3HB ALA 14 -20.624 11.026 13.474
98 HB2 ALA 14 1HB ALA 14 -20.986 9.516 12.635
99 HB3 ALA 14 2HB ALA 14 -21.938 9.995 14.042
100 H MET 15 H MET 15 -24.867 11.638 11.994
101 HA MET 15 HA MET 15 -25.824 8.915 11.936
102 HB2 MET 15 2HB MET 15 -27.365 11.491 11.539
103 HB3 MET 15 1HB MET 15 -28.050 9.909 11.886
104 HG2 MET 15 2HG MET 15 -28.053 11.252 13.883
105 HG3 MET 15 1HG MET 15 -26.914 9.919 14.071
106 HE1 MET 15 3HE MET 15 -26.988 12.526 15.954
107 HE2 MET 15 1HE MET 15 -25.263 12.846 16.121
108 HE3 MET 15 2HE MET 15 -25.862 11.187 16.178
109 H ALA 16 H ALA 16 -26.590 7.771 10.239
110 HA ALA 16 HA ALA 16 -26.907 7.056 8.114
111 HB1 ALA 16 3HB ALA 16 -27.956 8.565 6.505
112 HB2 ALA 16 1HB ALA 16 -27.564 9.949 7.528
113 HB3 ALA 16 2HB ALA 16 -28.701 8.728 8.095
114 H ASN 17 H ASN 17 -24.631 6.555 8.006
115 HA ASN 17 HA ASN 17 -22.831 8.495 6.817
116 HB2 ASN 17 2HB ASN 17 -22.258 5.606 7.504
117 HB3 ASN 17 1HB ASN 17 -21.081 6.885 7.222
118 HD21 ASN 17 1HD2 ASN 17 -20.923 8.575 8.786
119 HD22 ASN 17 2HD2 ASN 17 -21.421 8.305 10.415
120 H ASN 18 H ASN 18 -24.141 8.606 4.795
121 HA ASN 18 HA ASN 18 -23.947 6.394 2.951
122 HB2 ASN 18 2HB ASN 18 -24.865 9.258 2.624
123 HB3 ASN 18 1HB ASN 18 -24.849 8.096 1.298
124 HD21 ASN 18 1HD2 ASN 18 -27.071 8.108 1.040
125 HD22 ASN 18 2HD2 ASN 18 -28.146 7.404 2.194
126 H LEU 19 H LEU 19 -21.415 6.920 3.843
127 HA LEU 19 HA LEU 19 -20.001 8.629 1.996
128 HG LEU 19 HG LEU 19 -20.060 6.318 4.875
129 HB2 LEU 19 2HB LEU 19 -17.960 7.626 3.133
130 HB3 LEU 19 1HB LEU 19 -19.052 8.554 4.139
131 HD11 LEU 19 1HD1 LEU 19 -19.161 4.902 3.107
132 HD12 LEU 19 2HD1 LEU 19 -18.631 4.347 4.693
133 HD13 LEU 19 3HD1 LEU 19 -17.518 5.239 3.657
134 HD21 LEU 19 3HD2 LEU 19 -18.641 7.656 6.322
135 HD22 LEU 19 1HD2 LEU 19 -17.197 6.943 5.599
136 HD23 LEU 19 2HD2 LEU 19 -18.300 5.939 6.540
137 H GLN 20 H GLN 20 -21.104 5.427 1.984
138 HA GLN 20 HA GLN 20 -19.139 4.520 0.033
139 HB2 GLN 20 2HB GLN 20 -20.320 2.319 0.252
140 HB3 GLN 20 1HB GLN 20 -19.622 2.925 1.748
141 HG2 GLN 20 2HG GLN 20 -21.831 3.695 2.472
142 HG3 GLN 20 1HG GLN 20 -22.535 3.088 0.973
143 HE21 GLN 20 1HE2 GLN 20 -22.749 0.861 0.690
144 HE22 GLN 20 2HE2 GLN 20 -22.598 -0.252 2.001
145 H LYS 21 H LYS 21 -19.584 5.497 -1.902
146 HA LYS 21 HA LYS 21 -22.178 5.801 -3.023
147 HB2 LYS 21 2HB LYS 21 -19.493 5.668 -4.427
148 HB3 LYS 21 1HB LYS 21 -20.985 6.293 -5.120
149 HG2 LYS 21 2HG LYS 21 -21.016 8.108 -3.508
150 HG3 LYS 21 1HG LYS 21 -19.582 7.453 -2.715
151 HD2 LYS 21 2HD LYS 21 -18.303 7.791 -4.803
152 HD3 LYS 21 1HD LYS 21 -19.734 8.506 -5.548
153 HE2 LYS 21 2HE LYS 21 -19.716 10.306 -3.913
154 HE3 LYS 21 1HE LYS 21 -18.357 9.562 -3.073
155 HZ1 LYS 21 3HZ LYS 21 -18.341 10.701 -5.812
156 HZ2 LYS 21 1HZ LYS 21 -17.046 9.858 -5.128
157 HZ3 LYS 21 2HZ LYS 21 -17.553 11.322 -4.453
158 H GLY 22 H GLY 22 -19.623 3.384 -3.480
159 HA2 GLY 22 2HA GLY 22 -21.612 1.333 -4.014
160 HA3 GLY 22 1HA GLY 22 -20.522 1.678 -5.353
161 H SER 23 H SER 23 -20.868 -0.746 -3.569
162 HA SER 23 HA SER 23 -18.569 -0.946 -1.896
163 HG SER 23 HG SER 23 -20.932 -4.085 -2.991
164 HB2 SER 23 2HB SER 23 -19.072 -3.360 -1.804
165 HB3 SER 23 1HB SER 23 -20.521 -2.389 -1.552
166 H ALA 24 H ALA 24 -19.032 -1.296 -5.286
167 HA ALA 24 HA ALA 24 -16.235 -2.215 -5.571
168 HB1 ALA 24 3HB ALA 24 -18.466 -2.322 -7.609
169 HB2 ALA 24 1HB ALA 24 -17.861 -3.687 -6.669
170 HB3 ALA 24 2HB ALA 24 -16.815 -2.894 -7.848
171 H GLY 25 H GLY 25 -15.059 -0.356 -5.546
172 HA2 GLY 25 2HA GLY 25 -15.028 1.341 -7.811
173 HA3 GLY 25 1HA GLY 25 -15.827 2.164 -6.478
174 HA PRO 26 HA PRO 26 -11.220 3.059 -6.294
175 HB2 PRO 26 2HB PRO 26 -12.347 5.616 -5.257
176 HB3 PRO 26 1HB PRO 26 -11.051 5.349 -6.429
177 HG2 PRO 26 2HG PRO 26 -13.457 6.167 -7.230
178 HG3 PRO 26 1HG PRO 26 -12.538 4.989 -8.187
179 HD2 PRO 26 2HD PRO 26 -14.860 4.534 -6.344
180 HD3 PRO 26 1HD PRO 26 -14.501 3.784 -7.914
181 H MET 27 H MET 27 -10.698 1.736 -4.582
182 HA MET 27 HA MET 27 -11.660 2.457 -1.892
183 HB2 MET 27 2HB MET 27 -12.083 0.152 -2.551
184 HB3 MET 27 1HB MET 27 -10.378 -0.092 -2.906
185 HG2 MET 27 2HG MET 27 -11.142 -1.066 -0.746
186 HG3 MET 27 1HG MET 27 -9.794 0.064 -0.599
187 HE1 MET 27 3HE MET 27 -11.814 0.664 2.714
188 HE2 MET 27 1HE MET 27 -10.260 0.208 2.018
189 HE3 MET 27 2HE MET 27 -11.645 -0.877 1.877
190 H ARG 28 H ARG 28 -10.257 2.737 -0.155
191 HA ARG 28 HA ARG 28 -7.463 3.352 -0.900
192 HE ARG 28 HE ARG 28 -7.013 7.604 -0.143
193 HB2 ARG 28 2HB ARG 28 -8.685 5.371 -0.382
194 HB3 ARG 28 1HB ARG 28 -9.276 4.684 1.124
195 HG2 ARG 28 2HG ARG 28 -7.001 4.662 2.018
196 HG3 ARG 28 1HG ARG 28 -6.394 5.330 0.501
197 HD2 ARG 28 2HD ARG 28 -8.441 6.694 2.256
198 HD3 ARG 28 1HD ARG 28 -6.708 7.008 2.333
199 HH11 ARG 28 1HH1 ARG 28 -9.443 8.107 2.250
200 HH12 ARG 28 2HH1 ARG 28 -10.070 9.514 1.467
201 HH21 ARG 28 1HH2 ARG 28 -7.822 9.393 -1.138
202 HH22 ARG 28 2HH2 ARG 28 -9.167 10.233 -0.441
203 H LEU 29 H LEU 29 -5.897 2.275 0.114
204 HA LEU 29 HA LEU 29 -6.548 0.685 2.504
205 HG LEU 29 HG LEU 29 -6.290 -0.457 -0.446
206 HB2 LEU 29 2HB LEU 29 -4.252 0.440 0.549
207 HB3 LEU 29 1HB LEU 29 -4.469 -0.573 1.964
208 HD11 LEU 29 1HD1 LEU 29 -4.198 -1.626 -0.878
209 HD12 LEU 29 2HD1 LEU 29 -5.550 -2.755 -0.828
210 HD13 LEU 29 3HD1 LEU 29 -4.449 -2.636 0.546
211 HD21 LEU 29 3HD2 LEU 29 -6.511 -2.138 2.056
212 HD22 LEU 29 1HD2 LEU 29 -7.513 -2.300 0.612
213 HD23 LEU 29 2HD2 LEU 29 -7.592 -0.829 1.579
214 H TYR 30 H TYR 30 -5.216 0.696 4.305
215 HA TYR 30 HA TYR 30 -3.450 3.026 4.630
216 HD1 TYR 30 HD1 TYR 30 -3.495 4.661 7.079
217 HD2 TYR 30 HD2 TYR 30 -3.348 0.554 8.197
218 HE1 TYR 30 HE1 TYR 30 -2.014 5.227 8.957
219 HE2 TYR 30 HE2 TYR 30 -1.867 1.110 10.072
220 HH TYR 30 HH TYR 30 -1.378 4.280 11.153
221 HB2 TYR 30 2HB TYR 30 -5.190 3.004 6.269
222 HB3 TYR 30 1HB TYR 30 -4.957 1.292 6.599
223 H VAL 31 H VAL 31 -1.374 2.533 4.202
224 HA VAL 31 HA VAL 31 -0.300 -0.074 5.091
225 HB VAL 31 HB VAL 31 0.828 1.795 2.986
226 HG11 VAL 31 1HG1 VAL 31 2.553 0.452 4.071
227 HG12 VAL 31 2HG1 VAL 31 2.299 -0.089 2.413
228 HG13 VAL 31 3HG1 VAL 31 1.630 -1.019 3.753
229 HG21 VAL 31 3HG2 VAL 31 -1.295 0.821 2.262
230 HG22 VAL 31 1HG2 VAL 31 -0.696 -0.794 2.640
231 HG23 VAL 31 2HG2 VAL 31 0.052 0.144 1.347
232 H GLY 32 H GLY 32 0.692 0.139 7.034
233 HA2 GLY 32 2HA GLY 32 2.364 2.555 7.475
234 HA3 GLY 32 1HA GLY 32 1.398 1.825 8.742
235 H SER 33 H SER 33 4.265 1.507 6.771
236 HA SER 33 HA SER 33 5.697 0.165 8.867
237 HG SER 33 HG SER 33 4.159 -1.548 8.915
238 HB2 SER 33 2HB SER 33 5.146 -1.395 6.319
239 HB3 SER 33 1HB SER 33 6.292 -1.873 7.569
240 H LEU 34 H LEU 34 5.888 2.559 7.101
241 HA LEU 34 HA LEU 34 8.070 2.000 5.258
242 HG LEU 34 HG LEU 34 5.014 3.331 5.125
243 HB2 LEU 34 2HB LEU 34 6.854 4.680 5.938
244 HB3 LEU 34 1HB LEU 34 7.822 4.279 4.530
245 HD11 LEU 34 1HD1 LEU 34 4.418 4.585 3.118
246 HD12 LEU 34 2HD1 LEU 34 6.091 5.116 2.944
247 HD13 LEU 34 3HD1 LEU 34 5.143 5.632 4.339
248 HD21 LEU 34 3HD2 LEU 34 6.788 2.619 2.784
249 HD22 LEU 34 1HD2 LEU 34 5.082 2.204 2.951
250 HD23 LEU 34 2HD2 LEU 34 6.267 1.526 4.066
251 H HIS 35 H HIS 35 10.178 2.761 5.425
252 HA HIS 35 HA HIS 35 10.961 3.756 8.091
253 HD1 HIS 35 HD1 HIS 35 14.434 3.454 5.519
254 HD2 HIS 35 HD2 HIS 35 11.679 0.379 5.031
255 HE1 HIS 35 HE1 HIS 35 14.944 2.440 3.281
256 HE2 HIS 35 HE2 HIS 35 13.392 0.478 3.093
257 HB2 HIS 35 2HB HIS 35 13.172 2.770 7.698
258 HB3 HIS 35 1HB HIS 35 11.907 1.562 7.548
259 H PHE 36 H PHE 36 10.028 5.685 6.460
260 HA PHE 36 HA PHE 36 10.472 7.792 5.748
261 HD1 PHE 36 HD2 PHE 36 10.594 9.929 7.339
262 HD2 PHE 36 HD1 PHE 36 14.544 9.075 5.976
263 HE1 PHE 36 HE2 PHE 36 10.998 12.331 6.991
264 HE2 PHE 36 HE1 PHE 36 14.943 11.475 5.630
265 HZ PHE 36 HZ PHE 36 13.172 13.107 6.135
266 HB2 PHE 36 2HB PHE 36 11.824 7.738 7.864
267 HB3 PHE 36 1HB PHE 36 13.239 7.348 6.897
268 H ASN 37 H ASN 37 11.624 5.283 4.125
269 HA ASN 37 HA ASN 37 12.781 6.968 2.019
270 HB2 ASN 37 2HB ASN 37 14.647 5.988 3.390
271 HB3 ASN 37 1HB ASN 37 14.095 4.387 2.910
272 HD21 ASN 37 1HD2 ASN 37 14.142 7.243 0.845
273 HD22 ASN 37 2HD2 ASN 37 15.340 6.644 -0.245
274 H ILE 38 H ILE 38 10.190 5.754 2.207
275 HA ILE 38 HA ILE 38 10.336 3.948 -0.133
276 HB ILE 38 HB ILE 38 8.265 3.801 2.079
277 HG12 ILE 38 2HG1 ILE 38 10.472 2.913 2.785
278 HG13 ILE 38 1HG1 ILE 38 9.260 1.642 2.661
279 HG21 ILE 38 1HG2 ILE 38 8.639 2.109 -0.399
280 HG22 ILE 38 2HG2 ILE 38 7.314 3.229 -0.079
281 HG23 ILE 38 3HG2 ILE 38 7.492 1.772 0.898
282 HD11 ILE 38 3HD1 ILE 38 11.405 2.247 0.635
283 HD12 ILE 38 1HD1 ILE 38 10.191 0.974 0.499
284 HD13 ILE 38 2HD1 ILE 38 11.397 0.910 1.783
285 H THR 39 H THR 39 9.720 5.190 -1.817
286 HA THR 39 HA THR 39 7.725 7.299 -1.445
287 HB THR 39 HB THR 39 8.352 8.083 -3.670
288 HG1 THR 39 HG1 THR 39 9.504 6.881 -5.026
289 HG21 THR 39 3HG2 THR 39 10.715 8.637 -3.243
290 HG22 THR 39 1HG2 THR 39 10.771 7.411 -1.977
291 HG23 THR 39 2HG2 THR 39 9.731 8.826 -1.790
292 H GLU 40 H GLU 40 6.287 7.655 -3.465
293 HA GLU 40 HA GLU 40 4.315 5.720 -3.613
294 HB2 GLU 40 2HB GLU 40 4.920 7.655 -5.863
295 HB3 GLU 40 1HB GLU 40 3.371 6.926 -5.473
296 HG2 GLU 40 2HG GLU 40 3.143 9.093 -4.687
297 HG3 GLU 40 1HG GLU 40 3.577 8.191 -3.237
298 H ASP 41 H ASP 41 7.160 6.125 -5.616
299 HA ASP 41 HA ASP 41 6.555 4.486 -7.781
300 HB2 ASP 41 2HB ASP 41 9.279 4.828 -6.501
301 HB3 ASP 41 1HB ASP 41 8.945 4.408 -8.179
302 H MET 42 H MET 42 8.255 3.591 -4.767
303 HA MET 42 HA MET 42 8.604 0.858 -5.442
304 HB2 MET 42 2HB MET 42 9.947 2.035 -3.718
305 HB3 MET 42 1HB MET 42 8.524 2.131 -2.690
306 HG2 MET 42 2HG MET 42 9.999 0.329 -1.995
307 HG3 MET 42 1HG MET 42 8.446 -0.301 -2.546
308 HE1 MET 42 3HE MET 42 11.018 -3.086 -3.621
309 HE2 MET 42 1HE MET 42 9.563 -2.743 -2.687
310 HE3 MET 42 2HE MET 42 11.115 -2.076 -2.179
311 H LEU 43 H LEU 43 6.230 2.511 -3.375
312 HA LEU 43 HA LEU 43 4.694 0.321 -2.596
313 HG LEU 43 HG LEU 43 5.579 2.947 -1.394
314 HB2 LEU 43 2HB LEU 43 3.807 3.151 -3.185
315 HB3 LEU 43 1HB LEU 43 2.860 1.971 -2.295
316 HD11 LEU 43 1HD1 LEU 43 4.390 4.340 0.217
317 HD12 LEU 43 2HD1 LEU 43 2.849 3.868 -0.500
318 HD13 LEU 43 3HD1 LEU 43 4.008 4.813 -1.438
319 HD21 LEU 43 3HD2 LEU 43 4.932 0.752 -0.522
320 HD22 LEU 43 1HD2 LEU 43 3.405 1.423 0.055
321 HD23 LEU 43 2HD2 LEU 43 4.930 1.969 0.752
322 H ARG 44 H ARG 44 4.411 2.331 -5.509
323 HA ARG 44 HA ARG 44 2.077 1.107 -6.530
324 HE ARG 44 HE ARG 44 0.985 2.674 -11.184
325 HB2 ARG 44 2HB ARG 44 3.038 3.328 -7.244
326 HB3 ARG 44 1HB ARG 44 4.259 2.442 -8.148
327 HG2 ARG 44 2HG ARG 44 2.571 1.449 -9.555
328 HG3 ARG 44 1HG ARG 44 1.290 2.175 -8.584
329 HD2 ARG 44 2HD ARG 44 2.247 4.431 -9.213
330 HD3 ARG 44 1HD ARG 44 3.274 3.577 -10.368
331 HH11 ARG 44 1HH1 ARG 44 1.674 5.882 -10.132
332 HH12 ARG 44 2HH1 ARG 44 0.345 6.563 -11.004
333 HH21 ARG 44 1HH2 ARG 44 -0.700 3.529 -12.266
334 HH22 ARG 44 2HH2 ARG 44 -0.992 5.233 -12.220
335 H GLY 45 H GLY 45 5.532 0.519 -7.152
336 HA2 GLY 45 2HA GLY 45 5.278 -1.434 -9.136
337 HA3 GLY 45 1HA GLY 45 6.629 -1.302 -8.023
338 H ILE 46 H ILE 46 4.975 -1.747 -5.647
339 HA ILE 46 HA ILE 46 4.873 -4.647 -5.755
340 HB ILE 46 HB ILE 46 4.352 -2.783 -3.427
341 HG12 ILE 46 2HG1 ILE 46 6.854 -4.330 -4.178
342 HG13 ILE 46 1HG1 ILE 46 6.651 -2.586 -4.308
343 HG21 ILE 46 1HG2 ILE 46 4.719 -4.784 -2.029
344 HG22 ILE 46 2HG2 ILE 46 4.825 -5.768 -3.489
345 HG23 ILE 46 3HG2 ILE 46 3.314 -4.955 -3.082
346 HD11 ILE 46 3HD1 ILE 46 7.937 -3.141 -2.347
347 HD12 ILE 46 1HD1 ILE 46 6.652 -4.197 -1.765
348 HD13 ILE 46 2HD1 ILE 46 6.384 -2.457 -1.870
349 H PHE 47 H PHE 47 2.556 -1.994 -5.194
350 HA PHE 47 HA PHE 47 0.411 -3.848 -4.583
351 HD1 PHE 47 HD1 PHE 47 2.537 -1.517 -2.974
352 HD2 PHE 47 HD2 PHE 47 -1.591 -2.296 -2.261
353 HE1 PHE 47 HE1 PHE 47 2.997 -1.737 -0.568
354 HE2 PHE 47 HE2 PHE 47 -1.134 -2.519 0.144
355 HZ PHE 47 HZ PHE 47 1.160 -2.241 0.995
356 HB2 PHE 47 2HB PHE 47 0.634 -0.847 -4.612
357 HB3 PHE 47 1HB PHE 47 -0.915 -1.649 -4.392
358 H GLU 48 H GLU 48 1.137 -1.601 -7.276
359 HA GLU 48 HA GLU 48 -1.430 -1.640 -8.417
360 HB2 GLU 48 2HB GLU 48 0.285 0.048 -8.963
361 HB3 GLU 48 1HB GLU 48 1.173 -1.165 -9.882
362 HG2 GLU 48 2HG GLU 48 -0.587 -1.358 -11.484
363 HG3 GLU 48 1HG GLU 48 -1.677 -0.398 -10.486
364 HA PRO 49 HA PRO 49 0.436 -5.443 -11.209
365 HB2 PRO 49 2HB PRO 49 1.139 -6.715 -8.574
366 HB3 PRO 49 1HB PRO 49 1.772 -7.064 -10.190
367 HG2 PRO 49 2HG PRO 49 3.174 -5.563 -8.509
368 HG3 PRO 49 1HG PRO 49 3.091 -5.142 -10.229
369 HD2 PRO 49 2HD PRO 49 1.786 -3.832 -7.901
370 HD3 PRO 49 1HD PRO 49 2.298 -3.135 -9.450
371 H PHE 50 H PHE 50 -1.181 -5.237 -8.055
372 HA PHE 50 HA PHE 50 -2.964 -7.463 -8.613
373 HD1 PHE 50 HD1 PHE 50 -0.609 -5.782 -5.836
374 HD2 PHE 50 HD2 PHE 50 -3.352 -9.034 -6.030
375 HE1 PHE 50 HE1 PHE 50 0.997 -7.211 -4.635
376 HE2 PHE 50 HE2 PHE 50 -1.752 -10.463 -4.833
377 HZ PHE 50 HZ PHE 50 0.421 -9.553 -4.130
378 HB2 PHE 50 2HB PHE 50 -2.956 -5.419 -6.380
379 HB3 PHE 50 1HB PHE 50 -4.078 -6.771 -6.483
380 H GLY 51 H GLY 51 -3.023 -3.988 -8.898
381 HA2 GLY 51 2HA GLY 51 -5.266 -3.936 -10.612
382 HA3 GLY 51 1HA GLY 51 -5.765 -3.478 -8.990
383 H ARG 52 H ARG 52 -5.254 -2.091 -11.724
384 HA ARG 52 HA ARG 52 -3.282 -0.205 -11.654
385 HE ARG 52 HE ARG 52 -3.213 2.432 -15.631
386 HB2 ARG 52 2HB ARG 52 -5.053 -0.631 -13.451
387 HB3 ARG 52 1HB ARG 52 -6.093 0.453 -12.541
388 HG2 ARG 52 2HG ARG 52 -5.072 1.675 -14.334
389 HG3 ARG 52 1HG ARG 52 -4.395 2.244 -12.808
390 HD2 ARG 52 2HD ARG 52 -2.361 1.084 -13.163
391 HD3 ARG 52 1HD ARG 52 -3.045 0.141 -14.486
392 HH11 ARG 52 1HH1 ARG 52 -0.724 1.620 -13.396
393 HH12 ARG 52 2HH1 ARG 52 0.464 2.583 -14.200
394 HH21 ARG 52 1HH2 ARG 52 -1.678 3.664 -16.658
395 HH22 ARG 52 2HH2 ARG 52 -0.066 3.706 -16.033
396 H ILE 53 H ILE 53 -2.756 1.486 -10.407
397 HA ILE 53 HA ILE 53 -4.563 2.201 -8.215
398 HB ILE 53 HB ILE 53 -1.621 2.794 -8.629
399 HG12 ILE 53 2HG1 ILE 53 -3.029 0.859 -6.761
400 HG13 ILE 53 1HG1 ILE 53 -2.168 0.411 -8.229
401 HG21 ILE 53 1HG2 ILE 53 -2.672 4.552 -7.297
402 HG22 ILE 53 2HG2 ILE 53 -1.622 3.553 -6.293
403 HG23 ILE 53 3HG2 ILE 53 -3.371 3.338 -6.223
404 HD11 ILE 53 3HD1 ILE 53 -0.087 1.283 -7.218
405 HD12 ILE 53 1HD1 ILE 53 -0.801 -0.061 -6.327
406 HD13 ILE 53 2HD1 ILE 53 -0.982 1.592 -5.727
407 H GLU 54 H GLU 54 -5.465 4.166 -7.952
408 HA GLU 54 HA GLU 54 -5.357 6.034 -10.168
409 HB2 GLU 54 2HB GLU 54 -6.982 6.011 -7.617
410 HB3 GLU 54 1HB GLU 54 -7.145 7.228 -8.874
411 HG2 GLU 54 2HG GLU 54 -7.599 4.274 -9.271
412 HG3 GLU 54 1HG GLU 54 -8.869 5.459 -8.977
413 H SER 55 H SER 55 -4.749 6.219 -6.651
414 HA SER 55 HA SER 55 -2.753 8.290 -7.099
415 HG SER 55 HG SER 55 -4.536 9.477 -7.947
416 HB2 SER 55 2HB SER 55 -5.194 8.817 -5.374
417 HB3 SER 55 1HB SER 55 -3.778 9.863 -5.470
418 H ILE 56 H ILE 56 -1.100 8.113 -5.726
419 HA ILE 56 HA ILE 56 -1.446 6.464 -3.299
420 HB ILE 56 HB ILE 56 1.113 7.108 -4.791
421 HG12 ILE 56 2HG1 ILE 56 -0.494 4.540 -4.641
422 HG13 ILE 56 1HG1 ILE 56 -0.358 5.587 -6.049
423 HG21 ILE 56 1HG2 ILE 56 2.150 5.436 -3.315
424 HG22 ILE 56 2HG2 ILE 56 0.630 5.270 -2.437
425 HG23 ILE 56 3HG2 ILE 56 1.506 6.799 -2.403
426 HD11 ILE 56 3HD1 ILE 56 2.038 5.108 -6.160
427 HD12 ILE 56 1HD1 ILE 56 1.060 3.646 -6.278
428 HD13 ILE 56 2HD1 ILE 56 1.881 4.035 -4.767
429 H GLN 57 H GLN 57 -1.789 7.719 -1.576
430 HA GLN 57 HA GLN 57 -0.464 10.343 -1.377
431 HB2 GLN 57 2HB GLN 57 -2.891 10.370 -1.203
432 HB3 GLN 57 1HB GLN 57 -2.831 9.219 0.127
433 HG2 GLN 57 2HG GLN 57 -1.988 10.783 1.622
434 HG3 GLN 57 1HG GLN 57 -1.389 11.835 0.338
435 HE21 GLN 57 1HE2 GLN 57 -2.837 13.129 -0.774
436 HE22 GLN 57 2HE2 GLN 57 -4.378 13.525 -0.128
437 H LEU 58 H LEU 58 1.347 10.401 -0.162
438 HA LEU 58 HA LEU 58 1.624 8.517 2.080
439 HG LEU 58 HG LEU 58 3.501 7.289 1.198
440 HB2 LEU 58 2HB LEU 58 3.605 10.256 0.625
441 HB3 LEU 58 1HB LEU 58 3.982 9.561 2.191
442 HD11 LEU 58 1HD1 LEU 58 3.583 8.807 -1.408
443 HD12 LEU 58 2HD1 LEU 58 2.175 7.993 -0.722
444 HD13 LEU 58 3HD1 LEU 58 3.579 7.052 -1.227
445 HD21 LEU 58 3HD2 LEU 58 5.769 8.885 0.004
446 HD22 LEU 58 1HD2 LEU 58 5.675 7.125 0.085
447 HD23 LEU 58 2HD2 LEU 58 5.768 8.071 1.570
448 H MET 59 H MET 59 1.860 9.170 4.196
449 HA MET 59 HA MET 59 0.692 11.798 4.717
450 HB2 MET 59 2HB MET 59 -0.396 9.837 5.698
451 HB3 MET 59 1HB MET 59 1.091 9.410 6.535
452 HG2 MET 59 2HG MET 59 -0.556 10.481 8.002
453 HG3 MET 59 1HG MET 59 0.946 11.394 7.892
454 HE1 MET 59 3HE MET 59 -2.783 11.138 6.746
455 HE2 MET 59 1HE MET 59 -1.964 11.267 5.189
456 HE3 MET 59 2HE MET 59 -2.978 12.590 5.765
457 H MET 60 H MET 60 2.265 13.294 4.699
458 HA MET 60 HA MET 60 4.789 12.897 6.085
459 HB2 MET 60 2HB MET 60 3.664 15.273 4.580
460 HB3 MET 60 1HB MET 60 5.259 15.244 5.319
461 HG2 MET 60 2HG MET 60 5.889 13.375 3.859
462 HG3 MET 60 1HG MET 60 4.298 13.449 3.100
463 HE1 MET 60 3HE MET 60 5.529 13.648 0.725
464 HE2 MET 60 1HE MET 60 7.107 13.627 1.515
465 HE3 MET 60 2HE MET 60 6.721 14.892 0.350
466 H ASP 61 H ASP 61 5.469 15.120 7.297
467 HA ASP 61 HA ASP 61 3.815 15.202 9.651
468 HB2 ASP 61 2HB ASP 61 5.586 16.563 10.605
469 HB3 ASP 61 1HB ASP 61 6.285 15.185 9.764
470 H SER 62 H SER 62 3.900 16.939 6.765
471 HA SER 62 HA SER 62 2.961 18.838 5.955
472 HG SER 62 HG SER 62 1.427 18.290 9.269
473 HB2 SER 62 2HB SER 62 0.844 19.518 6.777
474 HB3 SER 62 1HB SER 62 0.930 17.792 7.109
475 H GLU 63 H GLU 63 5.165 18.953 8.027
476 HA GLU 63 HA GLU 63 4.838 21.762 8.896
477 HB2 GLU 63 2HB GLU 63 4.871 20.075 10.740
478 HB3 GLU 63 1HB GLU 63 6.483 19.593 10.224
479 HG2 GLU 63 2HG GLU 63 7.361 21.769 10.773
480 HG3 GLU 63 1HG GLU 63 5.746 22.362 11.158
481 H THR 64 H THR 64 7.446 19.379 8.367
482 HA THR 64 HA THR 64 9.056 21.507 7.085
483 HB THR 64 HB THR 64 11.048 20.227 7.697
484 HG1 THR 64 HG1 THR 64 9.357 18.470 9.164
485 HG21 THR 64 3HG2 THR 64 9.196 20.651 10.045
486 HG22 THR 64 1HG2 THR 64 10.236 21.872 9.309
487 HG23 THR 64 2HG2 THR 64 10.949 20.490 10.143
488 H GLY 65 H GLY 65 7.768 18.283 6.742
489 HA2 GLY 65 2HA GLY 65 7.333 17.532 4.429
490 HA3 GLY 65 1HA GLY 65 8.944 18.105 4.025
491 H ARG 66 H ARG 66 7.964 16.245 6.880
492 HA ARG 66 HA ARG 66 9.854 14.122 6.064
493 HE ARG 66 HE ARG 66 12.230 13.811 9.437
494 HB2 ARG 66 2HB ARG 66 8.944 14.895 8.848
495 HB3 ARG 66 1HB ARG 66 10.098 13.623 8.462
496 HG2 ARG 66 2HG ARG 66 11.643 15.277 7.552
497 HG3 ARG 66 1HG ARG 66 10.480 16.563 7.886
498 HD2 ARG 66 2HD ARG 66 12.124 16.548 9.632
499 HD3 ARG 66 1HD ARG 66 10.595 15.972 10.293
500 HH11 ARG 66 1HH1 ARG 66 11.874 16.117 11.971
501 HH12 ARG 66 2HH1 ARG 66 12.613 15.092 13.153
502 HH21 ARG 66 1HH2 ARG 66 13.167 12.500 10.964
503 HH22 ARG 66 2HH2 ARG 66 13.347 13.078 12.586
504 H SER 67 H SER 67 9.307 11.922 6.823
505 HA SER 67 HA SER 67 6.490 11.397 6.211
506 HG SER 67 HG SER 67 8.596 11.158 4.534
507 HB2 SER 67 2HB SER 67 8.869 9.520 6.325
508 HB3 SER 67 1HB SER 67 7.237 9.054 5.848
509 H LYS 68 H LYS 68 5.043 10.746 7.702
510 HA LYS 68 HA LYS 68 5.763 10.376 10.439
511 HB2 LYS 68 2HB LYS 68 3.162 9.891 8.968
512 HB3 LYS 68 1HB LYS 68 3.341 9.691 10.706
513 HG2 LYS 68 2HG LYS 68 3.985 12.071 10.888
514 HG3 LYS 68 1HG LYS 68 3.713 12.251 9.152
515 HD2 LYS 68 2HD LYS 68 1.367 11.620 9.441
516 HD3 LYS 68 1HD LYS 68 1.628 11.391 11.170
517 HE2 LYS 68 2HE LYS 68 1.976 14.007 9.700
518 HE3 LYS 68 1HE LYS 68 0.540 13.546 10.614
519 HZ1 LYS 68 3HZ LYS 68 3.279 13.908 11.706
520 HZ2 LYS 68 1HZ LYS 68 1.940 13.382 12.594
521 HZ3 LYS 68 2HZ LYS 68 1.956 14.936 11.940
522 H GLY 69 H GLY 69 5.360 8.191 7.754
523 HA2 GLY 69 2HA GLY 69 6.674 6.092 8.090
524 HA3 GLY 69 1HA GLY 69 5.805 5.909 9.600
525 H TYR 70 H TYR 70 3.473 7.041 7.607
526 HA TYR 70 HA TYR 70 2.909 4.445 6.360
527 HD1 TYR 70 HD2 TYR 70 -0.765 6.452 6.819
528 HD2 TYR 70 HD1 TYR 70 1.924 6.162 10.116
529 HE1 TYR 70 HE2 TYR 70 -1.922 8.313 7.924
530 HE2 TYR 70 HE1 TYR 70 0.761 8.024 11.226
531 HH TYR 70 HH TYR 70 -0.684 9.872 10.722
532 HB2 TYR 70 2HB TYR 70 0.605 4.429 7.192
533 HB3 TYR 70 1HB TYR 70 1.769 4.368 8.505
534 H GLY 71 H GLY 71 1.171 4.471 4.775
535 HA2 GLY 71 2HA GLY 71 0.549 7.107 3.617
536 HA3 GLY 71 1HA GLY 71 1.378 5.921 2.623
537 H PHE 72 H PHE 72 -1.266 7.143 2.246
538 HA PHE 72 HA PHE 72 -3.041 4.799 2.402
539 HD1 PHE 72 HD1 PHE 72 -5.347 5.337 4.108
540 HD2 PHE 72 HD2 PHE 72 -2.751 8.706 3.807
541 HE1 PHE 72 HE1 PHE 72 -5.572 5.728 6.525
542 HE2 PHE 72 HE2 PHE 72 -2.974 9.095 6.225
543 HZ PHE 72 HZ PHE 72 -4.384 7.607 7.588
544 HB2 PHE 72 2HB PHE 72 -3.683 7.708 1.838
545 HB3 PHE 72 1HB PHE 72 -4.864 6.409 1.942
546 H ILE 73 H ILE 73 -3.133 3.573 0.602
547 HA ILE 73 HA ILE 73 -2.610 4.832 -2.021
548 HB ILE 73 HB ILE 73 -2.538 1.893 -1.278
549 HG12 ILE 73 2HG1 ILE 73 -0.257 3.804 -1.861
550 HG13 ILE 73 1HG1 ILE 73 -0.725 3.257 -0.257
551 HG21 ILE 73 1HG2 ILE 73 -1.762 3.298 -3.843
552 HG22 ILE 73 2HG2 ILE 73 -3.133 2.210 -3.619
553 HG23 ILE 73 3HG2 ILE 73 -1.487 1.591 -3.492
554 HD11 ILE 73 3HD1 ILE 73 0.283 1.507 -2.492
555 HD12 ILE 73 1HD1 ILE 73 -0.167 0.961 -0.874
556 HD13 ILE 73 2HD1 ILE 73 1.209 2.041 -1.092
557 H THR 74 H THR 74 -4.209 5.021 -3.484
558 HA THR 74 HA THR 74 -6.777 3.657 -2.944
559 HB THR 74 HB THR 74 -6.229 6.229 -4.444
560 HG1 THR 74 HG1 THR 74 -8.031 5.980 -2.299
561 HG21 THR 74 3HG2 THR 74 -8.019 5.007 -5.589
562 HG22 THR 74 1HG2 THR 74 -8.674 6.403 -4.733
563 HG23 THR 74 2HG2 THR 74 -8.864 4.785 -4.058
564 H PHE 75 H PHE 75 -7.335 2.055 -4.218
565 HA PHE 75 HA PHE 75 -6.186 1.777 -6.912
566 HD1 PHE 75 HD2 PHE 75 -6.096 0.602 -3.403
567 HD2 PHE 75 HD1 PHE 75 -5.014 -1.533 -6.930
568 HE1 PHE 75 HE2 PHE 75 -4.035 -0.160 -2.307
569 HE2 PHE 75 HE1 PHE 75 -2.949 -2.299 -5.831
570 HZ PHE 75 HZ PHE 75 -2.462 -1.609 -3.515
571 HB2 PHE 75 2HB PHE 75 -7.794 -0.182 -5.242
572 HB3 PHE 75 1HB PHE 75 -7.098 -0.526 -6.821
573 H SER 76 H SER 76 -7.575 1.357 -8.743
574 HA SER 76 HA SER 76 -9.907 3.005 -8.772
575 HG SER 76 HG SER 76 -11.052 1.826 -11.367
576 HB2 SER 76 2HB SER 76 -8.412 2.645 -10.748
577 HB3 SER 76 1HB SER 76 -9.047 1.006 -10.881
578 H ASP 77 H ASP 77 -9.457 -0.227 -7.845
579 HA ASP 77 HA ASP 77 -12.369 -0.666 -7.885
580 HB2 ASP 77 2HB ASP 77 -11.249 -1.963 -9.707
581 HB3 ASP 77 1HB ASP 77 -10.309 -2.806 -8.479
582 H SER 78 H SER 78 -13.163 -2.089 -6.232
583 HA SER 78 HA SER 78 -11.877 -1.624 -3.720
584 HG SER 78 HG SER 78 -15.465 -3.482 -4.249
585 HB2 SER 78 2HB SER 78 -13.837 -2.839 -2.769
586 HB3 SER 78 1HB SER 78 -14.297 -1.536 -3.866
587 H GLU 79 H GLU 79 -12.670 -4.637 -5.507
588 HA GLU 79 HA GLU 79 -11.353 -6.264 -3.541
589 HB2 GLU 79 2HB GLU 79 -12.410 -6.958 -6.285
590 HB3 GLU 79 1HB GLU 79 -11.730 -8.133 -5.163
591 HG2 GLU 79 2HG GLU 79 -13.496 -7.179 -3.505
592 HG3 GLU 79 1HG GLU 79 -14.286 -6.590 -4.967
593 H CYS 80 H CYS 80 -10.315 -4.718 -6.497
594 HA CYS 80 HA CYS 80 -7.861 -6.057 -6.844
595 HG CYS 80 HG CYS 80 -8.807 -3.535 -10.008
596 HB2 CYS 80 2HB CYS 80 -8.540 -3.137 -7.297
597 HB3 CYS 80 1HB CYS 80 -7.047 -3.900 -7.831
598 H ALA 81 H ALA 81 -8.746 -3.329 -4.758
599 HA ALA 81 HA ALA 81 -6.230 -3.025 -3.486
600 HB1 ALA 81 3HB ALA 81 -7.454 -1.741 -1.805
601 HB2 ALA 81 1HB ALA 81 -8.985 -2.345 -2.442
602 HB3 ALA 81 2HB ALA 81 -7.971 -1.295 -3.431
603 H LYS 82 H LYS 82 -9.179 -4.798 -2.551
604 HA LYS 82 HA LYS 82 -8.381 -5.859 -0.118
605 HB2 LYS 82 2HB LYS 82 -10.655 -6.069 -1.086
606 HB3 LYS 82 1HB LYS 82 -10.043 -7.249 -2.237
607 HG2 LYS 82 2HG LYS 82 -9.309 -8.582 -0.142
608 HG3 LYS 82 1HG LYS 82 -10.419 -7.522 0.727
609 HD2 LYS 82 2HD LYS 82 -11.590 -9.542 0.142
610 HD3 LYS 82 1HD LYS 82 -12.229 -8.222 -0.843
611 HE2 LYS 82 2HE LYS 82 -10.946 -8.952 -2.747
612 HE3 LYS 82 1HE LYS 82 -10.109 -10.162 -1.774
613 HZ1 LYS 82 3HZ LYS 82 -12.993 -10.152 -2.483
614 HZ2 LYS 82 1HZ LYS 82 -12.263 -11.270 -1.439
615 HZ3 LYS 82 2HZ LYS 82 -11.808 -11.206 -3.066
616 H LYS 83 H LYS 83 -7.884 -7.256 -3.358
617 HA LYS 83 HA LYS 83 -6.582 -9.616 -2.581
618 HB2 LYS 83 2HB LYS 83 -7.508 -9.156 -4.849
619 HB3 LYS 83 1HB LYS 83 -6.179 -8.039 -5.135
620 HG2 LYS 83 2HG LYS 83 -4.574 -9.857 -4.960
621 HG3 LYS 83 1HG LYS 83 -5.876 -10.990 -4.584
622 HD2 LYS 83 2HD LYS 83 -6.874 -10.572 -6.789
623 HD3 LYS 83 1HD LYS 83 -5.575 -9.437 -7.163
624 HE2 LYS 83 2HE LYS 83 -5.167 -11.620 -8.185
625 HE3 LYS 83 1HE LYS 83 -3.937 -11.237 -6.981
626 HZ1 LYS 83 3HZ LYS 83 -4.670 -13.523 -6.791
627 HZ2 LYS 83 1HZ LYS 83 -6.268 -13.028 -6.567
628 HZ3 LYS 83 2HZ LYS 83 -5.098 -12.662 -5.405
629 H ALA 84 H ALA 84 -5.220 -6.444 -3.494
630 HA ALA 84 HA ALA 84 -2.507 -7.047 -3.123
631 HB1 ALA 84 3HB ALA 84 -3.916 -4.417 -2.633
632 HB2 ALA 84 1HB ALA 84 -3.274 -4.976 -4.177
633 HB3 ALA 84 2HB ALA 84 -2.177 -4.635 -2.839
634 H LEU 85 H LEU 85 -4.985 -6.045 -0.810
635 HA LEU 85 HA LEU 85 -3.326 -5.628 1.422
636 HG LEU 85 HG LEU 85 -4.648 -5.317 3.598
637 HB2 LEU 85 2HB LEU 85 -5.654 -4.845 1.241
638 HB3 LEU 85 1HB LEU 85 -6.226 -6.498 1.311
639 HD11 LEU 85 1HD1 LEU 85 -7.638 -5.125 3.203
640 HD12 LEU 85 2HD1 LEU 85 -6.503 -3.777 3.160
641 HD13 LEU 85 3HD1 LEU 85 -6.753 -4.671 4.660
642 HD21 LEU 85 3HD2 LEU 85 -5.912 -6.964 4.918
643 HD22 LEU 85 1HD2 LEU 85 -5.000 -7.746 3.626
644 HD23 LEU 85 2HD2 LEU 85 -6.739 -7.506 3.456
645 H GLU 86 H GLU 86 -5.294 -8.488 0.575
646 HA GLU 86 HA GLU 86 -4.516 -10.021 2.798
647 HB2 GLU 86 2HB GLU 86 -5.492 -11.937 1.554
648 HB3 GLU 86 1HB GLU 86 -6.540 -10.526 1.606
649 HG2 GLU 86 2HG GLU 86 -5.888 -9.934 -0.660
650 HG3 GLU 86 1HG GLU 86 -4.814 -11.329 -0.721
651 H GLN 87 H GLN 87 -2.894 -9.603 -0.312
652 HA GLN 87 HA GLN 87 -1.111 -11.853 0.235
653 HB2 GLN 87 2HB GLN 87 -1.646 -10.097 -2.104
654 HB3 GLN 87 1HB GLN 87 -0.012 -10.728 -1.961
655 HG2 GLN 87 2HG GLN 87 -1.460 -12.120 -3.381
656 HG3 GLN 87 1HG GLN 87 -0.819 -12.993 -1.991
657 HE21 GLN 87 1HE2 GLN 87 -3.659 -11.614 -3.442
658 HE22 GLN 87 2HE2 GLN 87 -4.808 -12.426 -2.441
659 H LEU 88 H LEU 88 -1.021 -8.336 0.389
660 HA LEU 88 HA LEU 88 1.881 -8.392 0.799
661 HG LEU 88 HG LEU 88 0.221 -7.421 -1.640
662 HB2 LEU 88 2HB LEU 88 0.040 -6.033 0.416
663 HB3 LEU 88 1HB LEU 88 1.792 -5.969 0.500
664 HD11 LEU 88 1HD1 LEU 88 -0.079 -5.035 -1.855
665 HD12 LEU 88 2HD1 LEU 88 0.981 -5.626 -3.134
666 HD13 LEU 88 3HD1 LEU 88 1.662 -4.773 -1.746
667 HD21 LEU 88 3HD2 LEU 88 3.185 -6.877 -1.390
668 HD22 LEU 88 1HD2 LEU 88 2.385 -7.614 -2.780
669 HD23 LEU 88 2HD2 LEU 88 2.393 -8.445 -1.225
670 H ASN 89 H ASN 89 -0.956 -8.181 2.686
671 HA ASN 89 HA ASN 89 0.052 -6.535 4.785
672 HB2 ASN 89 2HB ASN 89 -2.374 -6.956 4.380
673 HB3 ASN 89 1HB ASN 89 -2.146 -8.613 4.928
674 HD21 ASN 89 1HD2 ASN 89 -3.684 -8.209 6.552
675 HD22 ASN 89 2HD2 ASN 89 -3.268 -7.325 7.970
676 H GLY 90 H GLY 90 2.132 -7.371 5.135
677 HA2 GLY 90 2HA GLY 90 3.082 -8.715 7.080
678 HA3 GLY 90 1HA GLY 90 2.324 -10.090 6.289
679 H PHE 91 H PHE 91 3.228 -8.226 3.806
680 HA PHE 91 HA PHE 91 5.273 -9.900 2.889
681 HD1 PHE 91 HD2 PHE 91 5.752 -10.115 0.266
682 HD2 PHE 91 HD1 PHE 91 6.293 -5.975 1.120
683 HE1 PHE 91 HE2 PHE 91 7.579 -10.016 -1.378
684 HE2 PHE 91 HE1 PHE 91 8.122 -5.874 -0.523
685 HZ PHE 91 HZ PHE 91 8.765 -7.892 -1.774
686 HB2 PHE 91 2HB PHE 91 3.936 -8.609 1.349
687 HB3 PHE 91 1HB PHE 91 4.487 -7.097 2.058
688 H GLU 92 H GLU 92 7.488 -9.803 2.883
689 HA GLU 92 HA GLU 92 8.811 -8.261 4.898
690 HB2 GLU 92 2HB GLU 92 9.896 -10.050 2.709
691 HB3 GLU 92 1HB GLU 92 10.886 -9.323 3.964
692 HG2 GLU 92 2HG GLU 92 8.584 -11.189 4.514
693 HG3 GLU 92 1HG GLU 92 10.261 -11.708 4.360
694 H LEU 93 H LEU 93 8.357 -6.073 4.222
695 HA LEU 93 HA LEU 93 9.665 -5.111 1.790
696 HG LEU 93 HG LEU 93 9.619 -2.102 2.760
697 HB2 LEU 93 2HB LEU 93 7.477 -4.202 2.358
698 HB3 LEU 93 1HB LEU 93 8.072 -3.674 3.922
699 HD11 LEU 93 1HD1 LEU 93 8.126 -2.963 0.280
700 HD12 LEU 93 2HD1 LEU 93 9.831 -3.249 0.630
701 HD13 LEU 93 3HD1 LEU 93 9.246 -1.604 0.387
702 HD21 LEU 93 3HD2 LEU 93 6.692 -1.752 2.079
703 HD22 LEU 93 1HD2 LEU 93 7.902 -0.469 2.137
704 HD23 LEU 93 2HD2 LEU 93 7.456 -1.329 3.611
705 H ALA 94 H ALA 94 11.776 -4.632 1.824
706 HA ALA 94 HA ALA 94 13.840 -3.936 2.480
707 HB1 ALA 94 3HB ALA 94 13.979 -1.980 3.922
708 HB2 ALA 94 1HB ALA 94 12.305 -2.212 4.427
709 HB3 ALA 94 2HB ALA 94 12.673 -1.799 2.752
710 H GLY 95 H GLY 95 12.362 -6.137 4.042
711 HA2 GLY 95 2HA GLY 95 13.409 -7.701 5.492
712 HA3 GLY 95 1HA GLY 95 14.382 -6.403 6.163
713 H ARG 96 H ARG 96 11.128 -5.532 5.846
714 HA ARG 96 HA ARG 96 10.470 -6.387 8.589
715 HE ARG 96 HE ARG 96 9.533 -2.553 10.163
716 HB2 ARG 96 2HB ARG 96 10.157 -3.619 7.404
717 HB3 ARG 96 1HB ARG 96 9.346 -4.132 8.878
718 HG2 ARG 96 2HG ARG 96 11.437 -4.441 10.003
719 HG3 ARG 96 1HG ARG 96 12.337 -4.153 8.511
720 HD2 ARG 96 2HD ARG 96 12.370 -2.189 9.966
721 HD3 ARG 96 1HD ARG 96 11.526 -1.849 8.456
722 HH11 ARG 96 1HH1 ARG 96 12.114 -0.265 10.399
723 HH12 ARG 96 2HH1 ARG 96 11.173 0.853 11.328
724 HH21 ARG 96 1HH2 ARG 96 8.371 -1.127 11.394
725 HH22 ARG 96 2HH2 ARG 96 9.089 0.369 11.889
726 HA PRO 97 HA PRO 97 6.608 -7.746 6.745
727 HB2 PRO 97 2HB PRO 97 5.082 -7.617 9.049
728 HB3 PRO 97 1HB PRO 97 6.130 -8.973 8.618
729 HG2 PRO 97 2HG PRO 97 6.682 -6.661 10.453
730 HG3 PRO 97 1HG PRO 97 7.058 -8.382 10.673
731 HD2 PRO 97 2HD PRO 97 8.943 -6.640 9.915
732 HD3 PRO 97 1HD PRO 97 8.901 -8.286 9.249
733 H MET 98 H MET 98 5.080 -6.599 5.676
734 HA MET 98 HA MET 98 4.761 -3.770 6.373
735 HB2 MET 98 2HB MET 98 5.490 -4.285 4.101
736 HB3 MET 98 1HB MET 98 4.072 -5.296 3.851
737 HG2 MET 98 2HG MET 98 2.619 -3.414 3.890
738 HG3 MET 98 1HG MET 98 3.916 -2.347 4.437
739 HE1 MET 98 3HE MET 98 3.859 -4.276 0.240
740 HE2 MET 98 1HE MET 98 2.639 -4.604 1.472
741 HE3 MET 98 2HE MET 98 4.298 -5.157 1.705
742 H LYS 99 H LYS 99 3.019 -3.097 7.404
743 HA LYS 99 HA LYS 99 0.723 -4.856 7.723
744 HB2 LYS 99 2HB LYS 99 1.523 -2.251 9.027
745 HB3 LYS 99 1HB LYS 99 -0.002 -3.061 9.366
746 HG2 LYS 99 2HG LYS 99 2.731 -4.267 9.804
747 HG3 LYS 99 1HG LYS 99 1.738 -3.511 11.054
748 HD2 LYS 99 2HD LYS 99 -0.050 -5.191 10.538
749 HD3 LYS 99 1HD LYS 99 1.086 -5.986 9.445
750 HE2 LYS 99 2HE LYS 99 1.481 -5.571 12.414
751 HE3 LYS 99 1HE LYS 99 1.009 -7.082 11.637
752 HZ1 LYS 99 3HZ LYS 99 3.592 -5.652 11.284
753 HZ2 LYS 99 1HZ LYS 99 3.129 -7.039 10.424
754 HZ3 LYS 99 2HZ LYS 99 3.345 -7.115 12.096
755 H VAL 100 H VAL 100 -0.659 -4.796 6.078
756 HA VAL 100 HA VAL 100 -1.594 -2.191 5.041
757 HB VAL 100 HB VAL 100 -1.892 -4.908 3.735
758 HG11 VAL 100 1HG1 VAL 100 -2.291 -2.114 2.647
759 HG12 VAL 100 2HG1 VAL 100 -3.564 -3.272 3.034
760 HG13 VAL 100 3HG1 VAL 100 -2.435 -3.610 1.723
761 HG21 VAL 100 3HG2 VAL 100 0.170 -2.761 3.195
762 HG22 VAL 100 1HG2 VAL 100 -0.079 -4.209 2.214
763 HG23 VAL 100 2HG2 VAL 100 0.473 -4.357 3.881
764 H GLY 101 H GLY 101 -3.447 -1.599 6.035
765 HA2 GLY 101 2HA GLY 101 -5.620 -3.609 6.222
766 HA3 GLY 101 1HA GLY 101 -5.269 -2.541 7.575
767 H HIS 102 H HIS 102 -7.765 -2.786 5.988
768 HA HIS 102 HA HIS 102 -7.965 -0.543 4.251
769 HD1 HIS 102 HD1 HIS 102 -11.572 0.010 6.271
770 HD2 HIS 102 HD2 HIS 102 -10.271 -3.922 6.623
771 HE1 HIS 102 HE1 HIS 102 -12.821 -0.938 8.226
772 HE2 HIS 102 HE2 HIS 102 -12.152 -3.357 8.307
773 HB2 HIS 102 2HB HIS 102 -10.304 -0.927 4.176
774 HB3 HIS 102 1HB HIS 102 -9.567 -2.516 4.331
775 H VAL 103 H VAL 103 -8.781 1.534 4.590
776 HA VAL 103 HA VAL 103 -8.157 2.716 7.098
777 HB VAL 103 HB VAL 103 -9.714 3.960 4.813
778 HG11 VAL 103 1HG1 VAL 103 -8.864 6.083 5.662
779 HG12 VAL 103 2HG1 VAL 103 -8.036 5.246 6.976
780 HG13 VAL 103 3HG1 VAL 103 -9.799 5.247 6.902
781 HG21 VAL 103 3HG2 VAL 103 -7.616 3.021 3.990
782 HG22 VAL 103 1HG2 VAL 103 -6.725 3.868 5.254
783 HG23 VAL 103 2HG2 VAL 103 -7.555 4.783 3.994
784 H THR 104 H THR 104 -9.474 3.604 8.685
785 HA THR 104 HA THR 104 -12.119 2.552 9.042
786 HB THR 104 HB THR 104 -10.554 4.630 10.598
787 HG1 THR 104 HG1 THR 104 -9.697 2.826 11.320
788 HG21 THR 104 3HG2 THR 104 -13.226 3.389 11.298
789 HG22 THR 104 1HG2 THR 104 -12.947 5.082 10.887
790 HG23 THR 104 2HG2 THR 104 -12.256 4.406 12.364
791 H GLU 105 H GLU 105 -14.101 3.751 9.130
792 HA GLU 105 HA GLU 105 -14.579 5.400 6.956
793 HB2 GLU 105 2HB GLU 105 -16.213 5.263 9.500
794 HB3 GLU 105 1HB GLU 105 -16.779 5.840 7.935
795 HG2 GLU 105 2HG GLU 105 -16.279 3.552 7.023
796 HG3 GLU 105 1HG GLU 105 -15.974 3.032 8.678
797 H ARG 106 H ARG 106 -14.257 6.449 10.384
798 HA ARG 106 HA ARG 106 -14.266 9.228 9.585
799 HE ARG 106 HE ARG 106 -15.765 7.448 14.288
800 HB2 ARG 106 2HB ARG 106 -13.751 7.946 12.274
801 HB3 ARG 106 1HB ARG 106 -13.770 9.682 11.996
802 HG2 ARG 106 2HG ARG 106 -16.129 9.403 11.136
803 HG3 ARG 106 1HG ARG 106 -16.066 7.750 11.752
804 HD2 ARG 106 2HD ARG 106 -15.643 10.254 13.388
805 HD3 ARG 106 1HD ARG 106 -17.126 9.303 13.340
806 HH11 ARG 106 1HH1 ARG 106 -14.613 10.683 14.664
807 HH12 ARG 106 2HH1 ARG 106 -13.880 10.344 16.194
808 HH21 ARG 106 1HH2 ARG 106 -14.811 7.049 16.254
809 HH22 ARG 106 2HH2 ARG 106 -13.981 8.330 17.072
810 H THR 107 H THR 107 -12.475 9.185 8.118
811 HA THR 107 HA THR 107 -9.796 9.001 9.297
812 HB THR 107 HB THR 107 -9.972 8.005 7.116
813 HG1 THR 107 HG1 THR 107 -8.720 10.440 6.455
814 HG21 THR 107 3HG2 THR 107 -10.614 9.294 5.115
815 HG22 THR 107 1HG2 THR 107 -11.007 10.675 6.139
816 HG23 THR 107 2HG2 THR 107 -11.939 9.184 6.273
817 H ASP 108 H ASP 108 -12.091 11.386 8.250
818 HA ASP 108 HA ASP 108 -12.206 13.631 8.333
819 HB2 ASP 108 2HB ASP 108 -11.373 13.301 10.670
820 HB3 ASP 108 1HB ASP 108 -9.733 13.561 10.079
Start of MODEL 3
1 HA MET 1 HA MET 1 1.015 -10.355 -30.484
2 H1 MET 1 1H MET 1 2.551 -8.255 -29.064
3 H2 MET 1 2H MET 1 0.953 -8.717 -28.758
4 H3 MET 1 3H MET 1 1.351 -7.977 -30.224
5 HB2 MET 1 2HB MET 1 3.105 -10.829 -31.693
6 HB3 MET 1 1HB MET 1 2.549 -9.189 -31.999
7 HG2 MET 1 2HG MET 1 4.192 -8.335 -30.398
8 HG3 MET 1 1HG MET 1 4.750 -9.980 -30.099
9 HE1 MET 1 3HE MET 1 4.464 -7.073 -32.728
10 HE2 MET 1 1HE MET 1 3.653 -8.402 -33.557
11 HE3 MET 1 2HE MET 1 5.202 -7.807 -34.154
12 H GLY 2 H GLY 2 2.625 -12.430 -30.391
13 HA2 GLY 2 2HA GLY 2 4.420 -12.912 -28.395
14 HA3 GLY 2 1HA GLY 2 2.871 -13.079 -27.584
15 H HIS 3 H HIS 3 4.887 -15.100 -27.965
16 HA HIS 3 HA HIS 3 3.837 -16.938 -29.965
17 HD1 HIS 3 HD1 HIS 3 6.062 -18.107 -31.609
18 HD2 HIS 3 HD2 HIS 3 5.904 -20.178 -28.015
19 HE1 HIS 3 HE1 HIS 3 6.442 -20.512 -32.205
20 HE2 HIS 3 HE2 HIS 3 6.553 -21.703 -29.995
21 HB2 HIS 3 2HB HIS 3 6.298 -16.631 -29.448
22 HB3 HIS 3 1HB HIS 3 6.004 -17.426 -27.908
23 H HIS 4 H HIS 4 3.506 -16.320 -26.580
24 HA HIS 4 HA HIS 4 1.390 -18.237 -26.300
25 HD1 HIS 4 HD1 HIS 4 2.262 -19.222 -22.520
26 HD2 HIS 4 HD2 HIS 4 1.536 -21.551 -25.881
27 HE1 HIS 4 HE1 HIS 4 0.824 -21.119 -21.730
28 HE2 HIS 4 HE2 HIS 4 0.585 -22.613 -23.729
29 HB2 HIS 4 2HB HIS 4 3.530 -19.610 -26.026
30 HB3 HIS 4 1HB HIS 4 3.818 -18.698 -24.549
31 H HIS 5 H HIS 5 -0.066 -17.148 -25.081
32 HA HIS 5 HA HIS 5 0.936 -15.162 -23.125
33 HD1 HIS 5 HD1 HIS 5 -1.415 -14.782 -26.909
34 HD2 HIS 5 HD2 HIS 5 1.148 -12.575 -24.494
35 HE1 HIS 5 HE1 HIS 5 -0.207 -13.220 -28.459
36 HE2 HIS 5 HE2 HIS 5 1.179 -11.764 -26.947
37 HB2 HIS 5 2HB HIS 5 -1.755 -15.274 -24.513
38 HB3 HIS 5 1HB HIS 5 -1.221 -14.018 -23.402
39 H HIS 6 H HIS 6 0.342 -15.282 -20.984
40 HA HIS 6 HA HIS 6 -1.151 -17.555 -20.046
41 HD1 HIS 6 HD1 HIS 6 1.770 -14.332 -18.973
42 HD2 HIS 6 HD2 HIS 6 -2.039 -14.108 -17.336
43 HE1 HIS 6 HE1 HIS 6 1.514 -11.963 -18.191
44 HE2 HIS 6 HE2 HIS 6 -0.869 -11.804 -17.405
45 HB2 HIS 6 2HB HIS 6 -0.817 -16.665 -17.802
46 HB3 HIS 6 1HB HIS 6 0.690 -16.592 -18.703
47 H HIS 7 H HIS 7 -3.208 -17.563 -19.032
48 HA HIS 7 HA HIS 7 -4.975 -15.837 -20.533
49 HD1 HIS 7 HD1 HIS 7 -4.279 -20.039 -19.938
50 HD2 HIS 7 HD2 HIS 7 -6.173 -17.509 -22.629
51 HE1 HIS 7 HE1 HIS 7 -3.912 -21.064 -22.195
52 HE2 HIS 7 HE2 HIS 7 -4.875 -19.404 -23.813
53 HB2 HIS 7 2HB HIS 7 -5.564 -18.232 -18.795
54 HB3 HIS 7 1HB HIS 7 -6.758 -17.378 -19.772
55 H HIS 8 H HIS 8 -4.935 -13.830 -19.532
56 HA HIS 8 HA HIS 8 -6.724 -13.752 -17.178
57 HD1 HIS 8 HD1 HIS 8 -6.527 -12.206 -14.841
58 HD2 HIS 8 HD2 HIS 8 -6.256 -9.269 -17.773
59 HE1 HIS 8 HE1 HIS 8 -7.695 -10.200 -13.896
60 HE2 HIS 8 HE2 HIS 8 -7.343 -8.387 -15.598
61 HB2 HIS 8 2HB HIS 8 -4.617 -12.556 -16.761
62 HB3 HIS 8 1HB HIS 8 -4.864 -11.582 -18.204
63 H SER 9 H SER 9 -6.175 -12.791 -20.485
64 HA SER 9 HA SER 9 -8.340 -11.110 -20.978
65 HG SER 9 HG SER 9 -6.466 -10.523 -22.822
66 HB2 SER 9 2HB SER 9 -7.234 -13.237 -22.840
67 HB3 SER 9 1HB SER 9 -8.161 -11.814 -23.316
68 H HIS 10 H HIS 10 -10.481 -11.396 -20.929
69 HA HIS 10 HA HIS 10 -12.550 -12.319 -20.890
70 HD1 HIS 10 HD1 HIS 10 -14.645 -13.601 -22.811
71 HD2 HIS 10 HD2 HIS 10 -12.770 -16.712 -20.795
72 HE1 HIS 10 HE1 HIS 10 -16.454 -15.267 -22.311
73 HE2 HIS 10 HE2 HIS 10 -15.325 -17.045 -20.938
74 HB2 HIS 10 2HB HIS 10 -12.038 -13.542 -22.916
75 HB3 HIS 10 1HB HIS 10 -11.170 -14.773 -22.006
76 H MET 11 H MET 11 -10.030 -14.417 -19.509
77 HA MET 11 HA MET 11 -11.804 -15.852 -17.812
78 HB2 MET 11 2HB MET 11 -9.640 -16.776 -18.530
79 HB3 MET 11 1HB MET 11 -8.797 -15.531 -17.620
80 HG2 MET 11 2HG MET 11 -9.739 -16.428 -15.538
81 HG3 MET 11 1HG MET 11 -10.562 -17.684 -16.460
82 HE1 MET 11 3HE MET 11 -8.569 -18.193 -13.962
83 HE2 MET 11 1HE MET 11 -7.692 -19.605 -14.556
84 HE3 MET 11 2HE MET 11 -9.434 -19.478 -14.809
85 H ALA 12 H ALA 12 -12.955 -13.971 -16.926
86 HA ALA 12 HA ALA 12 -11.604 -12.866 -14.546
87 HB1 ALA 12 3HB ALA 12 -12.642 -11.193 -16.000
88 HB2 ALA 12 1HB ALA 12 -13.465 -11.264 -14.442
89 HB3 ALA 12 2HB ALA 12 -14.194 -12.017 -15.861
90 H ALA 13 H ALA 13 -11.741 -14.986 -13.546
91 HA ALA 13 HA ALA 13 -12.621 -16.597 -12.211
92 HB1 ALA 13 3HB ALA 13 -14.944 -14.700 -11.878
93 HB2 ALA 13 1HB ALA 13 -13.472 -14.705 -10.907
94 HB3 ALA 13 2HB ALA 13 -14.572 -16.084 -10.847
95 H ALA 14 H ALA 14 -15.614 -15.338 -13.695
96 HA ALA 14 HA ALA 14 -15.905 -17.324 -15.666
97 HB1 ALA 14 3HB ALA 14 -16.220 -18.832 -13.752
98 HB2 ALA 14 1HB ALA 14 -17.689 -18.693 -14.716
99 HB3 ALA 14 2HB ALA 14 -17.553 -17.828 -13.185
100 H MET 15 H MET 15 -18.375 -17.419 -16.370
101 HA MET 15 HA MET 15 -19.220 -14.829 -17.017
102 HB2 MET 15 2HB MET 15 -20.881 -17.364 -16.947
103 HB3 MET 15 1HB MET 15 -21.323 -15.879 -17.780
104 HG2 MET 15 2HG MET 15 -20.481 -17.428 -19.386
105 HG3 MET 15 1HG MET 15 -19.302 -16.132 -19.199
106 HE1 MET 15 3HE MET 15 -20.003 -19.249 -16.844
107 HE2 MET 15 1HE MET 15 -18.815 -20.392 -17.473
108 HE3 MET 15 2HE MET 15 -20.166 -19.880 -18.483
109 H ALA 16 H ALA 16 -21.023 -13.589 -16.331
110 HA ALA 16 HA ALA 16 -22.408 -12.581 -14.844
111 HB1 ALA 16 3HB ALA 16 -23.599 -14.736 -14.821
112 HB2 ALA 16 1HB ALA 16 -23.684 -13.907 -13.265
113 HB3 ALA 16 2HB ALA 16 -22.584 -15.270 -13.482
114 H ASN 17 H ASN 17 -21.092 -11.118 -13.902
115 HA ASN 17 HA ASN 17 -20.120 -11.781 -11.214
116 HB2 ASN 17 2HB ASN 17 -18.142 -10.145 -11.767
117 HB3 ASN 17 1HB ASN 17 -18.052 -11.833 -12.242
118 HD21 ASN 17 1HD2 ASN 17 -19.963 -9.369 -13.904
119 HD22 ASN 17 2HD2 ASN 17 -19.030 -9.391 -15.350
120 H ASN 18 H ASN 18 -21.068 -10.512 -9.785
121 HA ASN 18 HA ASN 18 -22.259 -8.849 -8.820
122 HB2 ASN 18 2HB ASN 18 -20.366 -7.387 -9.321
123 HB3 ASN 18 1HB ASN 18 -21.000 -7.082 -10.937
124 HD21 ASN 18 1HD2 ASN 18 -21.202 -4.869 -10.608
125 HD22 ASN 18 2HD2 ASN 18 -22.400 -4.192 -9.561
126 H LEU 19 H LEU 19 -24.314 -8.102 -8.887
127 HA LEU 19 HA LEU 19 -25.687 -8.011 -11.501
128 HG LEU 19 HG LEU 19 -27.544 -8.433 -8.226
129 HB2 LEU 19 2HB LEU 19 -27.600 -9.156 -10.614
130 HB3 LEU 19 1HB LEU 19 -26.181 -10.140 -10.329
131 HD11 LEU 19 1HD1 LEU 19 -27.642 -11.423 -8.652
132 HD12 LEU 19 2HD1 LEU 19 -28.965 -10.290 -8.937
133 HD13 LEU 19 3HD1 LEU 19 -28.359 -10.544 -7.301
134 HD21 LEU 19 3HD2 LEU 19 -26.157 -9.661 -6.629
135 HD22 LEU 19 1HD2 LEU 19 -25.159 -8.764 -7.775
136 HD23 LEU 19 2HD2 LEU 19 -25.362 -10.507 -7.957
137 H GLN 20 H GLN 20 -24.783 -6.240 -8.939
138 HA GLN 20 HA GLN 20 -27.282 -4.689 -8.730
139 HB2 GLN 20 2HB GLN 20 -26.383 -5.625 -6.621
140 HB3 GLN 20 1HB GLN 20 -24.885 -4.748 -6.877
141 HG2 GLN 20 2HG GLN 20 -26.242 -3.612 -5.242
142 HG3 GLN 20 1HG GLN 20 -26.105 -2.623 -6.692
143 HE21 GLN 20 1HE2 GLN 20 -28.113 -2.620 -4.550
144 HE22 GLN 20 2HE2 GLN 20 -29.634 -2.827 -5.339
145 H LYS 21 H LYS 21 -27.181 -2.380 -8.757
146 HA LYS 21 HA LYS 21 -25.257 -1.373 -10.683
147 HB2 LYS 21 2HB LYS 21 -27.575 0.041 -9.341
148 HB3 LYS 21 1HB LYS 21 -26.674 0.615 -10.742
149 HG2 LYS 21 2HG LYS 21 -27.480 -1.259 -12.062
150 HG3 LYS 21 1HG LYS 21 -28.323 -1.910 -10.654
151 HD2 LYS 21 2HD LYS 21 -29.689 0.175 -10.583
152 HD3 LYS 21 1HD LYS 21 -28.908 0.690 -12.080
153 HE2 LYS 21 2HE LYS 21 -31.080 -0.321 -12.536
154 HE3 LYS 21 1HE LYS 21 -29.784 -1.300 -13.218
155 HZ1 LYS 21 3HZ LYS 21 -29.959 -2.778 -11.303
156 HZ2 LYS 21 1HZ LYS 21 -31.430 -2.674 -12.127
157 HZ3 LYS 21 2HZ LYS 21 -31.216 -1.842 -10.673
158 H GLY 22 H GLY 22 -23.532 -0.109 -10.244
159 HA2 GLY 22 2HA GLY 22 -22.301 1.534 -9.066
160 HA3 GLY 22 1HA GLY 22 -23.354 1.310 -7.678
161 H SER 23 H SER 23 -20.342 0.610 -9.015
162 HA SER 23 HA SER 23 -19.851 -1.786 -7.417
163 HG SER 23 HG SER 23 -16.882 -1.602 -7.720
164 HB2 SER 23 2HB SER 23 -18.922 -1.603 -9.707
165 HB3 SER 23 1HB SER 23 -17.961 -0.216 -9.198
166 H ALA 24 H ALA 24 -20.328 0.969 -6.216
167 HA ALA 24 HA ALA 24 -19.712 2.031 -4.307
168 HB1 ALA 24 3HB ALA 24 -17.465 0.028 -4.097
169 HB2 ALA 24 1HB ALA 24 -19.084 -0.167 -3.423
170 HB3 ALA 24 2HB ALA 24 -18.026 1.110 -2.824
171 H GLY 25 H GLY 25 -17.113 1.386 -6.613
172 HA2 GLY 25 2HA GLY 25 -15.986 3.193 -7.702
173 HA3 GLY 25 1HA GLY 25 -16.181 4.149 -6.242
174 HA PRO 26 HA PRO 26 -11.706 2.527 -6.536
175 HB2 PRO 26 2HB PRO 26 -11.502 5.326 -5.484
176 HB3 PRO 26 1HB PRO 26 -10.431 4.463 -6.595
177 HG2 PRO 26 2HG PRO 26 -12.141 6.280 -7.512
178 HG3 PRO 26 1HG PRO 26 -11.845 4.782 -8.415
179 HD2 PRO 26 2HD PRO 26 -14.206 5.557 -6.758
180 HD3 PRO 26 1HD PRO 26 -14.131 4.567 -8.229
181 H MET 27 H MET 27 -10.922 1.450 -4.825
182 HA MET 27 HA MET 27 -11.904 2.103 -2.124
183 HB2 MET 27 2HB MET 27 -12.346 -0.184 -2.850
184 HB3 MET 27 1HB MET 27 -10.642 -0.431 -3.206
185 HG2 MET 27 2HG MET 27 -10.107 -0.186 -0.830
186 HG3 MET 27 1HG MET 27 -11.812 0.076 -0.471
187 HE1 MET 27 3HE MET 27 -11.617 -1.899 1.370
188 HE2 MET 27 1HE MET 27 -9.924 -2.156 0.936
189 HE3 MET 27 2HE MET 27 -11.041 -3.519 0.992
190 H ARG 28 H ARG 28 -10.527 2.649 -0.486
191 HA ARG 28 HA ARG 28 -7.713 3.103 -1.234
192 HE ARG 28 HE ARG 28 -7.279 6.844 -1.215
193 HB2 ARG 28 2HB ARG 28 -8.966 5.123 -0.734
194 HB3 ARG 28 1HB ARG 28 -9.444 4.475 0.828
195 HG2 ARG 28 2HG ARG 28 -7.272 4.695 1.709
196 HG3 ARG 28 1HG ARG 28 -6.557 4.906 0.106
197 HD2 ARG 28 2HD ARG 28 -8.435 6.845 1.472
198 HD3 ARG 28 1HD ARG 28 -6.688 7.038 1.309
199 HH11 ARG 28 1HH1 ARG 28 -9.051 8.553 1.193
200 HH12 ARG 28 2HH1 ARG 28 -9.743 9.645 0.048
201 HH21 ARG 28 1HH2 ARG 28 -8.164 8.244 -2.656
202 HH22 ARG 28 2HH2 ARG 28 -9.234 9.489 -2.103
203 H LEU 29 H LEU 29 -6.066 2.253 -0.097
204 HA LEU 29 HA LEU 29 -6.714 0.615 2.272
205 HG LEU 29 HG LEU 29 -6.450 -0.486 -0.774
206 HB2 LEU 29 2HB LEU 29 -4.422 0.271 0.329
207 HB3 LEU 29 1HB LEU 29 -4.756 -0.750 1.714
208 HD11 LEU 29 1HD1 LEU 29 -4.413 -1.802 -1.066
209 HD12 LEU 29 2HD1 LEU 29 -5.850 -2.820 -1.133
210 HD13 LEU 29 3HD1 LEU 29 -4.851 -2.800 0.323
211 HD21 LEU 29 3HD2 LEU 29 -7.893 -0.769 1.173
212 HD22 LEU 29 1HD2 LEU 29 -6.933 -2.148 1.705
213 HD23 LEU 29 2HD2 LEU 29 -7.860 -2.244 0.209
214 H TYR 30 H TYR 30 -5.401 0.685 4.061
215 HA TYR 30 HA TYR 30 -3.589 2.962 4.337
216 HD1 TYR 30 HD2 TYR 30 -3.746 4.503 6.950
217 HD2 TYR 30 HD1 TYR 30 -2.941 0.379 7.644
218 HE1 TYR 30 HE2 TYR 30 -2.159 5.113 8.726
219 HE2 TYR 30 HE1 TYR 30 -1.358 0.976 9.420
220 HH TYR 30 HH TYR 30 -1.187 4.089 10.745
221 HB2 TYR 30 2HB TYR 30 -5.230 2.756 6.083
222 HB3 TYR 30 1HB TYR 30 -4.851 1.056 6.322
223 H VAL 31 H VAL 31 -1.437 2.701 4.169
224 HA VAL 31 HA VAL 31 -0.289 -0.003 4.538
225 HB VAL 31 HB VAL 31 0.762 2.211 2.755
226 HG11 VAL 31 1HG1 VAL 31 2.555 0.806 3.615
227 HG12 VAL 31 2HG1 VAL 31 2.300 0.485 1.899
228 HG13 VAL 31 3HG1 VAL 31 1.687 -0.645 3.109
229 HG21 VAL 31 3HG2 VAL 31 -1.312 1.269 1.871
230 HG22 VAL 31 1HG2 VAL 31 -0.645 -0.359 2.015
231 HG23 VAL 31 2HG2 VAL 31 0.067 0.791 0.880
232 H GLY 32 H GLY 32 1.097 -0.212 6.196
233 HA2 GLY 32 2HA GLY 32 2.414 2.218 7.261
234 HA3 GLY 32 1HA GLY 32 1.718 0.989 8.301
235 H SER 33 H SER 33 4.421 1.885 6.341
236 HA SER 33 HA SER 33 6.238 0.275 7.808
237 HG SER 33 HG SER 33 6.025 -1.278 4.090
238 HB2 SER 33 2HB SER 33 6.976 -1.261 6.000
239 HB3 SER 33 1HB SER 33 5.310 -1.569 6.491
240 H LEU 34 H LEU 34 5.771 2.998 6.410
241 HA LEU 34 HA LEU 34 7.920 3.152 4.470
242 HG LEU 34 HG LEU 34 4.639 3.924 4.764
243 HB2 LEU 34 2HB LEU 34 6.335 5.469 5.577
244 HB3 LEU 34 1HB LEU 34 7.193 5.382 4.050
245 HD11 LEU 34 1HD1 LEU 34 3.628 5.322 3.048
246 HD12 LEU 34 2HD1 LEU 34 5.173 6.129 2.775
247 HD13 LEU 34 3HD1 LEU 34 4.344 6.309 4.322
248 HD21 LEU 34 3HD2 LEU 34 6.209 3.858 2.185
249 HD22 LEU 34 1HD2 LEU 34 4.631 3.120 2.457
250 HD23 LEU 34 2HD2 LEU 34 6.043 2.527 3.331
251 H HIS 35 H HIS 35 9.749 2.653 5.856
252 HA HIS 35 HA HIS 35 10.257 4.321 8.147
253 HD1 HIS 35 HD1 HIS 35 14.331 3.142 7.232
254 HD2 HIS 35 HD2 HIS 35 11.431 0.785 5.412
255 HE1 HIS 35 HE1 HIS 35 15.514 1.938 5.379
256 HE2 HIS 35 HE2 HIS 35 13.788 0.404 4.398
257 HB2 HIS 35 2HB HIS 35 12.192 3.003 8.571
258 HB3 HIS 35 1HB HIS 35 10.941 1.904 8.017
259 H PHE 36 H PHE 36 10.038 6.281 6.661
260 HA PHE 36 HA PHE 36 10.934 8.165 5.767
261 HD1 PHE 36 HD1 PHE 36 11.457 10.366 6.895
262 HD2 PHE 36 HD2 PHE 36 15.255 8.479 6.456
263 HE1 PHE 36 HE1 PHE 36 12.485 12.549 6.404
264 HE2 PHE 36 HE2 PHE 36 16.282 10.660 5.966
265 HZ PHE 36 HZ PHE 36 14.897 12.694 5.941
266 HB2 PHE 36 2HB PHE 36 12.110 8.031 7.948
267 HB3 PHE 36 1HB PHE 36 13.448 7.208 7.159
268 H ASN 37 H ASN 37 11.583 5.388 4.326
269 HA ASN 37 HA ASN 37 13.339 6.621 2.313
270 HB2 ASN 37 2HB ASN 37 14.685 5.205 3.904
271 HB3 ASN 37 1HB ASN 37 13.780 3.808 3.335
272 HD21 ASN 37 1HD2 ASN 37 14.922 6.534 1.410
273 HD22 ASN 37 2HD2 ASN 37 16.009 5.610 0.441
274 H ILE 38 H ILE 38 10.440 5.184 2.806
275 HA ILE 38 HA ILE 38 10.467 3.677 0.268
276 HB ILE 38 HB ILE 38 8.275 3.675 2.356
277 HG12 ILE 38 2HG1 ILE 38 10.328 2.780 3.353
278 HG13 ILE 38 1HG1 ILE 38 9.166 1.487 3.082
279 HG21 ILE 38 1HG2 ILE 38 8.832 1.816 0.034
280 HG22 ILE 38 2HG2 ILE 38 7.550 3.025 0.113
281 HG23 ILE 38 3HG2 ILE 38 7.523 1.641 1.205
282 HD11 ILE 38 3HD1 ILE 38 11.556 2.105 1.355
283 HD12 ILE 38 1HD1 ILE 38 10.392 0.808 1.080
284 HD13 ILE 38 2HD1 ILE 38 11.415 0.783 2.515
285 H THR 39 H THR 39 9.679 4.688 -1.486
286 HA THR 39 HA THR 39 8.015 7.092 -1.106
287 HB THR 39 HB THR 39 8.753 7.858 -3.274
288 HG1 THR 39 HG1 THR 39 9.726 6.591 -4.712
289 HG21 THR 39 3HG2 THR 39 11.182 8.037 -2.912
290 HG22 THR 39 1HG2 THR 39 11.090 6.768 -1.694
291 HG23 THR 39 2HG2 THR 39 10.281 8.311 -1.422
292 H GLU 40 H GLU 40 6.672 7.570 -3.185
293 HA GLU 40 HA GLU 40 4.462 5.908 -3.281
294 HB2 GLU 40 2HB GLU 40 5.382 7.678 -5.561
295 HB3 GLU 40 1HB GLU 40 3.731 7.221 -5.170
296 HG2 GLU 40 2HG GLU 40 3.668 8.629 -3.290
297 HG3 GLU 40 1HG GLU 40 5.419 8.827 -3.274
298 H ASP 41 H ASP 41 7.165 6.102 -5.558
299 HA ASP 41 HA ASP 41 6.182 4.408 -7.537
300 HB2 ASP 41 2HB ASP 41 9.076 4.936 -6.820
301 HB3 ASP 41 1HB ASP 41 8.469 4.378 -8.380
302 H MET 42 H MET 42 8.160 3.605 -4.688
303 HA MET 42 HA MET 42 8.644 0.903 -5.397
304 HB2 MET 42 2HB MET 42 9.925 2.134 -3.653
305 HB3 MET 42 1HB MET 42 8.505 2.105 -2.617
306 HG2 MET 42 2HG MET 42 8.583 -0.348 -2.592
307 HG3 MET 42 1HG MET 42 10.023 -0.305 -3.608
308 HE1 MET 42 3HE MET 42 12.570 1.518 -1.192
309 HE2 MET 42 1HE MET 42 11.476 2.310 -2.325
310 HE3 MET 42 2HE MET 42 12.335 0.849 -2.806
311 H LEU 43 H LEU 43 6.194 2.414 -3.314
312 HA LEU 43 HA LEU 43 4.708 0.140 -2.648
313 HG LEU 43 HG LEU 43 5.518 2.787 -1.368
314 HB2 LEU 43 2HB LEU 43 3.724 2.960 -3.137
315 HB3 LEU 43 1HB LEU 43 2.840 1.710 -2.275
316 HD11 LEU 43 1HD1 LEU 43 4.265 4.054 0.313
317 HD12 LEU 43 2HD1 LEU 43 2.749 3.560 -0.444
318 HD13 LEU 43 3HD1 LEU 43 3.886 4.582 -1.327
319 HD21 LEU 43 3HD2 LEU 43 4.904 1.724 0.764
320 HD22 LEU 43 1HD2 LEU 43 5.020 0.552 -0.549
321 HD23 LEU 43 2HD2 LEU 43 3.437 1.087 0.018
322 H ARG 44 H ARG 44 4.387 2.333 -5.432
323 HA ARG 44 HA ARG 44 2.239 1.124 -6.737
324 HE ARG 44 HE ARG 44 2.303 4.934 -9.435
325 HB2 ARG 44 2HB ARG 44 3.276 3.286 -7.388
326 HB3 ARG 44 1HB ARG 44 4.674 2.417 -8.001
327 HG2 ARG 44 2HG ARG 44 3.145 1.263 -9.620
328 HG3 ARG 44 1HG ARG 44 1.855 2.336 -9.073
329 HD2 ARG 44 2HD ARG 44 4.457 3.149 -10.380
330 HD3 ARG 44 1HD ARG 44 2.852 3.207 -11.106
331 HH11 ARG 44 1HH1 ARG 44 5.615 4.311 -10.144
332 HH12 ARG 44 2HH1 ARG 44 6.133 5.886 -9.655
333 HH21 ARG 44 1HH2 ARG 44 2.977 6.959 -8.800
334 HH22 ARG 44 2HH2 ARG 44 4.658 7.362 -8.874
335 H GLY 45 H GLY 45 5.716 0.394 -6.966
336 HA2 GLY 45 2HA GLY 45 5.606 -1.602 -8.925
337 HA3 GLY 45 1HA GLY 45 6.839 -1.479 -7.680
338 H ILE 46 H ILE 46 5.014 -1.850 -5.450
339 HA ILE 46 HA ILE 46 4.934 -4.752 -5.504
340 HB ILE 46 HB ILE 46 4.210 -2.843 -3.268
341 HG12 ILE 46 2HG1 ILE 46 6.794 -4.360 -3.752
342 HG13 ILE 46 1HG1 ILE 46 6.568 -2.637 -4.042
343 HG21 ILE 46 1HG2 ILE 46 4.510 -4.790 -1.798
344 HG22 ILE 46 2HG2 ILE 46 4.788 -5.811 -3.209
345 HG23 ILE 46 3HG2 ILE 46 3.214 -5.053 -2.963
346 HD11 ILE 46 3HD1 ILE 46 7.712 -3.029 -1.946
347 HD12 ILE 46 1HD1 ILE 46 6.372 -4.025 -1.376
348 HD13 ILE 46 2HD1 ILE 46 6.132 -2.300 -1.660
349 H PHE 47 H PHE 47 2.559 -2.122 -5.132
350 HA PHE 47 HA PHE 47 0.382 -3.986 -4.678
351 HD1 PHE 47 HD2 PHE 47 2.361 -1.349 -3.017
352 HD2 PHE 47 HD1 PHE 47 -1.682 -2.586 -2.465
353 HE1 PHE 47 HE2 PHE 47 2.727 -1.464 -0.588
354 HE2 PHE 47 HE1 PHE 47 -1.315 -2.700 -0.037
355 HZ PHE 47 HZ PHE 47 0.891 -2.143 0.906
356 HB2 PHE 47 2HB PHE 47 0.536 -0.974 -4.765
357 HB3 PHE 47 1HB PHE 47 -0.985 -1.836 -4.574
358 H GLU 48 H GLU 48 1.512 -2.006 -7.375
359 HA GLU 48 HA GLU 48 -0.891 -1.726 -8.766
360 HB2 GLU 48 2HB GLU 48 1.213 -0.492 -9.258
361 HB3 GLU 48 1HB GLU 48 1.840 -1.942 -10.029
362 HG2 GLU 48 2HG GLU 48 -0.019 -1.851 -11.654
363 HG3 GLU 48 1HG GLU 48 -0.588 -0.372 -10.889
364 HA PRO 49 HA PRO 49 0.422 -5.930 -11.192
365 HB2 PRO 49 2HB PRO 49 0.993 -7.726 -9.069
366 HB3 PRO 49 1HB PRO 49 2.106 -7.169 -10.321
367 HG2 PRO 49 2HG PRO 49 1.730 -6.176 -7.536
368 HG3 PRO 49 1HG PRO 49 3.210 -6.267 -8.509
369 HD2 PRO 49 2HD PRO 49 1.998 -3.929 -8.085
370 HD3 PRO 49 1HD PRO 49 2.705 -4.303 -9.674
371 H PHE 50 H PHE 50 -0.956 -5.615 -7.937
372 HA PHE 50 HA PHE 50 -3.075 -7.517 -8.393
373 HD1 PHE 50 HD2 PHE 50 -0.441 -5.968 -5.751
374 HD2 PHE 50 HD1 PHE 50 -3.544 -8.890 -5.691
375 HE1 PHE 50 HE2 PHE 50 1.006 -7.484 -4.459
376 HE2 PHE 50 HE1 PHE 50 -2.101 -10.403 -4.398
377 HZ PHE 50 HZ PHE 50 0.174 -9.694 -3.772
378 HB2 PHE 50 2HB PHE 50 -2.753 -5.374 -6.273
379 HB3 PHE 50 1HB PHE 50 -4.018 -6.596 -6.282
380 H GLY 51 H GLY 51 -2.828 -3.972 -8.316
381 HA2 GLY 51 2HA GLY 51 -5.004 -3.648 -10.161
382 HA3 GLY 51 1HA GLY 51 -5.416 -3.164 -8.520
383 H ARG 52 H ARG 52 -4.845 -1.761 -11.202
384 HA ARG 52 HA ARG 52 -2.583 -0.163 -11.065
385 HE ARG 52 HE ARG 52 -3.179 0.187 -14.898
386 HB2 ARG 52 2HB ARG 52 -4.182 -0.347 -12.994
387 HB3 ARG 52 1HB ARG 52 -5.279 0.716 -12.124
388 HG2 ARG 52 2HG ARG 52 -4.140 2.095 -13.650
389 HG3 ARG 52 1HG ARG 52 -3.388 2.412 -12.086
390 HD2 ARG 52 2HD ARG 52 -1.688 2.221 -13.802
391 HD3 ARG 52 1HD ARG 52 -1.557 0.873 -12.672
392 HH11 ARG 52 1HH1 ARG 52 0.108 0.620 -13.965
393 HH12 ARG 52 2HH1 ARG 52 0.706 -0.464 -15.172
394 HH21 ARG 52 1HH2 ARG 52 -2.414 -1.186 -16.437
395 HH22 ARG 52 2HH2 ARG 52 -0.715 -1.480 -16.563
396 H ILE 53 H ILE 53 -1.985 1.639 -9.964
397 HA ILE 53 HA ILE 53 -3.592 2.497 -7.721
398 HB ILE 53 HB ILE 53 -0.812 3.177 -8.662
399 HG12 ILE 53 2HG1 ILE 53 -0.226 2.355 -6.363
400 HG13 ILE 53 1HG1 ILE 53 -1.923 1.967 -6.110
401 HG21 ILE 53 1HG2 ILE 53 -1.747 5.293 -7.928
402 HG22 ILE 53 2HG2 ILE 53 -0.572 4.711 -6.753
403 HG23 ILE 53 3HG2 ILE 53 -2.297 4.556 -6.421
404 HD11 ILE 53 3HD1 ILE 53 -0.119 0.754 -8.193
405 HD12 ILE 53 1HD1 ILE 53 -1.821 0.357 -7.943
406 HD13 ILE 53 2HD1 ILE 53 -0.636 -0.002 -6.686
407 H GLU 54 H GLU 54 -4.877 4.205 -7.630
408 HA GLU 54 HA GLU 54 -5.030 6.087 -9.850
409 HB2 GLU 54 2HB GLU 54 -6.744 5.744 -7.376
410 HB3 GLU 54 1HB GLU 54 -7.049 6.928 -8.643
411 HG2 GLU 54 2HG GLU 54 -7.014 3.933 -9.012
412 HG3 GLU 54 1HG GLU 54 -8.461 4.932 -8.876
413 H SER 55 H SER 55 -4.430 6.167 -6.334
414 HA SER 55 HA SER 55 -2.740 8.506 -6.686
415 HG SER 55 HG SER 55 -6.141 9.108 -4.539
416 HB2 SER 55 2HB SER 55 -3.865 9.820 -4.906
417 HB3 SER 55 1HB SER 55 -4.912 9.562 -6.299
418 H ILE 56 H ILE 56 -1.202 8.788 -5.041
419 HA ILE 56 HA ILE 56 -1.263 6.846 -2.810
420 HB ILE 56 HB ILE 56 1.208 7.698 -4.347
421 HG12 ILE 56 2HG1 ILE 56 -0.182 5.009 -4.162
422 HG13 ILE 56 1HG1 ILE 56 -0.137 6.053 -5.576
423 HG21 ILE 56 1HG2 ILE 56 1.676 7.433 -1.963
424 HG22 ILE 56 2HG2 ILE 56 2.425 6.136 -2.895
425 HG23 ILE 56 3HG2 ILE 56 0.946 5.826 -1.986
426 HD11 ILE 56 3HD1 ILE 56 2.223 4.675 -4.311
427 HD12 ILE 56 1HD1 ILE 56 2.289 5.747 -5.712
428 HD13 ILE 56 2HD1 ILE 56 1.415 4.218 -5.810
429 H GLN 57 H GLN 57 -1.702 8.071 -1.071
430 HA GLN 57 HA GLN 57 -0.457 10.719 -0.795
431 HB2 GLN 57 2HB GLN 57 -2.680 9.406 0.794
432 HB3 GLN 57 1HB GLN 57 -2.093 11.045 1.040
433 HG2 GLN 57 2HG GLN 57 -3.330 10.051 -1.523
434 HG3 GLN 57 1HG GLN 57 -4.210 10.899 -0.255
435 HE21 GLN 57 1HE2 GLN 57 -3.806 13.096 0.076
436 HE22 GLN 57 2HE2 GLN 57 -3.009 14.067 -1.108
437 H LEU 58 H LEU 58 1.413 10.807 0.316
438 HA LEU 58 HA LEU 58 2.028 8.704 2.276
439 HG LEU 58 HG LEU 58 3.256 9.191 -0.665
440 HB2 LEU 58 2HB LEU 58 3.827 10.817 1.065
441 HB3 LEU 58 1HB LEU 58 4.344 9.531 2.139
442 HD11 LEU 58 1HD1 LEU 58 6.014 8.739 0.482
443 HD12 LEU 58 2HD1 LEU 58 5.537 10.038 -0.614
444 HD13 LEU 58 3HD1 LEU 58 5.509 8.364 -1.167
445 HD21 LEU 58 3HD2 LEU 58 3.724 6.816 -0.399
446 HD22 LEU 58 1HD2 LEU 58 2.539 7.348 0.792
447 HD23 LEU 58 2HD2 LEU 58 4.214 7.080 1.273
448 H MET 59 H MET 59 2.184 9.086 4.418
449 HA MET 59 HA MET 59 1.485 11.773 5.347
450 HB2 MET 59 2HB MET 59 1.621 9.174 6.893
451 HB3 MET 59 1HB MET 59 0.998 10.705 7.494
452 HG2 MET 59 2HG MET 59 -0.168 9.122 5.207
453 HG3 MET 59 1HG MET 59 -0.791 9.159 6.857
454 HE1 MET 59 3HE MET 59 -1.911 12.912 7.191
455 HE2 MET 59 1HE MET 59 -0.350 12.217 7.628
456 HE3 MET 59 2HE MET 59 -1.837 11.344 7.995
457 H MET 60 H MET 60 3.324 12.969 5.350
458 HA MET 60 HA MET 60 5.514 12.052 7.113
459 HB2 MET 60 2HB MET 60 7.019 13.531 5.840
460 HB3 MET 60 1HB MET 60 6.294 12.299 4.819
461 HG2 MET 60 2HG MET 60 4.701 13.941 3.957
462 HG3 MET 60 1HG MET 60 5.419 15.178 4.988
463 HE1 MET 60 3HE MET 60 5.997 12.734 1.987
464 HE2 MET 60 1HE MET 60 7.343 12.320 3.045
465 HE3 MET 60 2HE MET 60 7.650 13.120 1.505
466 H ASP 61 H ASP 61 6.495 13.648 8.481
467 HA ASP 61 HA ASP 61 4.524 15.418 9.612
468 HB2 ASP 61 2HB ASP 61 7.418 15.061 10.415
469 HB3 ASP 61 1HB ASP 61 6.135 15.780 11.381
470 H SER 62 H SER 62 4.180 17.372 8.634
471 HA SER 62 HA SER 62 6.315 19.021 7.617
472 HG SER 62 HG SER 62 4.654 21.350 6.599
473 HB2 SER 62 2HB SER 62 4.013 19.372 6.827
474 HB3 SER 62 1HB SER 62 3.491 19.767 8.464
475 H GLU 63 H GLU 63 5.211 18.142 10.645
476 HA GLU 63 HA GLU 63 5.824 20.382 12.269
477 HB2 GLU 63 2HB GLU 63 4.412 18.469 12.951
478 HB3 GLU 63 1HB GLU 63 5.815 17.416 12.892
479 HG2 GLU 63 2HG GLU 63 6.838 18.759 14.708
480 HG3 GLU 63 1HG GLU 63 5.343 19.691 14.809
481 H THR 64 H THR 64 7.614 17.394 11.587
482 HA THR 64 HA THR 64 10.088 18.621 12.620
483 HB THR 64 HB THR 64 10.916 16.324 12.912
484 HG1 THR 64 HG1 THR 64 9.464 14.575 12.533
485 HG21 THR 64 3HG2 THR 64 8.172 16.709 14.131
486 HG22 THR 64 1HG2 THR 64 9.677 17.377 14.765
487 HG23 THR 64 2HG2 THR 64 9.431 15.631 14.731
488 H GLY 65 H GLY 65 8.582 17.808 9.727
489 HA2 GLY 65 2HA GLY 65 9.364 17.825 7.550
490 HA3 GLY 65 1HA GLY 65 10.973 18.167 8.169
491 H ARG 66 H ARG 66 9.339 15.414 9.466
492 HA ARG 66 HA ARG 66 11.183 13.654 7.950
493 HE ARG 66 HE ARG 66 13.703 12.439 10.155
494 HB2 ARG 66 2HB ARG 66 10.053 13.093 10.701
495 HB3 ARG 66 1HB ARG 66 11.378 12.265 9.892
496 HG2 ARG 66 2HG ARG 66 11.403 15.106 10.914
497 HG3 ARG 66 1HG ARG 66 12.209 13.724 11.650
498 HD2 ARG 66 2HD ARG 66 12.817 14.725 8.867
499 HD3 ARG 66 1HD ARG 66 13.687 15.256 10.305
500 HH11 ARG 66 1HH1 ARG 66 15.061 15.182 8.567
501 HH12 ARG 66 2HH1 ARG 66 16.542 14.368 8.204
502 HH21 ARG 66 1HH2 ARG 66 15.614 11.407 9.662
503 HH22 ARG 66 2HH2 ARG 66 16.838 12.266 8.789
504 H SER 67 H SER 67 10.063 11.173 8.801
505 HA SER 67 HA SER 67 7.500 11.226 7.318
506 HG SER 67 HG SER 67 10.029 10.773 6.057
507 HB2 SER 67 2HB SER 67 9.556 9.008 7.504
508 HB3 SER 67 1HB SER 67 8.007 8.873 6.673
509 H LYS 68 H LYS 68 5.698 10.290 8.171
510 HA LYS 68 HA LYS 68 5.721 9.571 10.962
511 HB2 LYS 68 2HB LYS 68 3.476 9.601 8.932
512 HB3 LYS 68 1HB LYS 68 3.261 9.303 10.651
513 HG2 LYS 68 2HG LYS 68 4.056 11.519 11.187
514 HG3 LYS 68 1HG LYS 68 4.430 11.832 9.494
515 HD2 LYS 68 2HD LYS 68 2.080 11.727 8.921
516 HD3 LYS 68 1HD LYS 68 1.668 11.279 10.578
517 HE2 LYS 68 2HE LYS 68 2.944 13.882 9.732
518 HE3 LYS 68 1HE LYS 68 1.237 13.661 10.118
519 HZ1 LYS 68 3HZ LYS 68 2.448 14.570 11.993
520 HZ2 LYS 68 1HZ LYS 68 3.505 13.247 11.993
521 HZ3 LYS 68 2HZ LYS 68 1.870 13.024 12.364
522 H GLY 69 H GLY 69 5.691 7.818 7.944
523 HA2 GLY 69 2HA GLY 69 6.609 5.599 7.927
524 HA3 GLY 69 1HA GLY 69 5.924 5.333 9.516
525 H TYR 70 H TYR 70 3.584 6.818 7.600
526 HA TYR 70 HA TYR 70 2.650 4.326 6.397
527 HD1 TYR 70 HD1 TYR 70 -0.638 6.865 7.609
528 HD2 TYR 70 HD2 TYR 70 2.409 5.590 10.299
529 HE1 TYR 70 HE1 TYR 70 -1.215 8.708 9.129
530 HE2 TYR 70 HE2 TYR 70 1.842 7.437 11.825
531 HH TYR 70 HH TYR 70 0.769 9.637 11.751
532 HB2 TYR 70 2HB TYR 70 0.359 4.639 7.414
533 HB3 TYR 70 1HB TYR 70 1.620 4.118 8.523
534 H GLY 71 H GLY 71 0.909 4.556 4.873
535 HA2 GLY 71 2HA GLY 71 0.174 7.257 4.025
536 HA3 GLY 71 1HA GLY 71 1.114 6.305 2.884
537 H PHE 72 H PHE 72 -1.462 7.273 2.307
538 HA PHE 72 HA PHE 72 -3.143 4.837 2.373
539 HD1 PHE 72 HD1 PHE 72 -2.894 8.368 4.164
540 HD2 PHE 72 HD2 PHE 72 -5.832 5.288 3.940
541 HE1 PHE 72 HE1 PHE 72 -3.224 8.507 6.597
542 HE2 PHE 72 HE2 PHE 72 -6.163 5.427 6.371
543 HZ PHE 72 HZ PHE 72 -4.859 7.036 7.707
544 HB2 PHE 72 2HB PHE 72 -3.963 7.735 2.023
545 HB3 PHE 72 1HB PHE 72 -5.062 6.362 1.953
546 H ILE 73 H ILE 73 -3.428 3.779 0.490
547 HA ILE 73 HA ILE 73 -2.862 5.213 -2.038
548 HB ILE 73 HB ILE 73 -2.625 2.246 -1.475
549 HG12 ILE 73 2HG1 ILE 73 -0.463 4.330 -1.926
550 HG13 ILE 73 1HG1 ILE 73 -0.875 3.611 -0.373
551 HG21 ILE 73 1HG2 ILE 73 -1.922 3.822 -3.960
552 HG22 ILE 73 2HG2 ILE 73 -3.264 2.689 -3.790
553 HG23 ILE 73 3HG2 ILE 73 -1.602 2.105 -3.703
554 HD11 ILE 73 3HD1 ILE 73 0.237 2.156 -2.763
555 HD12 ILE 73 1HD1 ILE 73 -0.202 1.416 -1.223
556 HD13 ILE 73 2HD1 ILE 73 1.111 2.590 -1.293
557 H THR 74 H THR 74 -4.388 5.299 -3.588
558 HA THR 74 HA THR 74 -6.994 4.016 -3.062
559 HB THR 74 HB THR 74 -6.357 6.277 -4.983
560 HG1 THR 74 HG1 THR 74 -6.153 7.214 -3.034
561 HG21 THR 74 3HG2 THR 74 -8.362 5.027 -5.620
562 HG22 THR 74 1HG2 THR 74 -8.796 6.625 -5.010
563 HG23 THR 74 2HG2 THR 74 -9.007 5.203 -3.987
564 H PHE 75 H PHE 75 -7.637 2.337 -4.267
565 HA PHE 75 HA PHE 75 -6.350 1.825 -6.879
566 HD1 PHE 75 HD1 PHE 75 -6.192 0.590 -3.180
567 HD2 PHE 75 HD2 PHE 75 -4.838 -0.991 -6.899
568 HE1 PHE 75 HE1 PHE 75 -4.008 0.084 -2.170
569 HE2 PHE 75 HE2 PHE 75 -2.654 -1.497 -5.891
570 HZ PHE 75 HZ PHE 75 -2.240 -0.962 -3.527
571 HB2 PHE 75 2HB PHE 75 -7.762 -0.078 -4.989
572 HB3 PHE 75 1HB PHE 75 -7.137 -0.526 -6.572
573 H SER 76 H SER 76 -7.660 1.132 -8.661
574 HA SER 76 HA SER 76 -10.029 2.620 -9.009
575 HG SER 76 HG SER 76 -8.593 3.009 -11.133
576 HB2 SER 76 2HB SER 76 -9.070 0.259 -10.648
577 HB3 SER 76 1HB SER 76 -10.226 1.484 -11.168
578 H ASP 77 H ASP 77 -9.513 -0.647 -7.906
579 HA ASP 77 HA ASP 77 -12.421 -1.145 -7.941
580 HB2 ASP 77 2HB ASP 77 -11.244 -2.349 -9.758
581 HB3 ASP 77 1HB ASP 77 -10.224 -3.135 -8.561
582 H SER 78 H SER 78 -13.269 -2.387 -6.230
583 HA SER 78 HA SER 78 -11.818 -2.164 -3.757
584 HG SER 78 HG SER 78 -12.956 -3.173 -2.026
585 HB2 SER 78 2HB SER 78 -14.256 -1.801 -3.848
586 HB3 SER 78 1HB SER 78 -14.488 -3.496 -4.277
587 H GLU 79 H GLU 79 -12.587 -4.842 -5.934
588 HA GLU 79 HA GLU 79 -11.750 -6.869 -4.059
589 HB2 GLU 79 2HB GLU 79 -13.437 -7.374 -5.764
590 HB3 GLU 79 1HB GLU 79 -12.274 -7.040 -7.038
591 HG2 GLU 79 2HG GLU 79 -12.598 -9.436 -6.707
592 HG3 GLU 79 1HG GLU 79 -10.938 -8.953 -6.368
593 H CYS 80 H CYS 80 -10.262 -5.191 -6.820
594 HA CYS 80 HA CYS 80 -7.836 -6.657 -6.864
595 HG CYS 80 HG CYS 80 -7.235 -2.598 -6.592
596 HB2 CYS 80 2HB CYS 80 -6.895 -4.862 -8.142
597 HB3 CYS 80 1HB CYS 80 -8.581 -4.999 -8.626
598 H ALA 81 H ALA 81 -8.768 -3.701 -5.124
599 HA ALA 81 HA ALA 81 -6.358 -3.346 -3.682
600 HB1 ALA 81 3HB ALA 81 -7.686 -1.917 -2.200
601 HB2 ALA 81 1HB ALA 81 -9.170 -2.536 -2.926
602 HB3 ALA 81 2HB ALA 81 -8.045 -1.586 -3.894
603 H LYS 82 H LYS 82 -9.400 -4.976 -2.805
604 HA LYS 82 HA LYS 82 -8.750 -5.924 -0.279
605 HB2 LYS 82 2HB LYS 82 -10.979 -6.132 -1.021
606 HB3 LYS 82 1HB LYS 82 -10.505 -6.985 -2.481
607 HG2 LYS 82 2HG LYS 82 -10.018 -8.978 -1.232
608 HG3 LYS 82 1HG LYS 82 -10.279 -8.132 0.299
609 HD2 LYS 82 2HD LYS 82 -12.590 -7.984 -0.030
610 HD3 LYS 82 1HD LYS 82 -12.457 -8.253 -1.771
611 HE2 LYS 82 2HE LYS 82 -11.862 -10.333 0.341
612 HE3 LYS 82 1HE LYS 82 -13.395 -10.192 -0.523
613 HZ1 LYS 82 3HZ LYS 82 -12.124 -11.818 -1.636
614 HZ2 LYS 82 1HZ LYS 82 -10.739 -10.849 -1.663
615 HZ3 LYS 82 2HZ LYS 82 -12.072 -10.443 -2.616
616 H LYS 83 H LYS 83 -8.084 -7.431 -3.432
617 HA LYS 83 HA LYS 83 -6.841 -9.770 -2.448
618 HB2 LYS 83 2HB LYS 83 -7.668 -9.507 -4.766
619 HB3 LYS 83 1HB LYS 83 -6.387 -8.346 -5.084
620 HG2 LYS 83 2HG LYS 83 -4.707 -10.087 -4.725
621 HG3 LYS 83 1HG LYS 83 -5.985 -11.253 -4.374
622 HD2 LYS 83 2HD LYS 83 -6.882 -10.934 -6.647
623 HD3 LYS 83 1HD LYS 83 -5.584 -9.791 -6.994
624 HE2 LYS 83 2HE LYS 83 -3.931 -11.574 -6.640
625 HE3 LYS 83 1HE LYS 83 -5.234 -12.711 -6.298
626 HZ1 LYS 83 3HZ LYS 83 -4.810 -11.289 -8.868
627 HZ2 LYS 83 1HZ LYS 83 -6.067 -12.371 -8.544
628 HZ3 LYS 83 2HZ LYS 83 -4.467 -12.918 -8.574
629 H ALA 84 H ALA 84 -5.498 -6.616 -3.419
630 HA ALA 84 HA ALA 84 -2.774 -7.181 -3.043
631 HB1 ALA 84 3HB ALA 84 -4.213 -4.551 -2.633
632 HB2 ALA 84 1HB ALA 84 -3.575 -5.158 -4.162
633 HB3 ALA 84 2HB ALA 84 -2.473 -4.756 -2.846
634 H LEU 85 H LEU 85 -5.037 -5.603 -0.786
635 HA LEU 85 HA LEU 85 -3.454 -5.418 1.473
636 HG LEU 85 HG LEU 85 -4.837 -4.961 3.622
637 HB2 LEU 85 2HB LEU 85 -5.696 -4.434 1.217
638 HB3 LEU 85 1HB LEU 85 -6.418 -6.027 1.281
639 HD11 LEU 85 1HD1 LEU 85 -6.501 -3.260 3.100
640 HD12 LEU 85 2HD1 LEU 85 -6.940 -4.127 4.574
641 HD13 LEU 85 3HD1 LEU 85 -7.767 -4.489 3.059
642 HD21 LEU 85 3HD2 LEU 85 -5.406 -7.340 3.665
643 HD22 LEU 85 1HD2 LEU 85 -7.106 -6.953 3.400
644 HD23 LEU 85 2HD2 LEU 85 -6.314 -6.464 4.898
645 H GLU 86 H GLU 86 -5.653 -8.072 0.618
646 HA GLU 86 HA GLU 86 -5.282 -9.714 2.814
647 HB2 GLU 86 2HB GLU 86 -7.040 -9.910 1.077
648 HB3 GLU 86 1HB GLU 86 -5.841 -10.532 -0.043
649 HG2 GLU 86 2HG GLU 86 -5.492 -12.462 1.463
650 HG3 GLU 86 1HG GLU 86 -6.780 -11.846 2.500
651 H GLN 87 H GLN 87 -3.259 -9.432 -0.071
652 HA GLN 87 HA GLN 87 -1.663 -11.761 0.733
653 HB2 GLN 87 2HB GLN 87 -1.999 -10.202 -1.794
654 HB3 GLN 87 1HB GLN 87 -0.498 -11.080 -1.551
655 HG2 GLN 87 2HG GLN 87 -2.307 -12.264 -2.852
656 HG3 GLN 87 1HG GLN 87 -1.591 -13.158 -1.516
657 HE21 GLN 87 1HE2 GLN 87 -4.429 -11.468 -2.625
658 HE22 GLN 87 2HE2 GLN 87 -5.513 -12.134 -1.457
659 H LEU 88 H LEU 88 -1.427 -8.278 0.773
660 HA LEU 88 HA LEU 88 1.503 -8.424 0.972
661 HG LEU 88 HG LEU 88 -0.072 -7.492 -1.496
662 HB2 LEU 88 2HB LEU 88 -0.312 -6.065 0.502
663 HB3 LEU 88 1HB LEU 88 1.433 -5.962 0.638
664 HD11 LEU 88 1HD1 LEU 88 -0.262 -5.086 -1.786
665 HD12 LEU 88 2HD1 LEU 88 0.777 -5.790 -3.027
666 HD13 LEU 88 3HD1 LEU 88 1.491 -4.917 -1.668
667 HD21 LEU 88 3HD2 LEU 88 2.133 -7.787 -2.541
668 HD22 LEU 88 1HD2 LEU 88 2.037 -8.580 -0.967
669 HD23 LEU 88 2HD2 LEU 88 2.896 -7.046 -1.131
670 H ASN 89 H ASN 89 -1.154 -8.065 3.110
671 HA ASN 89 HA ASN 89 0.124 -6.371 5.018
672 HB2 ASN 89 2HB ASN 89 -1.550 -7.419 6.654
673 HB3 ASN 89 1HB ASN 89 -2.195 -6.502 5.299
674 HD21 ASN 89 1HD2 ASN 89 -4.148 -7.540 5.416
675 HD22 ASN 89 2HD2 ASN 89 -4.362 -9.168 4.895
676 H GLY 90 H GLY 90 2.205 -7.071 5.254
677 HA2 GLY 90 2HA GLY 90 3.423 -8.290 7.097
678 HA3 GLY 90 1HA GLY 90 2.620 -9.734 6.494
679 H PHE 91 H PHE 91 3.204 -7.985 3.814
680 HA PHE 91 HA PHE 91 5.242 -9.605 2.786
681 HD1 PHE 91 HD1 PHE 91 5.091 -9.866 -0.080
682 HD2 PHE 91 HD2 PHE 91 6.303 -5.912 0.960
683 HE1 PHE 91 HE1 PHE 91 6.715 -9.874 -1.932
684 HE2 PHE 91 HE2 PHE 91 7.924 -5.918 -0.887
685 HZ PHE 91 HZ PHE 91 8.130 -7.898 -2.335
686 HB2 PHE 91 2HB PHE 91 3.690 -8.382 1.356
687 HB3 PHE 91 1HB PHE 91 4.336 -6.846 1.918
688 H GLU 92 H GLU 92 7.443 -9.468 2.743
689 HA GLU 92 HA GLU 92 8.714 -7.774 4.666
690 HB2 GLU 92 2HB GLU 92 9.927 -9.635 2.608
691 HB3 GLU 92 1HB GLU 92 10.811 -8.859 3.916
692 HG2 GLU 92 2HG GLU 92 9.394 -10.054 5.548
693 HG3 GLU 92 1HG GLU 92 8.582 -10.871 4.212
694 H LEU 93 H LEU 93 8.433 -5.654 4.027
695 HA LEU 93 HA LEU 93 9.680 -4.782 1.513
696 HG LEU 93 HG LEU 93 9.408 -1.688 2.433
697 HB2 LEU 93 2HB LEU 93 7.442 -3.933 1.905
698 HB3 LEU 93 1HB LEU 93 7.907 -3.330 3.485
699 HD11 LEU 93 1HD1 LEU 93 8.371 -2.796 -0.175
700 HD12 LEU 93 2HD1 LEU 93 10.024 -2.894 0.430
701 HD13 LEU 93 3HD1 LEU 93 9.336 -1.329 0.003
702 HD21 LEU 93 3HD2 LEU 93 6.592 -1.610 1.337
703 HD22 LEU 93 1HD2 LEU 93 7.691 -0.237 1.465
704 HD23 LEU 93 2HD2 LEU 93 7.108 -1.037 2.922
705 H ALA 94 H ALA 94 11.699 -4.009 1.546
706 HA ALA 94 HA ALA 94 13.698 -3.186 2.251
707 HB1 ALA 94 3HB ALA 94 13.678 -1.291 3.777
708 HB2 ALA 94 1HB ALA 94 12.030 -1.685 4.272
709 HB3 ALA 94 2HB ALA 94 12.353 -1.160 2.618
710 H GLY 95 H GLY 95 12.366 -5.563 3.669
711 HA2 GLY 95 2HA GLY 95 13.752 -7.104 4.927
712 HA3 GLY 95 1HA GLY 95 14.348 -5.738 5.856
713 H ARG 96 H ARG 96 11.376 -4.810 5.854
714 HA ARG 96 HA ARG 96 10.666 -6.405 8.243
715 HE ARG 96 HE ARG 96 8.204 -2.662 9.309
716 HB2 ARG 96 2HB ARG 96 9.689 -4.374 9.185
717 HB3 ARG 96 1HB ARG 96 11.381 -4.119 8.781
718 HG2 ARG 96 2HG ARG 96 10.769 -2.895 6.789
719 HG3 ARG 96 1HG ARG 96 9.061 -3.240 7.067
720 HD2 ARG 96 2HD ARG 96 10.821 -1.664 8.950
721 HD3 ARG 96 1HD ARG 96 9.738 -0.950 7.755
722 HH11 ARG 96 1HH1 ARG 96 10.121 0.149 9.835
723 HH12 ARG 96 2HH1 ARG 96 9.096 0.745 11.093
724 HH21 ARG 96 1HH2 ARG 96 6.904 -1.897 10.923
725 HH22 ARG 96 2HH2 ARG 96 7.273 -0.391 11.688
726 HA PRO 97 HA PRO 97 6.701 -7.329 6.439
727 HB2 PRO 97 2HB PRO 97 5.068 -7.184 8.651
728 HB3 PRO 97 1HB PRO 97 6.115 -8.558 8.281
729 HG2 PRO 97 2HG PRO 97 6.582 -6.265 10.152
730 HG3 PRO 97 1HG PRO 97 6.925 -7.990 10.386
731 HD2 PRO 97 2HD PRO 97 8.863 -6.234 9.741
732 HD3 PRO 97 1HD PRO 97 8.875 -7.901 9.129
733 H MET 98 H MET 98 5.117 -6.214 5.422
734 HA MET 98 HA MET 98 4.824 -3.359 6.029
735 HB2 MET 98 2HB MET 98 5.447 -3.872 3.759
736 HB3 MET 98 1HB MET 98 4.126 -5.018 3.595
737 HG2 MET 98 2HG MET 98 2.504 -3.265 3.608
738 HG3 MET 98 1HG MET 98 3.726 -2.066 4.043
739 HE1 MET 98 3HE MET 98 3.686 -4.232 -0.041
740 HE2 MET 98 1HE MET 98 2.528 -4.578 1.244
741 HE3 MET 98 2HE MET 98 4.229 -4.994 1.454
742 H LYS 99 H LYS 99 3.077 -2.623 7.072
743 HA LYS 99 HA LYS 99 0.903 -4.468 7.659
744 HB2 LYS 99 2HB LYS 99 1.629 -1.740 8.736
745 HB3 LYS 99 1HB LYS 99 0.192 -2.621 9.241
746 HG2 LYS 99 2HG LYS 99 3.025 -3.625 9.527
747 HG3 LYS 99 1HG LYS 99 2.079 -2.866 10.811
748 HD2 LYS 99 2HD LYS 99 0.390 -4.667 10.581
749 HD3 LYS 99 1HD LYS 99 1.411 -5.442 9.368
750 HE2 LYS 99 2HE LYS 99 3.171 -5.758 11.010
751 HE3 LYS 99 1HE LYS 99 2.230 -4.887 12.224
752 HZ1 LYS 99 3HZ LYS 99 0.540 -6.616 12.087
753 HZ2 LYS 99 1HZ LYS 99 2.040 -7.266 12.519
754 HZ3 LYS 99 2HZ LYS 99 1.458 -7.454 10.942
755 H VAL 100 H VAL 100 -0.499 -4.579 5.962
756 HA VAL 100 HA VAL 100 -1.660 -2.062 4.956
757 HB VAL 100 HB VAL 100 -2.007 -4.817 3.744
758 HG11 VAL 100 1HG1 VAL 100 -2.472 -2.042 2.623
759 HG12 VAL 100 2HG1 VAL 100 -3.718 -3.190 3.117
760 HG13 VAL 100 3HG1 VAL 100 -2.681 -3.557 1.741
761 HG21 VAL 100 3HG2 VAL 100 0.036 -2.693 3.042
762 HG22 VAL 100 1HG2 VAL 100 -0.299 -4.137 2.084
763 HG23 VAL 100 2HG2 VAL 100 0.362 -4.292 3.710
764 H GLY 101 H GLY 101 -3.673 -1.506 5.565
765 HA2 GLY 101 2HA GLY 101 -5.658 -3.573 6.194
766 HA3 GLY 101 1HA GLY 101 -5.250 -2.448 7.480
767 H HIS 102 H HIS 102 -7.849 -2.776 6.352
768 HA HIS 102 HA HIS 102 -8.527 -0.685 4.575
769 HD1 HIS 102 HD1 HIS 102 -10.229 -0.723 8.349
770 HD2 HIS 102 HD2 HIS 102 -10.574 -4.478 6.596
771 HE1 HIS 102 HE1 HIS 102 -10.646 -2.315 10.239
772 HE2 HIS 102 HE2 HIS 102 -10.643 -4.591 9.179
773 HB2 HIS 102 2HB HIS 102 -10.849 -0.957 5.542
774 HB3 HIS 102 1HB HIS 102 -10.119 -2.432 4.918
775 H VAL 103 H VAL 103 -10.217 1.057 5.376
776 HA VAL 103 HA VAL 103 -8.774 2.911 7.014
777 HB VAL 103 HB VAL 103 -11.662 3.206 6.126
778 HG11 VAL 103 1HG1 VAL 103 -11.110 5.606 6.021
779 HG12 VAL 103 2HG1 VAL 103 -9.482 5.250 6.601
780 HG13 VAL 103 3HG1 VAL 103 -10.875 4.948 7.640
781 HG21 VAL 103 3HG2 VAL 103 -10.356 2.492 4.191
782 HG22 VAL 103 1HG2 VAL 103 -9.178 3.769 4.498
783 HG23 VAL 103 2HG2 VAL 103 -10.827 4.185 4.029
784 H THR 104 H THR 104 -10.384 4.183 8.725
785 HA THR 104 HA THR 104 -10.263 2.848 11.073
786 HB THR 104 HB THR 104 -11.911 4.430 12.011
787 HG1 THR 104 HG1 THR 104 -13.115 5.723 10.699
788 HG21 THR 104 3HG2 THR 104 -9.594 5.160 11.673
789 HG22 THR 104 1HG2 THR 104 -10.720 6.497 11.430
790 HG23 THR 104 2HG2 THR 104 -9.992 5.693 10.039
791 H GLU 105 H GLU 105 -13.346 3.160 9.256
792 HA GLU 105 HA GLU 105 -15.124 1.743 9.024
793 HB2 GLU 105 2HB GLU 105 -13.436 -0.225 10.585
794 HB3 GLU 105 1HB GLU 105 -14.995 -0.605 9.868
795 HG2 GLU 105 2HG GLU 105 -12.622 0.354 8.279
796 HG3 GLU 105 1HG GLU 105 -12.994 -1.345 8.554
797 H ARG 106 H ARG 106 -13.794 1.923 12.292
798 HA ARG 106 HA ARG 106 -15.904 0.952 13.779
799 HE ARG 106 HE ARG 106 -10.889 2.057 14.946
800 HB2 ARG 106 2HB ARG 106 -13.862 3.067 14.427
801 HB3 ARG 106 1HB ARG 106 -14.999 2.450 15.617
802 HG2 ARG 106 2HG ARG 106 -14.104 0.200 15.335
803 HG3 ARG 106 1HG ARG 106 -12.982 0.792 14.107
804 HD2 ARG 106 2HD ARG 106 -13.049 1.834 16.938
805 HD3 ARG 106 1HD ARG 106 -12.015 0.503 16.421
806 HH11 ARG 106 1HH1 ARG 106 -12.979 3.525 17.269
807 HH12 ARG 106 2HH1 ARG 106 -12.042 4.979 17.333
808 HH21 ARG 106 1HH2 ARG 106 -9.734 3.935 15.013
809 HH22 ARG 106 2HH2 ARG 106 -10.242 5.218 16.055
810 H THR 107 H THR 107 -17.669 1.758 14.801
811 HA THR 107 HA THR 107 -19.067 3.888 13.456
812 HB THR 107 HB THR 107 -20.245 1.835 14.049
813 HG1 THR 107 HG1 THR 107 -21.141 4.257 14.442
814 HG21 THR 107 3HG2 THR 107 -20.794 1.309 16.383
815 HG22 THR 107 1HG2 THR 107 -19.784 2.654 16.924
816 HG23 THR 107 2HG2 THR 107 -19.054 1.271 16.110
817 H ASP 108 H ASP 108 -16.825 4.211 15.782
818 HA ASP 108 HA ASP 108 -17.783 5.540 17.957
819 HB2 ASP 108 2HB ASP 108 -15.316 6.161 16.317
820 HB3 ASP 108 1HB ASP 108 -15.644 6.911 17.876
Start of MODEL 4
1 HA MET 1 HA MET 1 15.425 17.626 6.243
2 H1 MET 1 1H MET 1 16.979 16.998 4.514
3 H2 MET 1 2H MET 1 15.615 16.005 4.499
4 H3 MET 1 3H MET 1 17.071 15.422 5.130
5 HB2 MET 1 2HB MET 1 15.957 14.822 7.262
6 HB3 MET 1 1HB MET 1 15.129 16.074 8.178
7 HG2 MET 1 2HG MET 1 13.374 16.153 6.468
8 HG3 MET 1 1HG MET 1 14.201 14.879 5.573
9 HE1 MET 1 3HE MET 1 11.133 14.713 6.422
10 HE2 MET 1 1HE MET 1 11.034 13.046 6.989
11 HE3 MET 1 2HE MET 1 11.965 13.430 5.540
12 H GLY 2 H GLY 2 17.947 15.362 7.419
13 HA2 GLY 2 2HA GLY 2 19.879 15.729 8.594
14 HA3 GLY 2 1HA GLY 2 19.997 17.242 7.711
15 H HIS 3 H HIS 3 20.901 18.244 9.562
16 HA HIS 3 HA HIS 3 20.859 19.600 11.374
17 HD1 HIS 3 HD1 HIS 3 17.726 19.872 8.629
18 HD2 HIS 3 HD2 HIS 3 19.948 22.640 10.790
19 HE1 HIS 3 HE1 HIS 3 18.096 21.803 7.069
20 HE2 HIS 3 HE2 HIS 3 19.536 23.415 8.360
21 HB2 HIS 3 2HB HIS 3 17.851 19.353 11.137
22 HB3 HIS 3 1HB HIS 3 18.694 20.506 12.168
23 H HIS 4 H HIS 4 21.529 18.984 13.314
24 HA HIS 4 HA HIS 4 20.818 16.476 14.444
25 HD1 HIS 4 HD1 HIS 4 23.980 19.159 13.769
26 HD2 HIS 4 HD2 HIS 4 23.694 15.184 14.934
27 HE1 HIS 4 HE1 HIS 4 25.872 17.987 12.620
28 HE2 HIS 4 HE2 HIS 4 25.548 15.560 13.169
29 HB2 HIS 4 2HB HIS 4 22.339 18.797 15.662
30 HB3 HIS 4 1HB HIS 4 22.234 17.181 16.358
31 H HIS 5 H HIS 5 18.561 16.565 14.673
32 HA HIS 5 HA HIS 5 17.644 18.047 17.061
33 HD1 HIS 5 HD1 HIS 5 14.072 16.634 16.376
34 HD2 HIS 5 HD2 HIS 5 15.235 20.623 16.488
35 HE1 HIS 5 HE1 HIS 5 12.262 17.827 17.636
36 HE2 HIS 5 HE2 HIS 5 12.908 20.254 17.559
37 HB2 HIS 5 2HB HIS 5 16.702 18.934 14.908
38 HB3 HIS 5 1HB HIS 5 15.976 17.358 14.622
39 H HIS 6 H HIS 6 16.914 16.760 18.654
40 HA HIS 6 HA HIS 6 16.868 13.934 18.387
41 HD1 HIS 6 HD1 HIS 6 18.453 12.957 20.434
42 HD2 HIS 6 HD2 HIS 6 18.207 17.018 21.268
43 HE1 HIS 6 HE1 HIS 6 20.737 13.623 21.208
44 HE2 HIS 6 HE2 HIS 6 20.518 16.026 21.887
45 HB2 HIS 6 2HB HIS 6 15.872 15.725 20.616
46 HB3 HIS 6 1HB HIS 6 15.969 13.969 20.724
47 H HIS 7 H HIS 7 14.758 12.824 19.545
48 HA HIS 7 HA HIS 7 12.781 12.957 17.485
49 HD1 HIS 7 HD1 HIS 7 11.917 8.936 18.130
50 HD2 HIS 7 HD2 HIS 7 15.387 11.218 17.953
51 HE1 HIS 7 HE1 HIS 7 13.580 7.541 16.865
52 HE2 HIS 7 HE2 HIS 7 15.715 8.858 16.953
53 HB2 HIS 7 2HB HIS 7 12.893 11.427 20.090
54 HB3 HIS 7 1HB HIS 7 11.558 11.281 18.953
55 H HIS 8 H HIS 8 12.135 13.144 20.983
56 HA HIS 8 HA HIS 8 10.711 14.370 22.240
57 HD1 HIS 8 HD1 HIS 8 10.345 16.398 23.789
58 HD2 HIS 8 HD2 HIS 8 9.205 18.383 20.323
59 HE1 HIS 8 HE1 HIS 8 8.674 18.117 24.523
60 HE2 HIS 8 HE2 HIS 8 7.846 19.157 22.389
61 HB2 HIS 8 2HB HIS 8 12.036 16.280 21.507
62 HB3 HIS 8 1HB HIS 8 11.067 16.426 20.044
63 H SER 9 H SER 9 8.541 14.601 22.599
64 HA SER 9 HA SER 9 6.292 14.548 22.286
65 HG SER 9 HG SER 9 6.357 17.378 20.100
66 HB2 SER 9 2HB SER 9 6.928 15.283 19.412
67 HB3 SER 9 1HB SER 9 5.324 15.318 20.140
68 H HIS 10 H HIS 10 4.520 13.413 21.098
69 HA HIS 10 HA HIS 10 5.256 11.276 19.293
70 HD1 HIS 10 HD1 HIS 10 5.709 11.247 23.560
71 HD2 HIS 10 HD2 HIS 10 1.862 10.314 22.301
72 HE1 HIS 10 HE1 HIS 10 4.238 11.628 25.553
73 HE2 HIS 10 HE2 HIS 10 1.966 10.834 24.826
74 HB2 HIS 10 2HB HIS 10 4.059 9.532 20.702
75 HB3 HIS 10 1HB HIS 10 5.633 10.046 21.295
76 H MET 11 H MET 11 3.960 12.694 17.960
77 HA MET 11 HA MET 11 1.153 13.051 18.636
78 HB2 MET 11 2HB MET 11 2.721 13.980 16.215
79 HB3 MET 11 1HB MET 11 1.074 14.456 16.609
80 HG2 MET 11 2HG MET 11 1.890 15.496 18.683
81 HG3 MET 11 1HG MET 11 3.536 15.045 18.247
82 HE1 MET 11 3HE MET 11 4.133 17.204 15.020
83 HE2 MET 11 1HE MET 11 3.463 15.572 15.047
84 HE3 MET 11 2HE MET 11 4.805 15.993 16.110
85 H ALA 12 H ALA 12 -0.056 11.273 18.356
86 HA ALA 12 HA ALA 12 0.140 9.790 15.802
87 HB1 ALA 12 3HB ALA 12 -0.746 7.860 16.965
88 HB2 ALA 12 1HB ALA 12 -0.963 8.809 18.439
89 HB3 ALA 12 2HB ALA 12 0.661 8.478 17.833
90 H ALA 13 H ALA 13 -2.180 8.507 15.607
91 HA ALA 13 HA ALA 13 -4.263 10.606 15.684
92 HB1 ALA 13 3HB ALA 13 -3.502 10.114 13.397
93 HB2 ALA 13 1HB ALA 13 -5.193 9.677 13.639
94 HB3 ALA 13 2HB ALA 13 -3.952 8.423 13.618
95 H ALA 14 H ALA 14 -6.366 10.013 16.253
96 HA ALA 14 HA ALA 14 -6.668 7.866 18.070
97 HB1 ALA 14 3HB ALA 14 -8.808 9.509 16.705
98 HB2 ALA 14 1HB ALA 14 -7.995 9.918 18.214
99 HB3 ALA 14 2HB ALA 14 -9.034 8.495 18.131
100 H MET 15 H MET 15 -7.041 5.767 17.690
101 HA MET 15 HA MET 15 -7.130 4.620 15.157
102 HB2 MET 15 2HB MET 15 -8.149 3.418 17.740
103 HB3 MET 15 1HB MET 15 -7.724 2.525 16.285
104 HG2 MET 15 2HG MET 15 -5.859 4.102 18.049
105 HG3 MET 15 1HG MET 15 -5.946 2.348 17.888
106 HE1 MET 15 3HE MET 15 -2.491 3.196 16.245
107 HE2 MET 15 1HE MET 15 -3.326 2.243 17.474
108 HE3 MET 15 2HE MET 15 -3.226 3.997 17.634
109 H ALA 16 H ALA 16 -8.665 5.061 13.691
110 HA ALA 16 HA ALA 16 -11.413 5.550 14.441
111 HB1 ALA 16 3HB ALA 16 -10.305 6.864 12.688
112 HB2 ALA 16 1HB ALA 16 -11.757 6.059 12.091
113 HB3 ALA 16 2HB ALA 16 -10.164 5.413 11.697
114 H ASN 17 H ASN 17 -9.741 2.727 13.958
115 HA ASN 17 HA ASN 17 -11.482 1.244 12.295
116 HB2 ASN 17 2HB ASN 17 -9.147 0.556 12.844
117 HB3 ASN 17 1HB ASN 17 -9.674 0.173 14.480
118 HD21 ASN 17 1HD2 ASN 17 -11.564 -0.415 11.575
119 HD22 ASN 17 2HD2 ASN 17 -11.532 -2.135 11.701
120 H ASN 18 H ASN 18 -13.540 1.836 13.024
121 HA ASN 18 HA ASN 18 -14.844 -0.006 14.715
122 HB2 ASN 18 2HB ASN 18 -13.834 1.346 16.526
123 HB3 ASN 18 1HB ASN 18 -14.573 2.798 15.854
124 HD21 ASN 18 1HD2 ASN 18 -15.742 3.190 17.735
125 HD22 ASN 18 2HD2 ASN 18 -17.098 2.225 18.192
126 H LEU 19 H LEU 19 -14.967 3.336 13.508
127 HA LEU 19 HA LEU 19 -17.734 3.090 12.652
128 HG LEU 19 HG LEU 19 -16.059 5.188 14.472
129 HB2 LEU 19 2HB LEU 19 -15.695 5.251 12.054
130 HB3 LEU 19 1HB LEU 19 -17.426 5.357 11.775
131 HD11 LEU 19 1HD1 LEU 19 -15.790 7.360 13.424
132 HD12 LEU 19 2HD1 LEU 19 -16.913 7.469 14.778
133 HD13 LEU 19 3HD1 LEU 19 -17.525 7.458 13.123
134 HD21 LEU 19 3HD2 LEU 19 -18.310 5.560 15.410
135 HD22 LEU 19 1HD2 LEU 19 -18.182 4.023 14.556
136 HD23 LEU 19 2HD2 LEU 19 -18.997 5.390 13.794
137 H GLN 20 H GLN 20 -16.494 1.034 11.539
138 HA GLN 20 HA GLN 20 -15.222 1.735 9.000
139 HB2 GLN 20 2HB GLN 20 -14.356 0.028 10.770
140 HB3 GLN 20 1HB GLN 20 -15.562 -1.053 10.093
141 HG2 GLN 20 2HG GLN 20 -13.744 -1.660 8.864
142 HG3 GLN 20 1HG GLN 20 -14.406 -0.402 7.822
143 HE21 GLN 20 1HE2 GLN 20 -12.477 0.164 6.893
144 HE22 GLN 20 2HE2 GLN 20 -11.193 0.935 7.756
145 H LYS 21 H LYS 21 -17.086 2.316 7.700
146 HA LYS 21 HA LYS 21 -18.368 -0.013 6.549
147 HB2 LYS 21 2HB LYS 21 -20.668 0.749 6.850
148 HB3 LYS 21 1HB LYS 21 -19.889 0.438 8.392
149 HG2 LYS 21 2HG LYS 21 -19.586 2.822 8.756
150 HG3 LYS 21 1HG LYS 21 -20.287 3.172 7.173
151 HD2 LYS 21 2HD LYS 21 -21.707 1.809 9.474
152 HD3 LYS 21 1HD LYS 21 -21.923 3.491 8.985
153 HE2 LYS 21 2HE LYS 21 -22.809 2.785 6.833
154 HE3 LYS 21 1HE LYS 21 -22.498 1.095 7.228
155 HZ1 LYS 21 3HZ LYS 21 -24.110 1.223 8.995
156 HZ2 LYS 21 1HZ LYS 21 -24.825 1.713 7.544
157 HZ3 LYS 21 2HZ LYS 21 -24.376 2.865 8.696
158 H GLY 22 H GLY 22 -18.899 0.206 4.457
159 HA2 GLY 22 2HA GLY 22 -19.503 1.211 2.458
160 HA3 GLY 22 1HA GLY 22 -19.550 2.760 3.277
161 H SER 23 H SER 23 -18.556 2.553 0.736
162 HA SER 23 HA SER 23 -15.779 3.385 1.158
163 HG SER 23 HG SER 23 -16.404 0.729 -1.886
164 HB2 SER 23 2HB SER 23 -15.025 2.206 -0.871
165 HB3 SER 23 1HB SER 23 -15.660 1.060 0.310
166 H ALA 24 H ALA 24 -15.000 4.846 -0.493
167 HA ALA 24 HA ALA 24 -17.052 6.605 -1.480
168 HB1 ALA 24 3HB ALA 24 -14.951 7.459 -0.560
169 HB2 ALA 24 1HB ALA 24 -15.203 8.016 -2.216
170 HB3 ALA 24 2HB ALA 24 -14.061 6.710 -1.887
171 H GLY 25 H GLY 25 -16.376 3.773 -2.749
172 HA2 GLY 25 2HA GLY 25 -17.041 3.194 -5.017
173 HA3 GLY 25 1HA GLY 25 -16.324 4.707 -5.562
174 HA PRO 26 HA PRO 26 -12.346 2.530 -5.966
175 HB2 PRO 26 2HB PRO 26 -10.610 4.483 -5.156
176 HB3 PRO 26 1HB PRO 26 -11.368 4.472 -6.754
177 HG2 PRO 26 2HG PRO 26 -12.160 5.996 -4.290
178 HG3 PRO 26 1HG PRO 26 -12.045 6.565 -5.969
179 HD2 PRO 26 2HD PRO 26 -14.407 5.908 -4.853
180 HD3 PRO 26 1HD PRO 26 -14.068 5.596 -6.567
181 H MET 27 H MET 27 -10.753 1.533 -4.555
182 HA MET 27 HA MET 27 -11.600 1.577 -1.735
183 HB2 MET 27 2HB MET 27 -11.649 -0.599 -2.948
184 HB3 MET 27 1HB MET 27 -9.904 -0.501 -3.147
185 HG2 MET 27 2HG MET 27 -9.583 -0.590 -0.757
186 HG3 MET 27 1HG MET 27 -11.326 -0.546 -0.490
187 HE1 MET 27 3HE MET 27 -11.218 -2.655 1.058
188 HE2 MET 27 1HE MET 27 -9.472 -2.766 0.854
189 HE3 MET 27 2HE MET 27 -10.483 -4.190 0.599
190 H ARG 28 H ARG 28 -10.385 2.529 -0.266
191 HA ARG 28 HA ARG 28 -7.638 3.324 -0.931
192 HE ARG 28 HE ARG 28 -10.005 6.547 0.821
193 HB2 ARG 28 2HB ARG 28 -9.438 4.967 -0.139
194 HB3 ARG 28 1HB ARG 28 -9.284 4.219 1.443
195 HG2 ARG 28 2HG ARG 28 -6.870 4.833 1.439
196 HG3 ARG 28 1HG ARG 28 -7.138 5.687 -0.083
197 HD2 ARG 28 2HD ARG 28 -8.230 6.329 2.648
198 HD3 ARG 28 1HD ARG 28 -7.275 7.354 1.575
199 HH11 ARG 28 1HH1 ARG 28 -7.748 9.042 1.575
200 HH12 ARG 28 2HH1 ARG 28 -8.813 10.297 1.057
201 HH21 ARG 28 1HH2 ARG 28 -11.351 8.128 0.199
202 HH22 ARG 28 2HH2 ARG 28 -10.856 9.783 0.286
203 H LEU 29 H LEU 29 -5.937 2.312 -0.023
204 HA LEU 29 HA LEU 29 -6.409 0.588 2.322
205 HG LEU 29 HG LEU 29 -6.415 -0.533 -0.648
206 HB2 LEU 29 2HB LEU 29 -4.303 0.360 0.169
207 HB3 LEU 29 1HB LEU 29 -4.384 -0.663 1.591
208 HD11 LEU 29 1HD1 LEU 29 -4.332 -1.735 -1.179
209 HD12 LEU 29 2HD1 LEU 29 -5.731 -2.809 -1.112
210 HD13 LEU 29 3HD1 LEU 29 -4.585 -2.769 0.229
211 HD21 LEU 29 3HD2 LEU 29 -7.565 -0.880 1.468
212 HD22 LEU 29 1HD2 LEU 29 -6.447 -2.180 1.885
213 HD23 LEU 29 2HD2 LEU 29 -7.556 -2.370 0.525
214 H TYR 30 H TYR 30 -5.341 0.916 4.135
215 HA TYR 30 HA TYR 30 -3.422 3.094 4.356
216 HD1 TYR 30 HD2 TYR 30 -2.270 3.945 6.658
217 HD2 TYR 30 HD1 TYR 30 -4.482 0.671 8.254
218 HE1 TYR 30 HE2 TYR 30 -0.785 3.903 8.619
219 HE2 TYR 30 HE1 TYR 30 -2.999 0.623 10.221
220 HH TYR 30 HH TYR 30 -0.897 3.136 11.000
221 HB2 TYR 30 2HB TYR 30 -4.925 3.260 6.105
222 HB3 TYR 30 1HB TYR 30 -5.130 1.521 6.243
223 H VAL 31 H VAL 31 -1.363 2.635 3.931
224 HA VAL 31 HA VAL 31 -0.312 -0.060 4.534
225 HB VAL 31 HB VAL 31 0.709 1.964 2.526
226 HG11 VAL 31 1HG1 VAL 31 1.543 -0.905 2.993
227 HG12 VAL 31 2HG1 VAL 31 2.485 0.527 3.410
228 HG13 VAL 31 3HG1 VAL 31 2.148 0.158 1.719
229 HG21 VAL 31 3HG2 VAL 31 -1.460 1.057 1.865
230 HG22 VAL 31 1HG2 VAL 31 -0.856 -0.584 2.088
231 HG23 VAL 31 2HG2 VAL 31 -0.182 0.438 0.818
232 H GLY 32 H GLY 32 1.145 -0.225 6.131
233 HA2 GLY 32 2HA GLY 32 2.747 2.155 6.864
234 HA3 GLY 32 1HA GLY 32 2.065 1.064 8.061
235 H SER 33 H SER 33 4.630 1.574 5.781
236 HA SER 33 HA SER 33 6.311 -0.283 7.229
237 HG SER 33 HG SER 33 5.385 -1.447 3.434
238 HB2 SER 33 2HB SER 33 6.935 -1.672 5.306
239 HB3 SER 33 1HB SER 33 5.199 -1.788 5.592
240 H LEU 34 H LEU 34 6.028 2.624 6.056
241 HA LEU 34 HA LEU 34 8.300 2.784 4.241
242 HG LEU 34 HG LEU 34 4.967 3.592 4.467
243 HB2 LEU 34 2HB LEU 34 6.694 5.133 5.223
244 HB3 LEU 34 1HB LEU 34 7.563 4.953 3.708
245 HD11 LEU 34 1HD1 LEU 34 4.013 4.932 2.658
246 HD12 LEU 34 2HD1 LEU 34 5.575 5.713 2.410
247 HD13 LEU 34 3HD1 LEU 34 4.704 5.944 3.925
248 HD21 LEU 34 3HD2 LEU 34 6.533 3.373 1.892
249 HD22 LEU 34 1HD2 LEU 34 4.943 2.676 2.207
250 HD23 LEU 34 2HD2 LEU 34 6.349 2.100 3.100
251 H HIS 35 H HIS 35 10.080 2.363 5.656
252 HA HIS 35 HA HIS 35 10.400 3.861 8.069
253 HD1 HIS 35 HD1 HIS 35 13.872 0.462 7.389
254 HD2 HIS 35 HD2 HIS 35 12.139 2.951 4.553
255 HE1 HIS 35 HE1 HIS 35 14.969 -0.131 5.220
256 HE2 HIS 35 HE2 HIS 35 14.091 1.562 3.586
257 HB2 HIS 35 2HB HIS 35 12.614 2.810 8.258
258 HB3 HIS 35 1HB HIS 35 11.345 1.640 7.945
259 H PHE 36 H PHE 36 10.062 5.976 7.001
260 HA PHE 36 HA PHE 36 10.821 8.062 6.522
261 HD1 PHE 36 HD1 PHE 36 11.312 9.689 8.851
262 HD2 PHE 36 HD2 PHE 36 12.665 5.689 9.439
263 HE1 PHE 36 HE1 PHE 36 10.369 9.704 11.122
264 HE2 PHE 36 HE2 PHE 36 11.721 5.703 11.711
265 HZ PHE 36 HZ PHE 36 10.572 7.711 12.557
266 HB2 PHE 36 2HB PHE 36 13.437 6.956 7.571
267 HB3 PHE 36 1HB PHE 36 13.045 8.662 7.397
268 H ASN 37 H ASN 37 11.224 5.922 4.352
269 HA ASN 37 HA ASN 37 12.877 7.546 2.606
270 HB2 ASN 37 2HB ASN 37 14.564 6.166 3.701
271 HB3 ASN 37 1HB ASN 37 13.685 4.705 3.263
272 HD21 ASN 37 1HD2 ASN 37 15.666 7.313 2.090
273 HD22 ASN 37 2HD2 ASN 37 16.048 6.594 0.568
274 H ILE 38 H ILE 38 10.874 4.650 2.947
275 HA ILE 38 HA ILE 38 10.789 3.895 0.248
276 HB ILE 38 HB ILE 38 8.582 3.493 2.282
277 HG12 ILE 38 2HG1 ILE 38 10.712 2.663 3.169
278 HG13 ILE 38 1HG1 ILE 38 9.662 1.315 2.744
279 HG21 ILE 38 1HG2 ILE 38 9.268 1.956 -0.232
280 HG22 ILE 38 2HG2 ILE 38 7.890 3.035 -0.015
281 HG23 ILE 38 3HG2 ILE 38 7.993 1.540 0.916
282 HD11 ILE 38 3HD1 ILE 38 11.983 2.342 1.121
283 HD12 ILE 38 1HD1 ILE 38 10.923 1.007 0.666
284 HD13 ILE 38 2HD1 ILE 38 11.949 0.871 2.093
285 H THR 39 H THR 39 9.688 4.626 -1.494
286 HA THR 39 HA THR 39 7.975 7.006 -1.103
287 HB THR 39 HB THR 39 8.726 7.805 -3.279
288 HG1 THR 39 HG1 THR 39 10.519 6.573 -4.278
289 HG21 THR 39 3HG2 THR 39 11.060 6.975 -1.543
290 HG22 THR 39 1HG2 THR 39 10.082 8.427 -1.335
291 HG23 THR 39 2HG2 THR 39 11.091 8.240 -2.771
292 H GLU 40 H GLU 40 6.693 7.488 -3.193
293 HA GLU 40 HA GLU 40 4.593 5.768 -3.596
294 HB2 GLU 40 2HB GLU 40 5.772 7.626 -5.676
295 HB3 GLU 40 1HB GLU 40 4.120 7.026 -5.643
296 HG2 GLU 40 2HG GLU 40 3.581 8.338 -3.746
297 HG3 GLU 40 1HG GLU 40 5.278 8.712 -3.438
298 H ASP 41 H ASP 41 7.560 5.973 -5.533
299 HA ASP 41 HA ASP 41 6.952 4.304 -7.637
300 HB2 ASP 41 2HB ASP 41 9.591 4.754 -6.231
301 HB3 ASP 41 1HB ASP 41 9.439 3.898 -7.763
302 H MET 42 H MET 42 8.282 3.347 -4.476
303 HA MET 42 HA MET 42 8.610 0.599 -5.128
304 HB2 MET 42 2HB MET 42 8.149 1.710 -2.354
305 HB3 MET 42 1HB MET 42 9.008 0.240 -2.794
306 HG2 MET 42 2HG MET 42 9.888 3.079 -3.253
307 HG3 MET 42 1HG MET 42 10.609 1.890 -2.170
308 HE1 MET 42 3HE MET 42 13.399 2.349 -4.859
309 HE2 MET 42 1HE MET 42 13.011 2.370 -3.139
310 HE3 MET 42 2HE MET 42 12.328 3.592 -4.213
311 H LEU 43 H LEU 43 6.073 2.385 -3.432
312 HA LEU 43 HA LEU 43 4.398 0.242 -2.772
313 HG LEU 43 HG LEU 43 5.350 2.810 -1.489
314 HB2 LEU 43 2HB LEU 43 3.694 3.123 -3.360
315 HB3 LEU 43 1HB LEU 43 2.643 1.976 -2.547
316 HD11 LEU 43 1HD1 LEU 43 4.160 4.202 0.111
317 HD12 LEU 43 2HD1 LEU 43 2.627 3.818 -0.673
318 HD13 LEU 43 3HD1 LEU 43 3.858 4.736 -1.542
319 HD21 LEU 43 3HD2 LEU 43 4.575 1.797 0.595
320 HD22 LEU 43 1HD2 LEU 43 4.595 0.618 -0.716
321 HD23 LEU 43 2HD2 LEU 43 3.067 1.322 -0.186
322 H ARG 44 H ARG 44 4.195 2.430 -5.610
323 HA ARG 44 HA ARG 44 2.045 1.157 -6.869
324 HE ARG 44 HE ARG 44 1.163 2.657 -10.946
325 HB2 ARG 44 2HB ARG 44 2.458 3.157 -7.890
326 HB3 ARG 44 1HB ARG 44 4.202 3.004 -7.736
327 HG2 ARG 44 2HG ARG 44 4.385 1.714 -9.679
328 HG3 ARG 44 1HG ARG 44 2.672 1.299 -9.676
329 HD2 ARG 44 2HD ARG 44 3.515 4.158 -9.992
330 HD3 ARG 44 1HD ARG 44 3.573 3.063 -11.371
331 HH11 ARG 44 1HH1 ARG 44 2.604 5.581 -9.854
332 HH12 ARG 44 2HH1 ARG 44 1.112 6.447 -9.865
333 HH21 ARG 44 1HH2 ARG 44 -0.732 3.764 -10.966
334 HH22 ARG 44 2HH2 ARG 44 -0.759 5.437 -10.515
335 H GLY 45 H GLY 45 5.533 0.521 -7.176
336 HA2 GLY 45 2HA GLY 45 5.475 -1.339 -9.245
337 HA3 GLY 45 1HA GLY 45 6.674 -1.311 -7.964
338 H ILE 46 H ILE 46 4.910 -1.891 -5.788
339 HA ILE 46 HA ILE 46 4.639 -4.761 -6.182
340 HB ILE 46 HB ILE 46 4.172 -3.109 -3.693
341 HG12 ILE 46 2HG1 ILE 46 6.599 -4.714 -4.555
342 HG13 ILE 46 1HG1 ILE 46 6.492 -2.958 -4.533
343 HG21 ILE 46 1HG2 ILE 46 4.383 -5.244 -2.492
344 HG22 ILE 46 2HG2 ILE 46 4.499 -6.095 -4.032
345 HG23 ILE 46 3HG2 ILE 46 3.011 -5.252 -3.600
346 HD11 ILE 46 3HD1 ILE 46 7.711 -3.798 -2.617
347 HD12 ILE 46 1HD1 ILE 46 6.317 -4.759 -2.131
348 HD13 ILE 46 2HD1 ILE 46 6.223 -2.998 -2.114
349 H PHE 47 H PHE 47 2.472 -2.066 -5.282
350 HA PHE 47 HA PHE 47 0.247 -3.813 -4.796
351 HD1 PHE 47 HD1 PHE 47 2.452 -1.434 -3.151
352 HD2 PHE 47 HD2 PHE 47 -1.648 -2.371 -2.459
353 HE1 PHE 47 HE1 PHE 47 2.917 -1.696 -0.752
354 HE2 PHE 47 HE2 PHE 47 -1.184 -2.634 -0.057
355 HZ PHE 47 HZ PHE 47 1.100 -2.296 0.798
356 HB2 PHE 47 2HB PHE 47 0.580 -0.823 -4.784
357 HB3 PHE 47 1HB PHE 47 -0.993 -1.576 -4.558
358 H GLU 48 H GLU 48 1.077 -1.597 -7.475
359 HA GLU 48 HA GLU 48 -1.517 -1.544 -8.584
360 HB2 GLU 48 2HB GLU 48 0.246 0.131 -9.083
361 HB3 GLU 48 1HB GLU 48 1.070 -1.069 -10.072
362 HG2 GLU 48 2HG GLU 48 -0.668 -1.106 -11.667
363 HG3 GLU 48 1HG GLU 48 -1.779 -0.259 -10.592
364 HA PRO 49 HA PRO 49 0.288 -5.295 -11.457
365 HB2 PRO 49 2HB PRO 49 1.283 -6.590 -8.937
366 HB3 PRO 49 1HB PRO 49 1.811 -6.835 -10.608
367 HG2 PRO 49 2HG PRO 49 3.241 -5.311 -8.977
368 HG3 PRO 49 1HG PRO 49 2.998 -4.831 -10.668
369 HD2 PRO 49 2HD PRO 49 1.772 -3.722 -8.190
370 HD3 PRO 49 1HD PRO 49 2.165 -2.908 -9.717
371 H PHE 50 H PHE 50 -1.273 -5.018 -8.330
372 HA PHE 50 HA PHE 50 -2.907 -7.387 -8.702
373 HD1 PHE 50 HD2 PHE 50 -0.634 -5.740 -6.042
374 HD2 PHE 50 HD1 PHE 50 -3.767 -8.631 -5.991
375 HE1 PHE 50 HE2 PHE 50 0.753 -7.217 -4.649
376 HE2 PHE 50 HE1 PHE 50 -2.381 -10.110 -4.596
377 HZ PHE 50 HZ PHE 50 -0.124 -9.404 -3.919
378 HB2 PHE 50 2HB PHE 50 -2.940 -5.155 -6.672
379 HB3 PHE 50 1HB PHE 50 -4.194 -6.386 -6.720
380 H GLY 51 H GLY 51 -3.350 -3.874 -9.027
381 HA2 GLY 51 2HA GLY 51 -5.615 -4.341 -10.814
382 HA3 GLY 51 1HA GLY 51 -5.966 -3.448 -9.343
383 H ARG 52 H ARG 52 -6.113 -1.341 -9.754
384 HA ARG 52 HA ARG 52 -3.929 -0.040 -11.209
385 HE ARG 52 HE ARG 52 -4.253 -0.846 -15.579
386 HB2 ARG 52 2HB ARG 52 -6.851 0.183 -11.878
387 HB3 ARG 52 1HB ARG 52 -5.766 1.531 -12.193
388 HG2 ARG 52 2HG ARG 52 -5.516 -1.259 -13.313
389 HG3 ARG 52 1HG ARG 52 -6.047 0.181 -14.182
390 HD2 ARG 52 2HD ARG 52 -3.834 1.214 -13.765
391 HD3 ARG 52 1HD ARG 52 -3.310 -0.280 -12.985
392 HH11 ARG 52 1HH1 ARG 52 -1.599 0.672 -13.989
393 HH12 ARG 52 2HH1 ARG 52 -0.495 0.339 -15.274
394 HH21 ARG 52 1HH2 ARG 52 -2.840 -1.264 -17.215
395 HH22 ARG 52 2HH2 ARG 52 -1.195 -0.753 -17.094
396 H ILE 53 H ILE 53 -3.208 1.746 -10.288
397 HA ILE 53 HA ILE 53 -4.543 2.600 -7.815
398 HB ILE 53 HB ILE 53 -1.676 2.980 -8.706
399 HG12 ILE 53 2HG1 ILE 53 -2.867 1.186 -6.568
400 HG13 ILE 53 1HG1 ILE 53 -2.318 0.639 -8.147
401 HG21 ILE 53 1HG2 ILE 53 -2.370 4.826 -7.289
402 HG22 ILE 53 2HG2 ILE 53 -1.285 3.762 -6.394
403 HG23 ILE 53 3HG2 ILE 53 -3.022 3.699 -6.098
404 HD11 ILE 53 3HD1 ILE 53 -0.665 0.118 -6.499
405 HD12 ILE 53 1HD1 ILE 53 -0.621 1.796 -5.946
406 HD13 ILE 53 2HD1 ILE 53 -0.037 1.380 -7.559
407 H GLU 54 H GLU 54 -5.596 4.440 -7.785
408 HA GLU 54 HA GLU 54 -5.529 6.344 -9.913
409 HB2 GLU 54 2HB GLU 54 -6.857 6.392 -7.191
410 HB3 GLU 54 1HB GLU 54 -7.094 7.631 -8.417
411 HG2 GLU 54 2HG GLU 54 -7.735 4.714 -8.826
412 HG3 GLU 54 1HG GLU 54 -8.904 5.917 -8.285
413 H SER 55 H SER 55 -4.630 6.525 -6.465
414 HA SER 55 HA SER 55 -2.483 8.380 -7.097
415 HG SER 55 HG SER 55 -3.533 11.008 -4.853
416 HB2 SER 55 2HB SER 55 -4.380 9.890 -6.772
417 HB3 SER 55 1HB SER 55 -4.718 9.156 -5.205
418 H ILE 56 H ILE 56 -0.892 8.549 -5.508
419 HA ILE 56 HA ILE 56 -1.168 6.765 -3.162
420 HB ILE 56 HB ILE 56 1.374 7.396 -4.693
421 HG12 ILE 56 2HG1 ILE 56 -0.206 4.809 -4.519
422 HG13 ILE 56 1HG1 ILE 56 -0.121 5.866 -5.925
423 HG21 ILE 56 1HG2 ILE 56 2.431 5.724 -3.226
424 HG22 ILE 56 2HG2 ILE 56 0.924 5.571 -2.323
425 HG23 ILE 56 3HG2 ILE 56 1.808 7.099 -2.315
426 HD11 ILE 56 3HD1 ILE 56 2.170 4.331 -4.710
427 HD12 ILE 56 1HD1 ILE 56 2.284 5.416 -6.097
428 HD13 ILE 56 2HD1 ILE 56 1.317 3.947 -6.205
429 H GLN 57 H GLN 57 -1.267 7.921 -1.321
430 HA GLN 57 HA GLN 57 0.248 10.461 -1.163
431 HB2 GLN 57 2HB GLN 57 -2.319 9.726 0.267
432 HB3 GLN 57 1HB GLN 57 -1.447 11.245 0.446
433 HG2 GLN 57 2HG GLN 57 -2.761 10.225 -2.068
434 HG3 GLN 57 1HG GLN 57 -3.376 11.491 -1.011
435 HE21 GLN 57 1HE2 GLN 57 -0.707 12.656 -0.597
436 HE22 GLN 57 2HE2 GLN 57 -0.331 13.480 -2.065
437 H LEU 58 H LEU 58 1.779 10.591 0.377
438 HA LEU 58 HA LEU 58 1.880 8.477 2.421
439 HG LEU 58 HG LEU 58 3.703 7.434 1.128
440 HB2 LEU 58 2HB LEU 58 4.002 10.417 1.489
441 HB3 LEU 58 1HB LEU 58 4.214 9.290 2.816
442 HD11 LEU 58 1HD1 LEU 58 2.734 8.784 -0.640
443 HD12 LEU 58 2HD1 LEU 58 4.170 7.947 -1.223
444 HD13 LEU 58 3HD1 LEU 58 4.251 9.666 -0.830
445 HD21 LEU 58 3HD2 LEU 58 6.215 9.076 0.809
446 HD22 LEU 58 1HD2 LEU 58 6.013 7.396 0.303
447 HD23 LEU 58 2HD2 LEU 58 5.922 7.818 2.013
448 H MET 59 H MET 59 1.974 8.913 4.618
449 HA MET 59 HA MET 59 0.838 11.508 5.347
450 HB2 MET 59 2HB MET 59 -0.429 9.666 6.154
451 HB3 MET 59 1HB MET 59 0.999 8.864 6.793
452 HG2 MET 59 2HG MET 59 -0.476 9.899 8.513
453 HG3 MET 59 1HG MET 59 1.199 10.439 8.560
454 HE1 MET 59 3HE MET 59 -2.496 11.371 7.620
455 HE2 MET 59 1HE MET 59 -1.668 11.517 6.071
456 HE3 MET 59 2HE MET 59 -2.290 12.956 6.876
457 H MET 60 H MET 60 2.400 12.960 5.572
458 HA MET 60 HA MET 60 4.402 12.502 7.688
459 HB2 MET 60 2HB MET 60 5.981 13.940 6.371
460 HB3 MET 60 1HB MET 60 5.618 12.395 5.618
461 HG2 MET 60 2HG MET 60 4.017 13.505 4.131
462 HG3 MET 60 1HG MET 60 4.422 15.055 4.869
463 HE1 MET 60 3HE MET 60 4.557 14.366 1.709
464 HE2 MET 60 1HE MET 60 6.041 15.216 1.279
465 HE3 MET 60 2HE MET 60 4.886 15.964 2.382
466 H ASP 61 H ASP 61 4.499 14.070 9.216
467 HA ASP 61 HA ASP 61 2.518 16.180 9.119
468 HB2 ASP 61 2HB ASP 61 2.871 14.885 11.178
469 HB3 ASP 61 1HB ASP 61 4.533 15.464 11.265
470 H SER 62 H SER 62 3.000 17.983 7.983
471 HA SER 62 HA SER 62 5.714 18.748 7.464
472 HG SER 62 HG SER 62 2.158 19.639 6.403
473 HB2 SER 62 2HB SER 62 4.696 20.658 6.211
474 HB3 SER 62 1HB SER 62 4.064 19.086 5.725
475 H GLU 63 H GLU 63 3.567 19.492 9.999
476 HA GLU 63 HA GLU 63 4.470 22.069 10.700
477 HB2 GLU 63 2HB GLU 63 2.495 21.042 11.735
478 HB3 GLU 63 1HB GLU 63 3.504 19.820 12.491
479 HG2 GLU 63 2HG GLU 63 2.831 21.546 14.077
480 HG3 GLU 63 1HG GLU 63 4.581 21.511 13.862
481 H THR 64 H THR 64 5.544 18.891 11.913
482 HA THR 64 HA THR 64 8.303 19.472 11.699
483 HB THR 64 HB THR 64 7.986 20.965 13.569
484 HG1 THR 64 HG1 THR 64 9.619 20.159 14.843
485 HG21 THR 64 3HG2 THR 64 6.926 18.568 15.080
486 HG22 THR 64 1HG2 THR 64 5.984 19.967 14.567
487 HG23 THR 64 2HG2 THR 64 7.253 20.155 15.777
488 H GLY 65 H GLY 65 5.781 17.337 12.408
489 HA2 GLY 65 2HA GLY 65 7.268 15.316 13.808
490 HA3 GLY 65 1HA GLY 65 5.669 15.135 13.098
491 H ARG 66 H ARG 66 6.689 16.150 10.504
492 HA ARG 66 HA ARG 66 7.563 15.424 8.547
493 HE ARG 66 HE ARG 66 12.163 14.228 10.795
494 HB2 ARG 66 2HB ARG 66 9.560 14.055 10.358
495 HB3 ARG 66 1HB ARG 66 9.780 14.365 8.641
496 HG2 ARG 66 2HG ARG 66 9.690 16.784 9.065
497 HG3 ARG 66 1HG ARG 66 9.466 16.480 10.787
498 HD2 ARG 66 2HD ARG 66 11.887 15.763 9.122
499 HD3 ARG 66 1HD ARG 66 11.787 17.039 10.334
500 HH11 ARG 66 1HH1 ARG 66 11.015 17.161 12.198
501 HH12 ARG 66 2HH1 ARG 66 11.316 16.634 13.811
502 HH21 ARG 66 1HH2 ARG 66 12.557 13.573 12.885
503 HH22 ARG 66 2HH2 ARG 66 12.173 14.625 14.200
504 H SER 67 H SER 67 8.872 12.915 7.971
505 HA SER 67 HA SER 67 6.716 11.372 7.172
506 HG SER 67 HG SER 67 9.348 10.790 5.193
507 HB2 SER 67 2HB SER 67 9.559 10.462 7.673
508 HB3 SER 67 1HB SER 67 8.370 9.609 6.687
509 H LYS 68 H LYS 68 5.232 10.380 8.441
510 HA LYS 68 HA LYS 68 5.870 9.475 11.101
511 HB2 LYS 68 2HB LYS 68 3.348 9.080 9.475
512 HB3 LYS 68 1HB LYS 68 3.524 8.705 11.182
513 HG2 LYS 68 2HG LYS 68 4.069 11.149 11.546
514 HG3 LYS 68 1HG LYS 68 3.565 11.418 9.874
515 HD2 LYS 68 2HD LYS 68 1.359 10.404 10.430
516 HD3 LYS 68 1HD LYS 68 1.879 10.275 12.111
517 HE2 LYS 68 2HE LYS 68 0.527 12.238 11.900
518 HE3 LYS 68 1HE LYS 68 2.195 12.761 12.122
519 HZ1 LYS 68 3HZ LYS 68 0.695 12.661 9.560
520 HZ2 LYS 68 1HZ LYS 68 2.336 13.053 9.696
521 HZ3 LYS 68 2HZ LYS 68 1.169 14.048 10.400
522 H GLY 69 H GLY 69 5.705 7.962 7.959
523 HA2 GLY 69 2HA GLY 69 7.045 5.937 7.700
524 HA3 GLY 69 1HA GLY 69 6.416 5.388 9.241
525 H TYR 70 H TYR 70 3.855 6.741 7.543
526 HA TYR 70 HA TYR 70 3.263 4.286 6.056
527 HD1 TYR 70 HD1 TYR 70 2.682 5.644 9.944
528 HD2 TYR 70 HD2 TYR 70 -0.538 5.965 7.173
529 HE1 TYR 70 HE1 TYR 70 1.623 7.346 11.372
530 HE2 TYR 70 HE2 TYR 70 -1.599 7.668 8.588
531 HH TYR 70 HH TYR 70 -1.595 8.404 10.914
532 HB2 TYR 70 2HB TYR 70 1.002 4.123 7.027
533 HB3 TYR 70 1HB TYR 70 2.262 3.889 8.229
534 H GLY 71 H GLY 71 1.454 4.455 4.577
535 HA2 GLY 71 2HA GLY 71 0.644 7.180 3.835
536 HA3 GLY 71 1HA GLY 71 1.501 6.217 2.646
537 H PHE 72 H PHE 72 -1.116 7.240 2.266
538 HA PHE 72 HA PHE 72 -2.802 4.822 2.356
539 HD1 PHE 72 HD1 PHE 72 -5.116 5.162 4.095
540 HD2 PHE 72 HD2 PHE 72 -2.662 8.644 3.950
541 HE1 PHE 72 HE1 PHE 72 -5.298 5.393 6.539
542 HE2 PHE 72 HE2 PHE 72 -2.841 8.876 6.393
543 HZ PHE 72 HZ PHE 72 -4.158 7.249 7.691
544 HB2 PHE 72 2HB PHE 72 -3.596 7.720 1.937
545 HB3 PHE 72 1HB PHE 72 -4.706 6.354 1.989
546 H ILE 73 H ILE 73 -3.145 3.736 0.511
547 HA ILE 73 HA ILE 73 -2.578 5.071 -2.069
548 HB ILE 73 HB ILE 73 -2.574 2.104 -1.452
549 HG12 ILE 73 2HG1 ILE 73 -0.226 3.963 -1.954
550 HG13 ILE 73 1HG1 ILE 73 -0.709 3.362 -0.373
551 HG21 ILE 73 1HG2 ILE 73 -1.773 3.610 -3.950
552 HG22 ILE 73 2HG2 ILE 73 -3.173 2.553 -3.764
553 HG23 ILE 73 3HG2 ILE 73 -1.546 1.881 -3.683
554 HD11 ILE 73 3HD1 ILE 73 0.242 1.685 -2.687
555 HD12 ILE 73 1HD1 ILE 73 -0.248 1.077 -1.106
556 HD13 ILE 73 2HD1 ILE 73 1.171 2.111 -1.250
557 H THR 74 H THR 74 -4.167 5.264 -3.543
558 HA THR 74 HA THR 74 -6.803 4.114 -2.866
559 HB THR 74 HB THR 74 -6.158 6.529 -4.581
560 HG1 THR 74 HG1 THR 74 -6.528 7.675 -2.806
561 HG21 THR 74 3HG2 THR 74 -8.211 5.387 -5.333
562 HG22 THR 74 1HG2 THR 74 -8.571 6.945 -4.590
563 HG23 THR 74 2HG2 THR 74 -8.848 5.454 -3.689
564 H PHE 75 H PHE 75 -7.324 2.366 -3.987
565 HA PHE 75 HA PHE 75 -6.455 2.014 -6.776
566 HD1 PHE 75 HD1 PHE 75 -6.132 0.827 -3.145
567 HD2 PHE 75 HD2 PHE 75 -5.036 -1.066 -6.804
568 HE1 PHE 75 HE1 PHE 75 -3.968 0.190 -2.167
569 HE2 PHE 75 HE2 PHE 75 -2.871 -1.700 -5.825
570 HZ PHE 75 HZ PHE 75 -2.340 -1.074 -3.505
571 HB2 PHE 75 2HB PHE 75 -7.824 0.062 -4.898
572 HB3 PHE 75 1HB PHE 75 -7.224 -0.313 -6.510
573 H SER 76 H SER 76 -8.028 1.406 -8.427
574 HA SER 76 HA SER 76 -10.645 2.683 -7.954
575 HG SER 76 HG SER 76 -11.405 1.811 -11.092
576 HB2 SER 76 2HB SER 76 -9.448 3.447 -9.951
577 HB3 SER 76 1HB SER 76 -9.332 1.789 -10.541
578 H ASP 77 H ASP 77 -9.273 -0.261 -7.758
579 HA ASP 77 HA ASP 77 -11.700 -1.732 -8.544
580 HB2 ASP 77 2HB ASP 77 -9.512 -3.514 -8.514
581 HB3 ASP 77 1HB ASP 77 -10.372 -2.904 -9.919
582 H SER 78 H SER 78 -12.757 -2.066 -6.657
583 HA SER 78 HA SER 78 -11.646 -2.168 -4.103
584 HG SER 78 HG SER 78 -14.786 -4.326 -4.758
585 HB2 SER 78 2HB SER 78 -13.826 -3.082 -3.364
586 HB3 SER 78 1HB SER 78 -14.013 -1.717 -4.463
587 H GLU 79 H GLU 79 -12.807 -4.990 -6.010
588 HA GLU 79 HA GLU 79 -12.041 -6.942 -4.158
589 HB2 GLU 79 2HB GLU 79 -12.471 -7.029 -7.130
590 HB3 GLU 79 1HB GLU 79 -11.906 -8.454 -6.273
591 HG2 GLU 79 2HG GLU 79 -14.254 -8.652 -6.505
592 HG3 GLU 79 1HG GLU 79 -13.927 -8.292 -4.811
593 H CYS 80 H CYS 80 -10.188 -5.681 -6.937
594 HA CYS 80 HA CYS 80 -7.935 -7.337 -6.621
595 HG CYS 80 HG CYS 80 -8.509 -5.429 -10.308
596 HB2 CYS 80 2HB CYS 80 -8.089 -4.555 -7.805
597 HB3 CYS 80 1HB CYS 80 -6.739 -5.669 -8.004
598 H ALA 81 H ALA 81 -8.655 -4.132 -5.288
599 HA ALA 81 HA ALA 81 -6.193 -3.750 -3.947
600 HB1 ALA 81 3HB ALA 81 -8.912 -2.634 -3.256
601 HB2 ALA 81 1HB ALA 81 -7.760 -1.926 -4.388
602 HB3 ALA 81 2HB ALA 81 -7.360 -2.028 -2.673
603 H LYS 82 H LYS 82 -9.275 -5.149 -2.880
604 HA LYS 82 HA LYS 82 -8.545 -5.669 -0.208
605 HB2 LYS 82 2HB LYS 82 -10.876 -5.736 -1.137
606 HB3 LYS 82 1HB LYS 82 -10.476 -7.263 -1.914
607 HG2 LYS 82 2HG LYS 82 -10.144 -8.322 0.235
608 HG3 LYS 82 1HG LYS 82 -10.385 -6.784 1.064
609 HD2 LYS 82 2HD LYS 82 -12.450 -8.251 -0.589
610 HD3 LYS 82 1HD LYS 82 -12.401 -8.169 1.172
611 HE2 LYS 82 2HE LYS 82 -12.673 -5.718 1.044
612 HE3 LYS 82 1HE LYS 82 -12.775 -5.836 -0.713
613 HZ1 LYS 82 3HZ LYS 82 -14.666 -7.042 1.231
614 HZ2 LYS 82 1HZ LYS 82 -14.746 -7.234 -0.447
615 HZ3 LYS 82 2HZ LYS 82 -14.967 -5.707 0.241
616 H LYS 83 H LYS 83 -8.146 -7.574 -3.169
617 HA LYS 83 HA LYS 83 -6.966 -9.866 -2.020
618 HB2 LYS 83 2HB LYS 83 -7.714 -9.827 -4.353
619 HB3 LYS 83 1HB LYS 83 -6.508 -8.606 -4.741
620 HG2 LYS 83 2HG LYS 83 -4.726 -10.225 -4.184
621 HG3 LYS 83 1HG LYS 83 -5.964 -11.445 -3.875
622 HD2 LYS 83 2HD LYS 83 -6.715 -11.261 -6.212
623 HD3 LYS 83 1HD LYS 83 -5.470 -10.049 -6.517
624 HE2 LYS 83 2HE LYS 83 -3.735 -11.701 -5.971
625 HE3 LYS 83 1HE LYS 83 -4.983 -12.912 -5.679
626 HZ1 LYS 83 3HZ LYS 83 -5.648 -12.742 -7.989
627 HZ2 LYS 83 1HZ LYS 83 -4.005 -13.123 -7.886
628 HZ3 LYS 83 2HZ LYS 83 -4.487 -11.550 -8.269
629 H ALA 84 H ALA 84 -5.455 -6.959 -3.443
630 HA ALA 84 HA ALA 84 -2.790 -7.462 -2.934
631 HB1 ALA 84 3HB ALA 84 -4.192 -4.790 -2.740
632 HB2 ALA 84 1HB ALA 84 -3.573 -5.533 -4.217
633 HB3 ALA 84 2HB ALA 84 -2.455 -5.035 -2.944
634 H LEU 85 H LEU 85 -5.185 -6.027 -0.749
635 HA LEU 85 HA LEU 85 -3.578 -5.469 1.439
636 HG LEU 85 HG LEU 85 -4.893 -5.129 3.633
637 HB2 LEU 85 2HB LEU 85 -5.934 -4.804 1.238
638 HB3 LEU 85 1HB LEU 85 -6.437 -6.471 1.413
639 HD11 LEU 85 1HD1 LEU 85 -7.874 -4.942 3.182
640 HD12 LEU 85 2HD1 LEU 85 -6.720 -3.608 3.112
641 HD13 LEU 85 3HD1 LEU 85 -7.012 -4.439 4.638
642 HD21 LEU 85 3HD2 LEU 85 -6.159 -6.683 5.035
643 HD22 LEU 85 1HD2 LEU 85 -5.254 -7.543 3.789
644 HD23 LEU 85 2HD2 LEU 85 -6.993 -7.305 3.610
645 H GLU 86 H GLU 86 -5.492 -8.487 0.986
646 HA GLU 86 HA GLU 86 -4.265 -9.635 3.318
647 HB2 GLU 86 2HB GLU 86 -6.623 -10.062 2.604
648 HB3 GLU 86 1HB GLU 86 -6.001 -11.036 1.278
649 HG2 GLU 86 2HG GLU 86 -5.112 -12.656 2.768
650 HG3 GLU 86 1HG GLU 86 -5.358 -11.611 4.166
651 H GLN 87 H GLN 87 -3.134 -9.381 0.161
652 HA GLN 87 HA GLN 87 -1.481 -11.800 0.392
653 HB2 GLN 87 2HB GLN 87 -1.746 -9.778 -1.847
654 HB3 GLN 87 1HB GLN 87 -0.677 -11.174 -1.890
655 HG2 GLN 87 2HG GLN 87 -3.684 -11.273 -1.670
656 HG3 GLN 87 1HG GLN 87 -2.752 -11.548 -3.139
657 HE21 GLN 87 1HE2 GLN 87 -4.596 -13.331 -1.751
658 HE22 GLN 87 2HE2 GLN 87 -3.689 -14.748 -1.360
659 H LEU 88 H LEU 88 -1.279 -8.326 0.686
660 HA LEU 88 HA LEU 88 1.662 -8.446 0.869
661 HG LEU 88 HG LEU 88 -0.073 -7.477 -1.568
662 HB2 LEU 88 2HB LEU 88 -0.154 -6.069 0.445
663 HB3 LEU 88 1HB LEU 88 1.599 -6.018 0.483
664 HD11 LEU 88 1HD1 LEU 88 1.525 -4.931 -1.791
665 HD12 LEU 88 2HD1 LEU 88 -0.232 -5.085 -1.850
666 HD13 LEU 88 3HD1 LEU 88 0.757 -5.782 -3.133
667 HD21 LEU 88 3HD2 LEU 88 2.917 -7.101 -1.409
668 HD22 LEU 88 1HD2 LEU 88 2.038 -7.842 -2.745
669 HD23 LEU 88 2HD2 LEU 88 2.044 -8.614 -1.160
670 H ASN 89 H ASN 89 -1.102 -8.086 2.841
671 HA ASN 89 HA ASN 89 0.016 -6.407 4.859
672 HB2 ASN 89 2HB ASN 89 -2.435 -6.844 4.522
673 HB3 ASN 89 1HB ASN 89 -2.188 -8.458 5.172
674 HD21 ASN 89 1HD2 ASN 89 -3.740 -7.861 6.757
675 HD22 ASN 89 2HD2 ASN 89 -3.285 -6.904 8.115
676 H GLY 90 H GLY 90 2.017 -7.100 5.466
677 HA2 GLY 90 2HA GLY 90 3.033 -8.511 7.282
678 HA3 GLY 90 1HA GLY 90 2.314 -9.883 6.450
679 H PHE 91 H PHE 91 3.008 -8.283 3.880
680 HA PHE 91 HA PHE 91 5.334 -9.641 3.124
681 HD1 PHE 91 HD1 PHE 91 5.423 -10.066 0.214
682 HD2 PHE 91 HD2 PHE 91 5.959 -5.943 1.140
683 HE1 PHE 91 HE1 PHE 91 7.154 -9.899 -1.526
684 HE2 PHE 91 HE2 PHE 91 7.689 -5.772 -0.596
685 HZ PHE 91 HZ PHE 91 8.288 -7.750 -1.933
686 HB2 PHE 91 2HB PHE 91 3.739 -8.791 1.498
687 HB3 PHE 91 1HB PHE 91 4.065 -7.134 1.987
688 H GLU 92 H GLU 92 7.484 -9.174 3.224
689 HA GLU 92 HA GLU 92 8.268 -6.952 4.942
690 HB2 GLU 92 2HB GLU 92 9.736 -9.379 3.913
691 HB3 GLU 92 1HB GLU 92 10.545 -8.101 4.812
692 HG2 GLU 92 2HG GLU 92 9.311 -8.534 6.765
693 HG3 GLU 92 1HG GLU 92 8.122 -9.506 5.901
694 H LEU 93 H LEU 93 8.050 -5.170 3.623
695 HA LEU 93 HA LEU 93 9.494 -4.978 1.112
696 HG LEU 93 HG LEU 93 9.374 -1.664 1.374
697 HB2 LEU 93 2HB LEU 93 7.346 -3.909 1.225
698 HB3 LEU 93 1HB LEU 93 7.801 -3.019 2.665
699 HD11 LEU 93 1HD1 LEU 93 9.457 -1.829 -1.083
700 HD12 LEU 93 2HD1 LEU 93 8.485 -3.298 -0.998
701 HD13 LEU 93 3HD1 LEU 93 10.096 -3.266 -0.283
702 HD21 LEU 93 3HD2 LEU 93 7.755 -0.443 -0.014
703 HD22 LEU 93 1HD2 LEU 93 7.079 -0.882 1.554
704 HD23 LEU 93 2HD2 LEU 93 6.630 -1.795 0.113
705 H ALA 94 H ALA 94 9.504 -2.922 4.021
706 HA ALA 94 HA ALA 94 12.154 -1.923 3.398
707 HB1 ALA 94 3HB ALA 94 10.351 -1.354 5.754
708 HB2 ALA 94 1HB ALA 94 10.413 -0.428 4.254
709 HB3 ALA 94 2HB ALA 94 11.812 -0.463 5.326
710 H GLY 95 H GLY 95 12.214 -4.707 3.912
711 HA2 GLY 95 2HA GLY 95 13.427 -6.263 5.105
712 HA3 GLY 95 1HA GLY 95 14.134 -4.935 6.014
713 H ARG 96 H ARG 96 10.719 -5.115 5.911
714 HA ARG 96 HA ARG 96 10.389 -6.530 8.401
715 HE ARG 96 HE ARG 96 8.675 -1.490 10.290
716 HB2 ARG 96 2HB ARG 96 9.577 -4.576 9.664
717 HB3 ARG 96 1HB ARG 96 11.260 -4.381 9.190
718 HG2 ARG 96 2HG ARG 96 10.422 -3.009 7.234
719 HG3 ARG 96 1HG ARG 96 8.838 -3.029 8.016
720 HD2 ARG 96 2HD ARG 96 11.386 -1.993 9.278
721 HD3 ARG 96 1HD ARG 96 10.161 -0.985 8.511
722 HH11 ARG 96 1HH1 ARG 96 11.835 -2.794 10.780
723 HH12 ARG 96 2HH1 ARG 96 11.626 -2.915 12.489
724 HH21 ARG 96 1HH2 ARG 96 8.453 -1.624 12.485
725 HH22 ARG 96 2HH2 ARG 96 9.746 -2.271 13.439
726 HA PRO 97 HA PRO 97 6.362 -7.361 6.787
727 HB2 PRO 97 2HB PRO 97 4.793 -6.987 9.069
728 HB3 PRO 97 1HB PRO 97 5.651 -8.470 8.646
729 HG2 PRO 97 2HG PRO 97 6.484 -6.261 10.488
730 HG3 PRO 97 1HG PRO 97 6.664 -8.016 10.687
731 HD2 PRO 97 2HD PRO 97 8.747 -6.522 9.964
732 HD3 PRO 97 1HD PRO 97 8.485 -8.115 9.220
733 H MET 98 H MET 98 4.737 -6.285 5.787
734 HA MET 98 HA MET 98 4.549 -3.396 6.255
735 HB2 MET 98 2HB MET 98 5.108 -4.101 3.993
736 HB3 MET 98 1HB MET 98 3.667 -5.104 3.916
737 HG2 MET 98 2HG MET 98 2.244 -3.242 3.800
738 HG3 MET 98 1HG MET 98 3.510 -2.136 4.335
739 HE1 MET 98 3HE MET 98 3.627 -4.212 0.210
740 HE2 MET 98 1HE MET 98 2.370 -4.533 1.405
741 HE3 MET 98 2HE MET 98 4.036 -5.024 1.720
742 H LYS 99 H LYS 99 2.808 -2.476 7.113
743 HA LYS 99 HA LYS 99 0.536 -4.126 7.896
744 HB2 LYS 99 2HB LYS 99 1.342 -1.279 8.537
745 HB3 LYS 99 1HB LYS 99 -0.122 -2.034 9.158
746 HG2 LYS 99 2HG LYS 99 1.250 -3.733 10.291
747 HG3 LYS 99 1HG LYS 99 2.708 -2.945 9.681
748 HD2 LYS 99 2HD LYS 99 2.224 -0.944 10.944
749 HD3 LYS 99 1HD LYS 99 0.650 -1.577 11.427
750 HE2 LYS 99 2HE LYS 99 2.203 -1.799 13.263
751 HE3 LYS 99 1HE LYS 99 1.790 -3.398 12.649
752 HZ1 LYS 99 3HZ LYS 99 4.101 -3.375 13.009
753 HZ2 LYS 99 1HZ LYS 99 4.308 -1.893 12.222
754 HZ3 LYS 99 2HZ LYS 99 3.902 -3.271 11.336
755 H VAL 100 H VAL 100 -0.891 -4.414 6.203
756 HA VAL 100 HA VAL 100 -1.853 -1.979 4.821
757 HB VAL 100 HB VAL 100 -2.010 -4.820 3.775
758 HG11 VAL 100 1HG1 VAL 100 -2.576 -2.168 2.434
759 HG12 VAL 100 2HG1 VAL 100 -3.773 -3.371 2.916
760 HG13 VAL 100 3HG1 VAL 100 -2.608 -3.746 1.646
761 HG21 VAL 100 3HG2 VAL 100 0.320 -4.090 3.883
762 HG22 VAL 100 1HG2 VAL 100 -0.090 -2.613 3.007
763 HG23 VAL 100 2HG2 VAL 100 -0.231 -4.181 2.210
764 H GLY 101 H GLY 101 -3.747 -1.329 5.665
765 HA2 GLY 101 2HA GLY 101 -5.804 -3.386 6.263
766 HA3 GLY 101 1HA GLY 101 -5.536 -2.007 7.315
767 H HIS 102 H HIS 102 -7.993 -2.834 5.894
768 HA HIS 102 HA HIS 102 -8.430 -1.016 3.735
769 HD1 HIS 102 HD1 HIS 102 -10.953 -1.272 7.018
770 HD2 HIS 102 HD2 HIS 102 -10.469 -5.024 5.299
771 HE1 HIS 102 HE1 HIS 102 -11.681 -2.911 8.767
772 HE2 HIS 102 HE2 HIS 102 -11.551 -5.153 7.641
773 HB2 HIS 102 2HB HIS 102 -10.884 -1.577 4.121
774 HB3 HIS 102 1HB HIS 102 -9.822 -2.928 3.751
775 H VAL 103 H VAL 103 -8.802 1.116 3.789
776 HA VAL 103 HA VAL 103 -9.025 2.505 6.289
777 HB VAL 103 HB VAL 103 -9.295 3.571 3.467
778 HG11 VAL 103 1HG1 VAL 103 -8.879 5.056 6.070
779 HG12 VAL 103 2HG1 VAL 103 -10.338 5.084 5.077
780 HG13 VAL 103 3HG1 VAL 103 -8.837 5.776 4.461
781 HG21 VAL 103 3HG2 VAL 103 -7.118 2.569 3.856
782 HG22 VAL 103 1HG2 VAL 103 -6.928 3.502 5.342
783 HG23 VAL 103 2HG2 VAL 103 -6.970 4.325 3.784
784 H THR 104 H THR 104 -11.219 2.383 3.452
785 HA THR 104 HA THR 104 -13.403 2.933 3.153
786 HB THR 104 HB THR 104 -15.055 1.925 4.651
787 HG1 THR 104 HG1 THR 104 -13.341 2.315 6.551
788 HG21 THR 104 3HG2 THR 104 -13.984 0.469 3.032
789 HG22 THR 104 1HG2 THR 104 -14.293 -0.420 4.524
790 HG23 THR 104 2HG2 THR 104 -12.662 0.146 4.155
791 H GLU 105 H GLU 105 -13.537 5.108 3.116
792 HA GLU 105 HA GLU 105 -13.345 6.607 5.613
793 HB2 GLU 105 2HB GLU 105 -12.952 8.574 4.242
794 HB3 GLU 105 1HB GLU 105 -11.878 7.272 3.765
795 HG2 GLU 105 2HG GLU 105 -14.414 7.999 2.305
796 HG3 GLU 105 1HG GLU 105 -12.816 8.600 1.878
797 H ARG 106 H ARG 106 -15.657 6.223 2.910
798 HA ARG 106 HA ARG 106 -17.670 7.586 4.588
799 HE ARG 106 HE ARG 106 -19.401 9.907 0.854
800 HB2 ARG 106 2HB ARG 106 -18.545 8.798 2.631
801 HB3 ARG 106 1HB ARG 106 -16.890 9.260 3.004
802 HG2 ARG 106 2HG ARG 106 -16.034 8.019 1.167
803 HG3 ARG 106 1HG ARG 106 -17.586 7.229 0.893
804 HD2 ARG 106 2HD ARG 106 -17.068 10.191 0.571
805 HD3 ARG 106 1HD ARG 106 -17.106 9.021 -0.749
806 HH11 ARG 106 1HH1 ARG 106 -18.170 8.146 -1.847
807 HH12 ARG 106 2HH1 ARG 106 -19.725 7.952 -2.570
808 HH21 ARG 106 1HH2 ARG 106 -21.379 9.666 -0.082
809 HH22 ARG 106 2HH2 ARG 106 -21.537 8.793 -1.570
810 H THR 107 H THR 107 -19.790 6.930 4.360
811 HA THR 107 HA THR 107 -20.291 4.608 2.601
812 HB THR 107 HB THR 107 -20.663 4.031 4.924
813 HG1 THR 107 HG1 THR 107 -23.322 4.348 4.155
814 HG21 THR 107 3HG2 THR 107 -22.345 5.167 6.306
815 HG22 THR 107 1HG2 THR 107 -22.601 6.353 5.026
816 HG23 THR 107 2HG2 THR 107 -21.043 6.266 5.850
817 H ASP 108 H ASP 108 -21.704 4.855 0.943
818 HA ASP 108 HA ASP 108 -22.693 7.495 0.389
819 HB2 ASP 108 2HB ASP 108 -21.730 5.937 -1.336
820 HB3 ASP 108 1HB ASP 108 -23.203 4.978 -1.213
Start of MODEL 5
1 HA MET 1 HA MET 1 -14.058 36.764 -14.385
2 H1 MET 1 1H MET 1 -11.945 35.712 -14.670
3 H2 MET 1 2H MET 1 -12.617 34.177 -14.450
4 H3 MET 1 3H MET 1 -12.590 35.276 -13.166
5 HB2 MET 1 2HB MET 1 -13.384 36.016 -16.637
6 HB3 MET 1 1HB MET 1 -14.174 34.470 -16.361
7 HG2 MET 1 2HG MET 1 -16.337 35.580 -16.229
8 HG3 MET 1 1HG MET 1 -15.557 37.147 -16.443
9 HE1 MET 1 3HE MET 1 -17.184 37.714 -18.446
10 HE2 MET 1 1HE MET 1 -17.990 36.152 -18.283
11 HE3 MET 1 2HE MET 1 -17.407 36.685 -19.860
12 H GLY 2 H GLY 2 -14.595 33.211 -14.538
13 HA2 GLY 2 2HA GLY 2 -17.299 33.555 -13.527
14 HA3 GLY 2 1HA GLY 2 -16.559 32.054 -14.052
15 H HIS 3 H HIS 3 -14.422 31.719 -12.424
16 HA HIS 3 HA HIS 3 -15.600 31.666 -9.719
17 HD1 HIS 3 HD1 HIS 3 -12.434 28.742 -10.409
18 HD2 HIS 3 HD2 HIS 3 -15.394 28.898 -13.322
19 HE1 HIS 3 HE1 HIS 3 -11.423 27.702 -12.450
20 HE2 HIS 3 HE2 HIS 3 -13.301 27.603 -14.115
21 HB2 HIS 3 2HB HIS 3 -14.833 29.300 -9.502
22 HB3 HIS 3 1HB HIS 3 -16.104 29.523 -10.700
23 H HIS 4 H HIS 4 -14.259 32.079 -8.088
24 HA HIS 4 HA HIS 4 -11.473 31.340 -8.153
25 HD1 HIS 4 HD1 HIS 4 -11.565 35.411 -6.119
26 HD2 HIS 4 HD2 HIS 4 -13.882 34.756 -9.506
27 HE1 HIS 4 HE1 HIS 4 -13.278 37.245 -6.123
28 HE2 HIS 4 HE2 HIS 4 -14.760 36.737 -8.096
29 HB2 HIS 4 2HB HIS 4 -10.625 33.616 -7.579
30 HB3 HIS 4 1HB HIS 4 -11.259 33.508 -9.216
31 H HIS 5 H HIS 5 -10.864 30.683 -6.135
32 HA HIS 5 HA HIS 5 -12.932 30.576 -4.176
33 HD1 HIS 5 HD1 HIS 5 -9.123 30.490 -2.165
34 HD2 HIS 5 HD2 HIS 5 -9.088 28.617 -5.872
35 HE1 HIS 5 HE1 HIS 5 -6.708 30.316 -2.802
36 HE2 HIS 5 HE2 HIS 5 -6.707 28.992 -4.931
37 HB2 HIS 5 2HB HIS 5 -11.355 29.257 -2.812
38 HB3 HIS 5 1HB HIS 5 -11.480 28.661 -4.461
39 H HIS 6 H HIS 6 -13.390 32.656 -3.484
40 HA HIS 6 HA HIS 6 -11.639 33.477 -1.281
41 HD1 HIS 6 HD1 HIS 6 -9.980 35.318 -0.700
42 HD2 HIS 6 HD2 HIS 6 -13.166 37.769 -1.756
43 HE1 HIS 6 HE1 HIS 6 -9.824 37.310 0.817
44 HE2 HIS 6 HE2 HIS 6 -11.849 38.691 0.271
45 HB2 HIS 6 2HB HIS 6 -11.176 34.981 -3.230
46 HB3 HIS 6 1HB HIS 6 -12.861 35.490 -3.187
47 H HIS 7 H HIS 7 -14.842 33.675 -2.807
48 HA HIS 7 HA HIS 7 -16.123 34.475 -0.355
49 HD1 HIS 7 HD1 HIS 7 -16.268 33.668 -4.694
50 HD2 HIS 7 HD2 HIS 7 -19.222 31.839 -2.416
51 HE1 HIS 7 HE1 HIS 7 -17.143 31.792 -6.108
52 HE2 HIS 7 HE2 HIS 7 -18.808 30.604 -4.645
53 HB2 HIS 7 2HB HIS 7 -18.215 34.283 -1.541
54 HB3 HIS 7 1HB HIS 7 -17.052 35.052 -2.609
55 H HIS 8 H HIS 8 -16.179 33.116 1.311
56 HA HIS 8 HA HIS 8 -16.148 30.257 0.995
57 HD1 HIS 8 HD1 HIS 8 -14.745 33.594 3.151
58 HD2 HIS 8 HD2 HIS 8 -18.299 32.105 4.706
59 HE1 HIS 8 HE1 HIS 8 -15.736 35.475 4.479
60 HE2 HIS 8 HE2 HIS 8 -17.758 34.477 5.583
61 HB2 HIS 8 2HB HIS 8 -16.448 30.308 3.533
62 HB3 HIS 8 1HB HIS 8 -14.994 31.061 2.889
63 H SER 9 H SER 9 -17.867 29.046 0.557
64 HA SER 9 HA SER 9 -20.553 29.975 1.380
65 HG SER 9 HG SER 9 -20.067 28.171 -2.235
66 HB2 SER 9 2HB SER 9 -21.422 28.972 -0.721
67 HB3 SER 9 1HB SER 9 -20.281 30.280 -1.025
68 H HIS 10 H HIS 10 -19.336 26.979 -0.126
69 HA HIS 10 HA HIS 10 -19.980 25.481 2.318
70 HD1 HIS 10 HD1 HIS 10 -23.378 25.631 -0.674
71 HD2 HIS 10 HD2 HIS 10 -22.351 25.065 3.310
72 HE1 HIS 10 HE1 HIS 10 -25.403 26.295 0.642
73 HE2 HIS 10 HE2 HIS 10 -24.823 25.770 3.028
74 HB2 HIS 10 2HB HIS 10 -21.046 24.843 -0.440
75 HB3 HIS 10 1HB HIS 10 -20.988 23.652 0.854
76 H MET 11 H MET 11 -18.525 25.350 -0.925
77 HA MET 11 HA MET 11 -16.956 23.026 -0.373
78 HB2 MET 11 2HB MET 11 -16.757 25.083 -2.586
79 HB3 MET 11 1HB MET 11 -15.817 23.598 -2.527
80 HG2 MET 11 2HG MET 11 -17.837 22.271 -2.659
81 HG3 MET 11 1HG MET 11 -18.827 23.729 -2.613
82 HE1 MET 11 3HE MET 11 -20.095 22.824 -4.818
83 HE2 MET 11 1HE MET 11 -19.044 21.407 -4.820
84 HE3 MET 11 2HE MET 11 -19.243 22.359 -6.290
85 H ALA 12 H ALA 12 -15.725 23.381 1.467
86 HA ALA 12 HA ALA 12 -13.287 24.934 1.057
87 HB1 ALA 12 3HB ALA 12 -14.805 26.527 2.145
88 HB2 ALA 12 1HB ALA 12 -13.449 26.107 3.191
89 HB3 ALA 12 2HB ALA 12 -15.038 25.395 3.478
90 H ALA 13 H ALA 13 -15.083 22.934 3.422
91 HA ALA 13 HA ALA 13 -12.761 21.867 4.667
92 HB1 ALA 13 3HB ALA 13 -14.924 21.940 5.797
93 HB2 ALA 13 1HB ALA 13 -14.297 20.294 5.741
94 HB3 ALA 13 2HB ALA 13 -15.582 20.787 4.637
95 H ALA 14 H ALA 14 -15.171 19.909 2.887
96 HA ALA 14 HA ALA 14 -13.229 18.771 1.111
97 HB1 ALA 14 3HB ALA 14 -12.612 17.584 3.161
98 HB2 ALA 14 1HB ALA 14 -13.302 16.478 1.973
99 HB3 ALA 14 2HB ALA 14 -14.273 17.021 3.341
100 H MET 15 H MET 15 -14.172 17.588 -0.554
101 HA MET 15 HA MET 15 -17.089 17.766 -0.740
102 HB2 MET 15 2HB MET 15 -15.566 18.583 -2.577
103 HB3 MET 15 1HB MET 15 -15.099 16.913 -2.862
104 HG2 MET 15 2HG MET 15 -16.746 17.566 -4.478
105 HG3 MET 15 1HG MET 15 -17.459 16.383 -3.381
106 HE1 MET 15 3HE MET 15 -20.498 18.710 -4.253
107 HE2 MET 15 1HE MET 15 -19.889 17.056 -4.246
108 HE3 MET 15 2HE MET 15 -19.185 18.251 -5.336
109 H ALA 16 H ALA 16 -14.843 15.500 0.236
110 HA ALA 16 HA ALA 16 -15.737 13.139 -1.065
111 HB1 ALA 16 3HB ALA 16 -13.501 13.352 -0.109
112 HB2 ALA 16 1HB ALA 16 -14.350 11.951 0.546
113 HB3 ALA 16 2HB ALA 16 -14.195 13.419 1.511
114 H ASN 17 H ASN 17 -17.265 14.927 1.369
115 HA ASN 17 HA ASN 17 -18.510 12.595 2.628
116 HB2 ASN 17 2HB ASN 17 -19.496 14.183 4.200
117 HB3 ASN 17 1HB ASN 17 -17.757 14.430 4.081
118 HD21 ASN 17 1HD2 ASN 17 -19.794 16.258 4.982
119 HD22 ASN 17 2HD2 ASN 17 -19.699 17.645 3.956
120 H ASN 18 H ASN 18 -19.039 14.252 -0.131
121 HA ASN 18 HA ASN 18 -21.845 14.667 -0.133
122 HB2 ASN 18 2HB ASN 18 -20.304 15.662 -1.799
123 HB3 ASN 18 1HB ASN 18 -20.003 14.061 -2.460
124 HD21 ASN 18 1HD2 ASN 18 -23.132 15.245 -1.369
125 HD22 ASN 18 2HD2 ASN 18 -23.863 15.253 -2.931
126 H LEU 19 H LEU 19 -23.429 13.176 -0.029
127 HA LEU 19 HA LEU 19 -22.799 10.386 -0.158
128 HG LEU 19 HG LEU 19 -25.693 9.323 -0.565
129 HB2 LEU 19 2HB LEU 19 -24.485 11.277 1.411
130 HB3 LEU 19 1HB LEU 19 -25.507 11.709 0.052
131 HD11 LEU 19 1HD1 LEU 19 -24.895 7.591 0.968
132 HD12 LEU 19 2HD1 LEU 19 -24.116 8.822 1.961
133 HD13 LEU 19 3HD1 LEU 19 -23.558 8.537 0.312
134 HD21 LEU 19 3HD2 LEU 19 -27.366 10.341 0.893
135 HD22 LEU 19 1HD2 LEU 19 -26.418 9.882 2.307
136 HD23 LEU 19 2HD2 LEU 19 -27.125 8.637 1.275
137 H GLN 20 H GLN 20 -22.094 10.024 -2.189
138 HA GLN 20 HA GLN 20 -23.721 10.690 -4.495
139 HB2 GLN 20 2HB GLN 20 -21.806 9.808 -5.801
140 HB3 GLN 20 1HB GLN 20 -21.334 11.059 -4.657
141 HG2 GLN 20 2HG GLN 20 -20.588 9.269 -3.091
142 HG3 GLN 20 1HG GLN 20 -20.938 8.085 -4.349
143 HE21 GLN 20 1HE2 GLN 20 -18.822 10.661 -3.358
144 HE22 GLN 20 2HE2 GLN 20 -17.586 10.355 -4.522
145 H LYS 21 H LYS 21 -24.216 9.072 -6.162
146 HA LYS 21 HA LYS 21 -25.301 6.651 -5.021
147 HB2 LYS 21 2HB LYS 21 -26.536 7.981 -6.707
148 HB3 LYS 21 1HB LYS 21 -25.292 7.614 -7.894
149 HG2 LYS 21 2HG LYS 21 -25.851 5.254 -7.804
150 HG3 LYS 21 1HG LYS 21 -27.028 5.560 -6.525
151 HD2 LYS 21 2HD LYS 21 -28.334 6.959 -8.065
152 HD3 LYS 21 1HD LYS 21 -27.157 6.651 -9.344
153 HE2 LYS 21 2HE LYS 21 -27.692 4.270 -9.287
154 HE3 LYS 21 1HE LYS 21 -28.816 4.540 -7.954
155 HZ1 LYS 21 3HZ LYS 21 -30.188 5.871 -9.387
156 HZ2 LYS 21 1HZ LYS 21 -29.930 4.369 -10.116
157 HZ3 LYS 21 2HZ LYS 21 -29.087 5.732 -10.661
158 H GLY 22 H GLY 22 -24.602 4.563 -5.337
159 HA2 GLY 22 2HA GLY 22 -21.852 4.133 -5.634
160 HA3 GLY 22 1HA GLY 22 -23.074 2.878 -5.632
161 H SER 23 H SER 23 -21.123 4.987 -7.632
162 HA SER 23 HA SER 23 -22.015 3.883 -10.137
163 HG SER 23 HG SER 23 -20.578 5.833 -11.981
164 HB2 SER 23 2HB SER 23 -21.084 6.169 -9.987
165 HB3 SER 23 1HB SER 23 -19.520 5.498 -9.526
166 H ALA 24 H ALA 24 -18.929 3.652 -8.371
167 HA ALA 24 HA ALA 24 -18.629 0.879 -9.285
168 HB1 ALA 24 3HB ALA 24 -16.324 1.230 -9.981
169 HB2 ALA 24 1HB ALA 24 -16.455 2.949 -9.608
170 HB3 ALA 24 2HB ALA 24 -17.417 2.254 -10.914
171 H GLY 25 H GLY 25 -17.049 3.444 -7.355
172 HA2 GLY 25 2HA GLY 25 -16.751 3.430 -5.037
173 HA3 GLY 25 1HA GLY 25 -17.162 1.727 -5.001
174 HA PRO 26 HA PRO 26 -12.369 2.093 -6.028
175 HB2 PRO 26 2HB PRO 26 -11.848 4.817 -4.980
176 HB3 PRO 26 1HB PRO 26 -11.231 4.039 -6.442
177 HG2 PRO 26 2HG PRO 26 -13.070 5.985 -6.579
178 HG3 PRO 26 1HG PRO 26 -13.113 4.602 -7.688
179 HD2 PRO 26 2HD PRO 26 -14.756 5.107 -5.227
180 HD3 PRO 26 1HD PRO 26 -15.264 4.477 -6.810
181 H MET 27 H MET 27 -11.064 1.199 -4.469
182 HA MET 27 HA MET 27 -11.943 1.532 -1.683
183 HB2 MET 27 2HB MET 27 -11.977 -0.749 -2.665
184 HB3 MET 27 1HB MET 27 -10.234 -0.661 -2.885
185 HG2 MET 27 2HG MET 27 -9.917 -0.498 -0.480
186 HG3 MET 27 1HG MET 27 -11.664 -0.512 -0.234
187 HE1 MET 27 3HE MET 27 -11.405 -2.499 1.492
188 HE2 MET 27 1HE MET 27 -9.659 -2.534 1.246
189 HE3 MET 27 2HE MET 27 -10.594 -4.022 1.127
190 H ARG 28 H ARG 28 -10.611 2.182 -0.068
191 HA ARG 28 HA ARG 28 -7.952 3.195 -0.864
192 HE ARG 28 HE ARG 28 -7.397 7.324 3.017
193 HB2 ARG 28 2HB ARG 28 -9.599 4.941 -0.355
194 HB3 ARG 28 1HB ARG 28 -9.882 4.233 1.228
195 HG2 ARG 28 2HG ARG 28 -7.638 4.814 1.934
196 HG3 ARG 28 1HG ARG 28 -7.253 5.406 0.314
197 HD2 ARG 28 2HD ARG 28 -8.929 7.154 0.515
198 HD3 ARG 28 1HD ARG 28 -9.432 6.529 2.084
199 HH11 ARG 28 1HH1 ARG 28 -7.806 8.241 -0.294
200 HH12 ARG 28 2HH1 ARG 28 -6.753 9.603 -0.157
201 HH21 ARG 28 1HH2 ARG 28 -6.046 9.092 3.162
202 HH22 ARG 28 2HH2 ARG 28 -5.773 10.073 1.765
203 H LEU 29 H LEU 29 -6.273 2.162 0.031
204 HA LEU 29 HA LEU 29 -6.669 0.604 2.492
205 HG LEU 29 HG LEU 29 -6.513 -0.535 -0.474
206 HB2 LEU 29 2HB LEU 29 -4.470 0.469 0.424
207 HB3 LEU 29 1HB LEU 29 -4.574 -0.547 1.848
208 HD11 LEU 29 1HD1 LEU 29 -4.339 -1.566 -0.966
209 HD12 LEU 29 2HD1 LEU 29 -5.636 -2.760 -0.927
210 HD13 LEU 29 3HD1 LEU 29 -4.524 -2.620 0.436
211 HD21 LEU 29 3HD2 LEU 29 -7.679 -0.992 1.621
212 HD22 LEU 29 1HD2 LEU 29 -6.490 -2.231 2.029
213 HD23 LEU 29 2HD2 LEU 29 -7.558 -2.454 0.642
214 H TYR 30 H TYR 30 -5.387 0.816 4.257
215 HA TYR 30 HA TYR 30 -3.577 3.124 4.411
216 HD1 TYR 30 HD2 TYR 30 -2.957 4.567 6.779
217 HD2 TYR 30 HD1 TYR 30 -3.873 0.646 8.175
218 HE1 TYR 30 HE2 TYR 30 -1.336 4.841 8.610
219 HE2 TYR 30 HE1 TYR 30 -2.255 0.912 10.007
220 HH TYR 30 HH TYR 30 -0.932 3.893 10.881
221 HB2 TYR 30 2HB TYR 30 -5.139 3.284 6.157
222 HB3 TYR 30 1HB TYR 30 -5.148 1.551 6.444
223 H VAL 31 H VAL 31 -1.449 2.749 4.266
224 HA VAL 31 HA VAL 31 -0.399 0.108 5.102
225 HB VAL 31 HB VAL 31 0.744 1.928 2.960
226 HG11 VAL 31 1HG1 VAL 31 2.471 0.642 4.094
227 HG12 VAL 31 2HG1 VAL 31 2.232 0.029 2.459
228 HG13 VAL 31 3HG1 VAL 31 1.565 -0.849 3.836
229 HG21 VAL 31 3HG2 VAL 31 -1.355 0.920 2.225
230 HG22 VAL 31 1HG2 VAL 31 -0.763 -0.680 2.672
231 HG23 VAL 31 2HG2 VAL 31 0.008 0.212 1.362
232 H GLY 32 H GLY 32 0.759 0.261 6.941
233 HA2 GLY 32 2HA GLY 32 2.394 2.705 7.358
234 HA3 GLY 32 1HA GLY 32 1.515 1.929 8.664
235 H SER 33 H SER 33 4.230 1.659 6.477
236 HA SER 33 HA SER 33 5.875 0.366 8.434
237 HG SER 33 HG SER 33 4.329 -1.318 8.644
238 HB2 SER 33 2HB SER 33 4.889 -1.269 6.084
239 HB3 SER 33 1HB SER 33 6.408 -1.637 6.896
240 H LEU 34 H LEU 34 5.857 2.726 6.730
241 HA LEU 34 HA LEU 34 7.956 2.228 4.742
242 HG LEU 34 HG LEU 34 4.733 3.338 4.836
243 HB2 LEU 34 2HB LEU 34 6.581 4.861 5.252
244 HB3 LEU 34 1HB LEU 34 7.395 4.323 3.795
245 HD11 LEU 34 1HD1 LEU 34 3.831 4.347 2.808
246 HD12 LEU 34 2HD1 LEU 34 5.441 4.920 2.367
247 HD13 LEU 34 3HD1 LEU 34 4.646 5.546 3.812
248 HD21 LEU 34 3HD2 LEU 34 6.238 2.469 2.366
249 HD22 LEU 34 1HD2 LEU 34 4.606 1.978 2.814
250 HD23 LEU 34 2HD2 LEU 34 5.976 1.496 3.814
251 H HIS 35 H HIS 35 9.938 2.186 5.719
252 HA HIS 35 HA HIS 35 10.530 3.763 8.026
253 HD1 HIS 35 HD1 HIS 35 14.371 3.207 5.962
254 HD2 HIS 35 HD2 HIS 35 11.469 0.341 5.162
255 HE1 HIS 35 HE1 HIS 35 15.103 2.084 3.842
256 HE2 HIS 35 HE2 HIS 35 13.440 0.230 3.489
257 HB2 HIS 35 2HB HIS 35 12.767 2.783 7.919
258 HB3 HIS 35 1HB HIS 35 11.532 1.557 7.711
259 H PHE 36 H PHE 36 9.860 5.801 6.787
260 HA PHE 36 HA PHE 36 10.390 7.868 5.992
261 HD1 PHE 36 HD1 PHE 36 11.683 5.948 9.035
262 HD2 PHE 36 HD2 PHE 36 11.276 10.113 8.204
263 HE1 PHE 36 HE1 PHE 36 10.613 6.281 11.224
264 HE2 PHE 36 HE2 PHE 36 10.207 10.444 10.394
265 HZ PHE 36 HZ PHE 36 9.875 8.528 11.905
266 HB2 PHE 36 2HB PHE 36 13.041 7.128 7.249
267 HB3 PHE 36 1HB PHE 36 12.579 8.761 6.777
268 H ASN 37 H ASN 37 11.025 5.554 4.112
269 HA ASN 37 HA ASN 37 12.713 7.053 2.246
270 HB2 ASN 37 2HB ASN 37 14.073 5.418 3.712
271 HB3 ASN 37 1HB ASN 37 13.307 4.144 2.777
272 HD21 ASN 37 1HD2 ASN 37 13.370 5.681 0.254
273 HD22 ASN 37 2HD2 ASN 37 15.020 5.680 -0.233
274 H ILE 38 H ILE 38 10.605 4.252 2.782
275 HA ILE 38 HA ILE 38 10.307 3.455 0.108
276 HB ILE 38 HB ILE 38 8.195 3.235 2.268
277 HG12 ILE 38 2HG1 ILE 38 10.360 2.309 3.024
278 HG13 ILE 38 1HG1 ILE 38 9.161 1.043 2.788
279 HG21 ILE 38 1HG2 ILE 38 8.655 1.615 -0.244
280 HG22 ILE 38 2HG2 ILE 38 7.340 2.759 0.033
281 HG23 ILE 38 3HG2 ILE 38 7.435 1.278 0.985
282 HD11 ILE 38 3HD1 ILE 38 11.381 1.749 0.877
283 HD12 ILE 38 1HD1 ILE 38 10.189 0.467 0.649
284 HD13 ILE 38 2HD1 ILE 38 11.349 0.369 1.975
285 H THR 39 H THR 39 9.648 4.714 -1.519
286 HA THR 39 HA THR 39 7.908 7.012 -1.030
287 HB THR 39 HB THR 39 8.541 7.744 -3.287
288 HG1 THR 39 HG1 THR 39 9.976 6.471 -4.520
289 HG21 THR 39 3HG2 THR 39 10.959 8.037 -2.934
290 HG22 THR 39 1HG2 THR 39 10.918 6.816 -1.661
291 HG23 THR 39 2HG2 THR 39 10.047 8.335 -1.455
292 H GLU 40 H GLU 40 6.375 7.579 -2.877
293 HA GLU 40 HA GLU 40 4.276 5.775 -3.090
294 HB2 GLU 40 2HB GLU 40 5.017 8.060 -4.934
295 HB3 GLU 40 1HB GLU 40 3.464 7.234 -4.953
296 HG2 GLU 40 2HG GLU 40 2.977 8.005 -2.710
297 HG3 GLU 40 1HG GLU 40 4.580 8.729 -2.583
298 H ASP 41 H ASP 41 6.929 6.367 -5.377
299 HA ASP 41 HA ASP 41 5.978 4.746 -7.476
300 HB2 ASP 41 2HB ASP 41 8.856 5.406 -6.801
301 HB3 ASP 41 1HB ASP 41 8.237 4.893 -8.370
302 H MET 42 H MET 42 8.008 3.976 -4.667
303 HA MET 42 HA MET 42 8.680 1.324 -5.440
304 HB2 MET 42 2HB MET 42 8.422 2.475 -2.642
305 HB3 MET 42 1HB MET 42 9.260 0.989 -3.069
306 HG2 MET 42 2HG MET 42 10.023 3.767 -3.954
307 HG3 MET 42 1HG MET 42 10.814 2.826 -2.690
308 HE1 MET 42 3HE MET 42 12.318 4.182 -5.180
309 HE2 MET 42 1HE MET 42 13.439 2.898 -5.631
310 HE3 MET 42 2HE MET 42 13.162 3.270 -3.929
311 H LEU 43 H LEU 43 6.223 2.551 -3.171
312 HA LEU 43 HA LEU 43 4.805 0.207 -2.693
313 HG LEU 43 HG LEU 43 5.532 2.628 -1.127
314 HB2 LEU 43 2HB LEU 43 3.777 3.043 -2.921
315 HB3 LEU 43 1HB LEU 43 2.872 1.713 -2.225
316 HD11 LEU 43 1HD1 LEU 43 4.261 3.801 0.610
317 HD12 LEU 43 2HD1 LEU 43 2.760 3.444 -0.245
318 HD13 LEU 43 3HD1 LEU 43 3.977 4.484 -0.990
319 HD21 LEU 43 3HD2 LEU 43 3.331 0.917 0.046
320 HD22 LEU 43 1HD2 LEU 43 4.818 1.394 0.868
321 HD23 LEU 43 2HD2 LEU 43 4.892 0.342 -0.545
322 H ARG 44 H ARG 44 4.482 2.520 -5.359
323 HA ARG 44 HA ARG 44 2.258 1.369 -6.625
324 HE ARG 44 HE ARG 44 1.511 5.051 -8.782
325 HB2 ARG 44 2HB ARG 44 3.163 3.605 -7.157
326 HB3 ARG 44 1HB ARG 44 4.578 2.858 -7.883
327 HG2 ARG 44 2HG ARG 44 3.198 1.841 -9.601
328 HG3 ARG 44 1HG ARG 44 1.742 2.504 -8.852
329 HD2 ARG 44 2HD ARG 44 4.030 4.110 -10.004
330 HD3 ARG 44 1HD ARG 44 2.466 3.845 -10.772
331 HH11 ARG 44 1HH1 ARG 44 4.743 5.636 -9.840
332 HH12 ARG 44 2HH1 ARG 44 4.767 7.248 -9.214
333 HH21 ARG 44 1HH2 ARG 44 1.555 7.114 -7.988
334 HH22 ARG 44 2HH2 ARG 44 2.995 8.064 -8.152
335 H GLY 45 H GLY 45 5.747 0.786 -7.120
336 HA2 GLY 45 2HA GLY 45 5.589 -1.072 -9.198
337 HA3 GLY 45 1HA GLY 45 6.868 -1.020 -7.997
338 H ILE 46 H ILE 46 5.092 -1.553 -5.743
339 HA ILE 46 HA ILE 46 4.923 -4.447 -5.998
340 HB ILE 46 HB ILE 46 4.254 -2.701 -3.619
341 HG12 ILE 46 2HG1 ILE 46 6.804 -4.210 -4.263
342 HG13 ILE 46 1HG1 ILE 46 6.607 -2.463 -4.360
343 HG21 ILE 46 1HG2 ILE 46 4.538 -4.774 -2.312
344 HG22 ILE 46 2HG2 ILE 46 4.754 -5.677 -3.811
345 HG23 ILE 46 3HG2 ILE 46 3.211 -4.895 -3.468
346 HD11 ILE 46 3HD1 ILE 46 7.750 -3.045 -2.333
347 HD12 ILE 46 1HD1 ILE 46 6.457 -4.152 -1.874
348 HD13 ILE 46 2HD1 ILE 46 6.150 -2.417 -1.938
349 H PHE 47 H PHE 47 2.641 -1.804 -5.284
350 HA PHE 47 HA PHE 47 0.420 -3.623 -4.959
351 HD1 PHE 47 HD2 PHE 47 2.581 -1.490 -3.167
352 HD2 PHE 47 HD1 PHE 47 -1.599 -2.024 -2.504
353 HE1 PHE 47 HE2 PHE 47 3.003 -1.781 -0.761
354 HE2 PHE 47 HE1 PHE 47 -1.177 -2.315 -0.096
355 HZ PHE 47 HZ PHE 47 1.124 -2.192 0.776
356 HB2 PHE 47 2HB PHE 47 0.673 -0.620 -4.786
357 HB3 PHE 47 1HB PHE 47 -0.870 -1.442 -4.624
358 H GLU 48 H GLU 48 1.618 -1.618 -7.580
359 HA GLU 48 HA GLU 48 -0.793 -0.993 -8.847
360 HB2 GLU 48 2HB GLU 48 1.499 -0.044 -9.405
361 HB3 GLU 48 1HB GLU 48 1.772 -1.498 -10.361
362 HG2 GLU 48 2HG GLU 48 -0.354 -0.921 -11.613
363 HG3 GLU 48 1HG GLU 48 -0.311 0.628 -10.783
364 HA PRO 49 HA PRO 49 0.014 -5.105 -11.624
365 HB2 PRO 49 2HB PRO 49 0.859 -6.690 -9.216
366 HB3 PRO 49 1HB PRO 49 1.278 -6.924 -10.921
367 HG2 PRO 49 2HG PRO 49 3.017 -5.787 -9.270
368 HG3 PRO 49 1HG PRO 49 2.807 -5.165 -10.919
369 HD2 PRO 49 2HD PRO 49 1.853 -4.026 -8.326
370 HD3 PRO 49 1HD PRO 49 2.393 -3.192 -9.797
371 H PHE 50 H PHE 50 -1.312 -4.647 -8.430
372 HA PHE 50 HA PHE 50 -3.238 -6.776 -8.621
373 HD1 PHE 50 HD2 PHE 50 -3.703 -8.002 -6.029
374 HD2 PHE 50 HD1 PHE 50 -0.697 -4.989 -6.045
375 HE1 PHE 50 HE2 PHE 50 -2.223 -9.479 -4.741
376 HE2 PHE 50 HE1 PHE 50 0.790 -6.467 -4.756
377 HZ PHE 50 HZ PHE 50 0.026 -8.713 -4.096
378 HB2 PHE 50 2HB PHE 50 -2.956 -4.467 -6.692
379 HB3 PHE 50 1HB PHE 50 -4.234 -5.672 -6.575
380 H GLY 51 H GLY 51 -3.349 -3.243 -9.186
381 HA2 GLY 51 2HA GLY 51 -5.638 -3.546 -10.885
382 HA3 GLY 51 1HA GLY 51 -6.097 -2.899 -9.325
383 H ARG 52 H ARG 52 -3.112 -2.134 -11.068
384 HA ARG 52 HA ARG 52 -2.390 -0.300 -12.219
385 HE ARG 52 HE ARG 52 -1.406 1.670 -12.984
386 HB2 ARG 52 2HB ARG 52 -4.801 -0.508 -13.185
387 HB3 ARG 52 1HB ARG 52 -5.150 0.894 -12.193
388 HG2 ARG 52 2HG ARG 52 -3.096 0.751 -14.401
389 HG3 ARG 52 1HG ARG 52 -4.682 1.505 -14.505
390 HD2 ARG 52 2HD ARG 52 -3.520 3.381 -14.030
391 HD3 ARG 52 1HD ARG 52 -3.683 2.822 -12.371
392 HH11 ARG 52 1HH1 ARG 52 -2.472 4.865 -13.692
393 HH12 ARG 52 2HH1 ARG 52 -0.867 5.498 -13.790
394 HH21 ARG 52 1HH2 ARG 52 0.660 2.501 -13.080
395 HH22 ARG 52 2HH2 ARG 52 0.880 4.171 -13.472
396 H ILE 53 H ILE 53 -4.841 0.737 -9.875
397 HA ILE 53 HA ILE 53 -4.744 2.090 -8.044
398 HB ILE 53 HB ILE 53 -1.830 2.537 -8.743
399 HG12 ILE 53 2HG1 ILE 53 -3.116 0.853 -6.571
400 HG13 ILE 53 1HG1 ILE 53 -2.345 0.232 -8.027
401 HG21 ILE 53 1HG2 ILE 53 -2.731 4.454 -7.528
402 HG22 ILE 53 2HG2 ILE 53 -1.621 3.539 -6.509
403 HG23 ILE 53 3HG2 ILE 53 -3.363 3.381 -6.279
404 HD11 ILE 53 3HD1 ILE 53 -0.869 0.013 -6.140
405 HD12 ILE 53 1HD1 ILE 53 -1.001 1.735 -5.790
406 HD13 ILE 53 2HD1 ILE 53 -0.210 1.194 -7.270
407 H GLU 54 H GLU 54 -5.485 4.133 -7.835
408 HA GLU 54 HA GLU 54 -5.316 5.923 -10.113
409 HB2 GLU 54 2HB GLU 54 -6.643 6.379 -7.429
410 HB3 GLU 54 1HB GLU 54 -6.881 7.328 -8.891
411 HG2 GLU 54 2HG GLU 54 -7.825 5.300 -9.985
412 HG3 GLU 54 1HG GLU 54 -7.701 4.462 -8.439
413 H SER 55 H SER 55 -4.711 6.348 -6.605
414 HA SER 55 HA SER 55 -2.297 7.881 -7.197
415 HG SER 55 HG SER 55 -2.360 10.555 -6.412
416 HB2 SER 55 2HB SER 55 -4.060 9.590 -7.267
417 HB3 SER 55 1HB SER 55 -4.619 9.098 -5.669
418 H ILE 56 H ILE 56 -0.824 7.963 -5.542
419 HA ILE 56 HA ILE 56 -1.529 6.589 -3.018
420 HB ILE 56 HB ILE 56 1.197 6.816 -4.332
421 HG12 ILE 56 2HG1 ILE 56 -0.639 4.422 -4.002
422 HG13 ILE 56 1HG1 ILE 56 -0.286 5.251 -5.515
423 HG21 ILE 56 1HG2 ILE 56 1.353 6.819 -1.895
424 HG22 ILE 56 2HG2 ILE 56 1.965 5.304 -2.555
425 HG23 ILE 56 3HG2 ILE 56 0.365 5.360 -1.815
426 HD11 ILE 56 3HD1 ILE 56 1.690 3.731 -3.827
427 HD12 ILE 56 1HD1 ILE 56 2.052 4.569 -5.336
428 HD13 ILE 56 2HD1 ILE 56 0.961 3.185 -5.337
429 H GLN 57 H GLN 57 -1.331 7.766 -1.156
430 HA GLN 57 HA GLN 57 0.123 10.334 -1.315
431 HB2 GLN 57 2HB GLN 57 -2.500 9.815 0.108
432 HB3 GLN 57 1HB GLN 57 -1.590 11.320 0.181
433 HG2 GLN 57 2HG GLN 57 -2.795 10.106 -2.300
434 HG3 GLN 57 1HG GLN 57 -3.452 11.467 -1.391
435 HE21 GLN 57 1HE2 GLN 57 -2.514 11.241 -4.182
436 HE22 GLN 57 2HE2 GLN 57 -1.323 12.480 -4.365
437 H LEU 58 H LEU 58 1.724 10.507 0.103
438 HA LEU 58 HA LEU 58 1.789 8.696 2.418
439 HG LEU 58 HG LEU 58 3.517 8.718 -0.365
440 HB2 LEU 58 2HB LEU 58 3.993 10.431 1.285
441 HB3 LEU 58 1HB LEU 58 4.168 9.222 2.543
442 HD11 LEU 58 1HD1 LEU 58 5.947 7.995 1.274
443 HD12 LEU 58 2HD1 LEU 58 5.857 9.260 0.046
444 HD13 LEU 58 3HD1 LEU 58 5.667 7.571 -0.416
445 HD21 LEU 58 3HD2 LEU 58 3.764 6.731 1.896
446 HD22 LEU 58 1HD2 LEU 58 3.607 6.331 0.185
447 HD23 LEU 58 2HD2 LEU 58 2.287 7.144 1.024
448 H MET 59 H MET 59 2.219 9.476 4.529
449 HA MET 59 HA MET 59 1.333 12.242 4.957
450 HB2 MET 59 2HB MET 59 1.714 10.038 7.001
451 HB3 MET 59 1HB MET 59 0.874 11.564 7.237
452 HG2 MET 59 2HG MET 59 0.012 9.360 5.373
453 HG3 MET 59 1HG MET 59 -0.671 9.688 6.961
454 HE1 MET 59 3HE MET 59 -2.108 11.857 7.534
455 HE2 MET 59 1HE MET 59 -2.388 13.172 6.396
456 HE3 MET 59 2HE MET 59 -0.764 12.875 7.019
457 H MET 60 H MET 60 2.943 13.719 5.064
458 HA MET 60 HA MET 60 5.452 12.953 6.437
459 HB2 MET 60 2HB MET 60 6.619 14.577 5.053
460 HB3 MET 60 1HB MET 60 5.760 13.425 4.044
461 HG2 MET 60 2HG MET 60 4.733 16.176 4.716
462 HG3 MET 60 1HG MET 60 5.636 15.782 3.256
463 HE1 MET 60 3HE MET 60 4.713 14.321 1.279
464 HE2 MET 60 1HE MET 60 3.215 13.393 1.364
465 HE3 MET 60 2HE MET 60 4.572 12.978 2.411
466 H ASP 61 H ASP 61 6.403 14.381 7.899
467 HA ASP 61 HA ASP 61 4.702 16.299 9.194
468 HB2 ASP 61 2HB ASP 61 6.286 15.027 10.519
469 HB3 ASP 61 1HB ASP 61 7.634 15.628 9.560
470 H SER 62 H SER 62 5.163 18.603 9.420
471 HA SER 62 HA SER 62 6.262 19.664 6.897
472 HG SER 62 HG SER 62 5.314 22.395 7.321
473 HB2 SER 62 2HB SER 62 3.812 19.976 7.234
474 HB3 SER 62 1HB SER 62 4.157 20.922 8.683
475 H GLU 63 H GLU 63 7.591 19.267 9.642
476 HA GLU 63 HA GLU 63 8.787 21.975 9.736
477 HB2 GLU 63 2HB GLU 63 8.847 19.851 11.898
478 HB3 GLU 63 1HB GLU 63 9.522 21.471 12.012
479 HG2 GLU 63 2HG GLU 63 7.274 22.421 11.830
480 HG3 GLU 63 1HG GLU 63 6.602 20.795 11.713
481 H THR 64 H THR 64 9.761 18.676 10.623
482 HA THR 64 HA THR 64 11.806 18.534 8.596
483 HB THR 64 HB THR 64 13.062 19.892 10.104
484 HG1 THR 64 HG1 THR 64 14.316 17.667 10.993
485 HG21 THR 64 3HG2 THR 64 13.442 19.310 12.454
486 HG22 THR 64 1HG2 THR 64 12.375 17.916 12.286
487 HG23 THR 64 2HG2 THR 64 11.724 19.549 12.129
488 H GLY 65 H GLY 65 9.472 17.060 10.040
489 HA2 GLY 65 2HA GLY 65 10.755 14.630 11.003
490 HA3 GLY 65 1HA GLY 65 9.024 14.923 10.880
491 H ARG 66 H ARG 66 9.276 15.800 8.083
492 HA ARG 66 HA ARG 66 9.107 14.964 5.975
493 HE ARG 66 HE ARG 66 10.008 16.896 6.088
494 HB2 ARG 66 2HB ARG 66 11.319 13.154 6.952
495 HB3 ARG 66 1HB ARG 66 10.870 13.369 5.268
496 HG2 ARG 66 2HG ARG 66 11.837 15.622 7.047
497 HG3 ARG 66 1HG ARG 66 12.880 14.676 5.981
498 HD2 ARG 66 2HD ARG 66 12.306 16.706 4.841
499 HD3 ARG 66 1HD ARG 66 11.448 15.382 4.053
500 HH11 ARG 66 1HH1 ARG 66 10.550 16.346 2.723
501 HH12 ARG 66 2HH1 ARG 66 9.053 17.068 2.262
502 HH21 ARG 66 1HH2 ARG 66 8.112 17.840 5.485
503 HH22 ARG 66 2HH2 ARG 66 7.691 17.928 3.807
504 H SER 67 H SER 67 9.558 12.185 5.130
505 HA SER 67 HA SER 67 6.974 11.219 5.222
506 HG SER 67 HG SER 67 9.616 10.506 2.979
507 HB2 SER 67 2HB SER 67 9.524 9.633 4.868
508 HB3 SER 67 1HB SER 67 7.911 9.085 4.409
509 H LYS 68 H LYS 68 5.937 10.941 7.142
510 HA LYS 68 HA LYS 68 7.042 10.257 9.590
511 HB2 LYS 68 2HB LYS 68 4.213 9.877 8.592
512 HB3 LYS 68 1HB LYS 68 4.689 9.706 10.276
513 HG2 LYS 68 2HG LYS 68 5.319 12.021 10.400
514 HG3 LYS 68 1HG LYS 68 5.062 12.231 8.667
515 HD2 LYS 68 2HD LYS 68 2.687 11.854 8.923
516 HD3 LYS 68 1HD LYS 68 2.894 11.455 10.629
517 HE2 LYS 68 2HE LYS 68 3.530 14.146 9.408
518 HE3 LYS 68 1HE LYS 68 2.023 13.749 10.234
519 HZ1 LYS 68 3HZ LYS 68 3.319 13.253 12.232
520 HZ2 LYS 68 1HZ LYS 68 3.534 14.853 11.731
521 HZ3 LYS 68 2HZ LYS 68 4.738 13.707 11.434
522 H GLY 69 H GLY 69 5.371 8.056 7.323
523 HA2 GLY 69 2HA GLY 69 6.769 5.838 7.339
524 HA3 GLY 69 1HA GLY 69 6.183 5.769 8.991
525 H TYR 70 H TYR 70 3.641 7.140 7.607
526 HA TYR 70 HA TYR 70 2.516 4.624 6.573
527 HD1 TYR 70 HD1 TYR 70 2.871 6.404 10.181
528 HD2 TYR 70 HD2 TYR 70 -0.545 7.501 7.887
529 HE1 TYR 70 HE1 TYR 70 2.628 8.444 11.529
530 HE2 TYR 70 HE2 TYR 70 -0.793 9.548 9.230
531 HH TYR 70 HH TYR 70 1.632 10.557 11.523
532 HB2 TYR 70 2HB TYR 70 0.351 5.267 7.726
533 HB3 TYR 70 1HB TYR 70 1.659 4.740 8.776
534 H GLY 71 H GLY 71 0.965 4.761 4.974
535 HA2 GLY 71 2HA GLY 71 0.172 7.380 3.943
536 HA3 GLY 71 1HA GLY 71 1.181 6.395 2.893
537 H PHE 72 H PHE 72 -1.388 7.227 2.141
538 HA PHE 72 HA PHE 72 -3.017 4.769 2.378
539 HD1 PHE 72 HD2 PHE 72 -2.857 8.471 3.900
540 HD2 PHE 72 HD1 PHE 72 -5.613 5.220 3.999
541 HE1 PHE 72 HE2 PHE 72 -3.113 8.765 6.329
542 HE2 PHE 72 HE1 PHE 72 -5.872 5.513 6.428
543 HZ PHE 72 HZ PHE 72 -4.620 7.283 7.596
544 HB2 PHE 72 2HB PHE 72 -3.911 7.617 1.850
545 HB3 PHE 72 1HB PHE 72 -4.974 6.215 1.906
546 H ILE 73 H ILE 73 -3.368 3.616 0.600
547 HA ILE 73 HA ILE 73 -2.800 4.813 -2.047
548 HB ILE 73 HB ILE 73 -2.785 1.886 -1.258
549 HG12 ILE 73 2HG1 ILE 73 -0.468 3.736 -1.898
550 HG13 ILE 73 1HG1 ILE 73 -0.918 3.207 -0.282
551 HG21 ILE 73 1HG2 ILE 73 -1.999 3.219 -3.855
552 HG22 ILE 73 2HG2 ILE 73 -3.420 2.208 -3.593
553 HG23 ILE 73 3HG2 ILE 73 -1.806 1.507 -3.480
554 HD11 ILE 73 3HD1 ILE 73 0.968 1.941 -1.126
555 HD12 ILE 73 1HD1 ILE 73 0.026 1.438 -2.528
556 HD13 ILE 73 2HD1 ILE 73 -0.435 0.892 -0.914
557 H THR 74 H THR 74 -4.392 4.833 -3.590
558 HA THR 74 HA THR 74 -6.971 3.561 -2.873
559 HB THR 74 HB THR 74 -6.603 6.073 -4.529
560 HG1 THR 74 HG1 THR 74 -6.256 6.023 -2.063
561 HG21 THR 74 3HG2 THR 74 -8.618 4.807 -5.130
562 HG22 THR 74 1HG2 THR 74 -9.040 6.298 -4.285
563 HG23 THR 74 2HG2 THR 74 -9.099 4.753 -3.434
564 H PHE 75 H PHE 75 -7.683 2.013 -4.183
565 HA PHE 75 HA PHE 75 -6.453 1.675 -6.839
566 HD1 PHE 75 HD1 PHE 75 -6.067 0.481 -3.440
567 HD2 PHE 75 HD2 PHE 75 -5.456 -1.639 -7.089
568 HE1 PHE 75 HE1 PHE 75 -3.895 -0.325 -2.611
569 HE2 PHE 75 HE2 PHE 75 -3.286 -2.444 -6.261
570 HZ PHE 75 HZ PHE 75 -2.505 -1.786 -4.019
571 HB2 PHE 75 2HB PHE 75 -7.984 -0.238 -5.061
572 HB3 PHE 75 1HB PHE 75 -7.500 -0.625 -6.707
573 H SER 76 H SER 76 -7.704 1.304 -8.693
574 HA SER 76 HA SER 76 -10.166 2.738 -8.867
575 HG SER 76 HG SER 76 -8.519 3.543 -11.248
576 HB2 SER 76 2HB SER 76 -8.981 0.867 -10.935
577 HB3 SER 76 1HB SER 76 -10.124 2.181 -11.218
578 H ASP 77 H ASP 77 -9.554 -0.404 -7.836
579 HA ASP 77 HA ASP 77 -12.338 -1.214 -8.305
580 HB2 ASP 77 2HB ASP 77 -10.939 -2.260 -10.067
581 HB3 ASP 77 1HB ASP 77 -9.949 -3.011 -8.821
582 H SER 78 H SER 78 -13.185 -2.696 -6.790
583 HA SER 78 HA SER 78 -12.217 -2.371 -4.140
584 HG SER 78 HG SER 78 -14.454 -5.307 -5.080
585 HB2 SER 78 2HB SER 78 -14.090 -3.894 -3.519
586 HB3 SER 78 1HB SER 78 -14.601 -2.570 -4.566
587 H GLU 79 H GLU 79 -12.427 -5.296 -6.210
588 HA GLU 79 HA GLU 79 -11.219 -6.987 -4.259
589 HB2 GLU 79 2HB GLU 79 -11.964 -7.308 -7.137
590 HB3 GLU 79 1HB GLU 79 -10.884 -8.490 -6.411
591 HG2 GLU 79 2HG GLU 79 -13.209 -9.227 -6.337
592 HG3 GLU 79 1HG GLU 79 -12.537 -9.021 -4.722
593 H CYS 80 H CYS 80 -9.913 -5.074 -6.900
594 HA CYS 80 HA CYS 80 -7.307 -6.086 -6.995
595 HG CYS 80 HG CYS 80 -7.305 -5.279 -9.872
596 HB2 CYS 80 2HB CYS 80 -8.286 -3.242 -7.327
597 HB3 CYS 80 1HB CYS 80 -6.657 -3.777 -7.731
598 H ALA 81 H ALA 81 -8.738 -3.712 -4.799
599 HA ALA 81 HA ALA 81 -6.285 -3.287 -3.328
600 HB1 ALA 81 3HB ALA 81 -9.117 -2.436 -2.703
601 HB2 ALA 81 1HB ALA 81 -7.910 -1.481 -3.564
602 HB3 ALA 81 2HB ALA 81 -7.666 -1.885 -1.865
603 H LYS 82 H LYS 82 -9.295 -5.080 -2.859
604 HA LYS 82 HA LYS 82 -8.967 -6.019 -0.266
605 HB2 LYS 82 2HB LYS 82 -10.977 -6.340 -1.738
606 HB3 LYS 82 1HB LYS 82 -10.089 -7.579 -2.609
607 HG2 LYS 82 2HG LYS 82 -11.478 -8.732 -1.105
608 HG3 LYS 82 1HG LYS 82 -9.865 -8.792 -0.393
609 HD2 LYS 82 2HD LYS 82 -11.548 -8.293 1.307
610 HD3 LYS 82 1HD LYS 82 -10.450 -6.928 1.094
611 HE2 LYS 82 2HE LYS 82 -12.797 -6.212 1.293
612 HE3 LYS 82 1HE LYS 82 -12.101 -5.773 -0.264
613 HZ1 LYS 82 3HZ LYS 82 -14.376 -6.699 -0.391
614 HZ2 LYS 82 1HZ LYS 82 -13.784 -8.177 0.177
615 HZ3 LYS 82 2HZ LYS 82 -13.251 -7.569 -1.306
616 H LYS 83 H LYS 83 -7.842 -7.478 -3.309
617 HA LYS 83 HA LYS 83 -6.452 -9.630 -2.073
618 HB2 LYS 83 2HB LYS 83 -7.184 -9.886 -4.341
619 HB3 LYS 83 1HB LYS 83 -6.309 -8.446 -4.851
620 HG2 LYS 83 2HG LYS 83 -4.208 -9.526 -4.605
621 HG3 LYS 83 1HG LYS 83 -4.928 -10.892 -3.755
622 HD2 LYS 83 2HD LYS 83 -5.593 -10.179 -6.612
623 HD3 LYS 83 1HD LYS 83 -4.307 -11.303 -6.169
624 HE2 LYS 83 2HE LYS 83 -5.905 -12.756 -5.067
625 HE3 LYS 83 1HE LYS 83 -7.208 -11.609 -5.384
626 HZ1 LYS 83 3HZ LYS 83 -5.660 -13.100 -7.438
627 HZ2 LYS 83 1HZ LYS 83 -6.867 -11.960 -7.763
628 HZ3 LYS 83 2HZ LYS 83 -7.259 -13.401 -6.976
629 H ALA 84 H ALA 84 -5.378 -6.460 -3.337
630 HA ALA 84 HA ALA 84 -2.639 -6.689 -2.938
631 HB1 ALA 84 3HB ALA 84 -4.355 -4.243 -2.472
632 HB2 ALA 84 1HB ALA 84 -3.664 -4.748 -4.014
633 HB3 ALA 84 2HB ALA 84 -2.606 -4.245 -2.696
634 H LEU 85 H LEU 85 -5.130 -5.752 -0.599
635 HA LEU 85 HA LEU 85 -3.466 -5.403 1.641
636 HG LEU 85 HG LEU 85 -4.821 -5.008 3.789
637 HB2 LEU 85 2HB LEU 85 -5.838 -4.673 1.437
638 HB3 LEU 85 1HB LEU 85 -6.346 -6.344 1.541
639 HD11 LEU 85 1HD1 LEU 85 -7.815 -5.104 3.380
640 HD12 LEU 85 2HD1 LEU 85 -6.800 -3.660 3.335
641 HD13 LEU 85 3HD1 LEU 85 -6.990 -4.558 4.841
642 HD21 LEU 85 3HD2 LEU 85 -6.675 -7.400 3.695
643 HD22 LEU 85 1HD2 LEU 85 -5.942 -6.728 5.153
644 HD23 LEU 85 2HD2 LEU 85 -4.924 -7.438 3.904
645 H GLU 86 H GLU 86 -5.526 -8.212 0.841
646 HA GLU 86 HA GLU 86 -4.654 -9.876 2.896
647 HB2 GLU 86 2HB GLU 86 -5.858 -10.472 0.200
648 HB3 GLU 86 1HB GLU 86 -5.521 -11.739 1.373
649 HG2 GLU 86 2HG GLU 86 -7.258 -9.350 1.981
650 HG3 GLU 86 1HG GLU 86 -7.886 -10.867 1.338
651 H GLN 87 H GLN 87 -3.095 -9.251 -0.183
652 HA GLN 87 HA GLN 87 -1.440 -11.640 0.008
653 HB2 GLN 87 2HB GLN 87 -2.359 -10.795 -2.171
654 HB3 GLN 87 1HB GLN 87 -1.303 -9.398 -2.019
655 HG2 GLN 87 2HG GLN 87 -0.038 -10.727 -3.375
656 HG3 GLN 87 1HG GLN 87 0.574 -11.216 -1.799
657 HE21 GLN 87 1HE2 GLN 87 -2.064 -12.735 -1.381
658 HE22 GLN 87 2HE2 GLN 87 -1.811 -14.192 -2.266
659 H LEU 88 H LEU 88 -1.109 -8.142 0.418
660 HA LEU 88 HA LEU 88 1.799 -8.386 0.703
661 HG LEU 88 HG LEU 88 0.015 -7.157 -1.567
662 HB2 LEU 88 2HB LEU 88 0.063 -5.923 0.569
663 HB3 LEU 88 1HB LEU 88 1.820 -5.950 0.540
664 HD11 LEU 88 1HD1 LEU 88 0.823 -5.354 -3.008
665 HD12 LEU 88 2HD1 LEU 88 1.699 -4.657 -1.644
666 HD13 LEU 88 3HD1 LEU 88 -0.064 -4.736 -1.615
667 HD21 LEU 88 3HD2 LEU 88 3.026 -6.903 -1.470
668 HD22 LEU 88 1HD2 LEU 88 2.089 -7.455 -2.859
669 HD23 LEU 88 2HD2 LEU 88 2.096 -8.399 -1.371
670 H ASN 89 H ASN 89 -1.011 -7.847 2.683
671 HA ASN 89 HA ASN 89 0.258 -6.571 4.873
672 HB2 ASN 89 2HB ASN 89 -2.221 -6.692 4.486
673 HB3 ASN 89 1HB ASN 89 -2.169 -8.385 4.962
674 HD21 ASN 89 1HD2 ASN 89 -3.622 -7.883 6.630
675 HD22 ASN 89 2HD2 ASN 89 -3.095 -7.104 8.073
676 H GLY 90 H GLY 90 2.068 -7.466 5.680
677 HA2 GLY 90 2HA GLY 90 2.853 -9.091 7.370
678 HA3 GLY 90 1HA GLY 90 2.029 -10.334 6.442
679 H PHE 91 H PHE 91 3.199 -8.517 4.071
680 HA PHE 91 HA PHE 91 5.344 -10.317 3.467
681 HD1 PHE 91 HD1 PHE 91 5.754 -11.064 0.940
682 HD2 PHE 91 HD2 PHE 91 6.272 -6.835 0.984
683 HE1 PHE 91 HE1 PHE 91 7.603 -11.274 -0.667
684 HE2 PHE 91 HE2 PHE 91 8.122 -7.040 -0.623
685 HZ PHE 91 HZ PHE 91 8.790 -9.262 -1.450
686 HB2 PHE 91 2HB PHE 91 3.926 -9.404 1.697
687 HB3 PHE 91 1HB PHE 91 4.447 -7.772 2.090
688 H GLU 92 H GLU 92 7.449 -10.144 3.969
689 HA GLU 92 HA GLU 92 8.483 -7.786 5.273
690 HB2 GLU 92 2HB GLU 92 9.829 -10.368 4.452
691 HB3 GLU 92 1HB GLU 92 10.622 -9.079 5.348
692 HG2 GLU 92 2HG GLU 92 9.046 -9.367 7.189
693 HG3 GLU 92 1HG GLU 92 8.212 -10.631 6.286
694 H LEU 93 H LEU 93 8.750 -6.059 3.959
695 HA LEU 93 HA LEU 93 9.917 -6.376 1.305
696 HG LEU 93 HG LEU 93 10.566 -3.280 1.031
697 HB2 LEU 93 2HB LEU 93 8.033 -4.860 1.549
698 HB3 LEU 93 1HB LEU 93 8.905 -3.931 2.754
699 HD11 LEU 93 1HD1 LEU 93 8.711 -4.680 -0.897
700 HD12 LEU 93 2HD1 LEU 93 10.335 -5.207 -0.453
701 HD13 LEU 93 3HD1 LEU 93 10.108 -3.692 -1.326
702 HD21 LEU 93 3HD2 LEU 93 7.705 -2.636 0.301
703 HD22 LEU 93 1HD2 LEU 93 9.132 -1.714 -0.174
704 HD23 LEU 93 2HD2 LEU 93 8.674 -1.813 1.526
705 H ALA 94 H ALA 94 10.617 -4.141 3.994
706 HA ALA 94 HA ALA 94 13.378 -3.874 3.066
707 HB1 ALA 94 3HB ALA 94 13.494 -2.000 4.638
708 HB2 ALA 94 1HB ALA 94 11.883 -2.395 5.238
709 HB3 ALA 94 2HB ALA 94 12.097 -1.853 3.573
710 H GLY 95 H GLY 95 12.634 -6.398 4.299
711 HA2 GLY 95 2HA GLY 95 13.754 -7.870 5.726
712 HA3 GLY 95 1HA GLY 95 14.548 -6.501 6.496
713 H ARG 96 H ARG 96 11.323 -5.863 6.198
714 HA ARG 96 HA ARG 96 10.501 -7.104 8.707
715 HE ARG 96 HE ARG 96 7.972 -2.282 8.226
716 HB2 ARG 96 2HB ARG 96 9.695 -4.921 9.578
717 HB3 ARG 96 1HB ARG 96 11.444 -5.003 9.431
718 HG2 ARG 96 2HG ARG 96 11.523 -3.453 7.730
719 HG3 ARG 96 1HG ARG 96 9.889 -3.824 7.175
720 HD2 ARG 96 2HD ARG 96 10.426 -2.476 9.823
721 HD3 ARG 96 1HD ARG 96 10.218 -1.570 8.320
722 HH11 ARG 96 1HH1 ARG 96 9.554 -3.332 11.104
723 HH12 ARG 96 2HH1 ARG 96 8.077 -3.760 11.889
724 HH21 ARG 96 1HH2 ARG 96 6.086 -2.871 9.219
725 HH22 ARG 96 2HH2 ARG 96 6.131 -3.507 10.827
726 HA PRO 97 HA PRO 97 6.650 -7.727 6.704
727 HB2 PRO 97 2HB PRO 97 4.847 -7.262 8.725
728 HB3 PRO 97 1HB PRO 97 5.820 -8.733 8.579
729 HG2 PRO 97 2HG PRO 97 6.339 -6.278 10.235
730 HG3 PRO 97 1HG PRO 97 6.461 -7.989 10.703
731 HD2 PRO 97 2HD PRO 97 8.645 -6.593 10.088
732 HD3 PRO 97 1HD PRO 97 8.477 -8.281 9.556
733 H MET 98 H MET 98 4.842 -6.787 5.782
734 HA MET 98 HA MET 98 4.740 -3.854 5.798
735 HB2 MET 98 2HB MET 98 4.988 -5.054 3.637
736 HB3 MET 98 1HB MET 98 3.458 -5.868 3.929
737 HG2 MET 98 2HG MET 98 2.803 -4.187 2.525
738 HG3 MET 98 1HG MET 98 2.527 -3.431 4.094
739 HE1 MET 98 3HE MET 98 5.921 -4.082 2.149
740 HE2 MET 98 1HE MET 98 6.053 -2.556 1.271
741 HE3 MET 98 2HE MET 98 4.719 -3.659 0.931
742 H LYS 99 H LYS 99 3.220 -2.923 7.091
743 HA LYS 99 HA LYS 99 0.877 -4.458 7.913
744 HB2 LYS 99 2HB LYS 99 1.766 -1.672 8.702
745 HB3 LYS 99 1HB LYS 99 0.408 -2.545 9.403
746 HG2 LYS 99 2HG LYS 99 2.011 -4.304 10.157
747 HG3 LYS 99 1HG LYS 99 3.329 -3.284 9.578
748 HD2 LYS 99 2HD LYS 99 3.175 -2.847 11.890
749 HD3 LYS 99 1HD LYS 99 2.400 -1.471 11.108
750 HE2 LYS 99 2HE LYS 99 0.969 -3.842 12.325
751 HE3 LYS 99 1HE LYS 99 1.142 -2.255 13.070
752 HZ1 LYS 99 3HZ LYS 99 -0.381 -2.921 10.611
753 HZ2 LYS 99 1HZ LYS 99 -0.079 -1.338 11.122
754 HZ3 LYS 99 2HZ LYS 99 -1.002 -2.378 12.084
755 H VAL 100 H VAL 100 -0.646 -4.566 6.341
756 HA VAL 100 HA VAL 100 -1.604 -2.030 5.153
757 HB VAL 100 HB VAL 100 -1.749 -4.773 3.874
758 HG11 VAL 100 1HG1 VAL 100 -2.441 -2.033 2.805
759 HG12 VAL 100 2HG1 VAL 100 -3.572 -3.331 3.186
760 HG13 VAL 100 3HG1 VAL 100 -2.428 -3.523 1.859
761 HG21 VAL 100 3HG2 VAL 100 0.558 -4.021 3.952
762 HG22 VAL 100 1HG2 VAL 100 0.100 -2.466 3.256
763 HG23 VAL 100 2HG2 VAL 100 -0.053 -3.939 2.300
764 H GLY 101 H GLY 101 -3.545 -1.470 5.903
765 HA2 GLY 101 2HA GLY 101 -5.617 -3.552 6.195
766 HA3 GLY 101 1HA GLY 101 -5.337 -2.428 7.517
767 H HIS 102 H HIS 102 -7.753 -2.853 5.794
768 HA HIS 102 HA HIS 102 -7.993 -0.645 4.015
769 HD1 HIS 102 HD1 HIS 102 -12.014 -0.491 5.506
770 HD2 HIS 102 HD2 HIS 102 -9.898 -3.867 6.691
771 HE1 HIS 102 HE1 HIS 102 -13.222 -1.372 7.517
772 HE2 HIS 102 HE2 HIS 102 -11.866 -3.345 8.287
773 HB2 HIS 102 2HB HIS 102 -10.289 -1.195 3.820
774 HB3 HIS 102 1HB HIS 102 -9.467 -2.730 4.069
775 H VAL 103 H VAL 103 -9.152 1.344 4.289
776 HA VAL 103 HA VAL 103 -8.690 2.584 6.829
777 HB VAL 103 HB VAL 103 -9.639 4.608 5.831
778 HG11 VAL 103 1HG1 VAL 103 -7.794 3.134 3.944
779 HG12 VAL 103 2HG1 VAL 103 -7.304 4.056 5.365
780 HG13 VAL 103 3HG1 VAL 103 -8.038 4.881 3.990
781 HG21 VAL 103 3HG2 VAL 103 -11.476 3.609 4.565
782 HG22 VAL 103 1HG2 VAL 103 -10.324 2.858 3.459
783 HG23 VAL 103 2HG2 VAL 103 -10.473 4.617 3.519
784 H THR 104 H THR 104 -10.615 4.120 7.648
785 HA THR 104 HA THR 104 -12.697 2.300 8.512
786 HB THR 104 HB THR 104 -13.502 4.181 9.916
787 HG1 THR 104 HG1 THR 104 -12.900 5.965 8.640
788 HG21 THR 104 3HG2 THR 104 -10.516 3.722 10.109
789 HG22 THR 104 1HG2 THR 104 -11.762 2.658 10.767
790 HG23 THR 104 2HG2 THR 104 -11.566 4.290 11.408
791 H GLU 105 H GLU 105 -13.802 1.936 6.474
792 HA GLU 105 HA GLU 105 -15.350 4.154 5.397
793 HB2 GLU 105 2HB GLU 105 -15.848 1.240 4.761
794 HB3 GLU 105 1HB GLU 105 -16.236 2.648 3.789
795 HG2 GLU 105 2HG GLU 105 -14.429 1.894 2.635
796 HG3 GLU 105 1HG GLU 105 -13.600 2.937 3.791
797 H ARG 106 H ARG 106 -16.719 4.889 6.981
798 HA ARG 106 HA ARG 106 -18.812 3.030 7.896
799 HE ARG 106 HE ARG 106 -18.695 3.149 12.114
800 HB2 ARG 106 2HB ARG 106 -17.199 4.913 9.622
801 HB3 ARG 106 1HB ARG 106 -18.738 4.236 10.137
802 HG2 ARG 106 2HG ARG 106 -17.825 1.984 9.978
803 HG3 ARG 106 1HG ARG 106 -16.286 2.634 9.410
804 HD2 ARG 106 2HD ARG 106 -16.312 2.057 11.837
805 HD3 ARG 106 1HD ARG 106 -15.907 3.741 11.504
806 HH11 ARG 106 1HH1 ARG 106 -15.649 4.303 13.257
807 HH12 ARG 106 2HH1 ARG 106 -16.355 5.162 14.579
808 HH21 ARG 106 1HH2 ARG 106 -19.579 4.271 13.810
809 HH22 ARG 106 2HH2 ARG 106 -18.542 5.129 14.896
810 H THR 107 H THR 107 -20.842 3.922 8.256
811 HA THR 107 HA THR 107 -21.251 6.643 7.209
812 HB THR 107 HB THR 107 -23.260 4.425 7.706
813 HG1 THR 107 HG1 THR 107 -22.709 5.498 5.166
814 HG21 THR 107 3HG2 THR 107 -24.306 6.621 7.995
815 HG22 THR 107 1HG2 THR 107 -24.859 5.862 6.503
816 HG23 THR 107 2HG2 THR 107 -23.654 7.148 6.443
817 H ASP 108 H ASP 108 -22.065 4.603 10.002
818 HA ASP 108 HA ASP 108 -23.034 6.966 11.451
819 HB2 ASP 108 2HB ASP 108 -23.958 5.267 13.070
820 HB3 ASP 108 1HB ASP 108 -24.638 5.203 11.449
Start of MODEL 6
1 HA MET 1 HA MET 1 -15.231 23.850 -23.969
2 H1 MET 1 1H MET 1 -16.586 21.879 -23.675
3 H2 MET 1 2H MET 1 -17.411 22.200 -25.111
4 H3 MET 1 3H MET 1 -17.556 23.260 -23.805
5 HB2 MET 1 2HB MET 1 -15.270 21.984 -26.360
6 HB3 MET 1 1HB MET 1 -13.946 23.071 -25.966
7 HG2 MET 1 2HG MET 1 -13.589 21.892 -23.862
8 HG3 MET 1 1HG MET 1 -14.935 20.815 -24.231
9 HE1 MET 1 3HE MET 1 -11.779 18.498 -24.608
10 HE2 MET 1 1HE MET 1 -13.299 18.758 -23.755
11 HE3 MET 1 2HE MET 1 -11.933 19.837 -23.472
12 H GLY 2 H GLY 2 -14.796 25.787 -25.040
13 HA2 GLY 2 2HA GLY 2 -15.253 27.645 -26.339
14 HA3 GLY 2 1HA GLY 2 -16.162 26.604 -27.426
15 H HIS 3 H HIS 3 -18.355 25.942 -26.662
16 HA HIS 3 HA HIS 3 -19.763 28.067 -25.261
17 HD1 HIS 3 HD1 HIS 3 -23.140 27.841 -27.132
18 HD2 HIS 3 HD2 HIS 3 -19.294 27.379 -28.630
19 HE1 HIS 3 HE1 HIS 3 -23.102 29.123 -29.287
20 HE2 HIS 3 HE2 HIS 3 -20.728 28.960 -30.090
21 HB2 HIS 3 2HB HIS 3 -20.648 25.483 -26.559
22 HB3 HIS 3 1HB HIS 3 -21.753 26.488 -25.626
23 H HIS 4 H HIS 4 -20.682 27.899 -23.215
24 HA HIS 4 HA HIS 4 -20.829 27.304 -21.037
25 HD1 HIS 4 HD1 HIS 4 -22.548 24.451 -19.343
26 HD2 HIS 4 HD2 HIS 4 -23.142 25.920 -23.187
27 HE1 HIS 4 HE1 HIS 4 -25.036 24.639 -19.615
28 HE2 HIS 4 HE2 HIS 4 -25.373 25.383 -21.990
29 HB2 HIS 4 2HB HIS 4 -20.568 24.593 -22.280
30 HB3 HIS 4 1HB HIS 4 -20.424 24.739 -20.533
31 H HIS 5 H HIS 5 -19.130 28.467 -20.250
32 HA HIS 5 HA HIS 5 -16.457 27.341 -20.181
33 HD1 HIS 5 HD1 HIS 5 -15.907 30.542 -17.061
34 HD2 HIS 5 HD2 HIS 5 -14.028 28.658 -20.255
35 HE1 HIS 5 HE1 HIS 5 -13.456 30.655 -16.558
36 HE2 HIS 5 HE2 HIS 5 -12.335 29.614 -18.549
37 HB2 HIS 5 2HB HIS 5 -16.860 29.794 -20.385
38 HB3 HIS 5 1HB HIS 5 -17.537 29.790 -18.761
39 H HIS 6 H HIS 6 -19.284 27.313 -18.226
40 HA HIS 6 HA HIS 6 -17.839 26.120 -15.948
41 HD1 HIS 6 HD1 HIS 6 -18.404 27.918 -13.389
42 HD2 HIS 6 HD2 HIS 6 -20.116 29.675 -16.746
43 HE1 HIS 6 HE1 HIS 6 -17.987 30.381 -13.147
44 HE2 HIS 6 HE2 HIS 6 -19.182 31.432 -15.093
45 HB2 HIS 6 2HB HIS 6 -20.733 27.006 -16.155
46 HB3 HIS 6 1HB HIS 6 -19.966 26.352 -14.713
47 H HIS 7 H HIS 7 -17.504 23.988 -16.403
48 HA HIS 7 HA HIS 7 -19.508 22.441 -17.811
49 HD1 HIS 7 HD1 HIS 7 -18.651 20.953 -19.931
50 HD2 HIS 7 HD2 HIS 7 -17.417 18.711 -16.652
51 HE1 HIS 7 HE1 HIS 7 -19.022 18.559 -20.574
52 HE2 HIS 7 HE2 HIS 7 -18.152 17.220 -18.636
53 HB2 HIS 7 2HB HIS 7 -17.003 22.180 -18.124
54 HB3 HIS 7 1HB HIS 7 -16.967 21.398 -16.548
55 H HIS 8 H HIS 8 -18.944 23.261 -14.585
56 HA HIS 8 HA HIS 8 -20.767 21.108 -13.695
57 HD1 HIS 8 HD1 HIS 8 -19.537 19.128 -11.205
58 HD2 HIS 8 HD2 HIS 8 -16.882 20.881 -13.877
59 HE1 HIS 8 HE1 HIS 8 -17.939 17.309 -11.858
60 HE2 HIS 8 HE2 HIS 8 -16.423 18.359 -13.560
61 HB2 HIS 8 2HB HIS 8 -18.573 22.528 -12.177
62 HB3 HIS 8 1HB HIS 8 -19.842 21.614 -11.367
63 H SER 9 H SER 9 -22.753 21.851 -13.479
64 HA SER 9 HA SER 9 -23.261 24.695 -12.986
65 HG SER 9 HG SER 9 -26.703 23.807 -13.866
66 HB2 SER 9 2HB SER 9 -24.411 23.709 -14.884
67 HB3 SER 9 1HB SER 9 -25.075 22.431 -13.868
68 H HIS 10 H HIS 10 -25.508 24.974 -11.744
69 HA HIS 10 HA HIS 10 -26.738 24.860 -9.839
70 HD1 HIS 10 HD1 HIS 10 -26.266 21.106 -7.320
71 HD2 HIS 10 HD2 HIS 10 -28.986 23.933 -8.687
72 HE1 HIS 10 HE1 HIS 10 -28.080 21.180 -5.593
73 HE2 HIS 10 HE2 HIS 10 -29.769 22.808 -6.494
74 HB2 HIS 10 2HB HIS 10 -26.949 22.446 -10.478
75 HB3 HIS 10 1HB HIS 10 -25.552 22.092 -9.471
76 H MET 11 H MET 11 -24.091 25.991 -9.829
77 HA MET 11 HA MET 11 -22.519 26.856 -8.440
78 HB2 MET 11 2HB MET 11 -24.524 27.580 -7.180
79 HB3 MET 11 1HB MET 11 -24.471 26.087 -6.254
80 HG2 MET 11 2HG MET 11 -22.278 26.738 -5.355
81 HG3 MET 11 1HG MET 11 -22.370 28.250 -6.260
82 HE1 MET 11 3HE MET 11 -22.924 29.464 -2.576
83 HE2 MET 11 1HE MET 11 -21.980 29.668 -4.052
84 HE3 MET 11 2HE MET 11 -21.844 28.177 -3.119
85 H ALA 12 H ALA 12 -20.800 25.502 -8.718
86 HA ALA 12 HA ALA 12 -20.736 22.915 -7.392
87 HB1 ALA 12 3HB ALA 12 -18.698 22.535 -8.671
88 HB2 ALA 12 1HB ALA 12 -18.710 24.213 -9.214
89 HB3 ALA 12 2HB ALA 12 -19.997 23.115 -9.712
90 H ALA 13 H ALA 13 -18.053 25.231 -7.714
91 HA ALA 13 HA ALA 13 -16.378 25.837 -6.308
92 HB1 ALA 13 3HB ALA 13 -17.009 26.614 -4.090
93 HB2 ALA 13 1HB ALA 13 -18.548 25.759 -4.211
94 HB3 ALA 13 2HB ALA 13 -18.204 27.114 -5.286
95 H ALA 14 H ALA 14 -18.058 23.991 -3.789
96 HA ALA 14 HA ALA 14 -15.649 22.358 -3.412
97 HB1 ALA 14 3HB ALA 14 -18.099 22.643 -1.667
98 HB2 ALA 14 1HB ALA 14 -16.570 23.493 -1.449
99 HB3 ALA 14 2HB ALA 14 -16.640 21.740 -1.258
100 H MET 15 H MET 15 -18.933 22.104 -4.517
101 HA MET 15 HA MET 15 -19.020 19.204 -4.346
102 HB2 MET 15 2HB MET 15 -20.966 21.163 -5.588
103 HB3 MET 15 1HB MET 15 -21.256 19.443 -5.373
104 HG2 MET 15 2HG MET 15 -22.392 20.637 -3.646
105 HG3 MET 15 1HG MET 15 -21.045 19.757 -2.924
106 HE1 MET 15 3HE MET 15 -21.133 22.927 -0.665
107 HE2 MET 15 1HE MET 15 -21.071 21.166 -0.709
108 HE3 MET 15 2HE MET 15 -22.500 22.013 -1.305
109 H ALA 16 H ALA 16 -17.309 21.058 -6.321
110 HA ALA 16 HA ALA 16 -17.977 19.874 -8.878
111 HB1 ALA 16 3HB ALA 16 -17.075 22.159 -8.740
112 HB2 ALA 16 1HB ALA 16 -16.069 21.113 -9.741
113 HB3 ALA 16 2HB ALA 16 -15.563 21.516 -8.100
114 H ASN 17 H ASN 17 -17.778 17.666 -8.569
115 HA ASN 17 HA ASN 17 -16.838 15.611 -8.397
116 HB2 ASN 17 2HB ASN 17 -14.131 16.920 -8.743
117 HB3 ASN 17 1HB ASN 17 -14.555 15.244 -9.063
118 HD21 ASN 17 1HD2 ASN 17 -14.446 18.415 -10.280
119 HD22 ASN 17 2HD2 ASN 17 -15.054 18.067 -11.858
120 H ASN 18 H ASN 18 -17.439 15.358 -6.239
121 HA ASN 18 HA ASN 18 -15.819 16.405 -4.101
122 HB2 ASN 18 2HB ASN 18 -17.430 15.122 -2.634
123 HB3 ASN 18 1HB ASN 18 -18.162 16.325 -3.687
124 HD21 ASN 18 1HD2 ASN 18 -17.678 12.907 -3.167
125 HD22 ASN 18 2HD2 ASN 18 -18.970 12.380 -4.187
126 H LEU 19 H LEU 19 -14.139 15.475 -3.130
127 HA LEU 19 HA LEU 19 -13.433 12.711 -3.748
128 HG LEU 19 HG LEU 19 -11.137 12.546 -1.594
129 HB2 LEU 19 2HB LEU 19 -11.709 14.467 -3.869
130 HB3 LEU 19 1HB LEU 19 -11.951 14.824 -2.169
131 HD11 LEU 19 1HD1 LEU 19 -10.013 11.204 -3.316
132 HD12 LEU 19 2HD1 LEU 19 -10.577 12.330 -4.553
133 HD13 LEU 19 3HD1 LEU 19 -11.740 11.374 -3.633
134 HD21 LEU 19 3HD2 LEU 19 -8.776 12.957 -2.098
135 HD22 LEU 19 1HD2 LEU 19 -9.590 14.439 -1.592
136 HD23 LEU 19 2HD2 LEU 19 -9.237 14.165 -3.299
137 H GLN 20 H GLN 20 -14.121 14.723 -0.910
138 HA GLN 20 HA GLN 20 -14.094 12.425 0.863
139 HB2 GLN 20 2HB GLN 20 -13.221 14.608 1.626
140 HB3 GLN 20 1HB GLN 20 -14.818 15.313 1.436
141 HG2 GLN 20 2HG GLN 20 -14.511 12.943 3.226
142 HG3 GLN 20 1HG GLN 20 -13.927 14.506 3.786
143 HE21 GLN 20 1HE2 GLN 20 -16.164 12.798 4.712
144 HE22 GLN 20 2HE2 GLN 20 -17.557 13.816 4.666
145 H LYS 21 H LYS 21 -15.757 11.122 0.115
146 HA LYS 21 HA LYS 21 -18.278 11.468 1.294
147 HB2 LYS 21 2HB LYS 21 -18.565 13.159 -0.510
148 HB3 LYS 21 1HB LYS 21 -18.298 11.903 -1.709
149 HG2 LYS 21 2HG LYS 21 -20.339 10.832 -1.197
150 HG3 LYS 21 1HG LYS 21 -20.536 11.746 0.300
151 HD2 LYS 21 2HD LYS 21 -20.600 12.933 -2.484
152 HD3 LYS 21 1HD LYS 21 -22.023 12.544 -1.516
153 HE2 LYS 21 2HE LYS 21 -21.271 14.128 0.210
154 HE3 LYS 21 1HE LYS 21 -19.862 14.524 -0.771
155 HZ1 LYS 21 3HZ LYS 21 -21.344 15.367 -2.485
156 HZ2 LYS 21 1HZ LYS 21 -21.604 16.167 -1.020
157 HZ3 LYS 21 2HZ LYS 21 -22.692 14.985 -1.542
158 H GLY 22 H GLY 22 -19.712 9.641 0.896
159 HA2 GLY 22 2HA GLY 22 -18.321 7.197 0.648
160 HA3 GLY 22 1HA GLY 22 -20.062 7.380 0.731
161 H SER 23 H SER 23 -17.302 7.406 -1.480
162 HA SER 23 HA SER 23 -19.071 6.957 -3.779
163 HG SER 23 HG SER 23 -16.289 7.655 -5.922
164 HB2 SER 23 2HB SER 23 -17.274 8.602 -4.072
165 HB3 SER 23 1HB SER 23 -16.069 7.385 -3.652
166 H ALA 24 H ALA 24 -19.542 4.948 -4.395
167 HA ALA 24 HA ALA 24 -18.073 2.686 -3.326
168 HB1 ALA 24 3HB ALA 24 -19.822 1.318 -4.329
169 HB2 ALA 24 1HB ALA 24 -20.467 2.726 -5.174
170 HB3 ALA 24 2HB ALA 24 -20.528 2.648 -3.413
171 H GLY 25 H GLY 25 -16.763 1.284 -4.459
172 HA2 GLY 25 2HA GLY 25 -16.208 0.368 -6.730
173 HA3 GLY 25 1HA GLY 25 -16.144 2.040 -7.260
174 HA PRO 26 HA PRO 26 -11.830 2.230 -6.133
175 HB2 PRO 26 2HB PRO 26 -12.206 4.865 -4.863
176 HB3 PRO 26 1HB PRO 26 -11.281 4.440 -6.305
177 HG2 PRO 26 2HG PRO 26 -13.573 5.832 -6.463
178 HG3 PRO 26 1HG PRO 26 -13.114 4.651 -7.706
179 HD2 PRO 26 2HD PRO 26 -15.040 4.347 -5.420
180 HD3 PRO 26 1HD PRO 26 -15.218 3.838 -7.115
181 H MET 27 H MET 27 -10.635 1.460 -4.475
182 HA MET 27 HA MET 27 -11.743 1.678 -1.739
183 HB2 MET 27 2HB MET 27 -11.699 -0.612 -2.702
184 HB3 MET 27 1HB MET 27 -9.953 -0.495 -2.862
185 HG2 MET 27 2HG MET 27 -9.734 -0.309 -0.441
186 HG3 MET 27 1HG MET 27 -11.489 -0.388 -0.271
187 HE1 MET 27 3HE MET 27 -11.316 -2.396 1.433
188 HE2 MET 27 1HE MET 27 -9.557 -2.336 1.331
189 HE3 MET 27 2HE MET 27 -10.400 -3.871 1.127
190 H ARG 28 H ARG 28 -10.533 2.567 -0.163
191 HA ARG 28 HA ARG 28 -7.788 3.413 -0.794
192 HE ARG 28 HE ARG 28 -8.404 7.415 0.464
193 HB2 ARG 28 2HB ARG 28 -9.216 5.221 -0.070
194 HB3 ARG 28 1HB ARG 28 -9.736 4.315 1.346
195 HG2 ARG 28 2HG ARG 28 -7.396 4.404 2.196
196 HG3 ARG 28 1HG ARG 28 -6.980 5.432 0.825
197 HD2 ARG 28 2HD ARG 28 -9.163 6.133 2.787
198 HD3 ARG 28 1HD ARG 28 -7.483 6.607 3.025
199 HH11 ARG 28 1HH1 ARG 28 -8.682 8.205 3.806
200 HH12 ARG 28 2HH1 ARG 28 -8.917 9.889 3.496
201 HH21 ARG 28 1HH2 ARG 28 -8.734 9.584 0.089
202 HH22 ARG 28 2HH2 ARG 28 -8.956 10.659 1.431
203 H LEU 29 H LEU 29 -6.194 2.122 -0.103
204 HA LEU 29 HA LEU 29 -6.564 0.479 2.302
205 HG LEU 29 HG LEU 29 -6.539 -0.625 -0.627
206 HB2 LEU 29 2HB LEU 29 -4.456 0.402 0.140
207 HB3 LEU 29 1HB LEU 29 -4.445 -0.630 1.558
208 HD11 LEU 29 1HD1 LEU 29 -4.415 -1.641 -1.292
209 HD12 LEU 29 2HD1 LEU 29 -5.681 -2.856 -1.131
210 HD13 LEU 29 3HD1 LEU 29 -4.460 -2.683 0.131
211 HD21 LEU 29 3HD2 LEU 29 -7.579 -1.106 1.519
212 HD22 LEU 29 1HD2 LEU 29 -6.344 -2.317 1.871
213 HD23 LEU 29 2HD2 LEU 29 -7.481 -2.574 0.547
214 H TYR 30 H TYR 30 -5.279 0.625 4.075
215 HA TYR 30 HA TYR 30 -3.524 2.959 4.328
216 HD1 TYR 30 HD1 TYR 30 -3.534 4.531 6.906
217 HD2 TYR 30 HD2 TYR 30 -3.021 0.383 7.734
218 HE1 TYR 30 HE1 TYR 30 -1.942 5.085 8.695
219 HE2 TYR 30 HE2 TYR 30 -1.427 0.929 9.519
220 HH TYR 30 HH TYR 30 -1.101 3.962 10.835
221 HB2 TYR 30 2HB TYR 30 -5.147 2.832 6.080
222 HB3 TYR 30 1HB TYR 30 -4.839 1.120 6.341
223 H VAL 31 H VAL 31 -1.391 2.676 4.059
224 HA VAL 31 HA VAL 31 -0.184 0.064 4.755
225 HB VAL 31 HB VAL 31 0.843 2.128 2.788
226 HG11 VAL 31 1HG1 VAL 31 2.657 0.898 3.871
227 HG12 VAL 31 2HG1 VAL 31 2.510 0.437 2.175
228 HG13 VAL 31 3HG1 VAL 31 1.893 -0.633 3.436
229 HG21 VAL 31 3HG2 VAL 31 -1.146 1.004 1.935
230 HG22 VAL 31 1HG2 VAL 31 -0.428 -0.568 2.289
231 HG23 VAL 31 2HG2 VAL 31 0.286 0.471 1.056
232 H GLY 32 H GLY 32 0.888 0.173 6.674
233 HA2 GLY 32 2HA GLY 32 2.377 2.653 7.301
234 HA3 GLY 32 1HA GLY 32 1.244 2.000 8.466
235 H SER 33 H SER 33 4.371 1.627 6.973
236 HA SER 33 HA SER 33 5.537 0.594 9.331
237 HG SER 33 HG SER 33 5.906 -2.186 6.597
238 HB2 SER 33 2HB SER 33 6.141 -1.676 8.605
239 HB3 SER 33 1HB SER 33 4.386 -1.491 8.677
240 H LEU 34 H LEU 34 5.923 2.491 6.978
241 HA LEU 34 HA LEU 34 8.326 1.511 5.662
242 HG LEU 34 HG LEU 34 5.311 2.699 4.803
243 HB2 LEU 34 2HB LEU 34 7.073 4.250 5.412
244 HB3 LEU 34 1HB LEU 34 8.189 3.480 4.297
245 HD11 LEU 34 1HD1 LEU 34 4.994 3.311 2.456
246 HD12 LEU 34 2HD1 LEU 34 6.681 3.823 2.361
247 HD13 LEU 34 3HD1 LEU 34 5.557 4.677 3.421
248 HD21 LEU 34 3HD2 LEU 34 6.621 0.684 4.464
249 HD22 LEU 34 1HD2 LEU 34 7.356 1.374 3.017
250 HD23 LEU 34 2HD2 LEU 34 5.631 1.009 3.043
251 H HIS 35 H HIS 35 10.402 2.596 5.735
252 HA HIS 35 HA HIS 35 10.774 4.179 8.201
253 HD1 HIS 35 HD1 HIS 35 14.755 2.977 6.986
254 HD2 HIS 35 HD2 HIS 35 11.821 0.124 6.266
255 HE1 HIS 35 HE1 HIS 35 15.751 1.404 5.313
256 HE2 HIS 35 HE2 HIS 35 14.016 -0.372 4.970
257 HB2 HIS 35 2HB HIS 35 12.845 3.036 8.678
258 HB3 HIS 35 1HB HIS 35 11.552 1.858 8.505
259 H PHE 36 H PHE 36 10.560 6.003 6.711
260 HA PHE 36 HA PHE 36 11.410 7.752 5.500
261 HD1 PHE 36 HD2 PHE 36 11.511 9.968 6.836
262 HD2 PHE 36 HD1 PHE 36 15.516 8.671 6.161
263 HE1 PHE 36 HE2 PHE 36 12.164 12.272 6.280
264 HE2 PHE 36 HE1 PHE 36 16.168 10.975 5.607
265 HZ PHE 36 HZ PHE 36 14.497 12.779 5.665
266 HB2 PHE 36 2HB PHE 36 12.511 7.775 7.815
267 HB3 PHE 36 1HB PHE 36 13.954 7.156 7.023
268 H ASN 37 H ASN 37 11.568 5.470 3.911
269 HA ASN 37 HA ASN 37 13.770 6.171 2.155
270 HB2 ASN 37 2HB ASN 37 14.808 4.492 3.612
271 HB3 ASN 37 1HB ASN 37 13.509 3.360 3.258
272 HD21 ASN 37 1HD2 ASN 37 15.024 5.481 0.889
273 HD22 ASN 37 2HD2 ASN 37 15.768 4.214 -0.017
274 H ILE 38 H ILE 38 11.193 3.786 2.693
275 HA ILE 38 HA ILE 38 10.785 3.126 -0.010
276 HB ILE 38 HB ILE 38 8.843 2.929 2.308
277 HG12 ILE 38 2HG1 ILE 38 9.442 0.448 2.104
278 HG13 ILE 38 1HG1 ILE 38 10.781 0.950 1.079
279 HG21 ILE 38 1HG2 ILE 38 8.668 1.663 -0.426
280 HG22 ILE 38 2HG2 ILE 38 7.630 2.946 0.199
281 HG23 ILE 38 3HG2 ILE 38 7.586 1.343 0.932
282 HD11 ILE 38 3HD1 ILE 38 10.348 1.745 3.951
283 HD12 ILE 38 1HD1 ILE 38 11.695 2.257 2.932
284 HD13 ILE 38 2HD1 ILE 38 11.505 0.557 3.352
285 H THR 39 H THR 39 9.714 4.118 -1.621
286 HA THR 39 HA THR 39 8.380 6.682 -1.017
287 HB THR 39 HB THR 39 8.914 7.396 -3.260
288 HG1 THR 39 HG1 THR 39 10.168 5.912 -4.618
289 HG21 THR 39 3HG2 THR 39 11.368 7.353 -3.196
290 HG22 THR 39 1HG2 THR 39 11.321 6.049 -2.010
291 HG23 THR 39 2HG2 THR 39 10.699 7.647 -1.591
292 H GLU 40 H GLU 40 6.754 7.337 -2.761
293 HA GLU 40 HA GLU 40 4.583 5.504 -2.751
294 HB2 GLU 40 2HB GLU 40 4.924 8.024 -4.404
295 HB3 GLU 40 1HB GLU 40 3.403 7.213 -4.050
296 HG2 GLU 40 2HG GLU 40 3.626 7.733 -1.696
297 HG3 GLU 40 1HG GLU 40 5.211 8.446 -1.976
298 H ASP 41 H ASP 41 7.014 6.372 -5.138
299 HA ASP 41 HA ASP 41 5.929 5.018 -7.367
300 HB2 ASP 41 2HB ASP 41 8.844 5.503 -6.688
301 HB3 ASP 41 1HB ASP 41 8.211 5.086 -8.279
302 H MET 42 H MET 42 8.044 3.931 -4.731
303 HA MET 42 HA MET 42 8.546 1.313 -5.675
304 HB2 MET 42 2HB MET 42 8.337 2.282 -2.808
305 HB3 MET 42 1HB MET 42 9.061 0.765 -3.320
306 HG2 MET 42 2HG MET 42 10.802 1.967 -4.505
307 HG3 MET 42 1HG MET 42 10.054 3.504 -4.074
308 HE1 MET 42 3HE MET 42 13.115 2.983 -3.487
309 HE2 MET 42 1HE MET 42 13.240 3.600 -1.840
310 HE3 MET 42 2HE MET 42 12.258 4.456 -3.028
311 H LEU 43 H LEU 43 6.137 2.517 -3.364
312 HA LEU 43 HA LEU 43 4.721 0.176 -2.890
313 HG LEU 43 HG LEU 43 5.537 2.639 -1.365
314 HB2 LEU 43 2HB LEU 43 3.679 3.010 -3.039
315 HB3 LEU 43 1HB LEU 43 2.831 1.666 -2.295
316 HD11 LEU 43 1HD1 LEU 43 3.927 4.431 -1.099
317 HD12 LEU 43 2HD1 LEU 43 4.357 3.746 0.467
318 HD13 LEU 43 3HD1 LEU 43 2.812 3.334 -0.279
319 HD21 LEU 43 3HD2 LEU 43 4.995 1.375 0.661
320 HD22 LEU 43 1HD2 LEU 43 5.029 0.334 -0.761
321 HD23 LEU 43 2HD2 LEU 43 3.484 0.838 -0.073
322 H ARG 44 H ARG 44 4.022 2.675 -5.357
323 HA ARG 44 HA ARG 44 1.834 1.526 -6.582
324 HE ARG 44 HE ARG 44 1.381 2.989 -11.384
325 HB2 ARG 44 2HB ARG 44 2.742 3.748 -7.169
326 HB3 ARG 44 1HB ARG 44 4.101 2.973 -7.974
327 HG2 ARG 44 2HG ARG 44 2.563 1.927 -9.565
328 HG3 ARG 44 1HG ARG 44 1.203 2.706 -8.758
329 HD2 ARG 44 2HD ARG 44 2.059 4.897 -9.375
330 HD3 ARG 44 1HD ARG 44 3.488 4.158 -10.105
331 HH11 ARG 44 1HH1 ARG 44 2.381 6.246 -10.922
332 HH12 ARG 44 2HH1 ARG 44 1.711 6.771 -12.427
333 HH21 ARG 44 1HH2 ARG 44 0.534 3.668 -13.307
334 HH22 ARG 44 2HH2 ARG 44 0.678 5.331 -13.761
335 H GLY 45 H GLY 45 5.263 0.931 -7.375
336 HA2 GLY 45 2HA GLY 45 4.855 -0.917 -9.447
337 HA3 GLY 45 1HA GLY 45 6.301 -0.806 -8.459
338 H ILE 46 H ILE 46 4.782 -1.396 -5.972
339 HA ILE 46 HA ILE 46 4.856 -4.287 -6.177
340 HB ILE 46 HB ILE 46 4.238 -2.518 -3.797
341 HG12 ILE 46 2HG1 ILE 46 6.530 -2.223 -4.642
342 HG13 ILE 46 1HG1 ILE 46 6.539 -3.035 -3.082
343 HG21 ILE 46 1HG2 ILE 46 4.650 -4.528 -2.431
344 HG22 ILE 46 2HG2 ILE 46 4.795 -5.488 -3.904
345 HG23 ILE 46 3HG2 ILE 46 3.259 -4.725 -3.497
346 HD11 ILE 46 3HD1 ILE 46 6.885 -4.358 -5.763
347 HD12 ILE 46 1HD1 ILE 46 6.894 -5.176 -4.200
348 HD13 ILE 46 2HD1 ILE 46 8.159 -4.011 -4.594
349 H PHE 47 H PHE 47 2.359 -1.805 -5.728
350 HA PHE 47 HA PHE 47 0.318 -3.790 -5.158
351 HD1 PHE 47 HD1 PHE 47 2.166 -1.141 -3.557
352 HD2 PHE 47 HD2 PHE 47 -1.857 -2.387 -2.938
353 HE1 PHE 47 HE1 PHE 47 2.567 -1.207 -1.134
354 HE2 PHE 47 HE2 PHE 47 -1.462 -2.457 -0.514
355 HZ PHE 47 HZ PHE 47 0.749 -1.866 0.393
356 HB2 PHE 47 2HB PHE 47 0.281 -0.778 -5.289
357 HB3 PHE 47 1HB PHE 47 -1.190 -1.720 -5.079
358 H GLU 48 H GLU 48 1.258 -1.852 -7.980
359 HA GLU 48 HA GLU 48 -1.128 -1.980 -9.421
360 HB2 GLU 48 2HB GLU 48 1.718 -1.836 -10.382
361 HB3 GLU 48 1HB GLU 48 0.356 -1.828 -11.496
362 HG2 GLU 48 2HG GLU 48 -0.543 0.144 -10.229
363 HG3 GLU 48 1HG GLU 48 0.989 0.193 -9.361
364 HA PRO 49 HA PRO 49 0.530 -6.404 -11.178
365 HB2 PRO 49 2HB PRO 49 1.218 -7.170 -8.358
366 HB3 PRO 49 1HB PRO 49 1.848 -7.815 -9.881
367 HG2 PRO 49 2HG PRO 49 3.280 -6.080 -8.481
368 HG3 PRO 49 1HG PRO 49 3.214 -5.966 -10.251
369 HD2 PRO 49 2HD PRO 49 1.898 -4.255 -8.192
370 HD3 PRO 49 1HD PRO 49 2.495 -3.822 -9.806
371 H PHE 50 H PHE 50 -1.088 -5.389 -8.231
372 HA PHE 50 HA PHE 50 -3.094 -7.512 -8.446
373 HD1 PHE 50 HD1 PHE 50 -3.282 -8.775 -5.729
374 HD2 PHE 50 HD2 PHE 50 -0.542 -5.518 -5.919
375 HE1 PHE 50 HE1 PHE 50 -1.652 -10.067 -4.429
376 HE2 PHE 50 HE2 PHE 50 1.090 -6.813 -4.617
377 HZ PHE 50 HZ PHE 50 0.535 -9.091 -3.865
378 HB2 PHE 50 2HB PHE 50 -2.877 -5.214 -6.478
379 HB3 PHE 50 1HB PHE 50 -4.020 -6.551 -6.378
380 H GLY 51 H GLY 51 -2.861 -3.978 -8.674
381 HA2 GLY 51 2HA GLY 51 -4.893 -3.741 -10.625
382 HA3 GLY 51 1HA GLY 51 -5.540 -3.339 -9.038
383 H ARG 52 H ARG 52 -4.860 -1.740 -11.546
384 HA ARG 52 HA ARG 52 -2.726 -0.003 -11.075
385 HE ARG 52 HE ARG 52 -6.306 1.794 -14.042
386 HB2 ARG 52 2HB ARG 52 -3.927 -0.126 -13.217
387 HB3 ARG 52 1HB ARG 52 -5.335 0.620 -12.471
388 HG2 ARG 52 2HG ARG 52 -3.918 2.629 -11.991
389 HG3 ARG 52 1HG ARG 52 -2.633 1.878 -12.939
390 HD2 ARG 52 2HD ARG 52 -3.910 3.486 -14.277
391 HD3 ARG 52 1HD ARG 52 -4.083 1.846 -14.901
392 HH11 ARG 52 1HH1 ARG 52 -4.808 4.885 -13.810
393 HH12 ARG 52 2HH1 ARG 52 -6.308 5.710 -13.567
394 HH21 ARG 52 1HH2 ARG 52 -8.222 2.881 -13.764
395 HH22 ARG 52 2HH2 ARG 52 -8.207 4.597 -13.527
396 H ILE 53 H ILE 53 -2.406 1.761 -9.838
397 HA ILE 53 HA ILE 53 -4.488 2.506 -7.922
398 HB ILE 53 HB ILE 53 -1.560 3.284 -8.028
399 HG12 ILE 53 2HG1 ILE 53 -1.531 1.917 -5.851
400 HG13 ILE 53 1HG1 ILE 53 -3.095 1.286 -6.349
401 HG21 ILE 53 1HG2 ILE 53 -2.851 5.069 -7.021
402 HG22 ILE 53 2HG2 ILE 53 -1.927 4.226 -5.780
403 HG23 ILE 53 3HG2 ILE 53 -3.654 3.922 -5.948
404 HD11 ILE 53 3HD1 ILE 53 -2.064 0.385 -8.380
405 HD12 ILE 53 1HD1 ILE 53 -1.321 -0.250 -6.913
406 HD13 ILE 53 2HD1 ILE 53 -0.499 1.001 -7.846
407 H GLU 54 H GLU 54 -5.470 4.474 -7.869
408 HA GLU 54 HA GLU 54 -5.040 6.294 -10.098
409 HB2 GLU 54 2HB GLU 54 -7.090 6.281 -7.875
410 HB3 GLU 54 1HB GLU 54 -7.024 7.505 -9.137
411 HG2 GLU 54 2HG GLU 54 -7.315 4.567 -9.725
412 HG3 GLU 54 1HG GLU 54 -8.691 5.632 -9.455
413 H SER 55 H SER 55 -4.717 6.348 -6.561
414 HA SER 55 HA SER 55 -2.875 8.592 -6.784
415 HG SER 55 HG SER 55 -4.088 11.089 -5.216
416 HB2 SER 55 2HB SER 55 -5.002 9.759 -6.555
417 HB3 SER 55 1HB SER 55 -5.402 8.808 -5.125
418 H ILE 56 H ILE 56 -1.241 8.412 -5.412
419 HA ILE 56 HA ILE 56 -1.586 6.806 -2.948
420 HB ILE 56 HB ILE 56 1.002 7.282 -4.461
421 HG12 ILE 56 2HG1 ILE 56 -0.730 4.794 -4.304
422 HG13 ILE 56 1HG1 ILE 56 -0.502 5.806 -5.726
423 HG21 ILE 56 1HG2 ILE 56 1.931 5.573 -2.941
424 HG22 ILE 56 2HG2 ILE 56 0.397 5.527 -2.073
425 HG23 ILE 56 3HG2 ILE 56 1.365 7.000 -2.074
426 HD11 ILE 56 3HD1 ILE 56 1.607 4.147 -4.360
427 HD12 ILE 56 1HD1 ILE 56 1.876 5.198 -5.751
428 HD13 ILE 56 2HD1 ILE 56 0.816 3.797 -5.897
429 H GLN 57 H GLN 57 -1.179 7.828 -1.027
430 HA GLN 57 HA GLN 57 0.389 10.322 -1.071
431 HB2 GLN 57 2HB GLN 57 -1.986 10.947 -1.152
432 HB3 GLN 57 1HB GLN 57 -2.301 9.989 0.283
433 HG2 GLN 57 2HG GLN 57 -2.194 12.354 0.817
434 HG3 GLN 57 1HG GLN 57 -0.886 11.473 1.606
435 HE21 GLN 57 1HE2 GLN 57 1.214 11.911 1.036
436 HE22 GLN 57 2HE2 GLN 57 1.660 13.218 0.004
437 H LEU 58 H LEU 58 2.054 10.057 0.289
438 HA LEU 58 HA LEU 58 1.744 8.377 2.679
439 HG LEU 58 HG LEU 58 3.545 7.835 0.119
440 HB2 LEU 58 2HB LEU 58 4.183 9.747 1.520
441 HB3 LEU 58 1HB LEU 58 4.194 8.720 2.939
442 HD11 LEU 58 1HD1 LEU 58 5.941 7.278 1.873
443 HD12 LEU 58 2HD1 LEU 58 5.916 8.293 0.430
444 HD13 LEU 58 3HD1 LEU 58 5.635 6.557 0.292
445 HD21 LEU 58 3HD2 LEU 58 3.652 6.268 2.697
446 HD22 LEU 58 1HD2 LEU 58 3.564 5.556 1.087
447 HD23 LEU 58 2HD2 LEU 58 2.237 6.549 1.680
448 H MET 59 H MET 59 2.208 9.190 4.810
449 HA MET 59 HA MET 59 1.483 12.011 5.058
450 HB2 MET 59 2HB MET 59 1.602 9.818 7.145
451 HB3 MET 59 1HB MET 59 1.112 11.479 7.463
452 HG2 MET 59 2HG MET 59 -0.671 11.129 5.674
453 HG3 MET 59 1HG MET 59 -0.289 9.413 5.794
454 HE1 MET 59 3HE MET 59 -0.320 12.144 8.648
455 HE2 MET 59 1HE MET 59 -1.961 11.957 9.269
456 HE3 MET 59 2HE MET 59 -1.701 12.574 7.638
457 H MET 60 H MET 60 2.960 13.459 5.221
458 HA MET 60 HA MET 60 5.371 13.096 6.827
459 HB2 MET 60 2HB MET 60 6.807 13.882 4.935
460 HB3 MET 60 1HB MET 60 6.100 12.294 4.666
461 HG2 MET 60 2HG MET 60 4.315 13.425 3.308
462 HG3 MET 60 1HG MET 60 5.255 14.910 3.439
463 HE1 MET 60 3HE MET 60 8.571 13.914 1.575
464 HE2 MET 60 1HE MET 60 8.263 13.735 3.303
465 HE3 MET 60 2HE MET 60 7.721 15.184 2.458
466 H ASP 61 H ASP 61 6.283 15.109 7.492
467 HA ASP 61 HA ASP 61 4.549 17.450 6.970
468 HB2 ASP 61 2HB ASP 61 5.843 16.623 9.577
469 HB3 ASP 61 1HB ASP 61 4.933 18.113 9.331
470 H SER 62 H SER 62 5.678 18.868 5.808
471 HA SER 62 HA SER 62 8.431 18.951 5.465
472 HG SER 62 HG SER 62 8.699 21.211 3.615
473 HB2 SER 62 2HB SER 62 6.985 20.017 3.867
474 HB3 SER 62 1HB SER 62 6.369 21.133 5.085
475 H GLU 63 H GLU 63 6.500 20.604 7.888
476 HA GLU 63 HA GLU 63 8.315 22.546 8.734
477 HB2 GLU 63 2HB GLU 63 6.327 21.023 10.436
478 HB3 GLU 63 1HB GLU 63 7.068 22.563 10.850
479 HG2 GLU 63 2HG GLU 63 5.179 22.037 8.561
480 HG3 GLU 63 1HG GLU 63 4.812 22.897 10.054
481 H THR 64 H THR 64 8.102 19.140 9.623
482 HA THR 64 HA THR 64 10.745 18.786 10.362
483 HB THR 64 HB THR 64 10.396 20.333 12.216
484 HG1 THR 64 HG1 THR 64 10.974 18.800 13.949
485 HG21 THR 64 3HG2 THR 64 7.976 19.984 12.540
486 HG22 THR 64 1HG2 THR 64 8.866 19.812 14.054
487 HG23 THR 64 2HG2 THR 64 8.299 18.379 13.197
488 H GLY 65 H GLY 65 7.503 17.709 10.332
489 HA2 GLY 65 2HA GLY 65 7.696 15.290 11.779
490 HA3 GLY 65 1HA GLY 65 6.534 15.632 10.507
491 H ARG 66 H ARG 66 8.485 16.121 8.451
492 HA ARG 66 HA ARG 66 9.915 15.184 6.975
493 HE ARG 66 HE ARG 66 14.717 15.991 9.457
494 HB2 ARG 66 2HB ARG 66 10.636 13.595 9.420
495 HB3 ARG 66 1HB ARG 66 11.480 13.387 7.888
496 HG2 ARG 66 2HG ARG 66 12.248 15.663 7.928
497 HG3 ARG 66 1HG ARG 66 11.232 16.033 9.322
498 HD2 ARG 66 2HD ARG 66 12.546 14.567 10.724
499 HD3 ARG 66 1HD ARG 66 13.503 14.040 9.339
500 HH11 ARG 66 1HH1 ARG 66 11.952 16.289 11.503
501 HH12 ARG 66 2HH1 ARG 66 12.533 17.732 12.254
502 HH21 ARG 66 1HH2 ARG 66 15.453 17.819 10.434
503 HH22 ARG 66 2HH2 ARG 66 14.505 18.587 11.659
504 H SER 67 H SER 67 8.940 12.287 8.819
505 HA SER 67 HA SER 67 7.114 11.401 6.812
506 HG SER 67 HG SER 67 8.179 9.092 5.012
507 HB2 SER 67 2HB SER 67 9.163 10.839 5.595
508 HB3 SER 67 1HB SER 67 9.763 9.930 6.984
509 H LYS 68 H LYS 68 5.579 10.474 8.004
510 HA LYS 68 HA LYS 68 6.231 9.324 10.591
511 HB2 LYS 68 2HB LYS 68 3.627 9.935 9.197
512 HB3 LYS 68 1HB LYS 68 3.697 9.106 10.748
513 HG2 LYS 68 2HG LYS 68 4.779 10.994 11.777
514 HG3 LYS 68 1HG LYS 68 4.909 11.816 10.222
515 HD2 LYS 68 2HD LYS 68 2.543 12.114 10.095
516 HD3 LYS 68 1HD LYS 68 2.272 11.057 11.484
517 HE2 LYS 68 2HE LYS 68 3.365 12.660 12.945
518 HE3 LYS 68 1HE LYS 68 3.758 13.688 11.569
519 HZ1 LYS 68 3HZ LYS 68 1.844 14.522 12.742
520 HZ2 LYS 68 1HZ LYS 68 1.030 13.054 12.551
521 HZ3 LYS 68 2HZ LYS 68 1.384 14.006 11.202
522 H GLY 69 H GLY 69 6.011 8.123 7.465
523 HA2 GLY 69 2HA GLY 69 6.716 5.969 6.909
524 HA3 GLY 69 1HA GLY 69 6.446 5.468 8.566
525 H TYR 70 H TYR 70 3.634 6.963 7.523
526 HA TYR 70 HA TYR 70 2.611 4.512 6.272
527 HD1 TYR 70 HD1 TYR 70 2.779 5.989 10.146
528 HD2 TYR 70 HD2 TYR 70 -0.713 6.750 7.830
529 HE1 TYR 70 HE1 TYR 70 2.181 7.829 11.663
530 HE2 TYR 70 HE2 TYR 70 -1.314 8.593 9.337
531 HH TYR 70 HH TYR 70 -0.895 9.309 11.619
532 HB2 TYR 70 2HB TYR 70 0.506 4.679 7.571
533 HB3 TYR 70 1HB TYR 70 1.913 4.321 8.560
534 H GLY 71 H GLY 71 0.926 4.723 4.818
535 HA2 GLY 71 2HA GLY 71 -0.037 7.392 4.129
536 HA3 GLY 71 1HA GLY 71 0.979 6.600 2.939
537 H PHE 72 H PHE 72 -1.618 7.383 2.369
538 HA PHE 72 HA PHE 72 -3.205 4.899 2.410
539 HD1 PHE 72 HD1 PHE 72 -5.683 5.108 3.862
540 HD2 PHE 72 HD2 PHE 72 -3.356 8.679 4.033
541 HE1 PHE 72 HE1 PHE 72 -6.104 5.267 6.280
542 HE2 PHE 72 HE2 PHE 72 -3.777 8.838 6.451
543 HZ PHE 72 HZ PHE 72 -5.151 7.131 7.581
544 HB2 PHE 72 2HB PHE 72 -4.037 7.770 1.917
545 HB3 PHE 72 1HB PHE 72 -5.120 6.387 1.824
546 H ILE 73 H ILE 73 -3.530 3.779 0.588
547 HA ILE 73 HA ILE 73 -2.839 5.031 -2.001
548 HB ILE 73 HB ILE 73 -2.836 2.091 -1.263
549 HG12 ILE 73 2HG1 ILE 73 -0.530 3.986 -1.809
550 HG13 ILE 73 1HG1 ILE 73 -0.998 3.385 -0.224
551 HG21 ILE 73 1HG2 ILE 73 -2.009 3.463 -3.825
552 HG22 ILE 73 2HG2 ILE 73 -3.418 2.426 -3.605
553 HG23 ILE 73 3HG2 ILE 73 -1.796 1.751 -3.465
554 HD11 ILE 73 3HD1 ILE 73 0.027 1.728 -2.521
555 HD12 ILE 73 1HD1 ILE 73 -0.463 1.103 -0.945
556 HD13 ILE 73 2HD1 ILE 73 0.924 2.186 -1.073
557 H THR 74 H THR 74 -4.360 5.121 -3.596
558 HA THR 74 HA THR 74 -7.026 3.983 -2.977
559 HB THR 74 HB THR 74 -6.406 6.427 -4.655
560 HG1 THR 74 HG1 THR 74 -6.053 6.693 -2.362
561 HG21 THR 74 3HG2 THR 74 -8.465 5.303 -5.358
562 HG22 THR 74 1HG2 THR 74 -8.833 6.826 -4.548
563 HG23 THR 74 2HG2 THR 74 -9.044 5.299 -3.691
564 H PHE 75 H PHE 75 -7.641 2.354 -4.238
565 HA PHE 75 HA PHE 75 -6.444 1.986 -6.903
566 HD1 PHE 75 HD1 PHE 75 -6.167 0.779 -3.437
567 HD2 PHE 75 HD2 PHE 75 -5.432 -1.262 -7.103
568 HE1 PHE 75 HE1 PHE 75 -4.020 -0.031 -2.557
569 HE2 PHE 75 HE2 PHE 75 -3.283 -2.071 -6.226
570 HZ PHE 75 HZ PHE 75 -2.580 -1.454 -3.953
571 HB2 PHE 75 2HB PHE 75 -8.013 0.121 -5.112
572 HB3 PHE 75 1HB PHE 75 -7.503 -0.298 -6.742
573 H SER 76 H SER 76 -7.724 1.548 -8.761
574 HA SER 76 HA SER 76 -10.170 2.981 -8.988
575 HG SER 76 HG SER 76 -8.706 3.618 -11.325
576 HB2 SER 76 2HB SER 76 -9.066 0.890 -10.889
577 HB3 SER 76 1HB SER 76 -10.251 2.140 -11.273
578 H ASP 77 H ASP 77 -9.562 -0.064 -7.694
579 HA ASP 77 HA ASP 77 -12.379 -0.839 -7.939
580 HB2 ASP 77 2HB ASP 77 -11.158 -2.042 -9.705
581 HB3 ASP 77 1HB ASP 77 -10.053 -2.696 -8.500
582 H SER 78 H SER 78 -13.024 -2.526 -6.401
583 HA SER 78 HA SER 78 -11.770 -2.069 -3.807
584 HG SER 78 HG SER 78 -13.786 -0.889 -4.456
585 HB2 SER 78 2HB SER 78 -14.371 -3.449 -4.515
586 HB3 SER 78 1HB SER 78 -13.807 -3.117 -2.878
587 H GLU 79 H GLU 79 -12.412 -4.799 -6.003
588 HA GLU 79 HA GLU 79 -11.594 -6.745 -4.027
589 HB2 GLU 79 2HB GLU 79 -12.286 -7.021 -6.955
590 HB3 GLU 79 1HB GLU 79 -11.811 -8.379 -5.940
591 HG2 GLU 79 2HG GLU 79 -13.720 -7.785 -4.417
592 HG3 GLU 79 1HG GLU 79 -14.239 -6.625 -5.636
593 H CYS 80 H CYS 80 -10.123 -5.353 -6.961
594 HA CYS 80 HA CYS 80 -7.722 -6.793 -6.949
595 HG CYS 80 HG CYS 80 -8.823 -4.338 -10.207
596 HB2 CYS 80 2HB CYS 80 -8.123 -3.883 -7.700
597 HB3 CYS 80 1HB CYS 80 -6.737 -4.872 -8.146
598 H ALA 81 H ALA 81 -8.619 -3.866 -5.180
599 HA ALA 81 HA ALA 81 -6.128 -3.495 -3.851
600 HB1 ALA 81 3HB ALA 81 -7.768 -1.687 -4.123
601 HB2 ALA 81 1HB ALA 81 -7.350 -1.931 -2.425
602 HB3 ALA 81 2HB ALA 81 -8.883 -2.537 -3.054
603 H LYS 82 H LYS 82 -9.197 -5.000 -2.900
604 HA LYS 82 HA LYS 82 -8.554 -5.742 -0.295
605 HB2 LYS 82 2HB LYS 82 -10.814 -5.847 -1.307
606 HB3 LYS 82 1HB LYS 82 -10.308 -7.232 -2.261
607 HG2 LYS 82 2HG LYS 82 -9.994 -8.544 -0.241
608 HG3 LYS 82 1HG LYS 82 -10.408 -7.148 0.752
609 HD2 LYS 82 2HD LYS 82 -12.274 -8.406 -1.266
610 HD3 LYS 82 1HD LYS 82 -12.267 -8.802 0.450
611 HE2 LYS 82 2HE LYS 82 -14.013 -7.224 0.118
612 HE3 LYS 82 1HE LYS 82 -12.701 -6.367 0.919
613 HZ1 LYS 82 3HZ LYS 82 -12.071 -5.400 -1.193
614 HZ2 LYS 82 1HZ LYS 82 -13.698 -5.080 -0.879
615 HZ3 LYS 82 2HZ LYS 82 -13.280 -6.270 -1.996
616 H LYS 83 H LYS 83 -7.795 -7.362 -3.358
617 HA LYS 83 HA LYS 83 -6.680 -9.673 -2.082
618 HB2 LYS 83 2HB LYS 83 -7.549 -9.613 -4.469
619 HB3 LYS 83 1HB LYS 83 -6.063 -8.767 -4.897
620 HG2 LYS 83 2HG LYS 83 -4.771 -10.666 -3.936
621 HG3 LYS 83 1HG LYS 83 -6.292 -11.519 -3.693
622 HD2 LYS 83 2HD LYS 83 -6.686 -11.402 -6.145
623 HD3 LYS 83 1HD LYS 83 -5.088 -10.670 -6.330
624 HE2 LYS 83 2HE LYS 83 -5.758 -13.434 -5.322
625 HE3 LYS 83 1HE LYS 83 -4.832 -13.001 -6.758
626 HZ1 LYS 83 3HZ LYS 83 -4.007 -12.560 -3.938
627 HZ2 LYS 83 1HZ LYS 83 -3.123 -12.073 -5.300
628 HZ3 LYS 83 2HZ LYS 83 -3.375 -13.717 -5.003
629 H ALA 84 H ALA 84 -5.329 -6.653 -3.393
630 HA ALA 84 HA ALA 84 -2.615 -7.137 -2.957
631 HB1 ALA 84 3HB ALA 84 -4.121 -4.543 -2.568
632 HB2 ALA 84 1HB ALA 84 -3.426 -5.129 -4.081
633 HB3 ALA 84 2HB ALA 84 -2.372 -4.701 -2.733
634 H LEU 85 H LEU 85 -5.175 -6.330 -0.719
635 HA LEU 85 HA LEU 85 -3.607 -5.840 1.580
636 HG LEU 85 HG LEU 85 -5.047 -5.411 3.631
637 HB2 LEU 85 2HB LEU 85 -6.013 -5.224 1.253
638 HB3 LEU 85 1HB LEU 85 -6.436 -6.916 1.410
639 HD11 LEU 85 1HD1 LEU 85 -7.258 -5.043 4.630
640 HD12 LEU 85 2HD1 LEU 85 -8.019 -5.678 3.170
641 HD13 LEU 85 3HD1 LEU 85 -7.075 -4.190 3.097
642 HD21 LEU 85 3HD2 LEU 85 -6.074 -7.140 5.048
643 HD22 LEU 85 1HD2 LEU 85 -5.009 -7.841 3.831
644 HD23 LEU 85 2HD2 LEU 85 -6.757 -7.907 3.613
645 H GLU 86 H GLU 86 -5.342 -8.811 0.537
646 HA GLU 86 HA GLU 86 -4.513 -10.325 2.771
647 HB2 GLU 86 2HB GLU 86 -5.414 -12.271 1.586
648 HB3 GLU 86 1HB GLU 86 -6.508 -10.903 1.533
649 HG2 GLU 86 2HG GLU 86 -6.703 -11.488 -0.628
650 HG3 GLU 86 1HG GLU 86 -5.239 -10.528 -0.802
651 H GLN 87 H GLN 87 -2.805 -9.579 -0.138
652 HA GLN 87 HA GLN 87 -0.889 -11.754 0.303
653 HB2 GLN 87 2HB GLN 87 -1.108 -9.649 -1.851
654 HB3 GLN 87 1HB GLN 87 0.243 -10.769 -1.738
655 HG2 GLN 87 2HG GLN 87 -2.637 -11.597 -2.020
656 HG3 GLN 87 1HG GLN 87 -1.504 -11.446 -3.358
657 HE21 GLN 87 1HE2 GLN 87 -2.975 -13.772 -2.254
658 HE22 GLN 87 2HE2 GLN 87 -1.760 -14.960 -1.950
659 H LEU 88 H LEU 88 -0.984 -8.193 0.384
660 HA LEU 88 HA LEU 88 1.863 -8.103 0.974
661 HG LEU 88 HG LEU 88 0.154 -7.223 -1.491
662 HB2 LEU 88 2HB LEU 88 -0.097 -5.851 0.551
663 HB3 LEU 88 1HB LEU 88 1.649 -5.696 0.646
664 HD11 LEU 88 1HD1 LEU 88 -0.205 -4.846 -1.726
665 HD12 LEU 88 2HD1 LEU 88 0.875 -5.426 -2.994
666 HD13 LEU 88 3HD1 LEU 88 1.531 -4.544 -1.614
667 HD21 LEU 88 3HD2 LEU 88 3.099 -6.611 -1.198
668 HD22 LEU 88 1HD2 LEU 88 2.346 -7.336 -2.619
669 HD23 LEU 88 2HD2 LEU 88 2.338 -8.197 -1.081
670 H ASN 89 H ASN 89 -1.084 -7.928 2.795
671 HA ASN 89 HA ASN 89 -0.018 -6.408 4.972
672 HB2 ASN 89 2HB ASN 89 -2.475 -6.771 4.553
673 HB3 ASN 89 1HB ASN 89 -2.269 -8.428 5.110
674 HD21 ASN 89 1HD2 ASN 89 -3.843 -6.165 6.176
675 HD22 ASN 89 2HD2 ASN 89 -3.346 -6.003 7.823
676 H GLY 90 H GLY 90 1.938 -7.176 5.596
677 HA2 GLY 90 2HA GLY 90 2.895 -8.680 7.336
678 HA3 GLY 90 1HA GLY 90 2.120 -10.003 6.477
679 H PHE 91 H PHE 91 2.912 -8.333 3.957
680 HA PHE 91 HA PHE 91 5.189 -9.804 3.202
681 HD1 PHE 91 HD1 PHE 91 5.395 -10.246 0.385
682 HD2 PHE 91 HD2 PHE 91 5.927 -6.092 1.184
683 HE1 PHE 91 HE1 PHE 91 7.176 -10.149 -1.309
684 HE2 PHE 91 HE2 PHE 91 7.707 -5.995 -0.507
685 HZ PHE 91 HZ PHE 91 8.333 -8.020 -1.754
686 HB2 PHE 91 2HB PHE 91 3.655 -8.869 1.554
687 HB3 PHE 91 1HB PHE 91 4.048 -7.234 2.066
688 H GLU 92 H GLU 92 7.256 -9.567 3.796
689 HA GLU 92 HA GLU 92 8.066 -7.286 5.354
690 HB2 GLU 92 2HB GLU 92 9.637 -9.702 4.432
691 HB3 GLU 92 1HB GLU 92 10.200 -8.509 5.599
692 HG2 GLU 92 2HG GLU 92 8.480 -9.119 7.156
693 HG3 GLU 92 1HG GLU 92 7.711 -10.166 5.967
694 H LEU 93 H LEU 93 8.110 -5.496 4.044
695 HA LEU 93 HA LEU 93 9.867 -5.486 1.691
696 HG LEU 93 HG LEU 93 9.809 -2.407 1.297
697 HB2 LEU 93 2HB LEU 93 7.612 -4.484 1.487
698 HB3 LEU 93 1HB LEU 93 8.015 -3.339 2.753
699 HD11 LEU 93 1HD1 LEU 93 9.844 -2.990 -1.079
700 HD12 LEU 93 2HD1 LEU 93 8.648 -4.253 -0.790
701 HD13 LEU 93 3HD1 LEU 93 10.252 -4.374 -0.066
702 HD21 LEU 93 3HD2 LEU 93 8.320 -1.234 -0.249
703 HD22 LEU 93 1HD2 LEU 93 7.611 -1.349 1.362
704 HD23 LEU 93 2HD2 LEU 93 7.049 -2.415 0.073
705 H ALA 94 H ALA 94 11.792 -4.356 1.639
706 HA ALA 94 HA ALA 94 13.706 -3.412 2.452
707 HB1 ALA 94 3HB ALA 94 13.476 -1.427 3.866
708 HB2 ALA 94 1HB ALA 94 11.794 -1.843 4.192
709 HB3 ALA 94 2HB ALA 94 12.293 -1.407 2.559
710 H GLY 95 H GLY 95 12.523 -5.816 3.769
711 HA2 GLY 95 2HA GLY 95 13.326 -7.246 5.413
712 HA3 GLY 95 1HA GLY 95 14.288 -5.930 6.065
713 H ARG 96 H ARG 96 11.130 -4.854 5.737
714 HA ARG 96 HA ARG 96 10.474 -5.612 8.520
715 HE ARG 96 HE ARG 96 9.321 -1.826 9.865
716 HB2 ARG 96 2HB ARG 96 10.091 -2.960 7.123
717 HB3 ARG 96 1HB ARG 96 9.260 -3.374 8.618
718 HG2 ARG 96 2HG ARG 96 11.396 -3.634 9.752
719 HG3 ARG 96 1HG ARG 96 12.252 -3.271 8.254
720 HD2 ARG 96 2HD ARG 96 12.160 -1.320 9.729
721 HD3 ARG 96 1HD ARG 96 11.291 -1.033 8.222
722 HH11 ARG 96 1HH1 ARG 96 11.864 0.454 10.347
723 HH12 ARG 96 2HH1 ARG 96 10.893 1.493 11.332
724 HH21 ARG 96 1HH2 ARG 96 8.076 -0.464 11.113
725 HH22 ARG 96 2HH2 ARG 96 8.771 0.994 11.739
726 HA PRO 97 HA PRO 97 6.631 -7.255 6.869
727 HB2 PRO 97 2HB PRO 97 5.161 -7.037 9.202
728 HB3 PRO 97 1HB PRO 97 6.254 -8.376 8.833
729 HG2 PRO 97 2HG PRO 97 6.745 -5.928 10.498
730 HG3 PRO 97 1HG PRO 97 7.212 -7.611 10.816
731 HD2 PRO 97 2HD PRO 97 8.984 -5.823 9.894
732 HD3 PRO 97 1HD PRO 97 9.019 -7.513 9.346
733 H MET 98 H MET 98 5.068 -6.210 5.742
734 HA MET 98 HA MET 98 4.675 -3.370 6.317
735 HB2 MET 98 2HB MET 98 5.459 -3.945 4.081
736 HB3 MET 98 1HB MET 98 4.061 -4.984 3.835
737 HG2 MET 98 2HG MET 98 2.583 -3.120 3.794
738 HG3 MET 98 1HG MET 98 3.853 -2.023 4.337
739 HE1 MET 98 3HE MET 98 3.988 -4.071 0.196
740 HE2 MET 98 1HE MET 98 2.746 -4.425 1.398
741 HE3 MET 98 2HE MET 98 4.426 -4.883 1.697
742 H LYS 99 H LYS 99 2.867 -2.603 7.159
743 HA LYS 99 HA LYS 99 0.593 -4.380 7.565
744 HB2 LYS 99 2HB LYS 99 1.149 -1.575 8.558
745 HB3 LYS 99 1HB LYS 99 -0.290 -2.501 8.966
746 HG2 LYS 99 2HG LYS 99 1.108 -4.190 10.060
747 HG3 LYS 99 1HG LYS 99 2.550 -3.255 9.651
748 HD2 LYS 99 2HD LYS 99 1.774 -1.398 11.011
749 HD3 LYS 99 1HD LYS 99 0.261 -2.241 11.351
750 HE2 LYS 99 2HE LYS 99 3.025 -3.134 12.186
751 HE3 LYS 99 1HE LYS 99 1.808 -2.404 13.234
752 HZ1 LYS 99 3HZ LYS 99 0.346 -4.322 12.662
753 HZ2 LYS 99 1HZ LYS 99 1.726 -4.740 13.548
754 HZ3 LYS 99 2HZ LYS 99 1.667 -5.042 11.888
755 H VAL 100 H VAL 100 -0.617 -4.566 5.760
756 HA VAL 100 HA VAL 100 -1.629 -2.091 4.496
757 HB VAL 100 HB VAL 100 -1.518 -4.861 3.274
758 HG11 VAL 100 1HG1 VAL 100 -2.197 -2.184 2.041
759 HG12 VAL 100 2HG1 VAL 100 -3.332 -3.491 2.379
760 HG13 VAL 100 3HG1 VAL 100 -2.066 -3.713 1.170
761 HG21 VAL 100 3HG2 VAL 100 0.270 -2.479 2.767
762 HG22 VAL 100 1HG2 VAL 100 0.292 -3.993 1.861
763 HG23 VAL 100 2HG2 VAL 100 0.735 -3.981 3.569
764 H GLY 101 H GLY 101 -3.494 -1.697 5.636
765 HA2 GLY 101 2HA GLY 101 -5.561 -3.814 5.520
766 HA3 GLY 101 1HA GLY 101 -5.256 -2.956 7.022
767 H HIS 102 H HIS 102 -7.773 -3.036 5.730
768 HA HIS 102 HA HIS 102 -8.202 -0.580 4.311
769 HD1 HIS 102 HD1 HIS 102 -10.924 -1.673 7.432
770 HD2 HIS 102 HD2 HIS 102 -10.036 -4.798 4.840
771 HE1 HIS 102 HE1 HIS 102 -11.567 -3.764 8.655
772 HE2 HIS 102 HE2 HIS 102 -11.208 -5.616 6.994
773 HB2 HIS 102 2HB HIS 102 -10.655 -1.075 4.754
774 HB3 HIS 102 1HB HIS 102 -9.771 -2.298 3.852
775 H VAL 103 H VAL 103 -9.427 1.262 5.086
776 HA VAL 103 HA VAL 103 -8.280 2.273 7.453
777 HB VAL 103 HB VAL 103 -10.636 3.423 5.939
778 HG11 VAL 103 1HG1 VAL 103 -9.881 5.577 6.872
779 HG12 VAL 103 2HG1 VAL 103 -8.650 4.729 7.811
780 HG13 VAL 103 3HG1 VAL 103 -10.360 4.442 8.134
781 HG21 VAL 103 3HG2 VAL 103 -8.737 3.027 4.452
782 HG22 VAL 103 1HG2 VAL 103 -7.672 3.896 5.556
783 HG23 VAL 103 2HG2 VAL 103 -8.969 4.753 4.721
784 H THR 104 H THR 104 -8.878 0.781 9.091
785 HA THR 104 HA THR 104 -11.544 1.325 10.255
786 HB THR 104 HB THR 104 -9.974 -1.256 10.547
787 HG1 THR 104 HG1 THR 104 -12.501 -1.283 9.388
788 HG21 THR 104 3HG2 THR 104 -12.736 -0.503 11.533
789 HG22 THR 104 1HG2 THR 104 -11.303 -0.721 12.539
790 HG23 THR 104 2HG2 THR 104 -11.990 -2.094 11.675
791 H GLU 105 H GLU 105 -10.734 3.051 11.426
792 HA GLU 105 HA GLU 105 -8.363 2.815 13.059
793 HB2 GLU 105 2HB GLU 105 -8.849 5.165 13.660
794 HB3 GLU 105 1HB GLU 105 -8.843 4.909 11.918
795 HG2 GLU 105 2HG GLU 105 -11.274 4.862 11.895
796 HG3 GLU 105 1HG GLU 105 -11.314 5.052 13.644
797 H ARG 106 H ARG 106 -11.822 2.694 13.588
798 HA ARG 106 HA ARG 106 -11.481 2.925 16.490
799 HE ARG 106 HE ARG 106 -16.313 2.800 18.392
800 HB2 ARG 106 2HB ARG 106 -13.171 4.369 15.567
801 HB3 ARG 106 1HB ARG 106 -13.939 3.026 14.727
802 HG2 ARG 106 2HG ARG 106 -14.549 2.028 16.888
803 HG3 ARG 106 1HG ARG 106 -13.791 3.385 17.724
804 HD2 ARG 106 2HD ARG 106 -15.389 4.923 16.708
805 HD3 ARG 106 1HD ARG 106 -16.115 3.597 15.798
806 HH11 ARG 106 1HH1 ARG 106 -17.332 5.600 16.657
807 HH12 ARG 106 2HH1 ARG 106 -18.681 5.885 17.702
808 HH21 ARG 106 1HH2 ARG 106 -18.051 3.162 19.708
809 HH22 ARG 106 2HH2 ARG 106 -19.087 4.515 19.412
810 H THR 107 H THR 107 -11.065 1.018 17.485
811 HA THR 107 HA THR 107 -12.691 -1.339 16.814
812 HB THR 107 HB THR 107 -11.387 -2.546 18.512
813 HG1 THR 107 HG1 THR 107 -10.393 -1.460 20.022
814 HG21 THR 107 3HG2 THR 107 -9.629 -0.926 16.657
815 HG22 THR 107 1HG2 THR 107 -10.485 -2.411 16.238
816 HG23 THR 107 2HG2 THR 107 -9.184 -2.449 17.428
817 H ASP 108 H ASP 108 -11.796 0.206 19.899
818 HA ASP 108 HA ASP 108 -12.969 0.598 21.815
819 HB2 ASP 108 2HB ASP 108 -13.375 2.544 20.332
820 HB3 ASP 108 1HB ASP 108 -14.881 1.804 19.804
Start of MODEL 7
1 HA MET 1 HA MET 1 -5.949 34.955 -30.905
2 H1 MET 1 1H MET 1 -4.018 34.061 -29.811
3 H2 MET 1 2H MET 1 -4.707 32.894 -30.818
4 H3 MET 1 3H MET 1 -4.924 32.799 -29.142
5 HB2 MET 1 2HB MET 1 -8.182 34.013 -30.418
6 HB3 MET 1 1HB MET 1 -7.155 32.866 -31.269
7 HG2 MET 1 2HG MET 1 -7.671 32.862 -28.300
8 HG3 MET 1 1HG MET 1 -8.459 31.814 -29.479
9 HE1 MET 1 3HE MET 1 -7.676 29.786 -27.853
10 HE2 MET 1 1HE MET 1 -6.784 30.897 -26.811
11 HE3 MET 1 2HE MET 1 -5.984 29.463 -27.461
12 H GLY 2 H GLY 2 -8.009 35.869 -29.548
13 HA2 GLY 2 2HA GLY 2 -6.924 37.409 -27.462
14 HA3 GLY 2 1HA GLY 2 -8.633 37.255 -27.829
15 H HIS 3 H HIS 3 -5.959 35.890 -26.010
16 HA HIS 3 HA HIS 3 -5.809 34.508 -24.214
17 HD1 HIS 3 HD1 HIS 3 -4.800 36.175 -22.320
18 HD2 HIS 3 HD2 HIS 3 -8.001 38.505 -23.564
19 HE1 HIS 3 HE1 HIS 3 -4.033 38.549 -22.069
20 HE2 HIS 3 HE2 HIS 3 -6.073 39.925 -22.595
21 HB2 HIS 3 2HB HIS 3 -8.417 35.838 -23.447
22 HB3 HIS 3 1HB HIS 3 -7.321 35.009 -22.352
23 H HIS 4 H HIS 4 -9.080 34.098 -23.374
24 HA HIS 4 HA HIS 4 -9.539 31.798 -25.092
25 HD1 HIS 4 HD1 HIS 4 -6.900 31.300 -21.703
26 HD2 HIS 4 HD2 HIS 4 -8.231 29.170 -25.010
27 HE1 HIS 4 HE1 HIS 4 -4.919 29.979 -22.492
28 HE2 HIS 4 HE2 HIS 4 -5.782 28.605 -24.412
29 HB2 HIS 4 2HB HIS 4 -9.351 31.576 -22.077
30 HB3 HIS 4 1HB HIS 4 -10.119 30.359 -23.093
31 H HIS 5 H HIS 5 -11.397 32.583 -25.954
32 HA HIS 5 HA HIS 5 -13.329 34.003 -24.346
33 HD1 HIS 5 HD1 HIS 5 -14.518 36.203 -25.214
34 HD2 HIS 5 HD2 HIS 5 -16.175 33.459 -27.864
35 HE1 HIS 5 HE1 HIS 5 -16.863 36.994 -25.629
36 HE2 HIS 5 HE2 HIS 5 -17.763 35.444 -27.388
37 HB2 HIS 5 2HB HIS 5 -12.793 34.610 -26.717
38 HB3 HIS 5 1HB HIS 5 -13.561 33.113 -27.232
39 H HIS 6 H HIS 6 -13.478 31.973 -22.945
40 HA HIS 6 HA HIS 6 -15.066 29.775 -23.963
41 HD1 HIS 6 HD1 HIS 6 -15.820 30.330 -19.719
42 HD2 HIS 6 HD2 HIS 6 -12.011 31.423 -20.977
43 HE1 HIS 6 HE1 HIS 6 -14.930 31.848 -17.931
44 HE2 HIS 6 HE2 HIS 6 -12.697 32.620 -18.787
45 HB2 HIS 6 2HB HIS 6 -14.881 28.888 -21.668
46 HB3 HIS 6 1HB HIS 6 -13.311 29.339 -22.323
47 H HIS 7 H HIS 7 -16.432 32.204 -24.225
48 HA HIS 7 HA HIS 7 -18.162 32.774 -22.037
49 HD1 HIS 7 HD1 HIS 7 -20.945 33.756 -25.099
50 HD2 HIS 7 HD2 HIS 7 -19.270 35.836 -21.918
51 HE1 HIS 7 HE1 HIS 7 -22.770 35.235 -24.229
52 HE2 HIS 7 HE2 HIS 7 -21.677 36.623 -22.442
53 HB2 HIS 7 2HB HIS 7 -17.568 34.458 -23.726
54 HB3 HIS 7 1HB HIS 7 -18.402 33.525 -24.963
55 H HIS 8 H HIS 8 -19.097 30.728 -21.497
56 HA HIS 8 HA HIS 8 -21.601 30.289 -22.903
57 HD1 HIS 8 HD1 HIS 8 -20.308 26.911 -20.828
58 HD2 HIS 8 HD2 HIS 8 -17.535 27.989 -23.731
59 HE1 HIS 8 HE1 HIS 8 -18.169 25.780 -20.166
60 HE2 HIS 8 HE2 HIS 8 -16.494 26.479 -21.904
61 HB2 HIS 8 2HB HIS 8 -21.285 27.866 -23.200
62 HB3 HIS 8 1HB HIS 8 -20.110 28.785 -24.131
63 H SER 9 H SER 9 -20.189 30.830 -20.137
64 HA SER 9 HA SER 9 -20.715 30.635 -17.950
65 HG SER 9 HG SER 9 -24.023 31.519 -19.048
66 HB2 SER 9 2HB SER 9 -23.318 29.483 -18.994
67 HB3 SER 9 1HB SER 9 -23.033 30.021 -17.340
68 H HIS 10 H HIS 10 -21.440 29.027 -16.178
69 HA HIS 10 HA HIS 10 -19.814 26.690 -16.470
70 HD1 HIS 10 HD1 HIS 10 -21.108 29.902 -14.026
71 HD2 HIS 10 HD2 HIS 10 -23.331 26.446 -13.396
72 HE1 HIS 10 HE1 HIS 10 -23.235 30.657 -12.934
73 HE2 HIS 10 HE2 HIS 10 -24.623 28.577 -12.705
74 HB2 HIS 10 2HB HIS 10 -20.621 26.197 -14.106
75 HB3 HIS 10 1HB HIS 10 -19.762 27.713 -14.333
76 H MET 11 H MET 11 -20.832 25.537 -18.150
77 HA MET 11 HA MET 11 -23.470 24.626 -18.201
78 HB2 MET 11 2HB MET 11 -22.012 24.488 -20.144
79 HB3 MET 11 1HB MET 11 -20.965 23.343 -19.316
80 HG2 MET 11 2HG MET 11 -22.819 21.720 -19.265
81 HG3 MET 11 1HG MET 11 -23.822 22.865 -20.156
82 HE1 MET 11 3HE MET 11 -24.280 20.910 -21.960
83 HE2 MET 11 1HE MET 11 -23.233 19.832 -21.036
84 HE3 MET 11 2HE MET 11 -22.985 20.030 -22.771
85 H ALA 12 H ALA 12 -20.588 23.000 -16.886
86 HA ALA 12 HA ALA 12 -21.917 20.635 -16.088
87 HB1 ALA 12 3HB ALA 12 -19.338 21.784 -15.029
88 HB2 ALA 12 1HB ALA 12 -19.497 20.764 -16.456
89 HB3 ALA 12 2HB ALA 12 -19.883 20.115 -14.863
90 H ALA 13 H ALA 13 -20.427 22.993 -13.854
91 HA ALA 13 HA ALA 13 -20.989 23.720 -11.777
92 HB1 ALA 13 3HB ALA 13 -23.309 24.309 -11.366
93 HB2 ALA 13 1HB ALA 13 -23.832 23.287 -12.706
94 HB3 ALA 13 2HB ALA 13 -22.861 24.728 -13.020
95 H ALA 14 H ALA 14 -20.854 20.698 -12.372
96 HA ALA 14 HA ALA 14 -22.355 19.701 -10.041
97 HB1 ALA 14 3HB ALA 14 -21.089 18.130 -12.291
98 HB2 ALA 14 1HB ALA 14 -22.790 18.583 -12.189
99 HB3 ALA 14 2HB ALA 14 -22.100 17.484 -10.996
100 H MET 15 H MET 15 -21.324 18.461 -8.440
101 HA MET 15 HA MET 15 -18.451 19.004 -8.169
102 HB2 MET 15 2HB MET 15 -20.468 18.026 -6.133
103 HB3 MET 15 1HB MET 15 -18.788 18.416 -5.793
104 HG2 MET 15 2HG MET 15 -19.185 20.743 -6.380
105 HG3 MET 15 1HG MET 15 -20.855 20.364 -6.800
106 HE1 MET 15 3HE MET 15 -19.178 20.059 -2.509
107 HE2 MET 15 1HE MET 15 -18.214 20.561 -3.898
108 HE3 MET 15 2HE MET 15 -18.789 18.898 -3.777
109 H ALA 16 H ALA 16 -16.921 17.435 -8.222
110 HA ALA 16 HA ALA 16 -17.752 14.732 -8.896
111 HB1 ALA 16 3HB ALA 16 -14.966 15.890 -8.726
112 HB2 ALA 16 1HB ALA 16 -15.965 15.835 -10.178
113 HB3 ALA 16 2HB ALA 16 -15.415 14.337 -9.430
114 H ASN 17 H ASN 17 -18.656 14.206 -6.793
115 HA ASN 17 HA ASN 17 -16.593 13.234 -4.930
116 HB2 ASN 17 2HB ASN 17 -19.137 14.679 -4.139
117 HB3 ASN 17 1HB ASN 17 -18.072 13.847 -3.010
118 HD21 ASN 17 1HD2 ASN 17 -16.052 14.746 -2.546
119 HD22 ASN 17 2HD2 ASN 17 -15.680 16.389 -2.920
120 H ASN 18 H ASN 18 -16.804 11.102 -5.594
121 HA ASN 18 HA ASN 18 -19.391 9.840 -5.755
122 HB2 ASN 18 2HB ASN 18 -17.896 7.705 -5.961
123 HB3 ASN 18 1HB ASN 18 -17.933 8.875 -7.272
124 HD21 ASN 18 1HD2 ASN 18 -15.931 8.128 -7.998
125 HD22 ASN 18 2HD2 ASN 18 -14.463 8.563 -7.201
126 H LEU 19 H LEU 19 -16.598 8.821 -3.743
127 HA LEU 19 HA LEU 19 -16.399 8.177 -1.592
128 HG LEU 19 HG LEU 19 -18.496 8.263 0.764
129 HB2 LEU 19 2HB LEU 19 -17.379 10.377 -1.099
130 HB3 LEU 19 1HB LEU 19 -18.987 9.689 -1.206
131 HD11 LEU 19 1HD1 LEU 19 -16.500 8.704 2.109
132 HD12 LEU 19 2HD1 LEU 19 -15.894 9.792 0.859
133 HD13 LEU 19 3HD1 LEU 19 -16.085 8.072 0.515
134 HD21 LEU 19 3HD2 LEU 19 -19.605 10.407 1.080
135 HD22 LEU 19 1HD2 LEU 19 -18.043 11.220 1.197
136 HD23 LEU 19 2HD2 LEU 19 -18.529 10.061 2.434
137 H GLN 20 H GLN 20 -19.945 8.073 -1.693
138 HA GLN 20 HA GLN 20 -19.887 5.198 -2.052
139 HB2 GLN 20 2HB GLN 20 -21.364 4.821 -0.034
140 HB3 GLN 20 1HB GLN 20 -19.697 5.240 0.318
141 HG2 GLN 20 2HG GLN 20 -20.888 6.491 1.857
142 HG3 GLN 20 1HG GLN 20 -20.562 7.653 0.574
143 HE21 GLN 20 1HE2 GLN 20 -22.286 8.386 -0.691
144 HE22 GLN 20 2HE2 GLN 20 -23.931 8.130 -0.242
145 H LYS 21 H LYS 21 -21.194 8.041 -2.900
146 HA LYS 21 HA LYS 21 -23.968 7.361 -3.134
147 HB2 LYS 21 2HB LYS 21 -23.249 9.689 -3.060
148 HB3 LYS 21 1HB LYS 21 -22.308 9.471 -4.528
149 HG2 LYS 21 2HG LYS 21 -24.334 9.118 -5.816
150 HG3 LYS 21 1HG LYS 21 -25.312 9.225 -4.353
151 HD2 LYS 21 2HD LYS 21 -25.398 11.327 -5.571
152 HD3 LYS 21 1HD LYS 21 -24.562 11.551 -4.034
153 HE2 LYS 21 2HE LYS 21 -23.380 12.745 -5.767
154 HE3 LYS 21 1HE LYS 21 -22.394 11.382 -5.240
155 HZ1 LYS 21 3HZ LYS 21 -24.084 11.455 -7.683
156 HZ2 LYS 21 1HZ LYS 21 -23.137 10.147 -7.184
157 HZ3 LYS 21 2HZ LYS 21 -22.400 11.597 -7.640
158 H GLY 22 H GLY 22 -21.207 7.339 -5.381
159 HA2 GLY 22 2HA GLY 22 -22.790 6.312 -7.572
160 HA3 GLY 22 1HA GLY 22 -21.055 6.570 -7.568
161 H SER 23 H SER 23 -23.373 4.483 -5.837
162 HA SER 23 HA SER 23 -23.306 2.315 -5.181
163 HG SER 23 HG SER 23 -21.781 1.076 -8.675
164 HB2 SER 23 2HB SER 23 -22.929 0.664 -6.957
165 HB3 SER 23 1HB SER 23 -23.884 2.019 -7.543
166 H ALA 24 H ALA 24 -20.395 2.001 -7.177
167 HA ALA 24 HA ALA 24 -18.824 1.443 -4.738
168 HB1 ALA 24 3HB ALA 24 -17.695 -0.389 -5.908
169 HB2 ALA 24 1HB ALA 24 -18.722 -0.127 -7.319
170 HB3 ALA 24 2HB ALA 24 -19.430 -0.676 -5.799
171 H GLY 25 H GLY 25 -16.698 2.183 -4.746
172 HA2 GLY 25 2HA GLY 25 -15.742 3.548 -7.177
173 HA3 GLY 25 1HA GLY 25 -15.871 4.459 -5.682
174 HA PRO 26 HA PRO 26 -11.499 2.707 -6.215
175 HB2 PRO 26 2HB PRO 26 -10.993 5.451 -5.149
176 HB3 PRO 26 1HB PRO 26 -10.138 4.556 -6.411
177 HG2 PRO 26 2HG PRO 26 -11.799 6.528 -7.060
178 HG3 PRO 26 1HG PRO 26 -11.745 5.040 -8.025
179 HD2 PRO 26 2HD PRO 26 -13.769 5.909 -5.992
180 HD3 PRO 26 1HD PRO 26 -14.012 5.069 -7.538
181 H MET 27 H MET 27 -10.701 1.530 -4.578
182 HA MET 27 HA MET 27 -11.544 2.143 -1.828
183 HB2 MET 27 2HB MET 27 -12.032 -0.102 -2.830
184 HB3 MET 27 1HB MET 27 -10.303 -0.393 -2.924
185 HG2 MET 27 2HG MET 27 -10.127 -0.285 -0.507
186 HG3 MET 27 1HG MET 27 -11.845 0.098 -0.384
187 HE1 MET 27 3HE MET 27 -12.306 -1.897 1.300
188 HE2 MET 27 1HE MET 27 -10.578 -2.259 1.280
189 HE3 MET 27 2HE MET 27 -11.751 -3.550 1.023
190 H ARG 28 H ARG 28 -10.064 2.334 -0.126
191 HA ARG 28 HA ARG 28 -7.310 2.954 -1.020
192 HE ARG 28 HE ARG 28 -7.433 6.999 -0.916
193 HB2 ARG 28 2HB ARG 28 -8.699 4.926 -0.475
194 HB3 ARG 28 1HB ARG 28 -8.930 4.302 1.151
195 HG2 ARG 28 2HG ARG 28 -6.580 4.564 1.638
196 HG3 ARG 28 1HG ARG 28 -6.257 5.038 -0.033
197 HD2 ARG 28 2HD ARG 28 -8.031 6.547 1.893
198 HD3 ARG 28 1HD ARG 28 -6.366 6.977 1.507
199 HH11 ARG 28 1HH1 ARG 28 -8.744 8.272 2.019
200 HH12 ARG 28 2HH1 ARG 28 -9.539 9.579 1.210
201 HH21 ARG 28 1HH2 ARG 28 -8.496 8.683 -1.917
202 HH22 ARG 28 2HH2 ARG 28 -9.401 9.806 -0.966
203 H LEU 29 H LEU 29 -5.644 2.017 -0.003
204 HA LEU 29 HA LEU 29 -6.164 0.442 2.438
205 HG LEU 29 HG LEU 29 -6.008 -0.789 -0.494
206 HB2 LEU 29 2HB LEU 29 -3.957 0.175 0.387
207 HB3 LEU 29 1HB LEU 29 -4.090 -0.795 1.840
208 HD11 LEU 29 1HD1 LEU 29 -3.881 -1.919 -0.937
209 HD12 LEU 29 2HD1 LEU 29 -5.213 -3.068 -0.849
210 HD13 LEU 29 3HD1 LEU 29 -4.101 -2.906 0.508
211 HD21 LEU 29 3HD2 LEU 29 -7.215 -1.124 1.598
212 HD22 LEU 29 1HD2 LEU 29 -6.091 -2.405 2.056
213 HD23 LEU 29 2HD2 LEU 29 -7.152 -2.616 0.663
214 H TYR 30 H TYR 30 -4.889 0.638 4.226
215 HA TYR 30 HA TYR 30 -3.005 2.884 4.376
216 HD1 TYR 30 HD1 TYR 30 -2.942 4.536 6.977
217 HD2 TYR 30 HD2 TYR 30 -2.636 0.376 7.842
218 HE1 TYR 30 HE1 TYR 30 -1.357 5.033 8.790
219 HE2 TYR 30 HE2 TYR 30 -1.048 0.861 9.650
220 HH TYR 30 HH TYR 30 -0.581 3.944 10.907
221 HB2 TYR 30 2HB TYR 30 -4.611 2.926 6.136
222 HB3 TYR 30 1HB TYR 30 -4.431 1.207 6.451
223 H VAL 31 H VAL 31 -0.952 2.383 3.894
224 HA VAL 31 HA VAL 31 0.074 -0.316 4.496
225 HB VAL 31 HB VAL 31 1.170 1.766 2.585
226 HG11 VAL 31 1HG1 VAL 31 2.623 -0.033 1.771
227 HG12 VAL 31 2HG1 VAL 31 1.984 -1.118 3.005
228 HG13 VAL 31 3HG1 VAL 31 2.923 0.301 3.476
229 HG21 VAL 31 3HG2 VAL 31 -0.981 0.856 1.837
230 HG22 VAL 31 1HG2 VAL 31 -0.351 -0.785 2.004
231 HG23 VAL 31 2HG2 VAL 31 0.340 0.310 0.804
232 H GLY 32 H GLY 32 1.085 -0.351 6.427
233 HA2 GLY 32 2HA GLY 32 2.753 1.966 7.197
234 HA3 GLY 32 1HA GLY 32 1.923 0.924 8.334
235 H SER 33 H SER 33 4.715 1.336 6.339
236 HA SER 33 HA SER 33 6.353 -0.081 8.152
237 HG SER 33 HG SER 33 7.481 -2.927 6.267
238 HB2 SER 33 2HB SER 33 5.378 -2.067 7.022
239 HB3 SER 33 1HB SER 33 5.994 -1.476 5.480
240 H LEU 34 H LEU 34 6.069 2.396 6.357
241 HA LEU 34 HA LEU 34 8.292 2.170 4.497
242 HG LEU 34 HG LEU 34 4.960 3.024 4.630
243 HB2 LEU 34 2HB LEU 34 6.701 4.673 5.027
244 HB3 LEU 34 1HB LEU 34 7.536 4.197 3.559
245 HD11 LEU 34 1HD1 LEU 34 3.971 3.941 2.596
246 HD12 LEU 34 2HD1 LEU 34 5.530 4.639 2.147
247 HD13 LEU 34 3HD1 LEU 34 4.692 5.205 3.592
248 HD21 LEU 34 3HD2 LEU 34 6.478 2.259 2.137
249 HD22 LEU 34 1HD2 LEU 34 4.896 1.648 2.623
250 HD23 LEU 34 2HD2 LEU 34 6.322 1.273 3.591
251 H HIS 35 H HIS 35 10.130 2.063 5.834
252 HA HIS 35 HA HIS 35 10.363 3.899 8.053
253 HD1 HIS 35 HD1 HIS 35 14.511 2.711 7.080
254 HD2 HIS 35 HD2 HIS 35 11.547 0.015 5.984
255 HE1 HIS 35 HE1 HIS 35 15.601 1.147 5.456
256 HE2 HIS 35 HE2 HIS 35 13.861 -0.599 4.985
257 HB2 HIS 35 2HB HIS 35 12.469 2.797 8.587
258 HB3 HIS 35 1HB HIS 35 11.195 1.625 8.315
259 H PHE 36 H PHE 36 10.138 5.752 6.554
260 HA PHE 36 HA PHE 36 10.957 7.692 5.724
261 HD1 PHE 36 HD1 PHE 36 11.328 9.861 7.125
262 HD2 PHE 36 HD2 PHE 36 15.189 8.309 6.192
263 HE1 PHE 36 HE1 PHE 36 12.135 12.139 6.681
264 HE2 PHE 36 HE2 PHE 36 15.997 10.590 5.746
265 HZ PHE 36 HZ PHE 36 14.469 12.508 5.994
266 HB2 PHE 36 2HB PHE 36 12.179 7.545 7.910
267 HB3 PHE 36 1HB PHE 36 13.554 6.873 7.043
268 H ASN 37 H ASN 37 11.723 4.957 4.264
269 HA ASN 37 HA ASN 37 13.595 6.233 2.366
270 HB2 ASN 37 2HB ASN 37 14.610 4.047 1.944
271 HB3 ASN 37 1HB ASN 37 14.721 4.470 3.651
272 HD21 ASN 37 1HD2 ASN 37 14.792 1.865 2.318
273 HD22 ASN 37 2HD2 ASN 37 13.537 0.932 3.048
274 H ILE 38 H ILE 38 10.896 3.989 2.719
275 HA ILE 38 HA ILE 38 10.676 3.293 -0.016
276 HB ILE 38 HB ILE 38 8.550 3.189 2.132
277 HG12 ILE 38 2HG1 ILE 38 10.532 1.077 1.228
278 HG13 ILE 38 1HG1 ILE 38 10.610 1.966 2.745
279 HG21 ILE 38 1HG2 ILE 38 8.751 1.684 -0.481
280 HG22 ILE 38 2HG2 ILE 38 7.619 2.991 -0.124
281 HG23 ILE 38 3HG2 ILE 38 7.508 1.465 0.752
282 HD11 ILE 38 3HD1 ILE 38 8.420 0.071 1.927
283 HD12 ILE 38 1HD1 ILE 38 8.513 0.951 3.452
284 HD13 ILE 38 2HD1 ILE 38 9.722 -0.270 3.064
285 H THR 39 H THR 39 9.563 4.186 -1.686
286 HA THR 39 HA THR 39 8.328 6.830 -1.232
287 HB THR 39 HB THR 39 8.858 7.269 -3.632
288 HG1 THR 39 HG1 THR 39 10.026 5.802 -4.788
289 HG21 THR 39 3HG2 THR 39 11.267 7.579 -3.349
290 HG22 THR 39 1HG2 THR 39 11.257 6.487 -1.963
291 HG23 THR 39 2HG2 THR 39 10.406 8.028 -1.877
292 H GLU 40 H GLU 40 6.663 7.463 -2.870
293 HA GLU 40 HA GLU 40 4.516 5.637 -2.927
294 HB2 GLU 40 2HB GLU 40 4.876 8.136 -4.604
295 HB3 GLU 40 1HB GLU 40 3.361 7.291 -4.329
296 HG2 GLU 40 2HG GLU 40 3.118 8.932 -2.785
297 HG3 GLU 40 1HG GLU 40 3.974 7.761 -1.788
298 H ASP 41 H ASP 41 6.937 6.484 -5.355
299 HA ASP 41 HA ASP 41 5.737 5.096 -7.521
300 HB2 ASP 41 2HB ASP 41 8.031 5.215 -8.552
301 HB3 ASP 41 1HB ASP 41 7.384 6.762 -8.020
302 H MET 42 H MET 42 7.938 4.079 -4.963
303 HA MET 42 HA MET 42 8.460 1.464 -5.969
304 HB2 MET 42 2HB MET 42 9.836 2.519 -4.217
305 HB3 MET 42 1HB MET 42 8.465 2.501 -3.117
306 HG2 MET 42 2HG MET 42 8.461 0.050 -3.172
307 HG3 MET 42 1HG MET 42 9.859 0.080 -4.249
308 HE1 MET 42 3HE MET 42 11.186 -1.525 -2.563
309 HE2 MET 42 1HE MET 42 9.778 -1.555 -1.506
310 HE3 MET 42 2HE MET 42 11.369 -1.185 -0.844
311 H LEU 43 H LEU 43 6.076 2.784 -3.713
312 HA LEU 43 HA LEU 43 4.724 0.473 -2.990
313 HG LEU 43 HG LEU 43 5.427 3.043 -1.620
314 HB2 LEU 43 2HB LEU 43 3.670 3.275 -3.390
315 HB3 LEU 43 1HB LEU 43 2.767 1.990 -2.603
316 HD11 LEU 43 1HD1 LEU 43 4.151 4.174 0.132
317 HD12 LEU 43 2HD1 LEU 43 2.644 3.681 -0.643
318 HD13 LEU 43 3HD1 LEU 43 3.744 4.786 -1.471
319 HD21 LEU 43 3HD2 LEU 43 4.867 1.822 0.431
320 HD22 LEU 43 1HD2 LEU 43 4.985 0.741 -0.955
321 HD23 LEU 43 2HD2 LEU 43 3.402 1.206 -0.333
322 H ARG 44 H ARG 44 3.828 2.695 -5.700
323 HA ARG 44 HA ARG 44 1.730 1.049 -6.617
324 HE ARG 44 HE ARG 44 2.399 2.888 -10.819
325 HB2 ARG 44 2HB ARG 44 1.721 2.331 -8.662
326 HB3 ARG 44 1HB ARG 44 1.942 3.407 -7.296
327 HG2 ARG 44 2HG ARG 44 4.289 3.645 -7.803
328 HG3 ARG 44 1HG ARG 44 4.165 2.446 -9.094
329 HD2 ARG 44 2HD ARG 44 2.772 5.127 -8.997
330 HD3 ARG 44 1HD ARG 44 4.148 4.703 -10.015
331 HH11 ARG 44 1HH1 ARG 44 1.895 6.252 -10.242
332 HH12 ARG 44 2HH1 ARG 44 0.654 6.375 -11.434
333 HH21 ARG 44 1HH2 ARG 44 0.783 3.060 -12.317
334 HH22 ARG 44 2HH2 ARG 44 0.045 4.598 -12.614
335 H GLY 45 H GLY 45 5.182 0.999 -7.345
336 HA2 GLY 45 2HA GLY 45 5.218 -0.769 -9.504
337 HA3 GLY 45 1HA GLY 45 6.473 -0.662 -8.282
338 H ILE 46 H ILE 46 4.896 -1.469 -6.048
339 HA ILE 46 HA ILE 46 4.818 -4.343 -6.487
340 HB ILE 46 HB ILE 46 4.259 -2.747 -3.974
341 HG12 ILE 46 2HG1 ILE 46 6.767 -4.206 -4.859
342 HG13 ILE 46 1HG1 ILE 46 6.564 -2.458 -4.825
343 HG21 ILE 46 1HG2 ILE 46 4.579 -4.867 -2.784
344 HG22 ILE 46 2HG2 ILE 46 4.764 -5.708 -4.324
345 HG23 ILE 46 3HG2 ILE 46 3.222 -4.959 -3.905
346 HD11 ILE 46 3HD1 ILE 46 7.846 -3.253 -2.924
347 HD12 ILE 46 1HD1 ILE 46 6.502 -4.285 -2.433
348 HD13 ILE 46 2HD1 ILE 46 6.325 -2.529 -2.405
349 H PHE 47 H PHE 47 2.468 -1.829 -5.533
350 HA PHE 47 HA PHE 47 0.383 -3.782 -5.080
351 HD1 PHE 47 HD2 PHE 47 2.596 -1.520 -3.482
352 HD2 PHE 47 HD1 PHE 47 -1.424 -2.413 -2.383
353 HE1 PHE 47 HE2 PHE 47 3.304 -1.835 -1.147
354 HE2 PHE 47 HE1 PHE 47 -0.719 -2.727 -0.050
355 HZ PHE 47 HZ PHE 47 1.646 -2.436 0.572
356 HB2 PHE 47 2HB PHE 47 0.462 -0.774 -4.853
357 HB3 PHE 47 1HB PHE 47 -0.989 -1.715 -4.542
358 H GLU 48 H GLU 48 1.138 -1.507 -7.688
359 HA GLU 48 HA GLU 48 -1.474 -1.262 -8.716
360 HB2 GLU 48 2HB GLU 48 0.144 0.364 -9.358
361 HB3 GLU 48 1HB GLU 48 1.191 -0.861 -10.063
362 HG2 GLU 48 2HG GLU 48 -0.169 -1.146 -11.926
363 HG3 GLU 48 1HG GLU 48 -1.576 -0.446 -11.128
364 HA PRO 49 HA PRO 49 -0.070 -4.948 -11.838
365 HB2 PRO 49 2HB PRO 49 1.078 -6.489 -9.531
366 HB3 PRO 49 1HB PRO 49 1.473 -6.581 -11.253
367 HG2 PRO 49 2HG PRO 49 3.071 -5.256 -9.615
368 HG3 PRO 49 1HG PRO 49 2.693 -4.591 -11.217
369 HD2 PRO 49 2HD PRO 49 1.675 -3.766 -8.531
370 HD3 PRO 49 1HD PRO 49 2.023 -2.774 -9.961
371 H PHE 50 H PHE 50 -1.396 -4.888 -8.594
372 HA PHE 50 HA PHE 50 -2.980 -7.254 -8.837
373 HD1 PHE 50 HD2 PHE 50 -3.660 -8.448 -6.245
374 HD2 PHE 50 HD1 PHE 50 -0.863 -5.231 -6.139
375 HE1 PHE 50 HE2 PHE 50 -2.182 -9.781 -4.801
376 HE2 PHE 50 HE1 PHE 50 0.617 -6.563 -4.695
377 HZ PHE 50 HZ PHE 50 -0.041 -8.841 -4.022
378 HB2 PHE 50 2HB PHE 50 -3.105 -4.885 -6.970
379 HB3 PHE 50 1HB PHE 50 -4.302 -6.174 -6.911
380 H GLY 51 H GLY 51 -3.849 -3.767 -9.148
381 HA2 GLY 51 2HA GLY 51 -5.644 -4.344 -11.317
382 HA3 GLY 51 1HA GLY 51 -6.525 -4.091 -9.823
383 H ARG 52 H ARG 52 -3.624 -2.461 -11.022
384 HA ARG 52 HA ARG 52 -3.132 -0.316 -11.512
385 HE ARG 52 HE ARG 52 -3.620 3.003 -13.393
386 HB2 ARG 52 2HB ARG 52 -5.799 -0.677 -12.604
387 HB3 ARG 52 1HB ARG 52 -5.518 0.994 -12.134
388 HG2 ARG 52 2HG ARG 52 -3.199 0.415 -13.461
389 HG3 ARG 52 1HG ARG 52 -4.373 -0.562 -14.349
390 HD2 ARG 52 2HD ARG 52 -4.164 1.645 -15.354
391 HD3 ARG 52 1HD ARG 52 -5.777 1.436 -14.671
392 HH11 ARG 52 1HH1 ARG 52 -6.964 2.452 -14.044
393 HH12 ARG 52 2HH1 ARG 52 -7.475 3.846 -13.150
394 HH21 ARG 52 1HH2 ARG 52 -4.307 4.796 -12.246
395 HH22 ARG 52 2HH2 ARG 52 -5.999 5.155 -12.179
396 H ILE 53 H ILE 53 -2.902 1.674 -10.588
397 HA ILE 53 HA ILE 53 -4.536 2.192 -8.177
398 HB ILE 53 HB ILE 53 -1.593 2.735 -8.622
399 HG12 ILE 53 2HG1 ILE 53 -3.027 0.939 -6.643
400 HG13 ILE 53 1HG1 ILE 53 -2.241 0.387 -8.117
401 HG21 ILE 53 1HG2 ILE 53 -2.596 4.574 -7.363
402 HG22 ILE 53 2HG2 ILE 53 -1.568 3.594 -6.318
403 HG23 ILE 53 3HG2 ILE 53 -3.322 3.424 -6.238
404 HD11 ILE 53 3HD1 ILE 53 -0.095 1.194 -7.232
405 HD12 ILE 53 1HD1 ILE 53 -0.844 -0.049 -6.233
406 HD13 ILE 53 2HD1 ILE 53 -0.909 1.643 -5.734
407 H GLU 54 H GLU 54 -5.436 4.153 -7.956
408 HA GLU 54 HA GLU 54 -5.377 5.949 -10.227
409 HB2 GLU 54 2HB GLU 54 -6.953 5.938 -7.648
410 HB3 GLU 54 1HB GLU 54 -7.126 7.187 -8.876
411 HG2 GLU 54 2HG GLU 54 -7.556 4.253 -9.399
412 HG3 GLU 54 1HG GLU 54 -8.845 5.363 -8.954
413 H SER 55 H SER 55 -4.855 6.359 -6.716
414 HA SER 55 HA SER 55 -2.743 8.300 -7.228
415 HG SER 55 HG SER 55 -5.825 9.844 -5.053
416 HB2 SER 55 2HB SER 55 -3.746 10.037 -5.808
417 HB3 SER 55 1HB SER 55 -4.781 9.688 -7.192
418 H ILE 56 H ILE 56 -1.198 8.300 -5.653
419 HA ILE 56 HA ILE 56 -1.732 6.657 -3.264
420 HB ILE 56 HB ILE 56 0.940 7.349 -4.515
421 HG12 ILE 56 2HG1 ILE 56 -0.650 4.769 -4.411
422 HG13 ILE 56 1HG1 ILE 56 -0.301 5.727 -5.845
423 HG21 ILE 56 1HG2 ILE 56 1.102 7.160 -2.073
424 HG22 ILE 56 2HG2 ILE 56 1.901 5.803 -2.867
425 HG23 ILE 56 3HG2 ILE 56 0.311 5.583 -2.138
426 HD11 ILE 56 3HD1 ILE 56 2.061 5.209 -5.636
427 HD12 ILE 56 1HD1 ILE 56 1.095 3.735 -5.703
428 HD13 ILE 56 2HD1 ILE 56 1.743 4.294 -4.159
429 H GLN 57 H GLN 57 -2.116 7.740 -1.496
430 HA GLN 57 HA GLN 57 -1.049 10.449 -1.102
431 HB2 GLN 57 2HB GLN 57 -3.093 8.941 0.528
432 HB3 GLN 57 1HB GLN 57 -2.701 10.653 0.638
433 HG2 GLN 57 2HG GLN 57 -3.417 10.798 -1.807
434 HG3 GLN 57 1HG GLN 57 -4.127 9.203 -1.557
435 HE21 GLN 57 1HE2 GLN 57 -4.233 12.546 -0.654
436 HE22 GLN 57 2HE2 GLN 57 -5.795 12.500 0.047
437 H LEU 58 H LEU 58 0.861 10.547 0.046
438 HA LEU 58 HA LEU 58 1.474 8.322 1.863
439 HG LEU 58 HG LEU 58 4.199 9.586 2.938
440 HB2 LEU 58 2HB LEU 58 3.160 8.965 0.161
441 HB3 LEU 58 1HB LEU 58 3.281 10.549 0.906
442 HD11 LEU 58 1HD1 LEU 58 3.863 6.909 1.584
443 HD12 LEU 58 2HD1 LEU 58 2.945 7.497 2.971
444 HD13 LEU 58 3HD1 LEU 58 4.675 7.193 3.124
445 HD21 LEU 58 3HD2 LEU 58 6.307 8.683 2.072
446 HD22 LEU 58 1HD2 LEU 58 5.781 10.098 1.160
447 HD23 LEU 58 2HD2 LEU 58 5.567 8.482 0.484
448 H MET 59 H MET 59 1.700 8.557 4.046
449 HA MET 59 HA MET 59 0.461 10.985 5.092
450 HB2 MET 59 2HB MET 59 -0.486 8.754 5.651
451 HB3 MET 59 1HB MET 59 1.007 8.358 6.493
452 HG2 MET 59 2HG MET 59 -0.752 9.047 8.036
453 HG3 MET 59 1HG MET 59 0.620 10.153 8.077
454 HE1 MET 59 3HE MET 59 -0.892 11.962 9.343
455 HE2 MET 59 1HE MET 59 -2.254 10.844 9.293
456 HE3 MET 59 2HE MET 59 -2.457 12.508 8.744
457 H MET 60 H MET 60 1.974 12.484 5.310
458 HA MET 60 HA MET 60 4.079 12.003 7.308
459 HB2 MET 60 2HB MET 60 5.573 13.527 6.041
460 HB3 MET 60 1HB MET 60 5.201 12.057 5.156
461 HG2 MET 60 2HG MET 60 3.571 13.269 3.803
462 HG3 MET 60 1HG MET 60 3.912 14.744 4.707
463 HE1 MET 60 3HE MET 60 5.438 12.008 2.310
464 HE2 MET 60 1HE MET 60 6.577 12.040 3.656
465 HE3 MET 60 2HE MET 60 7.069 12.633 2.072
466 H ASP 61 H ASP 61 4.574 13.831 8.633
467 HA ASP 61 HA ASP 61 2.318 15.453 9.197
468 HB2 ASP 61 2HB ASP 61 5.165 15.556 10.214
469 HB3 ASP 61 1HB ASP 61 3.882 16.606 10.813
470 H SER 62 H SER 62 1.820 16.659 7.346
471 HA SER 62 HA SER 62 3.496 18.373 5.923
472 HG SER 62 HG SER 62 0.633 17.980 4.211
473 HB2 SER 62 2HB SER 62 0.563 18.797 6.586
474 HB3 SER 62 1HB SER 62 1.451 19.620 5.305
475 H GLU 63 H GLU 63 2.677 18.572 9.169
476 HA GLU 63 HA GLU 63 2.782 21.409 9.516
477 HB2 GLU 63 2HB GLU 63 1.721 19.639 11.062
478 HB3 GLU 63 1HB GLU 63 3.354 19.344 11.641
479 HG2 GLU 63 2HG GLU 63 2.276 20.847 13.149
480 HG3 GLU 63 1HG GLU 63 3.506 21.749 12.261
481 H THR 64 H THR 64 5.099 18.743 9.843
482 HA THR 64 HA THR 64 7.286 20.710 10.219
483 HB THR 64 HB THR 64 8.484 18.967 11.519
484 HG1 THR 64 HG1 THR 64 7.124 17.160 12.238
485 HG21 THR 64 3HG2 THR 64 5.728 19.622 12.594
486 HG22 THR 64 1HG2 THR 64 7.155 20.655 12.712
487 HG23 THR 64 2HG2 THR 64 7.116 19.105 13.555
488 H GLY 65 H GLY 65 6.058 18.618 8.004
489 HA2 GLY 65 2HA GLY 65 6.901 17.778 6.037
490 HA3 GLY 65 1HA GLY 65 8.414 18.588 6.407
491 H ARG 66 H ARG 66 7.152 16.311 8.720
492 HA ARG 66 HA ARG 66 9.452 14.568 8.142
493 HE ARG 66 HE ARG 66 11.102 18.050 9.635
494 HB2 ARG 66 2HB ARG 66 7.725 14.634 10.621
495 HB3 ARG 66 1HB ARG 66 9.242 13.767 10.419
496 HG2 ARG 66 2HG ARG 66 8.880 16.756 10.421
497 HG3 ARG 66 1HG ARG 66 9.577 15.782 11.714
498 HD2 ARG 66 2HD ARG 66 11.488 15.254 10.421
499 HD3 ARG 66 1HD ARG 66 10.736 15.836 8.937
500 HH11 ARG 66 1HH1 ARG 66 12.417 15.754 11.843
501 HH12 ARG 66 2HH1 ARG 66 13.394 16.934 12.642
502 HH21 ARG 66 1HH2 ARG 66 12.370 19.538 10.653
503 HH22 ARG 66 2HH2 ARG 66 13.398 19.045 11.953
504 H SER 67 H SER 67 9.274 12.322 8.060
505 HA SER 67 HA SER 67 6.761 11.393 6.913
506 HG SER 67 HG SER 67 9.440 10.367 4.878
507 HB2 SER 67 2HB SER 67 9.433 9.982 7.204
508 HB3 SER 67 1HB SER 67 8.044 9.353 6.321
509 H LYS 68 H LYS 68 5.293 10.133 7.930
510 HA LYS 68 HA LYS 68 5.767 9.448 10.714
511 HB2 LYS 68 2HB LYS 68 3.255 8.996 9.093
512 HB3 LYS 68 1HB LYS 68 3.405 9.012 10.845
513 HG2 LYS 68 2HG LYS 68 4.051 11.419 10.706
514 HG3 LYS 68 1HG LYS 68 3.711 11.359 8.977
515 HD2 LYS 68 2HD LYS 68 1.755 12.240 9.972
516 HD3 LYS 68 1HD LYS 68 1.377 10.556 9.611
517 HE2 LYS 68 2HE LYS 68 0.550 11.016 11.800
518 HE3 LYS 68 1HE LYS 68 1.983 10.006 11.988
519 HZ1 LYS 68 3HZ LYS 68 1.799 12.940 12.394
520 HZ2 LYS 68 1HZ LYS 68 3.257 12.079 12.397
521 HZ3 LYS 68 2HZ LYS 68 2.084 11.760 13.574
522 H GLY 69 H GLY 69 5.923 7.826 7.700
523 HA2 GLY 69 2HA GLY 69 7.066 5.734 7.576
524 HA3 GLY 69 1HA GLY 69 6.428 5.317 9.153
525 H TYR 70 H TYR 70 3.962 6.600 7.226
526 HA TYR 70 HA TYR 70 3.288 4.056 5.974
527 HD1 TYR 70 HD1 TYR 70 0.521 6.859 7.887
528 HD2 TYR 70 HD2 TYR 70 2.983 4.019 9.889
529 HE1 TYR 70 HE1 TYR 70 0.407 8.209 9.941
530 HE2 TYR 70 HE2 TYR 70 2.876 5.362 11.943
531 HH TYR 70 HH TYR 70 2.438 7.616 12.650
532 HB2 TYR 70 2HB TYR 70 0.847 4.517 7.016
533 HB3 TYR 70 1HB TYR 70 2.041 3.479 7.776
534 H GLY 71 H GLY 71 1.418 4.156 4.529
535 HA2 GLY 71 2HA GLY 71 0.714 6.853 3.574
536 HA3 GLY 71 1HA GLY 71 1.525 5.764 2.460
537 H PHE 72 H PHE 72 -1.214 6.973 2.416
538 HA PHE 72 HA PHE 72 -2.901 4.570 2.423
539 HD1 PHE 72 HD2 PHE 72 -2.507 8.075 4.265
540 HD2 PHE 72 HD1 PHE 72 -5.512 5.061 4.012
541 HE1 PHE 72 HE2 PHE 72 -2.798 8.163 6.703
542 HE2 PHE 72 HE1 PHE 72 -5.806 5.149 6.453
543 HZ PHE 72 HZ PHE 72 -4.447 6.700 7.801
544 HB2 PHE 72 2HB PHE 72 -3.587 7.504 2.125
545 HB3 PHE 72 1HB PHE 72 -4.764 6.201 2.038
546 H ILE 73 H ILE 73 -2.934 3.444 0.559
547 HA ILE 73 HA ILE 73 -2.465 4.838 -1.991
548 HB ILE 73 HB ILE 73 -2.459 1.868 -1.399
549 HG12 ILE 73 2HG1 ILE 73 -0.146 3.770 -1.891
550 HG13 ILE 73 1HG1 ILE 73 -0.604 3.116 -0.325
551 HG21 ILE 73 1HG2 ILE 73 -1.638 3.351 -3.904
552 HG22 ILE 73 2HG2 ILE 73 -3.078 2.352 -3.720
553 HG23 ILE 73 3HG2 ILE 73 -1.478 1.615 -3.632
554 HD11 ILE 73 3HD1 ILE 73 0.365 1.522 -2.690
555 HD12 ILE 73 1HD1 ILE 73 -0.099 0.862 -1.119
556 HD13 ILE 73 2HD1 ILE 73 1.298 1.933 -1.250
557 H THR 74 H THR 74 -4.061 5.191 -3.393
558 HA THR 74 HA THR 74 -6.701 3.978 -2.895
559 HB THR 74 HB THR 74 -6.040 6.387 -4.615
560 HG1 THR 74 HG1 THR 74 -5.890 7.351 -2.737
561 HG21 THR 74 3HG2 THR 74 -8.463 6.828 -4.500
562 HG22 THR 74 1HG2 THR 74 -8.690 5.321 -3.614
563 HG23 THR 74 2HG2 THR 74 -8.117 5.287 -5.284
564 H PHE 75 H PHE 75 -7.356 2.368 -4.182
565 HA PHE 75 HA PHE 75 -5.953 1.862 -6.717
566 HD1 PHE 75 HD1 PHE 75 -6.069 0.817 -3.157
567 HD2 PHE 75 HD2 PHE 75 -4.885 -1.365 -6.621
568 HE1 PHE 75 HE1 PHE 75 -4.033 0.077 -1.995
569 HE2 PHE 75 HE2 PHE 75 -2.848 -2.106 -5.458
570 HZ PHE 75 HZ PHE 75 -2.423 -1.386 -3.143
571 HB2 PHE 75 2HB PHE 75 -7.700 0.077 -5.002
572 HB3 PHE 75 1HB PHE 75 -7.007 -0.414 -6.543
573 H SER 76 H SER 76 -7.059 1.292 -8.628
574 HA SER 76 HA SER 76 -9.431 2.827 -9.124
575 HG SER 76 HG SER 76 -9.406 2.897 -12.008
576 HB2 SER 76 2HB SER 76 -7.691 2.519 -10.843
577 HB3 SER 76 1HB SER 76 -8.025 0.791 -10.880
578 H ASP 77 H ASP 77 -8.758 -0.515 -8.409
579 HA ASP 77 HA ASP 77 -11.622 -1.174 -8.684
580 HB2 ASP 77 2HB ASP 77 -10.090 -2.422 -10.197
581 HB3 ASP 77 1HB ASP 77 -9.249 -3.055 -8.786
582 H SER 78 H SER 78 -12.702 -1.871 -6.893
583 HA SER 78 HA SER 78 -11.544 -1.523 -4.323
584 HG SER 78 HG SER 78 -13.032 -2.216 -2.606
585 HB2 SER 78 2HB SER 78 -13.917 -1.125 -4.660
586 HB3 SER 78 1HB SER 78 -14.170 -2.807 -5.116
587 H GLU 79 H GLU 79 -12.641 -4.473 -6.002
588 HA GLU 79 HA GLU 79 -11.913 -6.328 -4.038
589 HB2 GLU 79 2HB GLU 79 -12.148 -6.577 -7.039
590 HB3 GLU 79 1HB GLU 79 -11.778 -7.952 -6.010
591 HG2 GLU 79 2HG GLU 79 -14.143 -7.875 -6.574
592 HG3 GLU 79 1HG GLU 79 -13.894 -7.683 -4.841
593 H CYS 80 H CYS 80 -10.003 -4.829 -6.593
594 HA CYS 80 HA CYS 80 -7.630 -6.297 -6.402
595 HG CYS 80 HG CYS 80 -5.333 -4.184 -5.970
596 HB2 CYS 80 2HB CYS 80 -7.783 -4.731 -8.174
597 HB3 CYS 80 1HB CYS 80 -8.142 -3.400 -7.077
598 H ALA 81 H ALA 81 -8.636 -3.426 -4.546
599 HA ALA 81 HA ALA 81 -6.271 -3.214 -3.001
600 HB1 ALA 81 3HB ALA 81 -9.066 -2.278 -2.330
601 HB2 ALA 81 1HB ALA 81 -7.863 -1.369 -3.242
602 HB3 ALA 81 2HB ALA 81 -7.578 -1.745 -1.545
603 H LYS 82 H LYS 82 -9.352 -4.876 -2.427
604 HA LYS 82 HA LYS 82 -8.789 -5.749 0.201
605 HB2 LYS 82 2HB LYS 82 -11.051 -5.670 -0.796
606 HB3 LYS 82 1HB LYS 82 -10.618 -7.000 -1.861
607 HG2 LYS 82 2HG LYS 82 -10.522 -8.540 -0.077
608 HG3 LYS 82 1HG LYS 82 -10.514 -7.254 1.134
609 HD2 LYS 82 2HD LYS 82 -12.698 -8.352 1.026
610 HD3 LYS 82 1HD LYS 82 -12.815 -6.663 0.536
611 HE2 LYS 82 2HE LYS 82 -14.144 -8.048 -0.946
612 HE3 LYS 82 1HE LYS 82 -12.776 -7.374 -1.830
613 HZ1 LYS 82 3HZ LYS 82 -13.123 -9.707 -2.347
614 HZ2 LYS 82 1HZ LYS 82 -12.918 -10.123 -0.719
615 HZ3 LYS 82 2HZ LYS 82 -11.625 -9.476 -1.596
616 H LYS 83 H LYS 83 -8.122 -7.219 -2.956
617 HA LYS 83 HA LYS 83 -7.008 -9.635 -1.912
618 HB2 LYS 83 2HB LYS 83 -7.787 -9.570 -4.206
619 HB3 LYS 83 1HB LYS 83 -6.660 -8.276 -4.594
620 HG2 LYS 83 2HG LYS 83 -4.775 -9.814 -4.173
621 HG3 LYS 83 1HG LYS 83 -5.929 -11.110 -3.851
622 HD2 LYS 83 2HD LYS 83 -6.766 -10.988 -6.118
623 HD3 LYS 83 1HD LYS 83 -5.753 -9.581 -6.452
624 HE2 LYS 83 2HE LYS 83 -3.747 -10.973 -6.073
625 HE3 LYS 83 1HE LYS 83 -4.786 -12.375 -5.816
626 HZ1 LYS 83 3HZ LYS 83 -3.848 -12.173 -8.096
627 HZ2 LYS 83 1HZ LYS 83 -4.767 -10.770 -8.312
628 HZ3 LYS 83 2HZ LYS 83 -5.536 -12.251 -8.055
629 H ALA 84 H ALA 84 -5.510 -6.648 -3.186
630 HA ALA 84 HA ALA 84 -2.836 -7.258 -2.837
631 HB1 ALA 84 3HB ALA 84 -4.160 -4.574 -2.398
632 HB2 ALA 84 1HB ALA 84 -3.619 -5.221 -3.948
633 HB3 ALA 84 2HB ALA 84 -2.441 -4.839 -2.694
634 H LEU 85 H LEU 85 -5.093 -5.900 -0.459
635 HA LEU 85 HA LEU 85 -3.404 -5.737 1.753
636 HG LEU 85 HG LEU 85 -4.703 -5.320 3.934
637 HB2 LEU 85 2HB LEU 85 -5.725 -4.860 1.610
638 HB3 LEU 85 1HB LEU 85 -6.341 -6.496 1.684
639 HD11 LEU 85 1HD1 LEU 85 -7.704 -5.209 3.615
640 HD12 LEU 85 2HD1 LEU 85 -6.600 -3.834 3.525
641 HD13 LEU 85 3HD1 LEU 85 -6.788 -4.715 5.040
642 HD21 LEU 85 3HD2 LEU 85 -6.713 -7.576 3.822
643 HD22 LEU 85 1HD2 LEU 85 -5.929 -6.983 5.285
644 HD23 LEU 85 2HD2 LEU 85 -4.968 -7.733 4.014
645 H GLU 86 H GLU 86 -5.525 -8.428 0.809
646 HA GLU 86 HA GLU 86 -4.921 -10.223 2.826
647 HB2 GLU 86 2HB GLU 86 -6.437 -10.215 0.465
648 HB3 GLU 86 1HB GLU 86 -5.327 -11.560 0.258
649 HG2 GLU 86 2HG GLU 86 -7.177 -11.168 2.608
650 HG3 GLU 86 1HG GLU 86 -7.479 -12.225 1.231
651 H GLN 87 H GLN 87 -3.100 -9.528 -0.105
652 HA GLN 87 HA GLN 87 -1.418 -11.884 0.166
653 HB2 GLN 87 2HB GLN 87 -1.199 -9.593 -1.803
654 HB3 GLN 87 1HB GLN 87 -0.400 -11.154 -1.922
655 HG2 GLN 87 2HG GLN 87 -3.374 -10.680 -2.056
656 HG3 GLN 87 1HG GLN 87 -2.315 -10.989 -3.428
657 HE21 GLN 87 1HE2 GLN 87 -1.550 -13.060 -3.772
658 HE22 GLN 87 2HE2 GLN 87 -2.200 -14.438 -2.960
659 H LEU 88 H LEU 88 -1.200 -8.418 0.771
660 HA LEU 88 HA LEU 88 1.696 -8.666 1.229
661 HG LEU 88 HG LEU 88 0.191 -7.570 -1.278
662 HB2 LEU 88 2HB LEU 88 0.028 -6.192 0.776
663 HB3 LEU 88 1HB LEU 88 1.777 -6.240 0.928
664 HD11 LEU 88 1HD1 LEU 88 0.085 -5.162 -1.479
665 HD12 LEU 88 2HD1 LEU 88 1.130 -5.835 -2.729
666 HD13 LEU 88 3HD1 LEU 88 1.838 -5.044 -1.319
667 HD21 LEU 88 3HD2 LEU 88 3.173 -7.254 -0.902
668 HD22 LEU 88 1HD2 LEU 88 2.383 -7.904 -2.341
669 HD23 LEU 88 2HD2 LEU 88 2.257 -8.759 -0.802
670 H ASN 89 H ASN 89 -1.144 -8.486 3.037
671 HA ASN 89 HA ASN 89 -0.383 -6.837 5.199
672 HB2 ASN 89 2HB ASN 89 -2.689 -7.600 4.863
673 HB3 ASN 89 1HB ASN 89 -2.202 -9.259 5.181
674 HD21 ASN 89 1HD2 ASN 89 -2.899 -6.169 6.571
675 HD22 ASN 89 2HD2 ASN 89 -2.896 -6.691 8.218
676 H GLY 90 H GLY 90 1.631 -7.134 6.031
677 HA2 GLY 90 2HA GLY 90 2.844 -8.152 7.839
678 HA3 GLY 90 1HA GLY 90 2.168 -9.705 7.380
679 H PHE 91 H PHE 91 2.995 -8.309 4.539
680 HA PHE 91 HA PHE 91 5.204 -10.028 4.075
681 HD1 PHE 91 HD1 PHE 91 5.565 -10.949 1.476
682 HD2 PHE 91 HD2 PHE 91 5.933 -6.704 1.356
683 HE1 PHE 91 HE1 PHE 91 7.371 -11.153 -0.185
684 HE2 PHE 91 HE2 PHE 91 7.739 -6.904 -0.304
685 HZ PHE 91 HZ PHE 91 8.457 -9.128 -1.076
686 HB2 PHE 91 2HB PHE 91 3.730 -9.383 2.261
687 HB3 PHE 91 1HB PHE 91 4.119 -7.684 2.491
688 H GLU 92 H GLU 92 7.377 -9.712 4.313
689 HA GLU 92 HA GLU 92 8.399 -7.418 5.654
690 HB2 GLU 92 2HB GLU 92 9.904 -9.582 4.167
691 HB3 GLU 92 1HB GLU 92 10.616 -8.417 5.273
692 HG2 GLU 92 2HG GLU 92 9.227 -9.344 7.095
693 HG3 GLU 92 1HG GLU 92 8.616 -10.560 5.973
694 H LEU 93 H LEU 93 8.261 -5.504 4.628
695 HA LEU 93 HA LEU 93 9.475 -5.284 1.945
696 HG LEU 93 HG LEU 93 8.920 -2.220 1.679
697 HB2 LEU 93 2HB LEU 93 7.103 -4.620 2.033
698 HB3 LEU 93 1HB LEU 93 7.478 -3.445 3.282
699 HD11 LEU 93 1HD1 LEU 93 7.897 -4.244 -0.315
700 HD12 LEU 93 2HD1 LEU 93 9.562 -4.056 0.235
701 HD13 LEU 93 3HD1 LEU 93 8.799 -2.781 -0.715
702 HD21 LEU 93 3HD2 LEU 93 6.089 -2.669 0.709
703 HD22 LEU 93 1HD2 LEU 93 7.112 -1.286 0.316
704 HD23 LEU 93 2HD2 LEU 93 6.583 -1.548 1.979
705 H ALA 94 H ALA 94 11.314 -4.149 1.756
706 HA ALA 94 HA ALA 94 13.184 -2.980 2.320
707 HB1 ALA 94 3HB ALA 94 12.867 -0.835 3.447
708 HB2 ALA 94 1HB ALA 94 11.235 -1.313 3.918
709 HB3 ALA 94 2HB ALA 94 11.634 -1.092 2.214
710 H GLY 95 H GLY 95 12.202 -5.205 4.082
711 HA2 GLY 95 2HA GLY 95 13.620 -6.295 5.645
712 HA3 GLY 95 1HA GLY 95 14.127 -4.731 6.259
713 H ARG 96 H ARG 96 11.052 -4.080 6.209
714 HA ARG 96 HA ARG 96 10.507 -5.365 8.812
715 HE ARG 96 HE ARG 96 10.985 -1.750 12.363
716 HB2 ARG 96 2HB ARG 96 10.188 -2.539 7.905
717 HB3 ARG 96 1HB ARG 96 9.020 -3.168 9.060
718 HG2 ARG 96 2HG ARG 96 10.740 -3.658 10.647
719 HG3 ARG 96 1HG ARG 96 12.004 -3.268 9.478
720 HD2 ARG 96 2HD ARG 96 11.556 -0.970 9.582
721 HD3 ARG 96 1HD ARG 96 9.953 -1.219 10.267
722 HH11 ARG 96 1HH1 ARG 96 13.187 -0.492 10.024
723 HH12 ARG 96 2HH1 ARG 96 14.300 0.045 11.228
724 HH21 ARG 96 1HH2 ARG 96 12.411 -1.044 13.866
725 HH22 ARG 96 2HH2 ARG 96 13.855 -0.229 13.375
726 HA PRO 97 HA PRO 97 6.761 -7.153 7.159
727 HB2 PRO 97 2HB PRO 97 5.706 -6.559 9.893
728 HB3 PRO 97 1HB PRO 97 5.703 -8.080 8.991
729 HG2 PRO 97 2HG PRO 97 7.410 -7.695 11.003
730 HG3 PRO 97 1HG PRO 97 7.910 -8.560 9.537
731 HD2 PRO 97 2HD PRO 97 8.528 -5.762 10.393
732 HD3 PRO 97 1HD PRO 97 9.553 -6.938 9.543
733 H MET 98 H MET 98 5.061 -6.270 6.080
734 HA MET 98 HA MET 98 4.651 -3.400 6.469
735 HB2 MET 98 2HB MET 98 5.375 -4.114 4.259
736 HB3 MET 98 1HB MET 98 4.004 -5.207 4.129
737 HG2 MET 98 2HG MET 98 2.473 -3.412 3.954
738 HG3 MET 98 1HG MET 98 3.689 -2.234 4.440
739 HE1 MET 98 3HE MET 98 2.698 -4.821 1.594
740 HE2 MET 98 1HE MET 98 4.374 -5.214 1.983
741 HE3 MET 98 2HE MET 98 3.974 -4.498 0.420
742 H LYS 99 H LYS 99 2.921 -2.662 7.434
743 HA LYS 99 HA LYS 99 0.691 -4.424 8.051
744 HB2 LYS 99 2HB LYS 99 1.373 -1.599 8.914
745 HB3 LYS 99 1HB LYS 99 -0.023 -2.500 9.500
746 HG2 LYS 99 2HG LYS 99 1.461 -4.170 10.484
747 HG3 LYS 99 1HG LYS 99 2.863 -3.302 9.856
748 HD2 LYS 99 2HD LYS 99 2.282 -1.354 11.226
749 HD3 LYS 99 1HD LYS 99 0.862 -2.201 11.843
750 HE2 LYS 99 2HE LYS 99 3.736 -3.058 12.222
751 HE3 LYS 99 1HE LYS 99 2.731 -2.262 13.432
752 HZ1 LYS 99 3HZ LYS 99 2.747 -4.601 13.844
753 HZ2 LYS 99 1HZ LYS 99 2.291 -4.950 12.254
754 HZ3 LYS 99 2HZ LYS 99 1.207 -4.179 13.295
755 H VAL 100 H VAL 100 -0.527 -4.627 6.162
756 HA VAL 100 HA VAL 100 -1.553 -2.166 4.915
757 HB VAL 100 HB VAL 100 -1.844 -5.003 3.904
758 HG11 VAL 100 1HG1 VAL 100 -3.484 -3.432 3.006
759 HG12 VAL 100 2HG1 VAL 100 -2.337 -3.922 1.759
760 HG13 VAL 100 3HG1 VAL 100 -2.190 -2.338 2.520
761 HG21 VAL 100 3HG2 VAL 100 0.248 -2.949 3.150
762 HG22 VAL 100 1HG2 VAL 100 0.010 -4.515 2.368
763 HG23 VAL 100 2HG2 VAL 100 0.531 -4.440 4.051
764 H GLY 101 H GLY 101 -3.432 -1.456 5.759
765 HA2 GLY 101 2HA GLY 101 -5.660 -3.382 5.988
766 HA3 GLY 101 1HA GLY 101 -5.308 -2.324 7.346
767 H HIS 102 H HIS 102 -7.547 -2.634 5.117
768 HA HIS 102 HA HIS 102 -7.561 -0.207 3.670
769 HD1 HIS 102 HD1 HIS 102 -11.577 -0.912 5.311
770 HD2 HIS 102 HD2 HIS 102 -9.352 -4.309 4.437
771 HE1 HIS 102 HE1 HIS 102 -12.679 -2.780 6.569
772 HE2 HIS 102 HE2 HIS 102 -11.478 -4.849 5.798
773 HB2 HIS 102 2HB HIS 102 -9.973 -0.669 3.256
774 HB3 HIS 102 1HB HIS 102 -8.922 -2.031 2.897
775 H VAL 103 H VAL 103 -7.224 1.593 4.861
776 HA VAL 103 HA VAL 103 -7.516 3.297 6.336
777 HB VAL 103 HB VAL 103 -10.454 2.697 5.913
778 HG11 VAL 103 1HG1 VAL 103 -9.038 5.235 6.742
779 HG12 VAL 103 2HG1 VAL 103 -10.108 4.251 7.742
780 HG13 VAL 103 3HG1 VAL 103 -10.753 5.113 6.347
781 HG21 VAL 103 3HG2 VAL 103 -9.296 2.915 3.774
782 HG22 VAL 103 1HG2 VAL 103 -8.581 4.441 4.297
783 HG23 VAL 103 2HG2 VAL 103 -10.326 4.318 4.062
784 H THR 104 H THR 104 -6.616 2.372 8.195
785 HA THR 104 HA THR 104 -8.114 0.634 9.903
786 HB THR 104 HB THR 104 -5.764 0.298 9.897
787 HG1 THR 104 HG1 THR 104 -5.623 0.018 12.010
788 HG21 THR 104 3HG2 THR 104 -5.046 2.552 9.227
789 HG22 THR 104 1HG2 THR 104 -4.140 1.978 10.628
790 HG23 THR 104 2HG2 THR 104 -5.436 3.156 10.838
791 H GLU 105 H GLU 105 -9.995 1.956 10.265
792 HA GLU 105 HA GLU 105 -9.690 4.083 12.253
793 HB2 GLU 105 2HB GLU 105 -12.136 2.970 10.860
794 HB3 GLU 105 1HB GLU 105 -12.181 4.270 12.042
795 HG2 GLU 105 2HG GLU 105 -10.636 4.394 9.457
796 HG3 GLU 105 1HG GLU 105 -12.276 5.004 9.660
797 H ARG 106 H ARG 106 -11.925 1.314 12.017
798 HA ARG 106 HA ARG 106 -12.482 -0.363 13.438
799 HE ARG 106 HE ARG 106 -13.523 -1.377 15.375
800 HB2 ARG 106 2HB ARG 106 -10.103 -0.754 13.771
801 HB3 ARG 106 1HB ARG 106 -10.035 0.507 14.989
802 HG2 ARG 106 2HG ARG 106 -10.012 -1.664 16.045
803 HG3 ARG 106 1HG ARG 106 -11.507 -0.820 16.444
804 HD2 ARG 106 2HD ARG 106 -11.324 -2.837 14.210
805 HD3 ARG 106 1HD ARG 106 -11.701 -3.287 15.872
806 HH11 ARG 106 1HH1 ARG 106 -12.603 -4.182 13.614
807 HH12 ARG 106 2HH1 ARG 106 -14.180 -4.422 12.954
808 HH21 ARG 106 1HH2 ARG 106 -15.537 -1.667 14.500
809 HH22 ARG 106 2HH2 ARG 106 -15.820 -3.002 13.435
810 H THR 107 H THR 107 -11.393 2.380 15.468
811 HA THR 107 HA THR 107 -13.113 2.038 17.603
812 HB THR 107 HB THR 107 -12.114 4.670 16.480
813 HG1 THR 107 HG1 THR 107 -10.279 4.209 17.461
814 HG21 THR 107 3HG2 THR 107 -12.430 5.537 18.760
815 HG22 THR 107 1HG2 THR 107 -13.126 3.992 19.253
816 HG23 THR 107 2HG2 THR 107 -13.962 4.999 18.070
817 H ASP 108 H ASP 108 -15.250 2.037 17.756
818 HA ASP 108 HA ASP 108 -16.941 2.988 15.636
819 HB2 ASP 108 2HB ASP 108 -17.478 0.955 16.922
820 HB3 ASP 108 1HB ASP 108 -17.657 1.924 18.383
Start of MODEL 8
1 HA MET 1 HA MET 1 -20.648 -20.127 20.408
2 H1 MET 1 1H MET 1 -22.665 -19.034 20.999
3 H2 MET 1 2H MET 1 -23.367 -19.386 19.505
4 H3 MET 1 3H MET 1 -22.051 -18.327 19.590
5 HB2 MET 1 2HB MET 1 -22.517 -21.457 21.373
6 HB3 MET 1 1HB MET 1 -23.036 -21.873 19.748
7 HG2 MET 1 2HG MET 1 -20.977 -23.076 19.354
8 HG3 MET 1 1HG MET 1 -20.355 -22.579 20.926
9 HE1 MET 1 3HE MET 1 -22.671 -24.523 23.403
10 HE2 MET 1 1HE MET 1 -22.948 -22.889 22.798
11 HE3 MET 1 2HE MET 1 -21.317 -23.405 23.230
12 H GLY 2 H GLY 2 -22.694 -19.451 17.717
13 HA2 GLY 2 2HA GLY 2 -20.840 -20.739 15.831
14 HA3 GLY 2 1HA GLY 2 -22.373 -19.984 15.425
15 H HIS 3 H HIS 3 -21.139 -18.903 13.689
16 HA HIS 3 HA HIS 3 -19.859 -16.461 14.732
17 HD1 HIS 3 HD1 HIS 3 -18.470 -20.198 13.137
18 HD2 HIS 3 HD2 HIS 3 -19.163 -17.332 10.210
19 HE1 HIS 3 HE1 HIS 3 -18.642 -21.466 10.984
20 HE2 HIS 3 HE2 HIS 3 -19.221 -19.735 9.258
21 HB2 HIS 3 2HB HIS 3 -18.308 -16.493 12.760
22 HB3 HIS 3 1HB HIS 3 -18.035 -17.782 13.921
23 H HIS 4 H HIS 4 -21.598 -15.129 14.453
24 HA HIS 4 HA HIS 4 -22.305 -14.530 11.647
25 HD1 HIS 4 HD1 HIS 4 -25.293 -15.505 10.606
26 HD2 HIS 4 HD2 HIS 4 -23.953 -17.453 14.026
27 HE1 HIS 4 HE1 HIS 4 -25.877 -17.921 10.277
28 HE2 HIS 4 HE2 HIS 4 -25.230 -19.038 12.431
29 HB2 HIS 4 2HB HIS 4 -24.189 -14.603 14.019
30 HB3 HIS 4 1HB HIS 4 -24.604 -13.907 12.457
31 H HIS 5 H HIS 5 -22.029 -12.433 11.085
32 HA HIS 5 HA HIS 5 -21.012 -10.579 13.066
33 HD1 HIS 5 HD1 HIS 5 -18.228 -9.280 11.359
34 HD2 HIS 5 HD2 HIS 5 -19.982 -12.761 9.905
35 HE1 HIS 5 HE1 HIS 5 -16.322 -10.800 10.764
36 HE2 HIS 5 HE2 HIS 5 -17.401 -12.845 9.763
37 HB2 HIS 5 2HB HIS 5 -21.497 -10.245 10.092
38 HB3 HIS 5 1HB HIS 5 -20.702 -9.056 11.117
39 H HIS 6 H HIS 6 -21.939 -8.642 13.721
40 HA HIS 6 HA HIS 6 -24.795 -8.250 13.041
41 HD1 HIS 6 HD1 HIS 6 -22.994 -9.929 16.702
42 HD2 HIS 6 HD2 HIS 6 -26.650 -9.736 14.732
43 HE1 HIS 6 HE1 HIS 6 -24.127 -12.121 17.158
44 HE2 HIS 6 HE2 HIS 6 -26.260 -12.040 15.835
45 HB2 HIS 6 2HB HIS 6 -23.384 -7.697 15.667
46 HB3 HIS 6 1HB HIS 6 -25.065 -7.303 15.320
47 H HIS 7 H HIS 7 -22.023 -7.064 12.167
48 HA HIS 7 HA HIS 7 -22.205 -4.277 12.829
49 HD1 HIS 7 HD1 HIS 7 -18.924 -3.405 13.055
50 HD2 HIS 7 HD2 HIS 7 -20.698 -3.017 9.321
51 HE1 HIS 7 HE1 HIS 7 -18.163 -1.185 12.180
52 HE2 HIS 7 HE2 HIS 7 -19.469 -0.866 10.061
53 HB2 HIS 7 2HB HIS 7 -20.074 -5.499 12.326
54 HB3 HIS 7 1HB HIS 7 -20.577 -5.604 10.643
55 H HIS 8 H HIS 8 -23.241 -2.689 11.788
56 HA HIS 8 HA HIS 8 -24.399 -1.494 10.262
57 HD1 HIS 8 HD1 HIS 8 -23.735 0.303 7.931
58 HD2 HIS 8 HD2 HIS 8 -24.990 -3.278 6.234
59 HE1 HIS 8 HE1 HIS 8 -25.074 0.950 5.910
60 HE2 HIS 8 HE2 HIS 8 -25.892 -1.226 4.948
61 HB2 HIS 8 2HB HIS 8 -22.483 -1.852 8.804
62 HB3 HIS 8 1HB HIS 8 -23.131 -3.402 8.284
63 H SER 9 H SER 9 -26.484 -1.881 10.851
64 HA SER 9 HA SER 9 -27.984 -3.763 9.139
65 HG SER 9 HG SER 9 -27.664 -5.119 12.429
66 HB2 SER 9 2HB SER 9 -28.489 -3.205 12.078
67 HB3 SER 9 1HB SER 9 -29.566 -4.133 11.036
68 H HIS 10 H HIS 10 -28.788 -1.240 11.539
69 HA HIS 10 HA HIS 10 -30.170 0.565 11.486
70 HD1 HIS 10 HD1 HIS 10 -29.703 3.116 11.620
71 HD2 HIS 10 HD2 HIS 10 -30.614 2.897 7.569
72 HE1 HIS 10 HE1 HIS 10 -30.843 5.284 11.064
73 HE2 HIS 10 HE2 HIS 10 -31.226 5.194 8.580
74 HB2 HIS 10 2HB HIS 10 -28.283 1.293 9.992
75 HB3 HIS 10 1HB HIS 10 -29.256 0.807 8.608
76 H MET 11 H MET 11 -31.367 -1.969 10.831
77 HA MET 11 HA MET 11 -33.284 -2.924 10.118
78 HB2 MET 11 2HB MET 11 -34.296 -0.987 11.285
79 HB3 MET 11 1HB MET 11 -34.274 -0.084 9.776
80 HG2 MET 11 2HG MET 11 -36.484 -1.015 10.260
81 HG3 MET 11 1HG MET 11 -35.807 -1.670 8.767
82 HE1 MET 11 3HE MET 11 -37.458 -3.743 8.694
83 HE2 MET 11 1HE MET 11 -38.273 -3.052 10.098
84 HE3 MET 11 2HE MET 11 -37.805 -4.751 10.099
85 H ALA 12 H ALA 12 -33.298 -0.045 7.989
86 HA ALA 12 HA ALA 12 -32.834 -1.777 5.666
87 HB1 ALA 12 3HB ALA 12 -34.712 -0.829 4.437
88 HB2 ALA 12 1HB ALA 12 -35.157 0.153 5.834
89 HB3 ALA 12 2HB ALA 12 -35.277 -1.604 5.915
90 H ALA 13 H ALA 13 -30.938 -0.896 4.987
91 HA ALA 13 HA ALA 13 -30.494 1.964 4.978
92 HB1 ALA 13 3HB ALA 13 -28.671 0.391 5.478
93 HB2 ALA 13 1HB ALA 13 -28.289 1.430 4.105
94 HB3 ALA 13 2HB ALA 13 -28.778 -0.243 3.837
95 H ALA 14 H ALA 14 -29.411 2.850 2.848
96 HA ALA 14 HA ALA 14 -29.604 3.535 0.694
97 HB1 ALA 14 3HB ALA 14 -30.365 1.986 -1.031
98 HB2 ALA 14 1HB ALA 14 -30.987 0.897 0.209
99 HB3 ALA 14 2HB ALA 14 -29.252 1.195 0.087
100 H MET 15 H MET 15 -32.071 3.371 2.757
101 HA MET 15 HA MET 15 -34.134 4.355 0.902
102 HB2 MET 15 2HB MET 15 -34.335 3.643 3.843
103 HB3 MET 15 1HB MET 15 -35.674 4.135 2.815
104 HG2 MET 15 2HG MET 15 -34.007 1.657 2.426
105 HG3 MET 15 1HG MET 15 -35.600 1.709 3.180
106 HE1 MET 15 3HE MET 15 -34.845 -0.212 0.722
107 HE2 MET 15 1HE MET 15 -36.300 -0.047 -0.262
108 HE3 MET 15 2HE MET 15 -36.432 -0.176 1.492
109 H ALA 16 H ALA 16 -34.323 6.511 0.646
110 HA ALA 16 HA ALA 16 -34.040 8.361 2.853
111 HB1 ALA 16 3HB ALA 16 -32.004 8.443 0.615
112 HB2 ALA 16 1HB ALA 16 -31.685 7.978 2.285
113 HB3 ALA 16 2HB ALA 16 -32.168 9.632 1.910
114 H ASN 17 H ASN 17 -33.724 10.730 1.574
115 HA ASN 17 HA ASN 17 -36.167 11.060 0.092
116 HB2 ASN 17 2HB ASN 17 -35.274 13.489 -0.076
117 HB3 ASN 17 1HB ASN 17 -35.693 12.852 1.512
118 HD21 ASN 17 1HD2 ASN 17 -34.072 12.363 2.966
119 HD22 ASN 17 2HD2 ASN 17 -32.458 12.954 2.779
120 H ASN 18 H ASN 18 -33.306 9.880 -0.925
121 HA ASN 18 HA ASN 18 -33.862 10.667 -3.700
122 HB2 ASN 18 2HB ASN 18 -31.421 10.831 -4.165
123 HB3 ASN 18 1HB ASN 18 -31.984 12.064 -3.040
124 HD21 ASN 18 1HD2 ASN 18 -31.328 11.991 -0.914
125 HD22 ASN 18 2HD2 ASN 18 -30.041 10.972 -0.369
126 H LEU 19 H LEU 19 -32.192 9.180 -5.129
127 HA LEU 19 HA LEU 19 -33.066 6.458 -4.477
128 HG LEU 19 HG LEU 19 -34.208 8.441 -6.688
129 HB2 LEU 19 2HB LEU 19 -31.925 7.627 -7.027
130 HB3 LEU 19 1HB LEU 19 -32.467 5.970 -6.837
131 HD11 LEU 19 1HD1 LEU 19 -35.227 7.537 -8.734
132 HD12 LEU 19 2HD1 LEU 19 -34.028 6.244 -8.751
133 HD13 LEU 19 3HD1 LEU 19 -33.521 7.921 -8.955
134 HD21 LEU 19 3HD2 LEU 19 -34.958 5.527 -6.438
135 HD22 LEU 19 1HD2 LEU 19 -36.087 6.881 -6.520
136 HD23 LEU 19 2HD2 LEU 19 -34.995 6.726 -5.144
137 H GLN 20 H GLN 20 -31.017 7.332 -2.881
138 HA GLN 20 HA GLN 20 -29.087 6.588 -1.982
139 HB2 GLN 20 2HB GLN 20 -29.613 4.345 -2.784
140 HB3 GLN 20 1HB GLN 20 -28.964 4.730 -4.367
141 HG2 GLN 20 2HG GLN 20 -27.298 3.456 -3.373
142 HG3 GLN 20 1HG GLN 20 -26.732 5.109 -3.179
143 HE21 GLN 20 1HE2 GLN 20 -28.544 5.661 -0.915
144 HE22 GLN 20 2HE2 GLN 20 -27.888 4.799 0.421
145 H LYS 21 H LYS 21 -29.143 7.720 -5.249
146 HA LYS 21 HA LYS 21 -27.891 9.267 -6.328
147 HB2 LYS 21 2HB LYS 21 -27.729 10.343 -4.071
148 HB3 LYS 21 1HB LYS 21 -26.227 9.469 -3.807
149 HG2 LYS 21 2HG LYS 21 -25.270 10.617 -5.798
150 HG3 LYS 21 1HG LYS 21 -26.759 11.558 -5.919
151 HD2 LYS 21 2HD LYS 21 -24.792 11.549 -3.623
152 HD3 LYS 21 1HD LYS 21 -25.097 12.866 -4.756
153 HE2 LYS 21 2HE LYS 21 -27.062 11.755 -2.743
154 HE3 LYS 21 1HE LYS 21 -26.197 13.283 -2.613
155 HZ1 LYS 21 3HZ LYS 21 -28.399 13.697 -3.390
156 HZ2 LYS 21 1HZ LYS 21 -28.242 12.575 -4.646
157 HZ3 LYS 21 2HZ LYS 21 -27.333 13.997 -4.666
158 H GLY 22 H GLY 22 -25.469 7.584 -4.295
159 HA2 GLY 22 2HA GLY 22 -24.438 6.056 -6.489
160 HA3 GLY 22 1HA GLY 22 -23.407 7.429 -6.110
161 H SER 23 H SER 23 -23.202 4.366 -5.789
162 HA SER 23 HA SER 23 -22.756 4.204 -2.886
163 HG SER 23 HG SER 23 -23.318 1.072 -5.418
164 HB2 SER 23 2HB SER 23 -22.599 1.762 -3.250
165 HB3 SER 23 1HB SER 23 -24.117 2.423 -3.857
166 H ALA 24 H ALA 24 -20.936 5.362 -5.176
167 HA ALA 24 HA ALA 24 -18.710 5.738 -5.411
168 HB1 ALA 24 3HB ALA 24 -18.375 4.004 -2.960
169 HB2 ALA 24 1HB ALA 24 -18.622 5.752 -2.965
170 HB3 ALA 24 2HB ALA 24 -17.153 5.067 -3.660
171 H GLY 25 H GLY 25 -16.467 4.113 -5.166
172 HA2 GLY 25 2HA GLY 25 -16.952 1.548 -6.389
173 HA3 GLY 25 1HA GLY 25 -16.394 2.754 -7.536
174 HA PRO 26 HA PRO 26 -12.107 2.301 -6.307
175 HB2 PRO 26 2HB PRO 26 -12.010 5.010 -5.078
176 HB3 PRO 26 1HB PRO 26 -11.017 4.320 -6.366
177 HG2 PRO 26 2HG PRO 26 -12.898 6.127 -6.922
178 HG3 PRO 26 1HG PRO 26 -12.611 4.753 -8.007
179 HD2 PRO 26 2HD PRO 26 -14.798 5.157 -5.995
180 HD3 PRO 26 1HD PRO 26 -14.882 4.460 -7.629
181 H MET 27 H MET 27 -10.683 1.879 -4.543
182 HA MET 27 HA MET 27 -11.891 2.086 -1.853
183 HB2 MET 27 2HB MET 27 -12.109 -0.211 -2.594
184 HB3 MET 27 1HB MET 27 -10.408 -0.274 -3.031
185 HG2 MET 27 2HG MET 27 -10.964 -1.419 -0.897
186 HG3 MET 27 1HG MET 27 -9.739 -0.159 -0.743
187 HE1 MET 27 3HE MET 27 -11.566 0.131 2.692
188 HE2 MET 27 1HE MET 27 -10.015 -0.049 1.872
189 HE3 MET 27 2HE MET 27 -11.206 -1.347 1.798
190 H ARG 28 H ARG 28 -10.446 2.325 -0.096
191 HA ARG 28 HA ARG 28 -7.761 3.304 -0.866
192 HE ARG 28 HE ARG 28 -6.814 7.560 2.656
193 HB2 ARG 28 2HB ARG 28 -9.381 5.107 -0.358
194 HB3 ARG 28 1HB ARG 28 -9.619 4.428 1.245
195 HG2 ARG 28 2HG ARG 28 -7.361 4.964 1.873
196 HG3 ARG 28 1HG ARG 28 -6.975 5.461 0.221
197 HD2 ARG 28 2HD ARG 28 -8.666 7.256 0.392
198 HD3 ARG 28 1HD ARG 28 -8.985 6.777 2.057
199 HH11 ARG 28 1HH1 ARG 28 -7.710 8.289 -0.591
200 HH12 ARG 28 2HH1 ARG 28 -6.614 9.620 -0.714
201 HH21 ARG 28 1HH2 ARG 28 -5.436 9.286 2.502
202 HH22 ARG 28 2HH2 ARG 28 -5.364 10.208 1.042
203 H LEU 29 H LEU 29 -6.133 2.240 0.091
204 HA LEU 29 HA LEU 29 -6.693 0.645 2.507
205 HG LEU 29 HG LEU 29 -6.552 -0.495 -0.485
206 HB2 LEU 29 2HB LEU 29 -4.478 0.353 0.471
207 HB3 LEU 29 1HB LEU 29 -4.684 -0.657 1.888
208 HD11 LEU 29 1HD1 LEU 29 -4.489 -1.727 -0.918
209 HD12 LEU 29 2HD1 LEU 29 -5.873 -2.816 -0.852
210 HD13 LEU 29 3HD1 LEU 29 -4.766 -2.717 0.517
211 HD21 LEU 29 3HD2 LEU 29 -7.841 -0.817 1.562
212 HD22 LEU 29 1HD2 LEU 29 -6.782 -2.147 2.041
213 HD23 LEU 29 2HD2 LEU 29 -7.807 -2.303 0.615
214 H TYR 30 H TYR 30 -5.473 0.804 4.321
215 HA TYR 30 HA TYR 30 -3.539 2.982 4.558
216 HD1 TYR 30 HD1 TYR 30 -3.173 4.405 7.036
217 HD2 TYR 30 HD2 TYR 30 -3.276 0.263 8.016
218 HE1 TYR 30 HE1 TYR 30 -1.483 4.781 8.787
219 HE2 TYR 30 HE2 TYR 30 -1.590 0.627 9.764
220 HH TYR 30 HH TYR 30 -0.695 3.730 10.851
221 HB2 TYR 30 2HB TYR 30 -5.098 2.878 6.363
222 HB3 TYR 30 1HB TYR 30 -4.890 1.142 6.544
223 H VAL 31 H VAL 31 -1.432 2.578 4.133
224 HA VAL 31 HA VAL 31 -0.369 -0.138 4.659
225 HB VAL 31 HB VAL 31 0.550 1.803 2.521
226 HG11 VAL 31 1HG1 VAL 31 2.382 0.417 3.377
227 HG12 VAL 31 2HG1 VAL 31 1.962 -0.035 1.725
228 HG13 VAL 31 3HG1 VAL 31 1.433 -1.039 3.076
229 HG21 VAL 31 3HG2 VAL 31 -1.630 0.854 1.970
230 HG22 VAL 31 1HG2 VAL 31 -1.020 -0.774 2.267
231 HG23 VAL 31 2HG2 VAL 31 -0.386 0.175 0.920
232 H GLY 32 H GLY 32 0.797 -0.044 6.492
233 HA2 GLY 32 2HA GLY 32 2.619 2.246 6.924
234 HA3 GLY 32 1HA GLY 32 1.964 1.230 8.199
235 H SER 33 H SER 33 4.552 1.716 6.040
236 HA SER 33 HA SER 33 6.216 -0.184 7.354
237 HG SER 33 HG SER 33 6.872 -2.677 6.014
238 HB2 SER 33 2HB SER 33 4.960 -1.789 5.973
239 HB3 SER 33 1HB SER 33 5.397 -0.897 4.517
240 H LEU 34 H LEU 34 6.035 2.658 6.127
241 HA LEU 34 HA LEU 34 8.121 2.628 4.101
242 HG LEU 34 HG LEU 34 4.919 3.773 4.619
243 HB2 LEU 34 2HB LEU 34 6.846 5.095 5.254
244 HB3 LEU 34 1HB LEU 34 7.568 4.879 3.670
245 HD11 LEU 34 1HD1 LEU 34 3.983 5.220 2.890
246 HD12 LEU 34 2HD1 LEU 34 5.601 5.819 2.512
247 HD13 LEU 34 3HD1 LEU 34 4.884 6.143 4.093
248 HD21 LEU 34 3HD2 LEU 34 6.260 3.396 1.940
249 HD22 LEU 34 1HD2 LEU 34 4.632 2.877 2.370
250 HD23 LEU 34 2HD2 LEU 34 6.027 2.149 3.163
251 H HIS 35 H HIS 35 9.949 1.971 5.443
252 HA HIS 35 HA HIS 35 10.691 3.673 7.646
253 HD1 HIS 35 HD1 HIS 35 14.385 2.323 5.960
254 HD2 HIS 35 HD2 HIS 35 11.375 -0.522 5.638
255 HE1 HIS 35 HE1 HIS 35 15.217 0.655 4.282
256 HE2 HIS 35 HE2 HIS 35 13.509 -1.186 4.340
257 HB2 HIS 35 2HB HIS 35 12.643 2.281 7.937
258 HB3 HIS 35 1HB HIS 35 11.218 1.285 7.710
259 H PHE 36 H PHE 36 10.498 5.568 6.124
260 HA PHE 36 HA PHE 36 11.482 7.447 5.326
261 HD1 PHE 36 HD2 PHE 36 12.231 9.495 6.566
262 HD2 PHE 36 HD1 PHE 36 15.852 7.467 5.588
263 HE1 PHE 36 HE2 PHE 36 13.321 11.657 6.119
264 HE2 PHE 36 HE1 PHE 36 16.942 9.626 5.143
265 HZ PHE 36 HZ PHE 36 15.680 11.723 5.406
266 HB2 PHE 36 2HB PHE 36 12.864 7.054 7.374
267 HB3 PHE 36 1HB PHE 36 14.051 6.234 6.370
268 H ASN 37 H ASN 37 11.782 4.690 3.717
269 HA ASN 37 HA ASN 37 13.462 5.880 1.595
270 HB2 ASN 37 2HB ASN 37 14.490 3.929 2.984
271 HB3 ASN 37 1HB ASN 37 13.392 2.902 2.076
272 HD21 ASN 37 1HD2 ASN 37 13.672 4.546 -0.385
273 HD22 ASN 37 2HD2 ASN 37 15.226 4.154 -1.004
274 H ILE 38 H ILE 38 10.720 3.835 2.409
275 HA ILE 38 HA ILE 38 10.134 3.038 -0.273
276 HB ILE 38 HB ILE 38 8.149 3.002 1.999
277 HG12 ILE 38 2HG1 ILE 38 10.242 2.043 2.869
278 HG13 ILE 38 1HG1 ILE 38 9.021 0.795 2.652
279 HG21 ILE 38 1HG2 ILE 38 8.570 1.186 -0.380
280 HG22 ILE 38 2HG2 ILE 38 7.312 2.411 -0.215
281 HG23 ILE 38 3HG2 ILE 38 7.315 1.003 0.847
282 HD11 ILE 38 3HD1 ILE 38 11.299 1.351 0.766
283 HD12 ILE 38 1HD1 ILE 38 10.102 0.065 0.609
284 HD13 ILE 38 2HD1 ILE 38 11.235 0.056 1.959
285 H THR 39 H THR 39 9.550 4.537 -1.734
286 HA THR 39 HA THR 39 7.824 6.789 -0.964
287 HB THR 39 HB THR 39 8.445 7.757 -3.155
288 HG1 THR 39 HG1 THR 39 10.364 6.482 -4.112
289 HG21 THR 39 3HG2 THR 39 10.805 8.190 -2.657
290 HG22 THR 39 1HG2 THR 39 10.836 6.820 -1.548
291 HG23 THR 39 2HG2 THR 39 9.843 8.232 -1.181
292 H GLU 40 H GLU 40 6.403 7.526 -2.978
293 HA GLU 40 HA GLU 40 4.309 5.681 -3.272
294 HB2 GLU 40 2HB GLU 40 4.898 8.039 -5.085
295 HB3 GLU 40 1HB GLU 40 3.354 7.223 -4.900
296 HG2 GLU 40 2HG GLU 40 2.890 8.889 -3.490
297 HG3 GLU 40 1HG GLU 40 3.839 7.958 -2.336
298 H ASP 41 H ASP 41 6.929 6.563 -5.496
299 HA ASP 41 HA ASP 41 6.126 5.010 -7.696
300 HB2 ASP 41 2HB ASP 41 7.850 6.787 -7.783
301 HB3 ASP 41 1HB ASP 41 8.936 5.772 -6.842
302 H MET 42 H MET 42 8.020 4.209 -4.837
303 HA MET 42 HA MET 42 8.868 1.611 -5.634
304 HB2 MET 42 2HB MET 42 9.816 3.082 -3.782
305 HB3 MET 42 1HB MET 42 8.436 2.612 -2.805
306 HG2 MET 42 2HG MET 42 10.433 0.675 -3.954
307 HG3 MET 42 1HG MET 42 10.533 1.361 -2.334
308 HE1 MET 42 3HE MET 42 10.707 -1.643 -2.530
309 HE2 MET 42 1HE MET 42 9.494 -2.214 -1.384
310 HE3 MET 42 2HE MET 42 10.509 -0.830 -0.977
311 H LEU 43 H LEU 43 6.301 2.653 -3.387
312 HA LEU 43 HA LEU 43 5.032 0.213 -2.962
313 HG LEU 43 HG LEU 43 5.607 2.551 -1.285
314 HB2 LEU 43 2HB LEU 43 3.866 3.003 -3.098
315 HB3 LEU 43 1HB LEU 43 3.000 1.607 -2.480
316 HD11 LEU 43 1HD1 LEU 43 4.286 3.648 0.454
317 HD12 LEU 43 2HD1 LEU 43 2.807 3.284 -0.435
318 HD13 LEU 43 3HD1 LEU 43 4.009 4.375 -1.128
319 HD21 LEU 43 3HD2 LEU 43 4.871 1.247 0.647
320 HD22 LEU 43 1HD2 LEU 43 4.975 0.238 -0.794
321 HD23 LEU 43 2HD2 LEU 43 3.403 0.783 -0.212
322 H ARG 44 H ARG 44 4.462 2.607 -5.516
323 HA ARG 44 HA ARG 44 2.273 1.400 -6.754
324 HE ARG 44 HE ARG 44 1.268 3.457 -11.212
325 HB2 ARG 44 2HB ARG 44 3.166 3.707 -7.199
326 HB3 ARG 44 1HB ARG 44 4.462 2.971 -8.133
327 HG2 ARG 44 2HG ARG 44 2.846 2.059 -9.704
328 HG3 ARG 44 1HG ARG 44 1.521 2.723 -8.747
329 HD2 ARG 44 2HD ARG 44 2.508 5.000 -9.119
330 HD3 ARG 44 1HD ARG 44 3.645 4.255 -10.244
331 HH11 ARG 44 1HH1 ARG 44 2.494 6.540 -10.285
332 HH12 ARG 44 2HH1 ARG 44 1.496 7.405 -11.398
333 HH21 ARG 44 1HH2 ARG 44 -0.011 4.561 -12.633
334 HH22 ARG 44 2HH2 ARG 44 0.084 6.285 -12.718
335 H GLY 45 H GLY 45 5.761 1.018 -7.463
336 HA2 GLY 45 2HA GLY 45 5.563 -0.814 -9.559
337 HA3 GLY 45 1HA GLY 45 6.913 -0.723 -8.437
338 H ILE 46 H ILE 46 5.293 -1.369 -6.085
339 HA ILE 46 HA ILE 46 5.295 -4.249 -6.324
340 HB ILE 46 HB ILE 46 4.442 -2.499 -4.010
341 HG12 ILE 46 2HG1 ILE 46 7.079 -3.920 -4.499
342 HG13 ILE 46 1HG1 ILE 46 6.809 -2.190 -4.697
343 HG21 ILE 46 1HG2 ILE 46 4.753 -4.511 -2.628
344 HG22 ILE 46 2HG2 ILE 46 5.070 -5.455 -4.084
345 HG23 ILE 46 3HG2 ILE 46 3.483 -4.730 -3.832
346 HD11 ILE 46 3HD1 ILE 46 7.903 -2.674 -2.593
347 HD12 ILE 46 1HD1 ILE 46 6.571 -3.730 -2.123
348 HD13 ILE 46 2HD1 ILE 46 6.298 -1.997 -2.320
349 H PHE 47 H PHE 47 2.741 -1.855 -5.558
350 HA PHE 47 HA PHE 47 0.719 -3.899 -5.359
351 HD1 PHE 47 HD2 PHE 47 2.493 -1.326 -3.415
352 HD2 PHE 47 HD1 PHE 47 -1.458 -2.872 -3.028
353 HE1 PHE 47 HE2 PHE 47 2.852 -1.636 -1.000
354 HE2 PHE 47 HE1 PHE 47 -1.104 -3.179 -0.616
355 HZ PHE 47 HZ PHE 47 1.050 -2.561 0.401
356 HB2 PHE 47 2HB PHE 47 0.650 -0.895 -5.127
357 HB3 PHE 47 1HB PHE 47 -0.809 -1.872 -5.039
358 H GLU 48 H GLU 48 1.637 -1.571 -7.858
359 HA GLU 48 HA GLU 48 -0.860 -1.402 -9.137
360 HB2 GLU 48 2HB GLU 48 1.027 0.186 -9.465
361 HB3 GLU 48 1HB GLU 48 1.828 -1.021 -10.460
362 HG2 GLU 48 2HG GLU 48 0.379 -0.734 -12.220
363 HG3 GLU 48 1HG GLU 48 -0.955 -0.255 -11.180
364 HA PRO 49 HA PRO 49 0.936 -5.169 -12.001
365 HB2 PRO 49 2HB PRO 49 1.750 -6.562 -9.464
366 HB3 PRO 49 1HB PRO 49 2.356 -6.785 -11.112
367 HG2 PRO 49 2HG PRO 49 3.758 -5.362 -9.367
368 HG3 PRO 49 1HG PRO 49 3.623 -4.832 -11.054
369 HD2 PRO 49 2HD PRO 49 2.309 -3.735 -8.613
370 HD3 PRO 49 1HD PRO 49 2.821 -2.897 -10.092
371 H PHE 50 H PHE 50 -0.621 -5.089 -8.814
372 HA PHE 50 HA PHE 50 -2.292 -7.354 -9.187
373 HD1 PHE 50 HD2 PHE 50 -0.296 -5.457 -6.431
374 HD2 PHE 50 HD1 PHE 50 -3.410 -8.363 -6.507
375 HE1 PHE 50 HE2 PHE 50 0.921 -6.804 -4.770
376 HE2 PHE 50 HE1 PHE 50 -2.196 -9.710 -4.846
377 HZ PHE 50 HZ PHE 50 -0.034 -8.933 -3.971
378 HB2 PHE 50 2HB PHE 50 -2.489 -4.942 -7.387
379 HB3 PHE 50 1HB PHE 50 -3.759 -6.156 -7.429
380 H GLY 51 H GLY 51 -3.234 -3.879 -9.333
381 HA2 GLY 51 2HA GLY 51 -4.815 -4.304 -11.703
382 HA3 GLY 51 1HA GLY 51 -5.798 -4.189 -10.257
383 H ARG 52 H ARG 52 -2.839 -2.365 -10.915
384 HA ARG 52 HA ARG 52 -2.427 -0.208 -11.520
385 HE ARG 52 HE ARG 52 -2.784 3.010 -15.186
386 HB2 ARG 52 2HB ARG 52 -4.129 -0.621 -13.279
387 HB3 ARG 52 1HB ARG 52 -5.373 -0.048 -12.180
388 HG2 ARG 52 2HG ARG 52 -4.853 1.705 -13.708
389 HG3 ARG 52 1HG ARG 52 -4.232 2.160 -12.125
390 HD2 ARG 52 2HD ARG 52 -1.988 1.617 -12.772
391 HD3 ARG 52 1HD ARG 52 -2.543 0.899 -14.283
392 HH11 ARG 52 1HH1 ARG 52 -1.961 3.244 -11.847
393 HH12 ARG 52 2HH1 ARG 52 -1.780 4.963 -11.902
394 HH21 ARG 52 1HH2 ARG 52 -2.460 5.201 -15.264
395 HH22 ARG 52 2HH2 ARG 52 -2.033 6.053 -13.818
396 H ILE 53 H ILE 53 -1.985 1.417 -10.155
397 HA ILE 53 HA ILE 53 -3.646 1.939 -7.835
398 HB ILE 53 HB ILE 53 -0.930 2.801 -8.730
399 HG12 ILE 53 2HG1 ILE 53 -0.406 2.317 -6.331
400 HG13 ILE 53 1HG1 ILE 53 -2.100 1.912 -6.082
401 HG21 ILE 53 1HG2 ILE 53 -1.931 4.970 -8.313
402 HG22 ILE 53 2HG2 ILE 53 -0.800 4.573 -7.020
403 HG23 ILE 53 3HG2 ILE 53 -2.536 4.420 -6.748
404 HD11 ILE 53 3HD1 ILE 53 -1.889 0.084 -7.684
405 HD12 ILE 53 1HD1 ILE 53 -0.755 -0.072 -6.343
406 HD13 ILE 53 2HD1 ILE 53 -0.188 0.493 -7.913
407 H GLU 54 H GLU 54 -4.907 3.705 -7.454
408 HA GLU 54 HA GLU 54 -5.445 5.545 -9.659
409 HB2 GLU 54 2HB GLU 54 -7.247 4.442 -8.215
410 HB3 GLU 54 1HB GLU 54 -6.726 5.499 -6.909
411 HG2 GLU 54 2HG GLU 54 -7.702 6.506 -9.578
412 HG3 GLU 54 1HG GLU 54 -8.757 6.231 -8.197
413 H SER 55 H SER 55 -4.659 5.793 -6.183
414 HA SER 55 HA SER 55 -2.821 8.000 -6.683
415 HG SER 55 HG SER 55 -5.459 9.039 -7.185
416 HB2 SER 55 2HB SER 55 -5.346 8.304 -5.045
417 HB3 SER 55 1HB SER 55 -3.945 9.342 -4.797
418 H ILE 56 H ILE 56 -1.209 8.188 -5.131
419 HA ILE 56 HA ILE 56 -1.423 6.432 -2.756
420 HB ILE 56 HB ILE 56 1.110 7.074 -4.292
421 HG12 ILE 56 2HG1 ILE 56 -0.442 4.481 -4.021
422 HG13 ILE 56 1HG1 ILE 56 -0.316 5.456 -5.480
423 HG21 ILE 56 1HG2 ILE 56 1.518 6.875 -1.893
424 HG22 ILE 56 2HG2 ILE 56 2.199 5.495 -2.750
425 HG23 ILE 56 3HG2 ILE 56 0.684 5.322 -1.863
426 HD11 ILE 56 3HD1 ILE 56 1.930 3.988 -4.111
427 HD12 ILE 56 1HD1 ILE 56 2.097 5.012 -5.538
428 HD13 ILE 56 2HD1 ILE 56 1.132 3.538 -5.619
429 H GLN 57 H GLN 57 -1.705 7.682 -1.020
430 HA GLN 57 HA GLN 57 -0.392 10.327 -0.919
431 HB2 GLN 57 2HB GLN 57 -2.799 9.370 0.656
432 HB3 GLN 57 1HB GLN 57 -2.153 11.007 0.618
433 HG2 GLN 57 2HG GLN 57 -3.406 9.533 -1.698
434 HG3 GLN 57 1HG GLN 57 -4.161 10.808 -0.745
435 HE21 GLN 57 1HE2 GLN 57 -1.701 12.393 -0.594
436 HE22 GLN 57 2HE2 GLN 57 -1.485 13.080 -2.159
437 H LEU 58 H LEU 58 1.417 10.320 0.303
438 HA LEU 58 HA LEU 58 1.624 8.427 2.546
439 HG LEU 58 HG LEU 58 3.190 8.619 -0.410
440 HB2 LEU 58 2HB LEU 58 3.789 10.154 1.338
441 HB3 LEU 58 1HB LEU 58 4.010 8.849 2.487
442 HD11 LEU 58 1HD1 LEU 58 5.571 7.560 1.109
443 HD12 LEU 58 2HD1 LEU 58 5.574 8.914 -0.023
444 HD13 LEU 58 3HD1 LEU 58 5.225 7.283 -0.598
445 HD21 LEU 58 3HD2 LEU 58 1.849 7.040 0.857
446 HD22 LEU 58 1HD2 LEU 58 3.289 6.446 1.685
447 HD23 LEU 58 2HD2 LEU 58 3.097 6.186 -0.047
448 H MET 59 H MET 59 2.029 9.083 4.667
449 HA MET 59 HA MET 59 1.231 11.845 5.218
450 HB2 MET 59 2HB MET 59 1.540 9.530 7.145
451 HB3 MET 59 1HB MET 59 0.807 11.090 7.496
452 HG2 MET 59 2HG MET 59 -0.915 10.586 5.760
453 HG3 MET 59 1HG MET 59 -0.223 8.969 5.627
454 HE1 MET 59 3HE MET 59 -0.657 11.178 8.882
455 HE2 MET 59 1HE MET 59 -2.226 10.614 9.453
456 HE3 MET 59 2HE MET 59 -2.110 11.519 7.944
457 H MET 60 H MET 60 2.924 13.201 5.145
458 HA MET 60 HA MET 60 5.248 12.608 6.876
459 HB2 MET 60 2HB MET 60 5.253 14.161 4.271
460 HB3 MET 60 1HB MET 60 6.648 13.902 5.313
461 HG2 MET 60 2HG MET 60 6.470 11.481 4.916
462 HG3 MET 60 1HG MET 60 5.114 11.775 3.829
463 HE1 MET 60 3HE MET 60 6.058 14.475 2.357
464 HE2 MET 60 1HE MET 60 5.306 13.099 1.546
465 HE3 MET 60 2HE MET 60 6.810 13.776 0.922
466 H ASP 61 H ASP 61 6.158 14.373 8.009
467 HA ASP 61 HA ASP 61 4.410 16.715 8.306
468 HB2 ASP 61 2HB ASP 61 5.082 15.465 10.336
469 HB3 ASP 61 1HB ASP 61 6.767 15.799 9.970
470 H SER 62 H SER 62 4.913 18.485 7.155
471 HA SER 62 HA SER 62 7.331 18.544 5.622
472 HG SER 62 HG SER 62 4.327 21.286 5.380
473 HB2 SER 62 2HB SER 62 6.383 20.667 4.687
474 HB3 SER 62 1HB SER 62 5.277 19.296 4.593
475 H GLU 63 H GLU 63 6.440 19.901 8.649
476 HA GLU 63 HA GLU 63 8.187 22.162 8.609
477 HB2 GLU 63 2HB GLU 63 7.086 20.645 10.993
478 HB3 GLU 63 1HB GLU 63 7.794 22.255 11.027
479 HG2 GLU 63 2HG GLU 63 5.307 21.533 9.487
480 HG3 GLU 63 1HG GLU 63 5.304 22.202 11.117
481 H THR 64 H THR 64 8.430 19.220 10.607
482 HA THR 64 HA THR 64 11.177 18.747 9.869
483 HB THR 64 HB THR 64 11.596 20.572 11.377
484 HG1 THR 64 HG1 THR 64 12.158 18.205 12.849
485 HG21 THR 64 3HG2 THR 64 10.004 19.033 13.435
486 HG22 THR 64 1HG2 THR 64 9.514 20.537 12.657
487 HG23 THR 64 2HG2 THR 64 10.907 20.517 13.740
488 H GLY 65 H GLY 65 8.357 17.483 10.540
489 HA2 GLY 65 2HA GLY 65 9.195 15.370 12.396
490 HA3 GLY 65 1HA GLY 65 7.588 15.587 11.716
491 H ARG 66 H ARG 66 8.613 15.907 9.008
492 HA ARG 66 HA ARG 66 9.168 14.751 7.147
493 HE ARG 66 HE ARG 66 14.443 15.435 9.905
494 HB2 ARG 66 2HB ARG 66 10.890 13.033 8.946
495 HB3 ARG 66 1HB ARG 66 11.109 13.337 7.225
496 HG2 ARG 66 2HG ARG 66 11.518 15.742 7.756
497 HG3 ARG 66 1HG ARG 66 11.437 15.338 9.471
498 HD2 ARG 66 2HD ARG 66 13.305 13.677 9.023
499 HD3 ARG 66 1HD ARG 66 13.472 14.427 7.436
500 HH11 ARG 66 1HH1 ARG 66 13.141 16.471 6.882
501 HH12 ARG 66 2HH1 ARG 66 13.902 18.015 6.962
502 HH21 ARG 66 1HH2 ARG 66 15.393 17.420 10.008
503 HH22 ARG 66 2HH2 ARG 66 15.141 18.562 8.733
504 H SER 67 H SER 67 9.752 11.972 6.788
505 HA SER 67 HA SER 67 7.207 10.923 6.397
506 HG SER 67 HG SER 67 9.381 9.488 4.240
507 HB2 SER 67 2HB SER 67 9.836 9.443 6.676
508 HB3 SER 67 1HB SER 67 8.360 8.754 5.997
509 H LYS 68 H LYS 68 5.723 10.432 7.923
510 HA LYS 68 HA LYS 68 6.378 9.615 10.578
511 HB2 LYS 68 2HB LYS 68 3.800 9.696 9.018
512 HB3 LYS 68 1HB LYS 68 3.862 8.994 10.629
513 HG2 LYS 68 2HG LYS 68 4.686 11.133 11.520
514 HG3 LYS 68 1HG LYS 68 4.586 11.834 9.903
515 HD2 LYS 68 2HD LYS 68 2.225 11.673 9.868
516 HD3 LYS 68 1HD LYS 68 2.200 10.585 11.257
517 HE2 LYS 68 2HE LYS 68 1.465 12.830 11.877
518 HE3 LYS 68 1HE LYS 68 2.957 12.398 12.705
519 HZ1 LYS 68 3HZ LYS 68 2.826 14.076 10.262
520 HZ2 LYS 68 1HZ LYS 68 4.197 13.766 11.206
521 HZ3 LYS 68 2HZ LYS 68 2.925 14.684 11.834
522 H GLY 69 H GLY 69 5.782 7.832 7.621
523 HA2 GLY 69 2HA GLY 69 6.975 5.676 7.536
524 HA3 GLY 69 1HA GLY 69 6.345 5.345 9.137
525 H TYR 70 H TYR 70 3.781 6.706 7.661
526 HA TYR 70 HA TYR 70 2.909 4.247 6.322
527 HD1 TYR 70 HD2 TYR 70 0.398 7.207 7.881
528 HD2 TYR 70 HD1 TYR 70 2.535 4.620 10.503
529 HE1 TYR 70 HE2 TYR 70 0.184 8.862 9.686
530 HE2 TYR 70 HE1 TYR 70 2.325 6.268 12.314
531 HH TYR 70 HH TYR 70 1.915 8.572 12.678
532 HB2 TYR 70 2HB TYR 70 0.633 4.618 7.517
533 HB3 TYR 70 1HB TYR 70 1.941 3.836 8.390
534 H GLY 71 H GLY 71 1.210 4.447 4.829
535 HA2 GLY 71 2HA GLY 71 0.193 7.114 4.195
536 HA3 GLY 71 1HA GLY 71 1.181 6.338 2.967
537 H PHE 72 H PHE 72 -1.516 7.099 2.594
538 HA PHE 72 HA PHE 72 -3.006 4.569 2.620
539 HD1 PHE 72 HD2 PHE 72 -5.482 4.788 4.205
540 HD2 PHE 72 HD1 PHE 72 -3.173 8.368 4.178
541 HE1 PHE 72 HE2 PHE 72 -5.830 5.032 6.628
542 HE2 PHE 72 HE1 PHE 72 -3.518 8.611 6.598
543 HZ PHE 72 HZ PHE 72 -4.850 6.945 7.826
544 HB2 PHE 72 2HB PHE 72 -3.966 7.400 2.117
545 HB3 PHE 72 1HB PHE 72 -4.992 5.969 2.118
546 H ILE 73 H ILE 73 -3.062 3.386 0.815
547 HA ILE 73 HA ILE 73 -2.567 4.681 -1.786
548 HB ILE 73 HB ILE 73 -2.408 1.749 -1.044
549 HG12 ILE 73 2HG1 ILE 73 -0.220 3.750 -1.688
550 HG13 ILE 73 1HG1 ILE 73 -0.605 3.148 -0.083
551 HG21 ILE 73 1HG2 ILE 73 -1.716 3.123 -3.651
552 HG22 ILE 73 2HG2 ILE 73 -3.094 2.054 -3.377
553 HG23 ILE 73 3HG2 ILE 73 -1.453 1.418 -3.280
554 HD11 ILE 73 3HD1 ILE 73 1.343 2.034 -0.981
555 HD12 ILE 73 1HD1 ILE 73 0.420 1.511 -2.390
556 HD13 ILE 73 2HD1 ILE 73 0.015 0.888 -0.791
557 H THR 74 H THR 74 -4.271 5.088 -2.994
558 HA THR 74 HA THR 74 -6.791 3.640 -2.563
559 HB THR 74 HB THR 74 -6.321 6.210 -4.102
560 HG1 THR 74 HG1 THR 74 -6.430 7.153 -2.222
561 HG21 THR 74 3HG2 THR 74 -8.312 5.033 -4.878
562 HG22 THR 74 1HG2 THR 74 -8.776 6.463 -3.954
563 HG23 THR 74 2HG2 THR 74 -8.885 4.862 -3.218
564 H PHE 75 H PHE 75 -7.448 2.155 -3.972
565 HA PHE 75 HA PHE 75 -6.345 2.086 -6.705
566 HD1 PHE 75 HD2 PHE 75 -6.168 0.279 -3.272
567 HD2 PHE 75 HD1 PHE 75 -5.006 -0.826 -7.219
568 HE1 PHE 75 HE2 PHE 75 -4.009 -0.519 -2.410
569 HE2 PHE 75 HE1 PHE 75 -2.845 -1.625 -6.359
570 HZ PHE 75 HZ PHE 75 -2.346 -1.475 -3.955
571 HB2 PHE 75 2HB PHE 75 -7.829 -0.031 -5.119
572 HB3 PHE 75 1HB PHE 75 -7.257 -0.234 -6.771
573 H SER 76 H SER 76 -7.747 1.882 -8.521
574 HA SER 76 HA SER 76 -10.223 3.309 -8.288
575 HG SER 76 HG SER 76 -11.299 2.161 -10.920
576 HB2 SER 76 2HB SER 76 -8.882 3.552 -10.307
577 HB3 SER 76 1HB SER 76 -9.039 1.833 -10.656
578 H ASP 77 H ASP 77 -9.440 0.054 -7.853
579 HA ASP 77 HA ASP 77 -12.280 -0.715 -8.094
580 HB2 ASP 77 2HB ASP 77 -10.902 -1.754 -9.876
581 HB3 ASP 77 1HB ASP 77 -9.873 -2.479 -8.644
582 H SER 78 H SER 78 -13.121 -2.039 -6.462
583 HA SER 78 HA SER 78 -11.806 -1.784 -3.904
584 HG SER 78 HG SER 78 -13.982 -0.630 -4.750
585 HB2 SER 78 2HB SER 78 -14.442 -3.101 -4.624
586 HB3 SER 78 1HB SER 78 -13.872 -2.800 -2.983
587 H GLU 79 H GLU 79 -12.676 -4.504 -6.035
588 HA GLU 79 HA GLU 79 -11.952 -6.514 -4.140
589 HB2 GLU 79 2HB GLU 79 -13.558 -6.892 -5.987
590 HB3 GLU 79 1HB GLU 79 -12.238 -6.761 -7.142
591 HG2 GLU 79 2HG GLU 79 -11.210 -8.750 -6.311
592 HG3 GLU 79 1HG GLU 79 -12.332 -8.829 -4.951
593 H CYS 80 H CYS 80 -10.220 -4.923 -6.782
594 HA CYS 80 HA CYS 80 -7.877 -6.466 -6.771
595 HG CYS 80 HG CYS 80 -5.447 -4.620 -6.661
596 HB2 CYS 80 2HB CYS 80 -8.232 -4.825 -8.501
597 HB3 CYS 80 1HB CYS 80 -8.264 -3.516 -7.324
598 H ALA 81 H ALA 81 -8.754 -3.632 -4.825
599 HA ALA 81 HA ALA 81 -6.375 -3.470 -3.312
600 HB1 ALA 81 3HB ALA 81 -8.026 -1.656 -3.440
601 HB2 ALA 81 1HB ALA 81 -7.667 -2.094 -1.771
602 HB3 ALA 81 2HB ALA 81 -9.171 -2.632 -2.519
603 H LYS 82 H LYS 82 -9.424 -5.193 -2.767
604 HA LYS 82 HA LYS 82 -8.941 -6.296 -0.253
605 HB2 LYS 82 2HB LYS 82 -11.097 -6.408 -1.441
606 HB3 LYS 82 1HB LYS 82 -10.403 -7.520 -2.610
607 HG2 LYS 82 2HG LYS 82 -10.046 -9.162 -0.798
608 HG3 LYS 82 1HG LYS 82 -10.829 -8.051 0.329
609 HD2 LYS 82 2HD LYS 82 -12.101 -9.279 -2.128
610 HD3 LYS 82 1HD LYS 82 -12.391 -9.766 -0.457
611 HE2 LYS 82 2HE LYS 82 -13.320 -7.550 0.031
612 HE3 LYS 82 1HE LYS 82 -13.006 -7.046 -1.627
613 HZ1 LYS 82 3HZ LYS 82 -14.831 -9.247 -0.826
614 HZ2 LYS 82 1HZ LYS 82 -14.562 -8.707 -2.406
615 HZ3 LYS 82 2HZ LYS 82 -15.318 -7.697 -1.278
616 H LYS 83 H LYS 83 -8.115 -7.589 -3.466
617 HA LYS 83 HA LYS 83 -6.844 -9.957 -2.629
618 HB2 LYS 83 2HB LYS 83 -7.532 -9.594 -4.944
619 HB3 LYS 83 1HB LYS 83 -6.386 -8.271 -5.105
620 HG2 LYS 83 2HG LYS 83 -4.530 -9.870 -4.777
621 HG3 LYS 83 1HG LYS 83 -5.706 -11.184 -4.696
622 HD2 LYS 83 2HD LYS 83 -6.440 -10.698 -6.974
623 HD3 LYS 83 1HD LYS 83 -5.329 -9.330 -7.057
624 HE2 LYS 83 2HE LYS 83 -3.429 -10.869 -6.795
625 HE3 LYS 83 1HE LYS 83 -4.546 -12.232 -6.736
626 HZ1 LYS 83 3HZ LYS 83 -4.205 -10.381 -9.034
627 HZ2 LYS 83 1HZ LYS 83 -5.255 -11.704 -8.980
628 HZ3 LYS 83 2HZ LYS 83 -3.583 -11.950 -8.939
629 H ALA 84 H ALA 84 -5.393 -6.811 -3.532
630 HA ALA 84 HA ALA 84 -2.723 -7.440 -3.085
631 HB1 ALA 84 3HB ALA 84 -2.329 -5.044 -2.896
632 HB2 ALA 84 1HB ALA 84 -4.051 -4.768 -2.629
633 HB3 ALA 84 2HB ALA 84 -3.487 -5.381 -4.183
634 H LEU 85 H LEU 85 -4.991 -5.929 -0.773
635 HA LEU 85 HA LEU 85 -3.303 -5.726 1.417
636 HG LEU 85 HG LEU 85 -4.583 -5.400 3.677
637 HB2 LEU 85 2HB LEU 85 -5.513 -4.703 1.308
638 HB3 LEU 85 1HB LEU 85 -6.277 -6.275 1.339
639 HD11 LEU 85 1HD1 LEU 85 -6.110 -3.547 3.272
640 HD12 LEU 85 2HD1 LEU 85 -6.567 -4.431 4.725
641 HD13 LEU 85 3HD1 LEU 85 -7.478 -4.659 3.229
642 HD21 LEU 85 3HD2 LEU 85 -5.351 -7.719 3.636
643 HD22 LEU 85 1HD2 LEU 85 -7.019 -7.181 3.430
644 HD23 LEU 85 2HD2 LEU 85 -6.153 -6.822 4.924
645 H GLU 86 H GLU 86 -5.482 -8.446 0.636
646 HA GLU 86 HA GLU 86 -4.855 -9.929 2.956
647 HB2 GLU 86 2HB GLU 86 -6.921 -10.182 1.591
648 HB3 GLU 86 1HB GLU 86 -5.963 -10.964 0.341
649 HG2 GLU 86 2HG GLU 86 -5.446 -12.799 1.809
650 HG3 GLU 86 1HG GLU 86 -6.233 -11.990 3.162
651 H GLN 87 H GLN 87 -3.178 -9.694 -0.105
652 HA GLN 87 HA GLN 87 -1.703 -12.181 0.413
653 HB2 GLN 87 2HB GLN 87 -1.519 -10.321 -1.964
654 HB3 GLN 87 1HB GLN 87 -0.794 -11.915 -1.836
655 HG2 GLN 87 2HG GLN 87 -3.751 -11.311 -1.892
656 HG3 GLN 87 1HG GLN 87 -2.796 -11.934 -3.232
657 HE21 GLN 87 1HE2 GLN 87 -4.026 -13.775 -3.439
658 HE22 GLN 87 2HE2 GLN 87 -3.999 -15.058 -2.285
659 H LEU 88 H LEU 88 -1.302 -8.811 0.878
660 HA LEU 88 HA LEU 88 1.653 -9.067 1.043
661 HG LEU 88 HG LEU 88 0.194 -7.922 -1.465
662 HB2 LEU 88 2HB LEU 88 -0.094 -6.639 0.597
663 HB3 LEU 88 1HB LEU 88 1.642 -6.567 0.823
664 HD11 LEU 88 1HD1 LEU 88 0.121 -5.497 -1.608
665 HD12 LEU 88 2HD1 LEU 88 1.183 -6.167 -2.846
666 HD13 LEU 88 3HD1 LEU 88 1.872 -5.416 -1.406
667 HD21 LEU 88 3HD2 LEU 88 3.162 -7.639 -0.948
668 HD22 LEU 88 1HD2 LEU 88 2.434 -8.253 -2.435
669 HD23 LEU 88 2HD2 LEU 88 2.231 -9.138 -0.925
670 H ASN 89 H ASN 89 -1.188 -8.319 2.908
671 HA ASN 89 HA ASN 89 -0.056 -6.685 4.882
672 HB2 ASN 89 2HB ASN 89 -2.499 -7.054 4.557
673 HB3 ASN 89 1HB ASN 89 -2.319 -8.659 5.263
674 HD21 ASN 89 1HD2 ASN 89 -3.674 -8.177 6.964
675 HD22 ASN 89 2HD2 ASN 89 -3.229 -7.104 8.239
676 H GLY 90 H GLY 90 1.814 -7.265 5.832
677 HA2 GLY 90 2HA GLY 90 2.580 -8.449 7.883
678 HA3 GLY 90 1HA GLY 90 1.949 -9.918 7.157
679 H PHE 91 H PHE 91 3.088 -8.677 4.508
680 HA PHE 91 HA PHE 91 5.418 -10.251 4.391
681 HD1 PHE 91 HD2 PHE 91 6.048 -11.310 1.918
682 HD2 PHE 91 HD1 PHE 91 6.432 -7.072 1.644
683 HE1 PHE 91 HE2 PHE 91 8.059 -11.582 0.524
684 HE2 PHE 91 HE1 PHE 91 8.441 -7.340 0.254
685 HZ PHE 91 HZ PHE 91 9.259 -9.597 -0.307
686 HB2 PHE 91 2HB PHE 91 4.133 -9.717 2.403
687 HB3 PHE 91 1HB PHE 91 4.489 -8.004 2.591
688 H GLU 92 H GLU 92 7.529 -9.828 4.980
689 HA GLU 92 HA GLU 92 8.291 -7.369 6.188
690 HB2 GLU 92 2HB GLU 92 9.781 -9.819 5.336
691 HB3 GLU 92 1HB GLU 92 10.702 -8.367 5.684
692 HG2 GLU 92 2HG GLU 92 10.613 -9.802 7.623
693 HG3 GLU 92 1HG GLU 92 9.766 -8.290 7.932
694 H LEU 93 H LEU 93 7.952 -5.629 4.864
695 HA LEU 93 HA LEU 93 9.078 -5.550 2.191
696 HG LEU 93 HG LEU 93 8.957 -2.417 2.021
697 HB2 LEU 93 2HB LEU 93 6.892 -4.556 2.589
698 HB3 LEU 93 1HB LEU 93 7.575 -3.478 3.794
699 HD11 LEU 93 1HD1 LEU 93 9.082 -4.293 0.477
700 HD12 LEU 93 2HD1 LEU 93 8.426 -2.868 -0.327
701 HD13 LEU 93 3HD1 LEU 93 7.348 -4.174 0.167
702 HD21 LEU 93 3HD2 LEU 93 7.127 -1.188 0.955
703 HD22 LEU 93 1HD2 LEU 93 6.822 -1.426 2.677
704 HD23 LEU 93 2HD2 LEU 93 5.986 -2.423 1.486
705 H ALA 94 H ALA 94 11.169 -5.089 1.905
706 HA ALA 94 HA ALA 94 13.231 -4.142 2.091
707 HB1 ALA 94 3HB ALA 94 13.314 -1.749 2.512
708 HB2 ALA 94 1HB ALA 94 11.691 -1.792 3.203
709 HB3 ALA 94 2HB ALA 94 11.931 -2.138 1.490
710 H GLY 95 H GLY 95 12.029 -5.568 4.489
711 HA2 GLY 95 2HA GLY 95 13.489 -6.308 6.271
712 HA3 GLY 95 1HA GLY 95 14.055 -4.658 6.447
713 H ARG 96 H ARG 96 10.894 -4.132 6.120
714 HA ARG 96 HA ARG 96 10.199 -4.800 8.909
715 HE ARG 96 HE ARG 96 8.045 -1.480 11.787
716 HB2 ARG 96 2HB ARG 96 10.918 -2.393 8.637
717 HB3 ARG 96 1HB ARG 96 9.537 -2.160 7.574
718 HG2 ARG 96 2HG ARG 96 8.010 -2.698 9.390
719 HG3 ARG 96 1HG ARG 96 9.370 -3.030 10.462
720 HD2 ARG 96 2HD ARG 96 10.103 -0.665 10.160
721 HD3 ARG 96 1HD ARG 96 8.631 -0.366 9.236
722 HH11 ARG 96 1HH1 ARG 96 8.956 1.470 10.261
723 HH12 ARG 96 2HH1 ARG 96 8.236 2.452 11.486
724 HH21 ARG 96 1HH2 ARG 96 7.146 -0.204 13.365
725 HH22 ARG 96 2HH2 ARG 96 7.252 1.517 13.231
726 HA PRO 97 HA PRO 97 6.628 -6.752 7.144
727 HB2 PRO 97 2HB PRO 97 4.819 -6.141 9.200
728 HB3 PRO 97 1HB PRO 97 5.875 -7.553 9.129
729 HG2 PRO 97 2HG PRO 97 6.281 -4.952 10.551
730 HG3 PRO 97 1HG PRO 97 6.680 -6.597 11.084
731 HD2 PRO 97 2HD PRO 97 8.591 -4.971 10.199
732 HD3 PRO 97 1HD PRO 97 8.603 -6.692 9.752
733 H MET 98 H MET 98 4.759 -6.262 6.015
734 HA MET 98 HA MET 98 4.293 -3.407 5.582
735 HB2 MET 98 2HB MET 98 4.796 -4.962 3.664
736 HB3 MET 98 1HB MET 98 3.266 -5.768 3.981
737 HG2 MET 98 2HG MET 98 2.126 -3.577 3.601
738 HG3 MET 98 1HG MET 98 3.680 -2.924 3.088
739 HE1 MET 98 3HE MET 98 5.053 -3.902 0.990
740 HE2 MET 98 1HE MET 98 4.429 -5.149 -0.089
741 HE3 MET 98 2HE MET 98 4.885 -5.561 1.563
742 H LYS 99 H LYS 99 2.816 -2.606 6.956
743 HA LYS 99 HA LYS 99 0.631 -4.261 7.931
744 HB2 LYS 99 2HB LYS 99 1.305 -1.379 8.578
745 HB3 LYS 99 1HB LYS 99 0.194 -2.414 9.467
746 HG2 LYS 99 2HG LYS 99 3.163 -2.881 9.197
747 HG3 LYS 99 1HG LYS 99 2.379 -2.128 10.584
748 HD2 LYS 99 2HD LYS 99 1.694 -4.911 9.629
749 HD3 LYS 99 1HD LYS 99 2.970 -4.594 10.802
750 HE2 LYS 99 2HE LYS 99 1.013 -5.184 12.024
751 HE3 LYS 99 1HE LYS 99 1.254 -3.453 12.236
752 HZ1 LYS 99 3HZ LYS 99 -0.638 -4.675 10.302
753 HZ2 LYS 99 1HZ LYS 99 -0.471 -3.027 10.638
754 HZ3 LYS 99 2HZ LYS 99 -1.069 -4.077 11.819
755 H VAL 100 H VAL 100 -0.708 -4.511 6.130
756 HA VAL 100 HA VAL 100 -1.880 -2.063 4.970
757 HB VAL 100 HB VAL 100 -2.098 -4.882 3.869
758 HG11 VAL 100 1HG1 VAL 100 -2.729 -3.732 1.789
759 HG12 VAL 100 2HG1 VAL 100 -2.628 -2.180 2.619
760 HG13 VAL 100 3HG1 VAL 100 -3.846 -3.359 3.102
761 HG21 VAL 100 3HG2 VAL 100 -0.144 -2.713 3.101
762 HG22 VAL 100 1HG2 VAL 100 -0.364 -4.248 2.260
763 HG23 VAL 100 2HG2 VAL 100 0.243 -4.228 3.916
764 H GLY 101 H GLY 101 -3.833 -1.478 5.697
765 HA2 GLY 101 2HA GLY 101 -5.835 -3.517 6.376
766 HA3 GLY 101 1HA GLY 101 -5.338 -2.423 7.655
767 H HIS 102 H HIS 102 -7.999 -2.622 6.772
768 HA HIS 102 HA HIS 102 -8.716 -0.606 4.913
769 HD1 HIS 102 HD1 HIS 102 -12.431 -1.802 4.520
770 HD2 HIS 102 HD2 HIS 102 -8.972 -4.005 5.197
771 HE1 HIS 102 HE1 HIS 102 -12.595 -3.795 2.999
772 HE2 HIS 102 HE2 HIS 102 -10.548 -5.166 3.505
773 HB2 HIS 102 2HB HIS 102 -10.231 -1.912 7.176
774 HB3 HIS 102 1HB HIS 102 -10.962 -0.691 6.143
775 H VAL 103 H VAL 103 -9.776 1.451 5.364
776 HA VAL 103 HA VAL 103 -8.479 2.911 7.552
777 HB VAL 103 HB VAL 103 -10.306 4.055 5.415
778 HG11 VAL 103 1HG1 VAL 103 -8.130 5.323 7.092
779 HG12 VAL 103 2HG1 VAL 103 -9.868 5.547 7.296
780 HG13 VAL 103 3HG1 VAL 103 -9.068 6.139 5.840
781 HG21 VAL 103 3HG2 VAL 103 -8.509 2.820 4.304
782 HG22 VAL 103 1HG2 VAL 103 -7.306 3.683 5.263
783 HG23 VAL 103 2HG2 VAL 103 -8.296 4.557 4.094
784 H THR 104 H THR 104 -10.932 0.977 7.540
785 HA THR 104 HA THR 104 -12.699 0.610 8.914
786 HB THR 104 HB THR 104 -12.391 3.454 9.922
787 HG1 THR 104 HG1 THR 104 -10.546 2.334 10.471
788 HG21 THR 104 3HG2 THR 104 -14.617 2.490 10.369
789 HG22 THR 104 1HG2 THR 104 -13.683 2.675 11.854
790 HG23 THR 104 2HG2 THR 104 -13.854 1.083 11.113
791 H GLU 105 H GLU 105 -12.524 3.215 6.724
792 HA GLU 105 HA GLU 105 -13.929 4.113 5.221
793 HB2 GLU 105 2HB GLU 105 -15.508 1.617 5.854
794 HB3 GLU 105 1HB GLU 105 -15.934 2.731 4.564
795 HG2 GLU 105 2HG GLU 105 -14.745 0.925 3.580
796 HG3 GLU 105 1HG GLU 105 -13.687 2.331 3.555
797 H ARG 106 H ARG 106 -15.463 5.694 5.110
798 HA ARG 106 HA ARG 106 -16.652 6.525 7.594
799 HE ARG 106 HE ARG 106 -14.293 9.119 3.955
800 HB2 ARG 106 2HB ARG 106 -16.664 7.713 4.820
801 HB3 ARG 106 1HB ARG 106 -17.535 8.440 6.165
802 HG2 ARG 106 2HG ARG 106 -15.449 8.698 7.401
803 HG3 ARG 106 1HG ARG 106 -14.561 7.932 6.082
804 HD2 ARG 106 2HD ARG 106 -16.192 10.453 5.762
805 HD3 ARG 106 1HD ARG 106 -14.466 10.446 6.119
806 HH11 ARG 106 1HH1 ARG 106 -16.784 11.446 4.499
807 HH12 ARG 106 2HH1 ARG 106 -16.889 11.883 2.831
808 HH21 ARG 106 1HH2 ARG 106 -14.452 9.663 1.826
809 HH22 ARG 106 2HH2 ARG 106 -15.573 10.880 1.322
810 H THR 107 H THR 107 -17.897 4.393 7.569
811 HA THR 107 HA THR 107 -20.670 5.078 7.145
812 HB THR 107 HB THR 107 -19.458 2.715 5.679
813 HG1 THR 107 HG1 THR 107 -19.990 5.068 4.824
814 HG21 THR 107 3HG2 THR 107 -22.378 3.226 6.287
815 HG22 THR 107 1HG2 THR 107 -21.411 1.866 6.853
816 HG23 THR 107 2HG2 THR 107 -21.781 2.029 5.135
817 H ASP 108 H ASP 108 -21.878 4.271 8.766
818 HA ASP 108 HA ASP 108 -20.673 2.972 10.962
819 HB2 ASP 108 2HB ASP 108 -23.610 3.382 10.350
820 HB3 ASP 108 1HB ASP 108 -22.942 2.949 11.921
Start of MODEL 9
1 HA MET 1 HA MET 1 -6.008 31.551 -23.911
2 H1 MET 1 1H MET 1 -4.165 31.339 -22.365
3 H2 MET 1 2H MET 1 -4.429 29.674 -22.245
4 H3 MET 1 3H MET 1 -5.606 30.758 -21.698
5 HB2 MET 1 2HB MET 1 -3.642 31.163 -24.658
6 HB3 MET 1 1HB MET 1 -4.013 29.451 -24.795
7 HG2 MET 1 2HG MET 1 -5.362 31.653 -26.348
8 HG3 MET 1 1HG MET 1 -4.073 30.617 -26.954
9 HE1 MET 1 3HE MET 1 -7.087 29.261 -28.992
10 HE2 MET 1 1HE MET 1 -5.432 29.867 -29.048
11 HE3 MET 1 2HE MET 1 -6.749 30.940 -28.575
12 H GLY 2 H GLY 2 -5.134 28.067 -23.824
13 HA2 GLY 2 2HA GLY 2 -8.000 27.454 -24.289
14 HA3 GLY 2 1HA GLY 2 -6.670 26.495 -24.914
15 H HIS 3 H HIS 3 -5.079 25.975 -22.842
16 HA HIS 3 HA HIS 3 -6.459 24.044 -21.318
17 HD1 HIS 3 HD1 HIS 3 -5.044 21.912 -21.927
18 HD2 HIS 3 HD2 HIS 3 -2.162 24.749 -22.881
19 HE1 HIS 3 HE1 HIS 3 -3.726 20.920 -23.816
20 HE2 HIS 3 HE2 HIS 3 -2.093 22.713 -24.477
21 HB2 HIS 3 2HB HIS 3 -3.760 25.312 -20.774
22 HB3 HIS 3 1HB HIS 3 -4.369 23.855 -20.001
23 H HIS 4 H HIS 4 -8.015 24.564 -19.885
24 HA HIS 4 HA HIS 4 -8.096 27.150 -18.646
25 HD1 HIS 4 HD1 HIS 4 -10.283 28.293 -19.648
26 HD2 HIS 4 HD2 HIS 4 -11.001 24.338 -20.719
27 HE1 HIS 4 HE1 HIS 4 -11.445 28.393 -21.870
28 HE2 HIS 4 HE2 HIS 4 -11.774 25.995 -22.543
29 HB2 HIS 4 2HB HIS 4 -9.893 24.749 -18.280
30 HB3 HIS 4 1HB HIS 4 -10.212 26.359 -17.640
31 H HIS 5 H HIS 5 -8.141 23.879 -17.145
32 HA HIS 5 HA HIS 5 -6.186 24.686 -15.207
33 HD1 HIS 5 HD1 HIS 5 -9.442 22.575 -12.965
34 HD2 HIS 5 HD2 HIS 5 -10.516 25.668 -15.520
35 HE1 HIS 5 HE1 HIS 5 -11.887 22.255 -13.416
36 HE2 HIS 5 HE2 HIS 5 -12.547 24.228 -14.824
37 HB2 HIS 5 2HB HIS 5 -7.641 24.357 -13.200
38 HB3 HIS 5 1HB HIS 5 -8.025 25.790 -14.143
39 H HIS 6 H HIS 6 -8.813 22.274 -15.643
40 HA HIS 6 HA HIS 6 -7.286 20.268 -14.248
41 HD1 HIS 6 HD1 HIS 6 -8.700 18.561 -12.500
42 HD2 HIS 6 HD2 HIS 6 -9.752 17.200 -16.281
43 HE1 HIS 6 HE1 HIS 6 -8.785 16.061 -12.314
44 HE2 HIS 6 HE2 HIS 6 -9.616 15.284 -14.554
45 HB2 HIS 6 2HB HIS 6 -9.778 20.385 -14.158
46 HB3 HIS 6 1HB HIS 6 -9.829 19.912 -15.854
47 H HIS 7 H HIS 7 -5.449 19.716 -15.306
48 HA HIS 7 HA HIS 7 -5.758 18.378 -17.918
49 HD1 HIS 7 HD1 HIS 7 -4.396 22.138 -16.265
50 HD2 HIS 7 HD2 HIS 7 -1.345 19.453 -17.137
51 HE1 HIS 7 HE1 HIS 7 -2.424 22.903 -14.923
52 HE2 HIS 7 HE2 HIS 7 -0.546 21.389 -15.627
53 HB2 HIS 7 2HB HIS 7 -3.645 19.371 -18.700
54 HB3 HIS 7 1HB HIS 7 -4.843 20.612 -18.352
55 H HIS 8 H HIS 8 -5.299 17.645 -14.944
56 HA HIS 8 HA HIS 8 -2.721 16.236 -15.127
57 HD1 HIS 8 HD1 HIS 8 -2.665 14.269 -12.023
58 HD2 HIS 8 HD2 HIS 8 -0.995 18.024 -12.631
59 HE1 HIS 8 HE1 HIS 8 -0.371 14.155 -11.019
60 HE2 HIS 8 HE2 HIS 8 0.664 16.393 -11.511
61 HB2 HIS 8 2HB HIS 8 -3.679 17.734 -13.121
62 HB3 HIS 8 1HB HIS 8 -4.384 16.196 -12.644
63 H SER 9 H SER 9 -5.263 15.363 -16.506
64 HA SER 9 HA SER 9 -5.424 12.645 -15.368
65 HG SER 9 HG SER 9 -8.866 14.381 -16.652
66 HB2 SER 9 2HB SER 9 -7.849 12.588 -15.972
67 HB3 SER 9 1HB SER 9 -7.473 13.772 -14.721
68 H HIS 10 H HIS 10 -7.124 13.970 -18.197
69 HA HIS 10 HA HIS 10 -7.211 13.294 -20.371
70 HD1 HIS 10 HD1 HIS 10 -4.023 11.200 -22.014
71 HD2 HIS 10 HD2 HIS 10 -5.904 14.781 -22.964
72 HE1 HIS 10 HE1 HIS 10 -4.142 11.253 -24.519
73 HE2 HIS 10 HE2 HIS 10 -5.383 13.367 -25.066
74 HB2 HIS 10 2HB HIS 10 -4.951 14.374 -20.318
75 HB3 HIS 10 1HB HIS 10 -4.240 12.792 -20.021
76 H MET 11 H MET 11 -7.949 11.317 -18.531
77 HA MET 11 HA MET 11 -6.686 8.820 -19.417
78 HB2 MET 11 2HB MET 11 -8.685 9.319 -17.194
79 HB3 MET 11 1HB MET 11 -7.915 7.777 -17.547
80 HG2 MET 11 2HG MET 11 -5.739 8.712 -17.008
81 HG3 MET 11 1HG MET 11 -6.470 10.290 -16.718
82 HE1 MET 11 3HE MET 11 -6.191 6.567 -15.485
83 HE2 MET 11 1HE MET 11 -7.926 6.759 -15.731
84 HE3 MET 11 2HE MET 11 -7.283 6.569 -14.099
85 H ALA 12 H ALA 12 -7.536 8.317 -21.387
86 HA ALA 12 HA ALA 12 -10.442 8.304 -21.777
87 HB1 ALA 12 3HB ALA 12 -8.208 7.685 -23.717
88 HB2 ALA 12 1HB ALA 12 -9.039 9.232 -23.554
89 HB3 ALA 12 2HB ALA 12 -9.921 7.814 -24.121
90 H ALA 13 H ALA 13 -7.774 6.107 -21.300
91 HA ALA 13 HA ALA 13 -9.231 3.729 -22.098
92 HB1 ALA 13 3HB ALA 13 -7.195 2.531 -21.451
93 HB2 ALA 13 1HB ALA 13 -6.531 4.018 -20.770
94 HB3 ALA 13 2HB ALA 13 -6.828 3.896 -22.505
95 H ALA 14 H ALA 14 -10.219 5.389 -19.784
96 HA ALA 14 HA ALA 14 -10.231 3.263 -17.727
97 HB1 ALA 14 3HB ALA 14 -10.552 4.989 -16.033
98 HB2 ALA 14 1HB ALA 14 -10.512 6.240 -17.277
99 HB3 ALA 14 2HB ALA 14 -9.070 5.282 -16.944
100 H MET 15 H MET 15 -12.184 2.439 -17.176
101 HA MET 15 HA MET 15 -14.542 3.459 -18.543
102 HB2 MET 15 2HB MET 15 -14.165 1.024 -16.781
103 HB3 MET 15 1HB MET 15 -15.665 1.439 -17.599
104 HG2 MET 15 2HG MET 15 -14.558 1.233 -19.762
105 HG3 MET 15 1HG MET 15 -13.040 0.843 -18.954
106 HE1 MET 15 3HE MET 15 -12.930 -1.335 -20.563
107 HE2 MET 15 1HE MET 15 -14.503 -0.918 -21.254
108 HE3 MET 15 2HE MET 15 -14.214 -2.543 -20.631
109 H ALA 16 H ALA 16 -15.083 2.027 -15.416
110 HA ALA 16 HA ALA 16 -15.836 2.780 -13.419
111 HB1 ALA 16 3HB ALA 16 -15.164 4.964 -12.604
112 HB2 ALA 16 1HB ALA 16 -14.705 5.453 -14.235
113 HB3 ALA 16 2HB ALA 16 -13.822 4.163 -13.418
114 H ASN 17 H ASN 17 -16.894 4.516 -16.267
115 HA ASN 17 HA ASN 17 -18.856 6.172 -15.238
116 HB2 ASN 17 2HB ASN 17 -18.802 4.670 -17.860
117 HB3 ASN 17 1HB ASN 17 -20.005 5.894 -17.469
118 HD21 ASN 17 1HD2 ASN 17 -19.376 7.281 -19.079
119 HD22 ASN 17 2HD2 ASN 17 -17.868 8.128 -19.056
120 H ASN 18 H ASN 18 -20.754 5.909 -14.306
121 HA ASN 18 HA ASN 18 -21.744 3.257 -13.722
122 HB2 ASN 18 2HB ASN 18 -22.953 5.932 -12.971
123 HB3 ASN 18 1HB ASN 18 -23.280 4.375 -12.219
124 HD21 ASN 18 1HD2 ASN 18 -20.452 3.580 -12.274
125 HD22 ASN 18 2HD2 ASN 18 -19.688 4.496 -11.030
126 H LEU 19 H LEU 19 -21.938 4.390 -16.527
127 HA LEU 19 HA LEU 19 -24.640 5.036 -17.102
128 HG LEU 19 HG LEU 19 -24.637 3.803 -20.022
129 HB2 LEU 19 2HB LEU 19 -22.775 5.690 -18.557
130 HB3 LEU 19 1HB LEU 19 -22.436 4.004 -18.901
131 HD11 LEU 19 1HD1 LEU 19 -24.831 6.767 -19.483
132 HD12 LEU 19 2HD1 LEU 19 -25.868 5.502 -18.818
133 HD13 LEU 19 3HD1 LEU 19 -25.899 5.849 -20.546
134 HD21 LEU 19 3HD2 LEU 19 -22.912 6.048 -21.078
135 HD22 LEU 19 1HD2 LEU 19 -24.060 5.091 -22.015
136 HD23 LEU 19 2HD2 LEU 19 -22.628 4.325 -21.324
137 H GLN 20 H GLN 20 -22.930 2.091 -16.644
138 HA GLN 20 HA GLN 20 -25.044 0.471 -17.841
139 HB2 GLN 20 2HB GLN 20 -22.413 -0.321 -16.571
140 HB3 GLN 20 1HB GLN 20 -23.535 -1.437 -17.340
141 HG2 GLN 20 2HG GLN 20 -23.194 -0.384 -19.483
142 HG3 GLN 20 1HG GLN 20 -22.189 0.863 -18.746
143 HE21 GLN 20 1HE2 GLN 20 -22.365 -2.498 -19.661
144 HE22 GLN 20 2HE2 GLN 20 -20.669 -2.810 -19.559
145 H LYS 21 H LYS 21 -25.073 2.073 -15.173
146 HA LYS 21 HA LYS 21 -25.904 1.927 -13.083
147 HB2 LYS 21 2HB LYS 21 -27.831 0.811 -14.085
148 HB3 LYS 21 1HB LYS 21 -26.999 -0.740 -14.013
149 HG2 LYS 21 2HG LYS 21 -26.920 -0.494 -11.522
150 HG3 LYS 21 1HG LYS 21 -27.931 0.942 -11.688
151 HD2 LYS 21 2HD LYS 21 -29.707 -0.394 -12.684
152 HD3 LYS 21 1HD LYS 21 -28.685 -1.835 -12.625
153 HE2 LYS 21 2HE LYS 21 -28.606 -1.627 -10.156
154 HE3 LYS 21 1HE LYS 21 -29.705 -0.250 -10.261
155 HZ1 LYS 21 3HZ LYS 21 -30.295 -3.043 -11.078
156 HZ2 LYS 21 1HZ LYS 21 -31.343 -1.732 -11.299
157 HZ3 LYS 21 2HZ LYS 21 -30.926 -2.228 -9.738
158 H GLY 22 H GLY 22 -24.379 1.808 -11.561
159 HA2 GLY 22 2HA GLY 22 -23.696 -0.242 -9.988
160 HA3 GLY 22 1HA GLY 22 -22.645 -0.536 -11.365
161 H SER 23 H SER 23 -21.374 -0.194 -9.063
162 HA SER 23 HA SER 23 -20.657 2.609 -8.700
163 HG SER 23 HG SER 23 -18.773 -0.339 -7.034
164 HB2 SER 23 2HB SER 23 -19.227 1.707 -6.845
165 HB3 SER 23 1HB SER 23 -20.939 1.307 -6.686
166 H ALA 24 H ALA 24 -18.338 3.215 -8.567
167 HA ALA 24 HA ALA 24 -16.982 2.399 -10.963
168 HB1 ALA 24 3HB ALA 24 -16.991 4.734 -10.234
169 HB2 ALA 24 1HB ALA 24 -15.346 4.114 -10.392
170 HB3 ALA 24 2HB ALA 24 -16.072 4.292 -8.794
171 H GLY 25 H GLY 25 -15.958 2.341 -7.506
172 HA2 GLY 25 2HA GLY 25 -15.023 -0.061 -7.043
173 HA3 GLY 25 1HA GLY 25 -13.855 0.413 -8.258
174 HA PRO 26 HA PRO 26 -11.162 3.242 -5.962
175 HB2 PRO 26 2HB PRO 26 -13.469 4.999 -5.164
176 HB3 PRO 26 1HB PRO 26 -11.796 5.452 -5.518
177 HG2 PRO 26 2HG PRO 26 -13.756 5.623 -7.372
178 HG3 PRO 26 1HG PRO 26 -12.079 5.246 -7.793
179 HD2 PRO 26 2HD PRO 26 -14.431 3.535 -7.957
180 HD3 PRO 26 1HD PRO 26 -12.794 3.235 -8.572
181 H MET 27 H MET 27 -10.494 1.979 -4.296
182 HA MET 27 HA MET 27 -11.642 2.639 -1.669
183 HB2 MET 27 2HB MET 27 -12.472 0.392 -2.182
184 HB3 MET 27 1HB MET 27 -10.837 -0.156 -2.528
185 HG2 MET 27 2HG MET 27 -10.204 0.187 -0.205
186 HG3 MET 27 1HG MET 27 -11.810 0.815 0.159
187 HE1 MET 27 3HE MET 27 -11.908 -0.947 2.199
188 HE2 MET 27 1HE MET 27 -10.323 -1.580 1.750
189 HE3 MET 27 2HE MET 27 -11.679 -2.684 1.991
190 H ARG 28 H ARG 28 -10.110 3.027 -0.069
191 HA ARG 28 HA ARG 28 -7.326 3.116 -1.011
192 HE ARG 28 HE ARG 28 -9.790 8.006 -0.949
193 HB2 ARG 28 2HB ARG 28 -8.628 4.526 1.329
194 HB3 ARG 28 1HB ARG 28 -6.957 4.732 0.816
195 HG2 ARG 28 2HG ARG 28 -7.740 5.612 -1.344
196 HG3 ARG 28 1HG ARG 28 -9.403 5.437 -0.795
197 HD2 ARG 28 2HD ARG 28 -8.905 6.994 1.075
198 HD3 ARG 28 1HD ARG 28 -7.287 7.223 0.407
199 HH11 ARG 28 1HH1 ARG 28 -6.428 8.457 -0.354
200 HH12 ARG 28 2HH1 ARG 28 -6.320 9.840 -1.381
201 HH21 ARG 28 1HH2 ARG 28 -9.651 9.785 -2.239
202 HH22 ARG 28 2HH2 ARG 28 -8.135 10.601 -2.423
203 H LEU 29 H LEU 29 -5.626 2.235 0.081
204 HA LEU 29 HA LEU 29 -6.243 0.423 2.332
205 HG LEU 29 HG LEU 29 -6.045 -0.445 -0.738
206 HB2 LEU 29 2HB LEU 29 -3.970 0.284 0.339
207 HB3 LEU 29 1HB LEU 29 -4.237 -0.843 1.654
208 HD11 LEU 29 1HD1 LEU 29 -3.985 -1.598 -1.307
209 HD12 LEU 29 2HD1 LEU 29 -5.343 -2.721 -1.333
210 HD13 LEU 29 3HD1 LEU 29 -4.223 -2.727 0.028
211 HD21 LEU 29 3HD2 LEU 29 -6.284 -2.387 1.569
212 HD22 LEU 29 1HD2 LEU 29 -7.305 -2.358 0.129
213 HD23 LEU 29 2HD2 LEU 29 -7.336 -1.006 1.259
214 H TYR 30 H TYR 30 -5.103 0.582 4.210
215 HA TYR 30 HA TYR 30 -3.276 2.834 4.544
216 HD1 TYR 30 HD2 TYR 30 -3.355 4.373 7.037
217 HD2 TYR 30 HD1 TYR 30 -2.865 0.253 7.991
218 HE1 TYR 30 HE2 TYR 30 -1.817 4.982 8.856
219 HE2 TYR 30 HE1 TYR 30 -1.327 0.850 9.813
220 HH TYR 30 HH TYR 30 -1.048 3.946 11.044
221 HB2 TYR 30 2HB TYR 30 -4.966 2.622 6.239
222 HB3 TYR 30 1HB TYR 30 -4.591 0.924 6.490
223 H VAL 31 H VAL 31 -1.215 2.437 3.964
224 HA VAL 31 HA VAL 31 0.003 -0.174 4.599
225 HB VAL 31 HB VAL 31 1.029 2.029 2.785
226 HG11 VAL 31 1HG1 VAL 31 2.841 0.697 3.743
227 HG12 VAL 31 2HG1 VAL 31 2.663 0.372 2.020
228 HG13 VAL 31 3HG1 VAL 31 2.051 -0.786 3.203
229 HG21 VAL 31 3HG2 VAL 31 -0.982 1.002 1.880
230 HG22 VAL 31 1HG2 VAL 31 -0.288 -0.605 2.105
231 HG23 VAL 31 2HG2 VAL 31 0.430 0.512 0.944
232 H GLY 32 H GLY 32 0.838 -0.132 6.633
233 HA2 GLY 32 2HA GLY 32 2.373 2.268 7.469
234 HA3 GLY 32 1HA GLY 32 1.489 1.228 8.570
235 H SER 33 H SER 33 4.401 1.574 6.656
236 HA SER 33 HA SER 33 5.997 0.253 8.575
237 HG SER 33 HG SER 33 6.836 -2.906 7.374
238 HB2 SER 33 2HB SER 33 4.929 -1.782 7.572
239 HB3 SER 33 1HB SER 33 5.647 -1.355 6.020
240 H LEU 34 H LEU 34 5.841 2.629 6.735
241 HA LEU 34 HA LEU 34 8.021 2.277 4.845
242 HG LEU 34 HG LEU 34 4.771 3.320 5.010
243 HB2 LEU 34 2HB LEU 34 6.598 4.867 5.434
244 HB3 LEU 34 1HB LEU 34 7.401 4.379 3.951
245 HD11 LEU 34 1HD1 LEU 34 3.816 4.349 3.023
246 HD12 LEU 34 2HD1 LEU 34 5.406 4.957 2.560
247 HD13 LEU 34 3HD1 LEU 34 4.629 5.546 4.031
248 HD21 LEU 34 3HD2 LEU 34 6.215 2.543 2.474
249 HD22 LEU 34 1HD2 LEU 34 4.629 1.976 2.995
250 HD23 LEU 34 2HD2 LEU 34 6.068 1.535 3.913
251 H HIS 35 H HIS 35 9.929 2.085 6.044
252 HA HIS 35 HA HIS 35 10.415 3.886 8.250
253 HD1 HIS 35 HD1 HIS 35 14.347 2.721 6.979
254 HD2 HIS 35 HD2 HIS 35 11.474 -0.173 6.195
255 HE1 HIS 35 HE1 HIS 35 15.403 1.161 5.326
256 HE2 HIS 35 HE2 HIS 35 13.769 -0.734 5.151
257 HB2 HIS 35 2HB HIS 35 12.418 2.626 8.697
258 HB3 HIS 35 1HB HIS 35 11.097 1.515 8.377
259 H PHE 36 H PHE 36 10.169 5.670 6.462
260 HA PHE 36 HA PHE 36 11.106 7.558 5.615
261 HD1 PHE 36 HD1 PHE 36 11.615 9.816 6.807
262 HD2 PHE 36 HD2 PHE 36 15.387 7.898 6.292
263 HE1 PHE 36 HE1 PHE 36 12.644 11.981 6.252
264 HE2 PHE 36 HE2 PHE 36 16.413 10.060 5.735
265 HZ PHE 36 HZ PHE 36 15.042 12.106 5.713
266 HB2 PHE 36 2HB PHE 36 12.229 7.512 7.840
267 HB3 PHE 36 1HB PHE 36 13.586 6.666 7.109
268 H ASN 37 H ASN 37 11.818 4.724 4.338
269 HA ASN 37 HA ASN 37 13.675 5.847 2.340
270 HB2 ASN 37 2HB ASN 37 14.856 4.290 3.906
271 HB3 ASN 37 1HB ASN 37 13.778 3.001 3.383
272 HD21 ASN 37 1HD2 ASN 37 14.078 2.082 1.363
273 HD22 ASN 37 2HD2 ASN 37 15.478 2.380 0.406
274 H ILE 38 H ILE 38 10.633 4.896 2.743
275 HA ILE 38 HA ILE 38 10.451 3.330 0.249
276 HB ILE 38 HB ILE 38 8.257 3.701 2.299
277 HG12 ILE 38 2HG1 ILE 38 10.139 2.574 3.385
278 HG13 ILE 38 1HG1 ILE 38 8.831 1.430 3.109
279 HG21 ILE 38 1HG2 ILE 38 8.615 1.739 0.024
280 HG22 ILE 38 2HG2 ILE 38 7.469 3.076 0.088
281 HG23 ILE 38 3HG2 ILE 38 7.291 1.711 1.190
282 HD11 ILE 38 3HD1 ILE 38 11.332 1.685 1.448
283 HD12 ILE 38 1HD1 ILE 38 10.022 0.536 1.172
284 HD13 ILE 38 2HD1 ILE 38 10.991 0.433 2.641
285 H THR 39 H THR 39 9.554 4.228 -1.524
286 HA THR 39 HA THR 39 8.422 6.942 -1.276
287 HB THR 39 HB THR 39 9.061 7.297 -3.605
288 HG1 THR 39 HG1 THR 39 10.342 5.608 -4.636
289 HG21 THR 39 3HG2 THR 39 11.505 7.221 -3.374
290 HG22 THR 39 1HG2 THR 39 11.344 6.136 -1.993
291 HG23 THR 39 2HG2 THR 39 10.743 7.791 -1.889
292 H GLU 40 H GLU 40 6.807 7.539 -2.977
293 HA GLU 40 HA GLU 40 4.531 5.938 -2.999
294 HB2 GLU 40 2HB GLU 40 5.320 7.958 -5.114
295 HB3 GLU 40 1HB GLU 40 3.690 7.395 -4.773
296 HG2 GLU 40 2HG GLU 40 3.744 8.462 -2.594
297 HG3 GLU 40 1HG GLU 40 5.415 8.962 -2.858
298 H ASP 41 H ASP 41 7.102 6.217 -5.430
299 HA ASP 41 HA ASP 41 5.844 4.576 -7.373
300 HB2 ASP 41 2HB ASP 41 7.573 6.216 -7.975
301 HB3 ASP 41 1HB ASP 41 8.779 5.269 -7.104
302 H MET 42 H MET 42 8.034 3.824 -4.703
303 HA MET 42 HA MET 42 8.675 1.176 -5.460
304 HB2 MET 42 2HB MET 42 9.820 2.370 -3.633
305 HB3 MET 42 1HB MET 42 8.343 2.341 -2.679
306 HG2 MET 42 2HG MET 42 8.437 -0.097 -2.595
307 HG3 MET 42 1HG MET 42 9.913 -0.078 -3.560
308 HE1 MET 42 3HE MET 42 12.425 1.705 -1.115
309 HE2 MET 42 1HE MET 42 11.436 2.460 -2.365
310 HE3 MET 42 2HE MET 42 12.242 0.923 -2.685
311 H LEU 43 H LEU 43 6.118 2.418 -3.326
312 HA LEU 43 HA LEU 43 4.652 0.075 -2.943
313 HG LEU 43 HG LEU 43 5.397 2.623 -1.437
314 HB2 LEU 43 2HB LEU 43 3.621 2.906 -3.220
315 HB3 LEU 43 1HB LEU 43 2.758 1.572 -2.474
316 HD11 LEU 43 1HD1 LEU 43 4.094 3.757 0.306
317 HD12 LEU 43 2HD1 LEU 43 2.602 3.314 -0.528
318 HD13 LEU 43 3HD1 LEU 43 3.757 4.401 -1.300
319 HD21 LEU 43 3HD2 LEU 43 4.799 1.397 0.590
320 HD22 LEU 43 1HD2 LEU 43 4.870 0.317 -0.802
321 HD23 LEU 43 2HD2 LEU 43 3.308 0.842 -0.173
322 H ARG 44 H ARG 44 4.380 2.518 -5.521
323 HA ARG 44 HA ARG 44 2.330 1.452 -7.040
324 HE ARG 44 HE ARG 44 5.689 3.093 -9.937
325 HB2 ARG 44 2HB ARG 44 3.464 3.629 -7.426
326 HB3 ARG 44 1HB ARG 44 4.865 2.775 -8.043
327 HG2 ARG 44 2HG ARG 44 2.176 2.432 -9.325
328 HG3 ARG 44 1HG ARG 44 3.188 3.821 -9.703
329 HD2 ARG 44 2HD ARG 44 3.852 0.909 -10.111
330 HD3 ARG 44 1HD ARG 44 3.565 2.124 -11.352
331 HH11 ARG 44 1HH1 ARG 44 5.017 0.193 -11.664
332 HH12 ARG 44 2HH1 ARG 44 6.679 -0.114 -12.019
333 HH21 ARG 44 1HH2 ARG 44 7.811 2.709 -10.394
334 HH22 ARG 44 2HH2 ARG 44 8.255 1.288 -11.283
335 H GLY 45 H GLY 45 5.806 0.628 -7.187
336 HA2 GLY 45 2HA GLY 45 5.644 -1.198 -9.329
337 HA3 GLY 45 1HA GLY 45 6.923 -1.145 -8.130
338 H ILE 46 H ILE 46 5.050 -1.642 -5.891
339 HA ILE 46 HA ILE 46 4.935 -4.537 -6.113
340 HB ILE 46 HB ILE 46 4.131 -2.732 -3.818
341 HG12 ILE 46 2HG1 ILE 46 6.687 -4.308 -4.274
342 HG13 ILE 46 1HG1 ILE 46 6.526 -2.560 -4.400
343 HG21 ILE 46 1HG2 ILE 46 4.272 -4.767 -2.436
344 HG22 ILE 46 2HG2 ILE 46 4.568 -5.723 -3.889
345 HG23 ILE 46 3HG2 ILE 46 3.023 -4.896 -3.677
346 HD11 ILE 46 3HD1 ILE 46 7.544 -3.177 -2.298
347 HD12 ILE 46 1HD1 ILE 46 6.161 -4.198 -1.900
348 HD13 ILE 46 2HD1 ILE 46 5.963 -2.449 -2.020
349 H PHE 47 H PHE 47 2.601 -1.888 -5.798
350 HA PHE 47 HA PHE 47 0.373 -3.712 -5.471
351 HD1 PHE 47 HD2 PHE 47 2.388 -1.437 -3.615
352 HD2 PHE 47 HD1 PHE 47 -1.787 -2.216 -3.263
353 HE1 PHE 47 HE2 PHE 47 2.648 -1.719 -1.187
354 HE2 PHE 47 HE1 PHE 47 -1.529 -2.500 -0.837
355 HZ PHE 47 HZ PHE 47 0.685 -2.253 0.207
356 HB2 PHE 47 2HB PHE 47 0.633 -0.713 -5.393
357 HB3 PHE 47 1HB PHE 47 -0.932 -1.511 -5.325
358 H GLU 48 H GLU 48 1.659 -1.757 -8.109
359 HA GLU 48 HA GLU 48 -0.594 -1.433 -9.699
360 HB2 GLU 48 2HB GLU 48 2.312 -1.478 -10.202
361 HB3 GLU 48 1HB GLU 48 1.325 -1.832 -11.612
362 HG2 GLU 48 2HG GLU 48 1.026 0.612 -9.876
363 HG3 GLU 48 1HG GLU 48 1.933 0.553 -11.383
364 HA PRO 49 HA PRO 49 0.540 -5.817 -11.844
365 HB2 PRO 49 2HB PRO 49 1.165 -7.126 -9.221
366 HB3 PRO 49 1HB PRO 49 1.774 -7.497 -10.840
367 HG2 PRO 49 2HG PRO 49 3.293 -6.153 -9.133
368 HG3 PRO 49 1HG PRO 49 3.243 -5.684 -10.844
369 HD2 PRO 49 2HD PRO 49 1.960 -4.378 -8.482
370 HD3 PRO 49 1HD PRO 49 2.667 -3.643 -9.935
371 H PHE 50 H PHE 50 -1.174 -5.084 -8.887
372 HA PHE 50 HA PHE 50 -2.966 -7.338 -9.053
373 HD1 PHE 50 HD2 PHE 50 -0.740 -5.396 -6.491
374 HD2 PHE 50 HD1 PHE 50 -3.953 -8.189 -6.305
375 HE1 PHE 50 HE2 PHE 50 0.526 -6.740 -4.864
376 HE2 PHE 50 HE1 PHE 50 -2.692 -9.536 -4.677
377 HZ PHE 50 HZ PHE 50 -0.453 -8.812 -3.954
378 HB2 PHE 50 2HB PHE 50 -2.955 -4.841 -7.359
379 HB3 PHE 50 1HB PHE 50 -4.267 -6.011 -7.294
380 H GLY 51 H GLY 51 -3.779 -3.839 -9.167
381 HA2 GLY 51 2HA GLY 51 -5.408 -4.248 -11.545
382 HA3 GLY 51 1HA GLY 51 -6.320 -3.961 -10.074
383 H ARG 52 H ARG 52 -3.253 -2.431 -10.462
384 HA ARG 52 HA ARG 52 -2.546 -0.341 -10.853
385 HE ARG 52 HE ARG 52 -1.751 1.049 -13.720
386 HB2 ARG 52 2HB ARG 52 -3.492 -0.427 -13.028
387 HB3 ARG 52 1HB ARG 52 -5.117 -0.145 -12.416
388 HG2 ARG 52 2HG ARG 52 -4.786 2.111 -12.161
389 HG3 ARG 52 1HG ARG 52 -3.048 1.939 -11.901
390 HD2 ARG 52 2HD ARG 52 -4.377 1.449 -14.565
391 HD3 ARG 52 1HD ARG 52 -3.728 3.016 -14.076
392 HH11 ARG 52 1HH1 ARG 52 -3.433 2.638 -16.283
393 HH12 ARG 52 2HH1 ARG 52 -2.080 2.572 -17.358
394 HH21 ARG 52 1HH2 ARG 52 -0.036 0.948 -15.115
395 HH22 ARG 52 2HH2 ARG 52 -0.172 1.626 -16.700
396 H ILE 53 H ILE 53 -2.505 1.678 -9.983
397 HA ILE 53 HA ILE 53 -4.514 2.224 -7.886
398 HB ILE 53 HB ILE 53 -1.648 3.201 -8.107
399 HG12 ILE 53 2HG1 ILE 53 -1.439 1.760 -5.956
400 HG13 ILE 53 1HG1 ILE 53 -2.913 0.975 -6.508
401 HG21 ILE 53 1HG2 ILE 53 -3.019 4.830 -6.963
402 HG22 ILE 53 2HG2 ILE 53 -1.964 4.019 -5.804
403 HG23 ILE 53 3HG2 ILE 53 -3.668 3.580 -5.899
404 HD11 ILE 53 3HD1 ILE 53 -1.764 0.351 -8.591
405 HD12 ILE 53 1HD1 ILE 53 -0.980 -0.304 -7.155
406 HD13 ILE 53 2HD1 ILE 53 -0.287 1.094 -7.975
407 H GLU 54 H GLU 54 -5.581 4.185 -7.824
408 HA GLU 54 HA GLU 54 -5.428 5.964 -10.090
409 HB2 GLU 54 2HB GLU 54 -6.939 6.282 -7.483
410 HB3 GLU 54 1HB GLU 54 -7.159 7.266 -8.922
411 HG2 GLU 54 2HG GLU 54 -7.915 5.254 -10.141
412 HG3 GLU 54 1HG GLU 54 -7.776 4.329 -8.644
413 H SER 55 H SER 55 -4.697 6.220 -6.622
414 HA SER 55 HA SER 55 -2.642 8.205 -7.158
415 HG SER 55 HG SER 55 -4.533 9.385 -7.933
416 HB2 SER 55 2HB SER 55 -4.985 8.833 -5.340
417 HB3 SER 55 1HB SER 55 -3.530 9.815 -5.488
418 H ILE 56 H ILE 56 -0.931 7.903 -5.860
419 HA ILE 56 HA ILE 56 -1.275 6.383 -3.351
420 HB ILE 56 HB ILE 56 1.283 6.963 -4.876
421 HG12 ILE 56 2HG1 ILE 56 -0.366 4.418 -4.740
422 HG13 ILE 56 1HG1 ILE 56 -0.231 5.475 -6.139
423 HG21 ILE 56 1HG2 ILE 56 2.274 5.256 -3.398
424 HG22 ILE 56 2HG2 ILE 56 0.743 5.128 -2.532
425 HG23 ILE 56 3HG2 ILE 56 1.658 6.634 -2.488
426 HD11 ILE 56 3HD1 ILE 56 2.020 3.911 -4.896
427 HD12 ILE 56 1HD1 ILE 56 2.140 4.957 -6.312
428 HD13 ILE 56 2HD1 ILE 56 1.153 3.498 -6.376
429 H GLN 57 H GLN 57 -0.983 7.432 -1.423
430 HA GLN 57 HA GLN 57 0.366 10.060 -1.487
431 HB2 GLN 57 2HB GLN 57 -2.084 10.379 -1.465
432 HB3 GLN 57 1HB GLN 57 -2.194 9.425 0.008
433 HG2 GLN 57 2HG GLN 57 -2.330 11.755 0.566
434 HG3 GLN 57 1HG GLN 57 -0.803 11.115 1.166
435 HE21 GLN 57 1HE2 GLN 57 -1.417 11.927 -2.202
436 HE22 GLN 57 2HE2 GLN 57 -0.327 13.263 -2.262
437 H LEU 58 H LEU 58 1.814 10.424 0.113
438 HA LEU 58 HA LEU 58 2.113 8.375 2.199
439 HG LEU 58 HG LEU 58 3.948 8.962 -0.410
440 HB2 LEU 58 2HB LEU 58 4.000 10.598 1.387
441 HB3 LEU 58 1HB LEU 58 4.343 9.342 2.564
442 HD11 LEU 58 1HD1 LEU 58 6.376 8.610 1.348
443 HD12 LEU 58 2HD1 LEU 58 6.107 9.919 0.193
444 HD13 LEU 58 3HD1 LEU 58 6.287 8.261 -0.381
445 HD21 LEU 58 3HD2 LEU 58 4.488 6.607 -0.012
446 HD22 LEU 58 1HD2 LEU 58 2.997 7.072 0.803
447 HD23 LEU 58 2HD2 LEU 58 4.490 6.896 1.726
448 H MET 59 H MET 59 2.163 8.891 4.407
449 HA MET 59 HA MET 59 0.718 11.349 5.058
450 HB2 MET 59 2HB MET 59 -0.104 9.120 5.836
451 HB3 MET 59 1HB MET 59 1.335 8.982 6.838
452 HG2 MET 59 2HG MET 59 -0.658 9.721 8.080
453 HG3 MET 59 1HG MET 59 0.670 10.880 8.145
454 HE1 MET 59 3HE MET 59 -2.529 11.357 8.793
455 HE2 MET 59 1HE MET 59 -2.723 12.985 8.142
456 HE3 MET 59 2HE MET 59 -1.290 12.580 9.086
457 H MET 60 H MET 60 1.798 13.073 5.713
458 HA MET 60 HA MET 60 4.434 12.745 7.006
459 HB2 MET 60 2HB MET 60 3.373 15.102 5.423
460 HB3 MET 60 1HB MET 60 4.986 14.969 6.120
461 HG2 MET 60 2HG MET 60 5.494 13.109 4.649
462 HG3 MET 60 1HG MET 60 3.860 13.163 3.982
463 HE1 MET 60 3HE MET 60 4.865 13.276 1.514
464 HE2 MET 60 1HE MET 60 6.500 13.223 2.168
465 HE3 MET 60 2HE MET 60 6.060 14.470 1.002
466 H ASP 61 H ASP 61 5.008 14.774 8.383
467 HA ASP 61 HA ASP 61 2.949 15.081 10.386
468 HB2 ASP 61 2HB ASP 61 5.362 14.766 10.958
469 HB3 ASP 61 1HB ASP 61 5.697 16.355 10.277
470 H SER 62 H SER 62 1.463 16.634 10.386
471 HA SER 62 HA SER 62 1.241 18.544 8.334
472 HG SER 62 HG SER 62 -1.082 20.222 10.250
473 HB2 SER 62 2HB SER 62 -0.692 17.621 9.538
474 HB3 SER 62 1HB SER 62 -0.198 18.473 10.999
475 H GLU 63 H GLU 63 3.186 18.738 11.087
476 HA GLU 63 HA GLU 63 3.101 21.679 11.166
477 HB2 GLU 63 2HB GLU 63 2.896 20.455 13.311
478 HB3 GLU 63 1HB GLU 63 4.477 19.734 13.031
479 HG2 GLU 63 2HG GLU 63 5.473 22.001 13.068
480 HG3 GLU 63 1HG GLU 63 3.883 22.659 13.460
481 H THR 64 H THR 64 5.654 19.178 11.395
482 HA THR 64 HA THR 64 7.598 21.109 10.334
483 HB THR 64 HB THR 64 9.305 19.461 11.107
484 HG1 THR 64 HG1 THR 64 7.747 18.008 12.735
485 HG21 THR 64 3HG2 THR 64 7.287 20.283 13.201
486 HG22 THR 64 1HG2 THR 64 8.597 21.287 12.577
487 HG23 THR 64 2HG2 THR 64 8.966 19.834 13.508
488 H GLY 65 H GLY 65 5.810 18.419 9.227
489 HA2 GLY 65 2HA GLY 65 5.791 17.529 7.076
490 HA3 GLY 65 1HA GLY 65 7.267 18.407 6.722
491 H ARG 66 H ARG 66 7.340 16.504 9.585
492 HA ARG 66 HA ARG 66 9.369 14.770 8.612
493 HE ARG 66 HE ARG 66 10.947 13.397 10.671
494 HB2 ARG 66 2HB ARG 66 7.671 14.599 11.107
495 HB3 ARG 66 1HB ARG 66 9.050 13.560 10.777
496 HG2 ARG 66 2HG ARG 66 9.163 16.562 11.053
497 HG3 ARG 66 1HG ARG 66 9.609 15.399 12.302
498 HD2 ARG 66 2HD ARG 66 10.935 15.767 9.610
499 HD3 ARG 66 1HD ARG 66 11.600 16.206 11.184
500 HH11 ARG 66 1HH1 ARG 66 13.338 15.831 11.168
501 HH12 ARG 66 2HH1 ARG 66 14.614 14.681 11.358
502 HH21 ARG 66 1HH2 ARG 66 12.598 11.939 10.918
503 HH22 ARG 66 2HH2 ARG 66 14.197 12.514 11.240
504 H SER 67 H SER 67 9.183 12.315 8.924
505 HA SER 67 HA SER 67 6.985 11.405 7.247
506 HG SER 67 HG SER 67 8.843 11.226 5.774
507 HB2 SER 67 2HB SER 67 9.445 9.931 8.233
508 HB3 SER 67 1HB SER 67 8.285 9.308 7.059
509 H LYS 68 H LYS 68 5.208 10.407 8.023
510 HA LYS 68 HA LYS 68 5.064 9.653 10.808
511 HB2 LYS 68 2HB LYS 68 3.059 9.478 8.554
512 HB3 LYS 68 1HB LYS 68 2.716 8.936 10.191
513 HG2 LYS 68 2HG LYS 68 3.439 11.751 9.377
514 HG3 LYS 68 1HG LYS 68 1.827 11.164 9.790
515 HD2 LYS 68 2HD LYS 68 2.589 10.644 12.060
516 HD3 LYS 68 1HD LYS 68 4.212 11.204 11.654
517 HE2 LYS 68 2HE LYS 68 3.268 13.451 11.191
518 HE3 LYS 68 1HE LYS 68 1.692 12.864 11.717
519 HZ1 LYS 68 3HZ LYS 68 2.869 14.056 13.475
520 HZ2 LYS 68 1HZ LYS 68 4.131 12.933 13.404
521 HZ3 LYS 68 2HZ LYS 68 2.591 12.443 13.897
522 H GLY 69 H GLY 69 5.686 7.997 7.820
523 HA2 GLY 69 2HA GLY 69 6.716 5.872 7.729
524 HA3 GLY 69 1HA GLY 69 6.109 5.523 9.338
525 H TYR 70 H TYR 70 3.598 6.777 7.523
526 HA TYR 70 HA TYR 70 2.885 4.232 6.271
527 HD1 TYR 70 HD1 TYR 70 -0.079 7.036 7.896
528 HD2 TYR 70 HD2 TYR 70 2.572 4.636 10.212
529 HE1 TYR 70 HE1 TYR 70 -0.341 8.579 9.795
530 HE2 TYR 70 HE2 TYR 70 2.314 6.175 12.110
531 HH TYR 70 HH TYR 70 1.711 8.464 12.543
532 HB2 TYR 70 2HB TYR 70 0.468 4.687 7.251
533 HB3 TYR 70 1HB TYR 70 1.670 3.784 8.160
534 H GLY 71 H GLY 71 1.070 4.384 4.764
535 HA2 GLY 71 2HA GLY 71 0.365 7.071 3.848
536 HA3 GLY 71 1HA GLY 71 1.310 6.088 2.739
537 H PHE 72 H PHE 72 -1.229 7.067 2.094
538 HA PHE 72 HA PHE 72 -2.964 4.680 2.235
539 HD1 PHE 72 HD1 PHE 72 -5.557 5.013 3.600
540 HD2 PHE 72 HD2 PHE 72 -2.902 8.336 3.961
541 HE1 PHE 72 HE1 PHE 72 -6.008 5.116 6.018
542 HE2 PHE 72 HE2 PHE 72 -3.353 8.436 6.375
543 HZ PHE 72 HZ PHE 72 -4.910 6.828 7.403
544 HB2 PHE 72 2HB PHE 72 -3.668 7.591 1.789
545 HB3 PHE 72 1HB PHE 72 -4.822 6.270 1.629
546 H ILE 73 H ILE 73 -3.191 3.505 0.462
547 HA ILE 73 HA ILE 73 -2.553 4.692 -2.167
548 HB ILE 73 HB ILE 73 -2.565 1.788 -1.306
549 HG12 ILE 73 2HG1 ILE 73 -0.270 3.615 -2.080
550 HG13 ILE 73 1HG1 ILE 73 -0.676 3.135 -0.438
551 HG21 ILE 73 1HG2 ILE 73 -1.872 3.006 -3.984
552 HG22 ILE 73 2HG2 ILE 73 -3.259 1.974 -3.631
553 HG23 ILE 73 3HG2 ILE 73 -1.625 1.318 -3.538
554 HD11 ILE 73 3HD1 ILE 73 1.195 1.858 -1.310
555 HD12 ILE 73 1HD1 ILE 73 0.199 1.285 -2.645
556 HD13 ILE 73 2HD1 ILE 73 -0.188 0.812 -0.991
557 H THR 74 H THR 74 -4.177 5.042 -3.546
558 HA THR 74 HA THR 74 -6.838 3.956 -2.914
559 HB THR 74 HB THR 74 -6.139 6.219 -4.807
560 HG1 THR 74 HG1 THR 74 -6.198 7.522 -3.120
561 HG21 THR 74 3HG2 THR 74 -8.317 5.201 -5.280
562 HG22 THR 74 1HG2 THR 74 -8.523 6.808 -4.588
563 HG23 THR 74 2HG2 THR 74 -8.782 5.379 -3.589
564 H PHE 75 H PHE 75 -7.476 2.204 -4.025
565 HA PHE 75 HA PHE 75 -6.445 1.709 -6.736
566 HD1 PHE 75 HD1 PHE 75 -5.662 0.332 -3.428
567 HD2 PHE 75 HD2 PHE 75 -5.859 -1.524 -7.262
568 HE1 PHE 75 HE1 PHE 75 -3.461 -0.699 -3.046
569 HE2 PHE 75 HE2 PHE 75 -3.661 -2.548 -6.884
570 HZ PHE 75 HZ PHE 75 -2.465 -2.142 -4.771
571 HB2 PHE 75 2HB PHE 75 -7.821 -0.008 -4.678
572 HB3 PHE 75 1HB PHE 75 -7.765 -0.512 -6.360
573 H SER 76 H SER 76 -7.731 1.615 -8.534
574 HA SER 76 HA SER 76 -10.325 2.844 -8.474
575 HG SER 76 HG SER 76 -11.332 1.888 -10.798
576 HB2 SER 76 2HB SER 76 -8.845 3.141 -10.410
577 HB3 SER 76 1HB SER 76 -8.884 1.409 -10.730
578 H ASP 77 H ASP 77 -9.400 -0.224 -7.661
579 HA ASP 77 HA ASP 77 -12.090 -1.288 -8.214
580 HB2 ASP 77 2HB ASP 77 -10.333 -2.217 -9.788
581 HB3 ASP 77 1HB ASP 77 -9.554 -2.937 -8.384
582 H SER 78 H SER 78 -13.073 -1.821 -6.369
583 HA SER 78 HA SER 78 -11.890 -1.692 -3.834
584 HG SER 78 HG SER 78 -14.696 -3.165 -5.646
585 HB2 SER 78 2HB SER 78 -14.001 -2.533 -2.961
586 HB3 SER 78 1HB SER 78 -14.317 -1.399 -4.269
587 H GLU 79 H GLU 79 -12.889 -4.618 -5.649
588 HA GLU 79 HA GLU 79 -12.071 -6.454 -3.656
589 HB2 GLU 79 2HB GLU 79 -13.471 -6.651 -6.010
590 HB3 GLU 79 1HB GLU 79 -11.961 -7.439 -6.440
591 HG2 GLU 79 2HG GLU 79 -13.713 -8.183 -4.099
592 HG3 GLU 79 1HG GLU 79 -13.682 -9.012 -5.650
593 H CYS 80 H CYS 80 -10.375 -5.087 -6.447
594 HA CYS 80 HA CYS 80 -8.000 -6.600 -6.252
595 HG CYS 80 HG CYS 80 -5.607 -4.789 -6.439
596 HB2 CYS 80 2HB CYS 80 -8.363 -5.278 -8.222
597 HB3 CYS 80 1HB CYS 80 -8.469 -3.796 -7.275
598 H ALA 81 H ALA 81 -8.956 -3.550 -4.698
599 HA ALA 81 HA ALA 81 -6.547 -3.088 -3.287
600 HB1 ALA 81 3HB ALA 81 -7.884 -1.617 -1.857
601 HB2 ALA 81 1HB ALA 81 -9.365 -2.308 -2.521
602 HB3 ALA 81 2HB ALA 81 -8.283 -1.377 -3.557
603 H LYS 82 H LYS 82 -9.550 -4.713 -2.330
604 HA LYS 82 HA LYS 82 -8.825 -5.559 0.223
605 HB2 LYS 82 2HB LYS 82 -11.094 -5.739 -0.421
606 HB3 LYS 82 1HB LYS 82 -10.701 -6.677 -1.854
607 HG2 LYS 82 2HG LYS 82 -10.106 -8.589 -0.462
608 HG3 LYS 82 1HG LYS 82 -10.444 -7.648 0.994
609 HD2 LYS 82 2HD LYS 82 -12.758 -7.573 0.541
610 HD3 LYS 82 1HD LYS 82 -12.531 -8.063 -1.140
611 HE2 LYS 82 2HE LYS 82 -12.008 -9.805 1.272
612 HE3 LYS 82 1HE LYS 82 -13.444 -9.882 0.251
613 HZ1 LYS 82 3HZ LYS 82 -11.876 -11.568 -0.401
614 HZ2 LYS 82 1HZ LYS 82 -10.653 -10.418 -0.610
615 HZ3 LYS 82 2HZ LYS 82 -11.995 -10.415 -1.636
616 H LYS 83 H LYS 83 -8.292 -7.151 -2.910
617 HA LYS 83 HA LYS 83 -7.121 -9.512 -1.877
618 HB2 LYS 83 2HB LYS 83 -8.038 -9.281 -4.187
619 HB3 LYS 83 1HB LYS 83 -6.664 -8.263 -4.600
620 HG2 LYS 83 2HG LYS 83 -5.135 -10.099 -4.210
621 HG3 LYS 83 1HG LYS 83 -6.467 -11.128 -3.677
622 HD2 LYS 83 2HD LYS 83 -7.490 -10.855 -5.946
623 HD3 LYS 83 1HD LYS 83 -6.027 -9.997 -6.443
624 HE2 LYS 83 2HE LYS 83 -4.685 -11.977 -5.956
625 HE3 LYS 83 1HE LYS 83 -6.123 -12.836 -5.402
626 HZ1 LYS 83 3HZ LYS 83 -5.566 -11.892 -8.157
627 HZ2 LYS 83 1HZ LYS 83 -7.040 -12.556 -7.665
628 HZ3 LYS 83 2HZ LYS 83 -5.635 -13.495 -7.625
629 H ALA 84 H ALA 84 -5.623 -6.566 -3.251
630 HA ALA 84 HA ALA 84 -2.944 -7.185 -2.848
631 HB1 ALA 84 3HB ALA 84 -4.261 -4.478 -2.568
632 HB2 ALA 84 1HB ALA 84 -3.698 -5.202 -4.074
633 HB3 ALA 84 2HB ALA 84 -2.538 -4.767 -2.818
634 H LEU 85 H LEU 85 -5.234 -5.674 -0.603
635 HA LEU 85 HA LEU 85 -3.590 -5.364 1.627
636 HG LEU 85 HG LEU 85 -4.975 -4.722 3.735
637 HB2 LEU 85 2HB LEU 85 -5.897 -4.473 1.354
638 HB3 LEU 85 1HB LEU 85 -6.533 -6.091 1.533
639 HD11 LEU 85 1HD1 LEU 85 -6.871 -3.307 3.193
640 HD12 LEU 85 2HD1 LEU 85 -7.151 -4.132 4.724
641 HD13 LEU 85 3HD1 LEU 85 -7.959 -4.692 3.259
642 HD21 LEU 85 3HD2 LEU 85 -5.186 -7.136 4.001
643 HD22 LEU 85 1HD2 LEU 85 -6.927 -7.038 3.739
644 HD23 LEU 85 2HD2 LEU 85 -6.209 -6.311 5.176
645 H GLU 86 H GLU 86 -5.767 -8.094 0.886
646 HA GLU 86 HA GLU 86 -5.106 -9.634 3.135
647 HB2 GLU 86 2HB GLU 86 -7.145 -9.869 1.724
648 HB3 GLU 86 1HB GLU 86 -6.159 -10.619 0.477
649 HG2 GLU 86 2HG GLU 86 -5.631 -12.462 1.970
650 HG3 GLU 86 1HG GLU 86 -6.544 -11.693 3.268
651 H GLN 87 H GLN 87 -3.441 -9.330 0.074
652 HA GLN 87 HA GLN 87 -1.878 -11.761 0.493
653 HB2 GLN 87 2HB GLN 87 -2.361 -9.920 -1.760
654 HB3 GLN 87 1HB GLN 87 -0.701 -10.474 -1.646
655 HG2 GLN 87 2HG GLN 87 -1.642 -12.022 -3.055
656 HG3 GLN 87 1HG GLN 87 -1.727 -12.838 -1.501
657 HE21 GLN 87 1HE2 GLN 87 -4.046 -11.252 -0.612
658 HE22 GLN 87 2HE2 GLN 87 -5.388 -11.851 -1.506
659 H LEU 88 H LEU 88 -1.370 -8.241 0.489
660 HA LEU 88 HA LEU 88 1.499 -8.592 0.838
661 HG LEU 88 HG LEU 88 -0.252 -7.475 -1.508
662 HB2 LEU 88 2HB LEU 88 -0.125 -6.070 0.532
663 HB3 LEU 88 1HB LEU 88 1.625 -6.178 0.479
664 HD11 LEU 88 1HD1 LEU 88 0.566 -5.779 -3.083
665 HD12 LEU 88 2HD1 LEU 88 1.453 -4.997 -1.772
666 HD13 LEU 88 3HD1 LEU 88 -0.310 -5.066 -1.731
667 HD21 LEU 88 3HD2 LEU 88 2.764 -7.253 -1.488
668 HD22 LEU 88 1HD2 LEU 88 1.793 -7.891 -2.815
669 HD23 LEU 88 2HD2 LEU 88 1.818 -8.726 -1.263
670 H ASN 89 H ASN 89 -1.129 -8.205 2.947
671 HA ASN 89 HA ASN 89 0.074 -6.552 4.926
672 HB2 ASN 89 2HB ASN 89 -2.379 -7.072 4.764
673 HB3 ASN 89 1HB ASN 89 -2.030 -8.684 5.374
674 HD21 ASN 89 1HD2 ASN 89 -3.657 -6.517 6.494
675 HD22 ASN 89 2HD2 ASN 89 -3.023 -6.234 8.073
676 H GLY 90 H GLY 90 2.204 -7.332 5.085
677 HA2 GLY 90 2HA GLY 90 3.216 -8.704 7.064
678 HA3 GLY 90 1HA GLY 90 2.616 -10.059 6.121
679 H PHE 91 H PHE 91 3.256 -8.445 3.621
680 HA PHE 91 HA PHE 91 5.625 -9.559 2.802
681 HD1 PHE 91 HD1 PHE 91 6.620 -5.854 1.393
682 HD2 PHE 91 HD2 PHE 91 5.389 -9.569 -0.297
683 HE1 PHE 91 HE1 PHE 91 8.335 -5.624 -0.356
684 HE2 PHE 91 HE2 PHE 91 7.106 -9.342 -2.043
685 HZ PHE 91 HZ PHE 91 8.581 -7.373 -2.075
686 HB2 PHE 91 2HB PHE 91 4.008 -8.436 1.322
687 HB3 PHE 91 1HB PHE 91 4.467 -6.876 1.985
688 H GLU 92 H GLU 92 7.701 -9.344 3.493
689 HA GLU 92 HA GLU 92 8.447 -7.293 5.330
690 HB2 GLU 92 2HB GLU 92 9.447 -9.581 5.314
691 HB3 GLU 92 1HB GLU 92 10.288 -9.168 3.824
692 HG2 GLU 92 2HG GLU 92 11.513 -7.420 4.972
693 HG3 GLU 92 1HG GLU 92 10.622 -7.736 6.459
694 H LEU 93 H LEU 93 8.243 -5.281 4.451
695 HA LEU 93 HA LEU 93 9.405 -4.628 1.875
696 HG LEU 93 HG LEU 93 9.259 -1.483 2.377
697 HB2 LEU 93 2HB LEU 93 7.224 -3.718 2.549
698 HB3 LEU 93 1HB LEU 93 7.973 -2.912 3.913
699 HD11 LEU 93 1HD1 LEU 93 7.731 -2.904 0.193
700 HD12 LEU 93 2HD1 LEU 93 9.466 -3.018 0.496
701 HD13 LEU 93 3HD1 LEU 93 8.761 -1.488 -0.023
702 HD21 LEU 93 3HD2 LEU 93 6.287 -1.497 1.817
703 HD22 LEU 93 1HD2 LEU 93 7.386 -0.142 1.551
704 HD23 LEU 93 2HD2 LEU 93 7.080 -0.720 3.189
705 H ALA 94 H ALA 94 11.518 -4.277 1.746
706 HA ALA 94 HA ALA 94 13.607 -3.463 2.088
707 HB1 ALA 94 3HB ALA 94 13.868 -1.306 3.183
708 HB2 ALA 94 1HB ALA 94 12.252 -1.443 3.881
709 HB3 ALA 94 2HB ALA 94 12.451 -1.300 2.134
710 H GLY 95 H GLY 95 12.044 -5.122 4.396
711 HA2 GLY 95 2HA GLY 95 13.622 -6.466 5.809
712 HA3 GLY 95 1HA GLY 95 14.262 -4.922 6.354
713 H ARG 96 H ARG 96 11.137 -4.202 6.137
714 HA ARG 96 HA ARG 96 10.404 -5.372 8.753
715 HE ARG 96 HE ARG 96 8.954 -2.053 10.638
716 HB2 ARG 96 2HB ARG 96 9.890 -2.585 7.702
717 HB3 ARG 96 1HB ARG 96 9.032 -3.255 9.082
718 HG2 ARG 96 2HG ARG 96 11.147 -3.513 10.280
719 HG3 ARG 96 1HG ARG 96 12.017 -2.848 8.896
720 HD2 ARG 96 2HD ARG 96 11.647 -1.171 10.662
721 HD3 ARG 96 1HD ARG 96 10.858 -0.728 9.149
722 HH11 ARG 96 1HH1 ARG 96 10.897 0.772 11.053
723 HH12 ARG 96 2HH1 ARG 96 9.696 1.593 11.986
724 HH21 ARG 96 1HH2 ARG 96 7.420 -0.986 11.845
725 HH22 ARG 96 2HH2 ARG 96 7.749 0.606 12.434
726 HA PRO 97 HA PRO 97 6.890 -7.172 6.577
727 HB2 PRO 97 2HB PRO 97 5.242 -7.166 8.867
728 HB3 PRO 97 1HB PRO 97 6.274 -8.493 8.322
729 HG2 PRO 97 2HG PRO 97 6.802 -6.403 10.390
730 HG3 PRO 97 1HG PRO 97 7.283 -8.110 10.365
731 HD2 PRO 97 2HD PRO 97 9.050 -6.172 9.846
732 HD3 PRO 97 1HD PRO 97 9.090 -7.705 8.944
733 H MET 98 H MET 98 5.165 -6.267 5.527
734 HA MET 98 HA MET 98 4.706 -3.428 6.078
735 HB2 MET 98 2HB MET 98 5.432 -4.045 3.822
736 HB3 MET 98 1HB MET 98 4.041 -5.105 3.644
737 HG2 MET 98 2HG MET 98 2.539 -3.239 3.666
738 HG3 MET 98 1HG MET 98 3.848 -2.129 4.069
739 HE1 MET 98 3HE MET 98 3.556 -4.315 0.005
740 HE2 MET 98 1HE MET 98 2.399 -4.550 1.316
741 HE3 MET 98 2HE MET 98 4.062 -5.113 1.496
742 H LYS 99 H LYS 99 2.987 -2.822 7.158
743 HA LYS 99 HA LYS 99 0.790 -4.675 7.607
744 HB2 LYS 99 2HB LYS 99 1.274 -1.917 8.762
745 HB3 LYS 99 1HB LYS 99 0.100 -3.096 9.340
746 HG2 LYS 99 2HG LYS 99 1.905 -4.590 10.010
747 HG3 LYS 99 1HG LYS 99 3.098 -3.455 9.374
748 HD2 LYS 99 2HD LYS 99 2.282 -1.759 10.994
749 HD3 LYS 99 1HD LYS 99 1.184 -2.967 11.662
750 HE2 LYS 99 2HE LYS 99 3.162 -2.819 13.041
751 HE3 LYS 99 1HE LYS 99 3.127 -4.382 12.226
752 HZ1 LYS 99 3HZ LYS 99 4.741 -3.584 10.646
753 HZ2 LYS 99 1HZ LYS 99 5.333 -3.339 12.209
754 HZ3 LYS 99 2HZ LYS 99 4.716 -2.039 11.327
755 H VAL 100 H VAL 100 -0.351 -4.665 5.668
756 HA VAL 100 HA VAL 100 -1.529 -2.126 4.761
757 HB VAL 100 HB VAL 100 -1.736 -4.842 3.434
758 HG11 VAL 100 1HG1 VAL 100 -2.269 -2.055 2.388
759 HG12 VAL 100 2HG1 VAL 100 -3.484 -3.278 2.769
760 HG13 VAL 100 3HG1 VAL 100 -2.353 -3.542 1.441
761 HG21 VAL 100 3HG2 VAL 100 0.609 -4.184 3.558
762 HG22 VAL 100 1HG2 VAL 100 0.223 -2.611 2.859
763 HG23 VAL 100 2HG2 VAL 100 0.025 -4.077 1.898
764 H GLY 101 H GLY 101 -3.367 -1.622 5.847
765 HA2 GLY 101 2HA GLY 101 -5.394 -3.752 6.206
766 HA3 GLY 101 1HA GLY 101 -4.950 -2.719 7.554
767 H HIS 102 H HIS 102 -7.581 -3.007 6.551
768 HA HIS 102 HA HIS 102 -8.455 -0.955 4.883
769 HD1 HIS 102 HD1 HIS 102 -9.153 -0.991 8.862
770 HD2 HIS 102 HD2 HIS 102 -10.731 -4.511 7.295
771 HE1 HIS 102 HE1 HIS 102 -9.492 -2.517 10.825
772 HE2 HIS 102 HE2 HIS 102 -10.552 -4.586 9.877
773 HB2 HIS 102 2HB HIS 102 -10.624 -1.113 6.201
774 HB3 HIS 102 1HB HIS 102 -10.030 -2.615 5.502
775 H VAL 103 H VAL 103 -9.091 1.171 5.170
776 HA VAL 103 HA VAL 103 -7.649 2.830 6.842
777 HB VAL 103 HB VAL 103 -10.392 3.426 5.700
778 HG11 VAL 103 1HG1 VAL 103 -9.683 5.779 5.769
779 HG12 VAL 103 2HG1 VAL 103 -8.171 5.303 6.543
780 HG13 VAL 103 3HG1 VAL 103 -9.705 5.064 7.382
781 HG21 VAL 103 3HG2 VAL 103 -8.850 2.637 3.973
782 HG22 VAL 103 1HG2 VAL 103 -7.658 3.837 4.473
783 HG23 VAL 103 2HG2 VAL 103 -9.191 4.356 3.771
784 H THR 104 H THR 104 -10.753 1.288 7.478
785 HA THR 104 HA THR 104 -11.605 2.523 9.794
786 HB THR 104 HB THR 104 -11.613 -0.465 9.251
787 HG1 THR 104 HG1 THR 104 -13.988 0.577 8.811
788 HG21 THR 104 3HG2 THR 104 -12.125 0.034 11.592
789 HG22 THR 104 1HG2 THR 104 -13.570 -0.518 10.744
790 HG23 THR 104 2HG2 THR 104 -13.351 1.197 11.089
791 H GLU 105 H GLU 105 -10.660 2.883 11.721
792 HA GLU 105 HA GLU 105 -8.090 1.811 12.340
793 HB2 GLU 105 2HB GLU 105 -9.973 3.503 13.996
794 HB3 GLU 105 1HB GLU 105 -8.320 3.115 14.458
795 HG2 GLU 105 2HG GLU 105 -7.469 4.292 12.509
796 HG3 GLU 105 1HG GLU 105 -9.113 4.616 11.963
797 H ARG 106 H ARG 106 -8.702 -0.442 12.277
798 HA ARG 106 HA ARG 106 -9.219 -2.467 13.159
799 HE ARG 106 HE ARG 106 -6.792 -3.911 15.903
800 HB2 ARG 106 2HB ARG 106 -8.124 -1.135 15.644
801 HB3 ARG 106 1HB ARG 106 -8.240 -2.871 15.379
802 HG2 ARG 106 2HG ARG 106 -6.717 -2.600 13.416
803 HG3 ARG 106 1HG ARG 106 -6.512 -0.909 13.873
804 HD2 ARG 106 2HD ARG 106 -4.672 -2.302 14.709
805 HD3 ARG 106 1HD ARG 106 -5.597 -1.585 16.030
806 HH11 ARG 106 1HH1 ARG 106 -3.411 -3.298 15.590
807 HH12 ARG 106 2HH1 ARG 106 -2.973 -4.834 16.248
808 HH21 ARG 106 1HH2 ARG 106 -6.220 -5.861 16.714
809 HH22 ARG 106 2HH2 ARG 106 -4.546 -6.270 16.882
810 H THR 107 H THR 107 -9.812 -1.308 16.382
811 HA THR 107 HA THR 107 -11.625 -1.308 17.738
812 HB THR 107 HB THR 107 -13.206 -1.070 15.171
813 HG1 THR 107 HG1 THR 107 -11.878 0.731 15.649
814 HG21 THR 107 3HG2 THR 107 -14.145 -0.740 18.030
815 HG22 THR 107 1HG2 THR 107 -14.654 -1.996 16.903
816 HG23 THR 107 2HG2 THR 107 -15.078 -0.312 16.597
817 H ASP 108 H ASP 108 -11.783 -3.613 15.055
818 HA ASP 108 HA ASP 108 -13.673 -5.345 16.314
819 HB2 ASP 108 2HB ASP 108 -13.152 -6.912 14.497
820 HB3 ASP 108 1HB ASP 108 -13.445 -5.290 13.885
Start of MODEL 10
1 HA MET 1 HA MET 1 3.040 15.079 -10.842
2 H1 MET 1 1H MET 1 2.869 13.370 -9.182
3 H2 MET 1 2H MET 1 2.313 12.789 -10.669
4 H3 MET 1 3H MET 1 1.210 13.207 -9.453
5 HB2 MET 1 2HB MET 1 0.041 14.726 -11.103
6 HB3 MET 1 1HB MET 1 0.981 16.001 -11.868
7 HG2 MET 1 2HG MET 1 0.485 14.259 -13.461
8 HG3 MET 1 1HG MET 1 2.220 14.304 -13.140
9 HE1 MET 1 3HE MET 1 1.601 10.487 -13.744
10 HE2 MET 1 1HE MET 1 2.512 11.914 -14.233
11 HE3 MET 1 2HE MET 1 0.783 11.816 -14.566
12 H GLY 2 H GLY 2 2.630 17.334 -10.347
13 HA2 GLY 2 2HA GLY 2 1.606 17.722 -7.601
14 HA3 GLY 2 1HA GLY 2 2.850 18.698 -8.360
15 H HIS 3 H HIS 3 2.281 20.434 -9.614
16 HA HIS 3 HA HIS 3 1.087 22.285 -10.114
17 HD1 HIS 3 HD1 HIS 3 0.093 18.411 -12.011
18 HD2 HIS 3 HD2 HIS 3 -3.151 20.681 -10.758
19 HE1 HIS 3 HE1 HIS 3 -1.845 16.822 -11.927
20 HE2 HIS 3 HE2 HIS 3 -3.829 18.264 -11.375
21 HB2 HIS 3 2HB HIS 3 -0.792 21.991 -11.650
22 HB3 HIS 3 1HB HIS 3 0.540 20.926 -12.059
23 H HIS 4 H HIS 4 0.452 23.481 -8.425
24 HA HIS 4 HA HIS 4 -0.793 24.329 -6.708
25 HD1 HIS 4 HD1 HIS 4 -2.462 23.760 -10.448
26 HD2 HIS 4 HD2 HIS 4 -2.955 26.704 -7.556
27 HE1 HIS 4 HE1 HIS 4 -2.648 25.920 -11.710
28 HE2 HIS 4 HE2 HIS 4 -3.157 27.639 -9.953
29 HB2 HIS 4 2HB HIS 4 -3.045 22.849 -8.100
30 HB3 HIS 4 1HB HIS 4 -3.269 24.019 -6.805
31 H HIS 5 H HIS 5 0.597 21.853 -6.297
32 HA HIS 5 HA HIS 5 -1.169 19.990 -4.962
33 HD1 HIS 5 HD1 HIS 5 2.621 17.453 -4.517
34 HD2 HIS 5 HD2 HIS 5 -1.493 17.685 -5.046
35 HE1 HIS 5 HE1 HIS 5 1.740 15.185 -3.924
36 HE2 HIS 5 HE2 HIS 5 -0.704 15.286 -4.485
37 HB2 HIS 5 2HB HIS 5 0.916 19.491 -6.432
38 HB3 HIS 5 1HB HIS 5 1.834 19.805 -4.965
39 H HIS 6 H HIS 6 0.309 22.794 -3.932
40 HA HIS 6 HA HIS 6 0.562 21.853 -1.140
41 HD1 HIS 6 HD1 HIS 6 3.749 22.916 0.010
42 HD2 HIS 6 HD2 HIS 6 3.076 22.356 -4.052
43 HE1 HIS 6 HE1 HIS 6 5.779 21.725 -0.850
44 HE2 HIS 6 HE2 HIS 6 5.406 21.505 -3.324
45 HB2 HIS 6 2HB HIS 6 1.573 24.372 -2.483
46 HB3 HIS 6 1HB HIS 6 1.689 24.070 -0.754
47 H HIS 7 H HIS 7 -1.259 23.985 -3.222
48 HA HIS 7 HA HIS 7 -2.389 25.542 -1.075
49 HD1 HIS 7 HD1 HIS 7 -5.336 26.525 -4.372
50 HD2 HIS 7 HD2 HIS 7 -3.366 28.112 -1.079
51 HE1 HIS 7 HE1 HIS 7 -6.835 28.336 -3.507
52 HE2 HIS 7 HE2 HIS 7 -5.678 29.208 -1.456
53 HB2 HIS 7 2HB HIS 7 -1.991 26.503 -3.319
54 HB3 HIS 7 1HB HIS 7 -3.188 25.403 -3.994
55 H HIS 8 H HIS 8 -4.202 25.166 0.046
56 HA HIS 8 HA HIS 8 -5.579 22.699 -0.149
57 HD1 HIS 8 HD1 HIS 8 -6.361 21.561 2.367
58 HD2 HIS 8 HD2 HIS 8 -9.095 24.631 1.762
59 HE1 HIS 8 HE1 HIS 8 -8.552 20.683 3.208
60 HE2 HIS 8 HE2 HIS 8 -10.125 22.634 3.049
61 HB2 HIS 8 2HB HIS 8 -5.318 23.987 1.960
62 HB3 HIS 8 1HB HIS 8 -6.431 25.201 1.339
63 H SER 9 H SER 9 -6.465 22.480 -2.207
64 HA SER 9 HA SER 9 -9.118 23.501 -2.535
65 HG SER 9 HG SER 9 -8.719 25.206 -5.688
66 HB2 SER 9 2HB SER 9 -7.846 25.454 -3.388
67 HB3 SER 9 1HB SER 9 -7.053 24.411 -4.569
68 H HIS 10 H HIS 10 -9.931 22.824 -4.869
69 HA HIS 10 HA HIS 10 -8.639 20.361 -5.796
70 HD1 HIS 10 HD1 HIS 10 -11.509 19.739 -2.394
71 HD2 HIS 10 HD2 HIS 10 -8.335 18.070 -4.495
72 HE1 HIS 10 HE1 HIS 10 -10.280 18.316 -0.737
73 HE2 HIS 10 HE2 HIS 10 -8.491 17.165 -2.078
74 HB2 HIS 10 2HB HIS 10 -11.478 20.494 -4.754
75 HB3 HIS 10 1HB HIS 10 -10.908 19.199 -5.803
76 H MET 11 H MET 11 -9.542 19.570 -7.869
77 HA MET 11 HA MET 11 -9.608 21.721 -9.699
78 HB2 MET 11 2HB MET 11 -9.876 19.989 -11.434
79 HB3 MET 11 1HB MET 11 -8.596 19.603 -10.293
80 HG2 MET 11 2HG MET 11 -10.131 18.069 -9.128
81 HG3 MET 11 1HG MET 11 -11.366 18.420 -10.337
82 HE1 MET 11 3HE MET 11 -10.446 15.451 -9.660
83 HE2 MET 11 1HE MET 11 -10.298 14.770 -11.280
84 HE3 MET 11 2HE MET 11 -11.648 15.836 -10.892
85 H ALA 12 H ALA 12 -12.201 19.849 -8.267
86 HA ALA 12 HA ALA 12 -14.217 20.849 -10.085
87 HB1 ALA 12 3HB ALA 12 -14.469 18.654 -9.033
88 HB2 ALA 12 1HB ALA 12 -15.812 19.719 -8.619
89 HB3 ALA 12 2HB ALA 12 -14.529 19.415 -7.445
90 H ALA 13 H ALA 13 -13.660 21.261 -6.581
91 HA ALA 13 HA ALA 13 -13.877 23.015 -5.166
92 HB1 ALA 13 3HB ALA 13 -13.713 25.277 -5.980
93 HB2 ALA 13 1HB ALA 13 -14.120 24.756 -7.615
94 HB3 ALA 13 2HB ALA 13 -12.598 24.247 -6.882
95 H ALA 14 H ALA 14 -16.088 23.931 -7.832
96 HA ALA 14 HA ALA 14 -17.972 25.276 -6.382
97 HB1 ALA 14 3HB ALA 14 -18.494 23.563 -8.808
98 HB2 ALA 14 1HB ALA 14 -17.908 25.227 -8.816
99 HB3 ALA 14 2HB ALA 14 -19.527 24.866 -8.216
100 H MET 15 H MET 15 -18.389 21.829 -7.321
101 HA MET 15 HA MET 15 -20.461 21.631 -5.228
102 HB2 MET 15 2HB MET 15 -21.208 19.590 -6.596
103 HB3 MET 15 1HB MET 15 -21.510 21.183 -7.270
104 HG2 MET 15 2HG MET 15 -20.721 19.616 -8.964
105 HG3 MET 15 1HG MET 15 -19.604 20.961 -8.747
106 HE1 MET 15 3HE MET 15 -17.773 19.534 -10.112
107 HE2 MET 15 1HE MET 15 -18.921 18.199 -10.257
108 HE3 MET 15 2HE MET 15 -17.292 17.901 -9.658
109 H ALA 16 H ALA 16 -17.693 21.327 -4.551
110 HA ALA 16 HA ALA 16 -16.851 18.654 -4.356
111 HB1 ALA 16 3HB ALA 16 -16.251 20.916 -2.446
112 HB2 ALA 16 1HB ALA 16 -15.389 20.591 -3.951
113 HB3 ALA 16 2HB ALA 16 -15.325 19.425 -2.629
114 H ASN 17 H ASN 17 -18.179 17.103 -3.567
115 HA ASN 17 HA ASN 17 -19.582 17.562 -1.005
116 HB2 ASN 17 2HB ASN 17 -21.097 17.093 -2.836
117 HB3 ASN 17 1HB ASN 17 -20.178 15.662 -3.287
118 HD21 ASN 17 1HD2 ASN 17 -21.825 14.227 -3.049
119 HD22 ASN 17 2HD2 ASN 17 -22.537 13.831 -1.527
120 H ASN 18 H ASN 18 -17.771 15.079 -2.807
121 HA ASN 18 HA ASN 18 -17.836 12.807 -1.558
122 HB2 ASN 18 2HB ASN 18 -15.191 14.176 -2.074
123 HB3 ASN 18 1HB ASN 18 -15.416 12.442 -1.869
124 HD21 ASN 18 1HD2 ASN 18 -16.537 11.286 -3.473
125 HD22 ASN 18 2HD2 ASN 18 -16.712 11.907 -5.073
126 H LEU 19 H LEU 19 -18.238 12.302 0.500
127 HA LEU 19 HA LEU 19 -17.191 13.847 2.701
128 HG LEU 19 HG LEU 19 -20.105 13.235 1.676
129 HB2 LEU 19 2HB LEU 19 -18.891 11.349 2.688
130 HB3 LEU 19 1HB LEU 19 -18.539 12.325 4.103
131 HD11 LEU 19 1HD1 LEU 19 -22.024 13.254 3.200
132 HD12 LEU 19 2HD1 LEU 19 -21.015 12.579 4.480
133 HD13 LEU 19 3HD1 LEU 19 -21.346 11.635 3.027
134 HD21 LEU 19 3HD2 LEU 19 -20.595 15.245 3.019
135 HD22 LEU 19 1HD2 LEU 19 -18.878 15.091 2.649
136 HD23 LEU 19 2HD2 LEU 19 -19.473 14.680 4.257
137 H GLN 20 H GLN 20 -15.569 11.681 0.969
138 HA GLN 20 HA GLN 20 -13.646 10.512 1.313
139 HB2 GLN 20 2HB GLN 20 -13.821 11.919 3.980
140 HB3 GLN 20 1HB GLN 20 -12.482 10.854 3.571
141 HG2 GLN 20 2HG GLN 20 -13.265 13.257 1.938
142 HG3 GLN 20 1HG GLN 20 -12.053 13.288 3.218
143 HE21 GLN 20 1HE2 GLN 20 -11.754 13.807 0.356
144 HE22 GLN 20 2HE2 GLN 20 -10.553 12.700 -0.200
145 H LYS 21 H LYS 21 -12.600 9.145 3.478
146 HA LYS 21 HA LYS 21 -12.665 7.245 4.685
147 HB2 LYS 21 2HB LYS 21 -15.636 7.793 4.827
148 HB3 LYS 21 1HB LYS 21 -14.831 6.505 5.715
149 HG2 LYS 21 2HG LYS 21 -13.419 8.203 6.836
150 HG3 LYS 21 1HG LYS 21 -14.314 9.466 5.993
151 HD2 LYS 21 2HD LYS 21 -16.372 8.796 7.105
152 HD3 LYS 21 1HD LYS 21 -15.537 7.454 7.891
153 HE2 LYS 21 2HE LYS 21 -14.082 9.062 9.057
154 HE3 LYS 21 1HE LYS 21 -14.955 10.390 8.294
155 HZ1 LYS 21 3HZ LYS 21 -15.740 9.990 10.535
156 HZ2 LYS 21 1HZ LYS 21 -16.128 8.390 10.144
157 HZ3 LYS 21 2HZ LYS 21 -16.962 9.666 9.415
158 H GLY 22 H GLY 22 -15.726 6.888 2.818
159 HA2 GLY 22 2HA GLY 22 -14.622 5.048 0.960
160 HA3 GLY 22 1HA GLY 22 -15.352 4.161 2.286
161 H SER 23 H SER 23 -17.320 3.462 1.825
162 HA SER 23 HA SER 23 -19.426 3.263 1.010
163 HG SER 23 HG SER 23 -18.797 6.567 0.286
164 HB2 SER 23 2HB SER 23 -20.886 5.198 1.097
165 HB3 SER 23 1HB SER 23 -19.783 5.250 2.468
166 H ALA 24 H ALA 24 -17.191 3.603 -0.968
167 HA ALA 24 HA ALA 24 -18.872 3.998 -3.325
168 HB1 ALA 24 3HB ALA 24 -17.290 5.523 -4.398
169 HB2 ALA 24 1HB ALA 24 -16.299 5.534 -2.938
170 HB3 ALA 24 2HB ALA 24 -17.927 6.213 -2.905
171 H GLY 25 H GLY 25 -17.461 3.562 -5.390
172 HA2 GLY 25 2HA GLY 25 -16.479 0.919 -5.262
173 HA3 GLY 25 1HA GLY 25 -16.333 2.000 -6.635
174 HA PRO 26 HA PRO 26 -11.971 2.894 -6.020
175 HB2 PRO 26 2HB PRO 26 -12.622 5.517 -4.718
176 HB3 PRO 26 1HB PRO 26 -11.473 5.158 -6.016
177 HG2 PRO 26 2HG PRO 26 -13.818 6.284 -6.573
178 HG3 PRO 26 1HG PRO 26 -13.141 5.036 -7.634
179 HD2 PRO 26 2HD PRO 26 -15.377 4.834 -5.664
180 HD3 PRO 26 1HD PRO 26 -15.168 4.017 -7.226
181 H MET 27 H MET 27 -10.847 1.812 -4.504
182 HA MET 27 HA MET 27 -11.635 2.133 -1.675
183 HB2 MET 27 2HB MET 27 -12.150 -0.079 -2.652
184 HB3 MET 27 1HB MET 27 -10.450 -0.297 -3.038
185 HG2 MET 27 2HG MET 27 -9.888 -0.296 -0.677
186 HG3 MET 27 1HG MET 27 -11.572 0.018 -0.260
187 HE1 MET 27 3HE MET 27 -11.493 -2.105 1.402
188 HE2 MET 27 1HE MET 27 -9.816 -2.404 0.938
189 HE3 MET 27 2HE MET 27 -10.993 -3.715 0.887
190 H ARG 28 H ARG 28 -10.163 2.974 -0.358
191 HA ARG 28 HA ARG 28 -7.369 3.141 -1.263
192 HE ARG 28 HE ARG 28 -8.372 6.732 1.980
193 HB2 ARG 28 2HB ARG 28 -8.508 5.270 -0.843
194 HB3 ARG 28 1HB ARG 28 -8.868 4.776 0.802
195 HG2 ARG 28 2HG ARG 28 -6.616 4.950 1.462
196 HG3 ARG 28 1HG ARG 28 -6.047 4.995 -0.207
197 HD2 ARG 28 2HD ARG 28 -5.952 7.212 0.844
198 HD3 ARG 28 1HD ARG 28 -7.058 7.181 -0.529
199 HH11 ARG 28 1HH1 ARG 28 -7.191 9.165 -0.166
200 HH12 ARG 28 2HH1 ARG 28 -8.252 10.376 0.456
201 HH21 ARG 28 1HH2 ARG 28 -9.745 8.279 2.741
202 HH22 ARG 28 2HH2 ARG 28 -9.710 9.874 2.066
203 H LEU 29 H LEU 29 -5.706 2.307 -0.076
204 HA LEU 29 HA LEU 29 -6.437 0.663 2.257
205 HG LEU 29 HG LEU 29 -6.147 -0.434 -0.687
206 HB2 LEU 29 2HB LEU 29 -4.104 0.413 0.356
207 HB3 LEU 29 1HB LEU 29 -4.370 -0.612 1.754
208 HD11 LEU 29 1HD1 LEU 29 -4.064 -1.599 -1.135
209 HD12 LEU 29 2HD1 LEU 29 -5.404 -2.743 -1.081
210 HD13 LEU 29 3HD1 LEU 29 -4.299 -2.616 0.287
211 HD21 LEU 29 3HD2 LEU 29 -7.482 -0.858 1.304
212 HD22 LEU 29 1HD2 LEU 29 -6.398 -2.168 1.778
213 HD23 LEU 29 2HD2 LEU 29 -7.376 -2.315 0.316
214 H TYR 30 H TYR 30 -5.207 0.660 4.102
215 HA TYR 30 HA TYR 30 -3.403 2.926 4.541
216 HD1 TYR 30 HD2 TYR 30 -2.897 4.110 7.056
217 HD2 TYR 30 HD1 TYR 30 -3.539 -0.007 7.953
218 HE1 TYR 30 HE2 TYR 30 -1.265 4.257 8.890
219 HE2 TYR 30 HE1 TYR 30 -1.906 0.131 9.784
220 HH TYR 30 HH TYR 30 -0.658 3.118 10.933
221 HB2 TYR 30 2HB TYR 30 -4.989 2.792 6.280
222 HB3 TYR 30 1HB TYR 30 -4.902 1.035 6.354
223 H VAL 31 H VAL 31 -1.310 2.542 4.079
224 HA VAL 31 HA VAL 31 -0.178 -0.112 4.690
225 HB VAL 31 HB VAL 31 0.984 2.010 2.872
226 HG11 VAL 31 1HG1 VAL 31 1.755 -0.883 3.299
227 HG12 VAL 31 2HG1 VAL 31 2.674 0.530 3.815
228 HG13 VAL 31 3HG1 VAL 31 2.459 0.199 2.098
229 HG21 VAL 31 3HG2 VAL 31 -1.101 1.175 1.935
230 HG22 VAL 31 1HG2 VAL 31 -0.564 -0.489 2.166
231 HG23 VAL 31 2HG2 VAL 31 0.268 0.556 1.012
232 H GLY 32 H GLY 32 0.472 0.037 6.794
233 HA2 GLY 32 2HA GLY 32 2.094 2.348 7.633
234 HA3 GLY 32 1HA GLY 32 1.354 1.167 8.698
235 H SER 33 H SER 33 4.046 1.815 6.562
236 HA SER 33 HA SER 33 5.871 0.356 8.171
237 HG SER 33 HG SER 33 6.654 -2.512 7.074
238 HB2 SER 33 2HB SER 33 4.776 -1.582 7.026
239 HB3 SER 33 1HB SER 33 5.293 -0.920 5.476
240 H LEU 34 H LEU 34 5.483 2.951 6.710
241 HA LEU 34 HA LEU 34 7.475 3.057 4.656
242 HG LEU 34 HG LEU 34 4.468 4.290 5.042
243 HB2 LEU 34 2HB LEU 34 6.283 5.331 6.255
244 HB3 LEU 34 1HB LEU 34 7.227 5.497 4.788
245 HD11 LEU 34 1HD1 LEU 34 3.820 6.131 3.563
246 HD12 LEU 34 2HD1 LEU 34 5.476 6.744 3.601
247 HD13 LEU 34 3HD1 LEU 34 4.507 6.721 5.077
248 HD21 LEU 34 3HD2 LEU 34 6.237 4.473 2.601
249 HD22 LEU 34 1HD2 LEU 34 4.545 3.979 2.608
250 HD23 LEU 34 2HD2 LEU 34 5.756 2.992 3.427
251 H HIS 35 H HIS 35 9.514 2.575 5.175
252 HA HIS 35 HA HIS 35 10.597 3.039 7.800
253 HD1 HIS 35 HD1 HIS 35 11.348 -0.290 4.576
254 HD2 HIS 35 HD2 HIS 35 9.873 0.606 8.343
255 HE1 HIS 35 HE1 HIS 35 9.839 -2.203 5.177
256 HE2 HIS 35 HE2 HIS 35 8.795 -1.519 7.359
257 HB2 HIS 35 2HB HIS 35 12.004 2.004 5.326
258 HB3 HIS 35 1HB HIS 35 12.516 1.799 7.003
259 H PHE 36 H PHE 36 9.936 5.472 6.408
260 HA PHE 36 HA PHE 36 10.709 7.581 6.172
261 HD1 PHE 36 HD1 PHE 36 10.755 9.143 8.455
262 HD2 PHE 36 HD2 PHE 36 12.278 5.258 9.341
263 HE1 PHE 36 HE1 PHE 36 9.501 9.134 10.571
264 HE2 PHE 36 HE2 PHE 36 11.022 5.250 11.458
265 HZ PHE 36 HZ PHE 36 9.635 7.188 12.075
266 HB2 PHE 36 2HB PHE 36 13.180 6.489 7.538
267 HB3 PHE 36 1HB PHE 36 12.806 8.198 7.327
268 H ASN 37 H ASN 37 11.629 5.291 4.200
269 HA ASN 37 HA ASN 37 13.005 7.182 2.451
270 HB2 ASN 37 2HB ASN 37 14.770 5.594 1.832
271 HB3 ASN 37 1HB ASN 37 14.838 5.960 3.553
272 HD21 ASN 37 1HD2 ASN 37 14.294 4.354 5.039
273 HD22 ASN 37 2HD2 ASN 37 14.206 2.691 4.580
274 H ILE 38 H ILE 38 10.430 5.396 2.763
275 HA ILE 38 HA ILE 38 10.489 3.815 0.325
276 HB ILE 38 HB ILE 38 8.097 4.408 2.079
277 HG12 ILE 38 2HG1 ILE 38 9.876 3.402 3.442
278 HG13 ILE 38 1HG1 ILE 38 8.549 2.271 3.209
279 HG21 ILE 38 1HG2 ILE 38 8.638 2.209 0.078
280 HG22 ILE 38 2HG2 ILE 38 7.492 3.540 -0.096
281 HG23 ILE 38 3HG2 ILE 38 7.221 2.302 1.129
282 HD11 ILE 38 3HD1 ILE 38 9.847 1.090 1.519
283 HD12 ILE 38 1HD1 ILE 38 10.705 1.171 3.059
284 HD13 ILE 38 2HD1 ILE 38 11.171 2.235 1.729
285 H THR 39 H THR 39 9.406 4.299 -1.602
286 HA THR 39 HA THR 39 8.460 7.095 -1.838
287 HB THR 39 HB THR 39 9.266 7.077 -4.157
288 HG1 THR 39 HG1 THR 39 10.893 5.010 -4.227
289 HG21 THR 39 3HG2 THR 39 11.393 6.244 -2.169
290 HG22 THR 39 1HG2 THR 39 10.777 7.882 -2.401
291 HG23 THR 39 2HG2 THR 39 11.680 7.088 -3.692
292 H GLU 40 H GLU 40 6.934 7.543 -3.551
293 HA GLU 40 HA GLU 40 4.641 5.969 -3.593
294 HB2 GLU 40 2HB GLU 40 5.566 7.928 -5.715
295 HB3 GLU 40 1HB GLU 40 3.909 7.391 -5.459
296 HG2 GLU 40 2HG GLU 40 3.729 8.574 -3.424
297 HG3 GLU 40 1HG GLU 40 5.474 8.817 -3.320
298 H ASP 41 H ASP 41 7.356 6.051 -5.860
299 HA ASP 41 HA ASP 41 6.227 4.397 -7.851
300 HB2 ASP 41 2HB ASP 41 8.133 5.857 -8.295
301 HB3 ASP 41 1HB ASP 41 9.134 4.927 -7.184
302 H MET 42 H MET 42 8.218 3.658 -5.011
303 HA MET 42 HA MET 42 8.613 0.908 -5.496
304 HB2 MET 42 2HB MET 42 9.888 2.092 -3.792
305 HB3 MET 42 1HB MET 42 8.423 2.428 -2.881
306 HG2 MET 42 2HG MET 42 8.136 0.001 -2.511
307 HG3 MET 42 1HG MET 42 9.661 -0.280 -3.348
308 HE1 MET 42 3HE MET 42 12.254 1.387 -0.953
309 HE2 MET 42 1HE MET 42 11.486 2.102 -2.371
310 HE3 MET 42 2HE MET 42 12.024 0.424 -2.412
311 H LEU 43 H LEU 43 6.181 2.554 -3.494
312 HA LEU 43 HA LEU 43 4.620 0.370 -2.768
313 HG LEU 43 HG LEU 43 5.518 2.997 -1.577
314 HB2 LEU 43 2HB LEU 43 3.731 3.203 -3.361
315 HB3 LEU 43 1HB LEU 43 2.802 2.018 -2.460
316 HD11 LEU 43 1HD1 LEU 43 4.329 4.417 0.026
317 HD12 LEU 43 2HD1 LEU 43 2.796 3.984 -0.733
318 HD13 LEU 43 3HD1 LEU 43 4.010 4.887 -1.642
319 HD21 LEU 43 3HD2 LEU 43 4.867 2.067 0.584
320 HD22 LEU 43 1HD2 LEU 43 4.838 0.827 -0.669
321 HD23 LEU 43 2HD2 LEU 43 3.328 1.536 -0.096
322 H ARG 44 H ARG 44 4.108 2.572 -5.547
323 HA ARG 44 HA ARG 44 1.925 1.290 -6.688
324 HE ARG 44 HE ARG 44 1.914 2.335 -11.703
325 HB2 ARG 44 2HB ARG 44 2.772 3.487 -7.425
326 HB3 ARG 44 1HB ARG 44 4.181 2.707 -8.131
327 HG2 ARG 44 2HG ARG 44 2.775 1.526 -9.710
328 HG3 ARG 44 1HG ARG 44 1.330 2.215 -8.973
329 HD2 ARG 44 2HD ARG 44 1.940 4.425 -9.699
330 HD3 ARG 44 1HD ARG 44 3.517 3.853 -10.258
331 HH11 ARG 44 1HH1 ARG 44 1.665 5.716 -11.088
332 HH12 ARG 44 2HH1 ARG 44 0.944 6.040 -12.621
333 HH21 ARG 44 1HH2 ARG 44 0.982 2.750 -13.638
334 HH22 ARG 44 2HH2 ARG 44 0.536 4.368 -14.057
335 H GLY 45 H GLY 45 5.388 0.680 -7.263
336 HA2 GLY 45 2HA GLY 45 5.129 -1.231 -9.302
337 HA3 GLY 45 1HA GLY 45 6.501 -1.086 -8.214
338 H ILE 46 H ILE 46 4.876 -1.613 -5.809
339 HA ILE 46 HA ILE 46 4.911 -4.514 -5.968
340 HB ILE 46 HB ILE 46 4.309 -2.697 -3.620
341 HG12 ILE 46 2HG1 ILE 46 6.842 -4.207 -4.337
342 HG13 ILE 46 1HG1 ILE 46 6.612 -2.469 -4.504
343 HG21 ILE 46 1HG2 ILE 46 3.306 -4.902 -3.315
344 HG22 ILE 46 2HG2 ILE 46 4.672 -4.685 -2.224
345 HG23 ILE 46 3HG2 ILE 46 4.852 -5.672 -3.675
346 HD11 ILE 46 3HD1 ILE 46 7.890 -2.991 -2.520
347 HD12 ILE 46 1HD1 ILE 46 6.588 -4.021 -1.926
348 HD13 ILE 46 2HD1 ILE 46 6.335 -2.282 -2.083
349 H PHE 47 H PHE 47 2.489 -1.965 -5.599
350 HA PHE 47 HA PHE 47 0.389 -3.854 -4.950
351 HD1 PHE 47 HD2 PHE 47 2.306 -1.336 -3.377
352 HD2 PHE 47 HD1 PHE 47 -1.813 -2.282 -2.853
353 HE1 PHE 47 HE2 PHE 47 2.635 -1.401 -0.944
354 HE2 PHE 47 HE1 PHE 47 -1.485 -2.351 -0.418
355 HZ PHE 47 HZ PHE 47 0.740 -1.910 0.542
356 HB2 PHE 47 2HB PHE 47 0.485 -0.857 -5.165
357 HB3 PHE 47 1HB PHE 47 -1.044 -1.711 -4.984
358 H GLU 48 H GLU 48 1.376 -2.081 -7.862
359 HA GLU 48 HA GLU 48 -1.032 -2.282 -9.286
360 HB2 GLU 48 2HB GLU 48 1.816 -2.080 -10.205
361 HB3 GLU 48 1HB GLU 48 0.524 -2.330 -11.372
362 HG2 GLU 48 2HG GLU 48 -0.591 -0.281 -10.326
363 HG3 GLU 48 1HG GLU 48 0.961 0.011 -9.544
364 HA PRO 49 HA PRO 49 0.719 -6.751 -10.815
365 HB2 PRO 49 2HB PRO 49 1.373 -7.358 -7.941
366 HB3 PRO 49 1HB PRO 49 2.017 -8.092 -9.418
367 HG2 PRO 49 2HG PRO 49 3.435 -6.260 -8.132
368 HG3 PRO 49 1HG PRO 49 3.365 -6.253 -9.903
369 HD2 PRO 49 2HD PRO 49 2.044 -4.431 -7.952
370 HD3 PRO 49 1HD PRO 49 2.620 -4.100 -9.597
371 H PHE 50 H PHE 50 -1.149 -5.524 -8.136
372 HA PHE 50 HA PHE 50 -3.001 -7.810 -8.285
373 HD1 PHE 50 HD1 PHE 50 -3.211 -9.147 -5.696
374 HD2 PHE 50 HD2 PHE 50 -0.543 -5.826 -5.645
375 HE1 PHE 50 HE1 PHE 50 -1.578 -10.482 -4.435
376 HE2 PHE 50 HE2 PHE 50 1.097 -7.158 -4.383
377 HZ PHE 50 HZ PHE 50 0.579 -9.487 -3.777
378 HB2 PHE 50 2HB PHE 50 -2.845 -5.540 -6.286
379 HB3 PHE 50 1HB PHE 50 -3.987 -6.881 -6.214
380 H GLY 51 H GLY 51 -2.727 -4.461 -9.169
381 HA2 GLY 51 2HA GLY 51 -5.082 -4.532 -10.755
382 HA3 GLY 51 1HA GLY 51 -5.399 -3.659 -9.266
383 H ARG 52 H ARG 52 -5.437 -1.538 -9.756
384 HA ARG 52 HA ARG 52 -3.022 -0.318 -10.831
385 HE ARG 52 HE ARG 52 -2.528 2.756 -14.353
386 HB2 ARG 52 2HB ARG 52 -4.793 -0.909 -12.706
387 HB3 ARG 52 1HB ARG 52 -5.606 0.526 -12.112
388 HG2 ARG 52 2HG ARG 52 -2.748 0.497 -13.082
389 HG3 ARG 52 1HG ARG 52 -4.132 0.877 -14.102
390 HD2 ARG 52 2HD ARG 52 -4.678 2.738 -12.508
391 HD3 ARG 52 1HD ARG 52 -3.151 2.405 -11.692
392 HH11 ARG 52 1HH1 ARG 52 -3.883 4.650 -11.817
393 HH12 ARG 52 2HH1 ARG 52 -3.425 6.151 -12.539
394 HH21 ARG 52 1HH2 ARG 52 -1.922 4.700 -15.261
395 HH22 ARG 52 2HH2 ARG 52 -2.331 6.176 -14.464
396 H ILE 53 H ILE 53 -2.563 1.438 -9.672
397 HA ILE 53 HA ILE 53 -4.499 2.450 -7.748
398 HB ILE 53 HB ILE 53 -1.583 3.155 -8.170
399 HG12 ILE 53 2HG1 ILE 53 -1.385 1.938 -5.903
400 HG13 ILE 53 1HG1 ILE 53 -2.987 1.297 -6.241
401 HG21 ILE 53 1HG2 ILE 53 -1.733 4.248 -5.950
402 HG22 ILE 53 2HG2 ILE 53 -3.478 3.991 -5.971
403 HG23 ILE 53 3HG2 ILE 53 -2.726 5.037 -7.177
404 HD11 ILE 53 3HD1 ILE 53 -2.128 0.242 -8.270
405 HD12 ILE 53 1HD1 ILE 53 -1.257 -0.289 -6.831
406 HD13 ILE 53 2HD1 ILE 53 -0.524 0.890 -7.920
407 H GLU 54 H GLU 54 -5.459 4.468 -7.792
408 HA GLU 54 HA GLU 54 -5.170 6.084 -10.190
409 HB2 GLU 54 2HB GLU 54 -6.910 6.425 -7.736
410 HB3 GLU 54 1HB GLU 54 -6.908 7.540 -9.096
411 HG2 GLU 54 2HG GLU 54 -7.536 5.587 -10.558
412 HG3 GLU 54 1HG GLU 54 -7.773 4.660 -9.074
413 H SER 55 H SER 55 -4.798 6.673 -6.691
414 HA SER 55 HA SER 55 -2.624 8.564 -7.245
415 HG SER 55 HG SER 55 -5.408 9.719 -7.700
416 HB2 SER 55 2HB SER 55 -5.049 9.227 -5.546
417 HB3 SER 55 1HB SER 55 -3.572 10.189 -5.582
418 H ILE 56 H ILE 56 -0.997 8.519 -5.725
419 HA ILE 56 HA ILE 56 -1.388 6.700 -3.427
420 HB ILE 56 HB ILE 56 1.200 7.548 -4.751
421 HG12 ILE 56 2HG1 ILE 56 -0.262 4.892 -4.855
422 HG13 ILE 56 1HG1 ILE 56 -0.202 6.066 -6.166
423 HG21 ILE 56 1HG2 ILE 56 2.244 5.812 -3.360
424 HG22 ILE 56 2HG2 ILE 56 0.693 5.512 -2.576
425 HG23 ILE 56 3HG2 ILE 56 1.494 7.069 -2.378
426 HD11 ILE 56 3HD1 ILE 56 2.118 4.530 -5.023
427 HD12 ILE 56 1HD1 ILE 56 2.239 5.768 -6.273
428 HD13 ILE 56 2HD1 ILE 56 1.345 4.283 -6.590
429 H GLN 57 H GLN 57 -1.762 7.762 -1.577
430 HA GLN 57 HA GLN 57 -0.488 10.386 -1.141
431 HB2 GLN 57 2HB GLN 57 -2.978 10.291 -1.023
432 HB3 GLN 57 1HB GLN 57 -2.849 9.151 0.308
433 HG2 GLN 57 2HG GLN 57 -3.310 11.354 1.165
434 HG3 GLN 57 1HG GLN 57 -1.683 10.869 1.638
435 HE21 GLN 57 1HE2 GLN 57 -3.565 12.983 -0.374
436 HE22 GLN 57 2HE2 GLN 57 -2.281 14.059 -0.779
437 H LEU 58 H LEU 58 1.090 10.556 0.351
438 HA LEU 58 HA LEU 58 1.375 8.390 2.341
439 HG LEU 58 HG LEU 58 3.140 7.254 1.036
440 HB2 LEU 58 2HB LEU 58 3.462 10.254 1.191
441 HB3 LEU 58 1HB LEU 58 3.749 9.206 2.568
442 HD11 LEU 58 1HD1 LEU 58 3.543 9.354 -1.094
443 HD12 LEU 58 2HD1 LEU 58 2.042 8.498 -0.733
444 HD13 LEU 58 3HD1 LEU 58 3.430 7.612 -1.364
445 HD21 LEU 58 3HD2 LEU 58 5.381 7.151 0.070
446 HD22 LEU 58 1HD2 LEU 58 5.424 7.722 1.737
447 HD23 LEU 58 2HD2 LEU 58 5.614 8.867 0.407
448 H MET 59 H MET 59 1.798 8.941 4.522
449 HA MET 59 HA MET 59 0.733 11.562 5.258
450 HB2 MET 59 2HB MET 59 1.374 9.140 6.965
451 HB3 MET 59 1HB MET 59 0.638 10.625 7.551
452 HG2 MET 59 2HG MET 59 -0.554 8.765 5.501
453 HG3 MET 59 1HG MET 59 -1.018 8.866 7.198
454 HE1 MET 59 3HE MET 59 -0.910 12.000 7.745
455 HE2 MET 59 1HE MET 59 -2.237 10.968 8.283
456 HE3 MET 59 2HE MET 59 -2.580 12.456 7.402
457 H MET 60 H MET 60 2.233 13.097 5.203
458 HA MET 60 HA MET 60 4.803 12.609 6.578
459 HB2 MET 60 2HB MET 60 4.226 14.403 4.206
460 HB3 MET 60 1HB MET 60 5.748 14.387 5.084
461 HG2 MET 60 2HG MET 60 6.016 11.995 4.491
462 HG3 MET 60 1HG MET 60 4.550 12.105 3.522
463 HE1 MET 60 3HE MET 60 5.591 14.580 0.685
464 HE2 MET 60 1HE MET 60 4.823 15.028 2.208
465 HE3 MET 60 2HE MET 60 4.307 13.573 1.353
466 H ASP 61 H ASP 61 5.765 14.464 7.626
467 HA ASP 61 HA ASP 61 4.167 15.796 9.429
468 HB2 ASP 61 2HB ASP 61 6.539 15.534 9.773
469 HB3 ASP 61 1HB ASP 61 6.904 16.514 8.357
470 H SER 62 H SER 62 4.777 16.648 6.133
471 HA SER 62 HA SER 62 3.729 18.108 4.747
472 HG SER 62 HG SER 62 1.800 16.822 6.416
473 HB2 SER 62 2HB SER 62 2.199 18.986 7.207
474 HB3 SER 62 1HB SER 62 1.864 19.541 5.567
475 H GLU 63 H GLU 63 4.956 19.502 7.772
476 HA GLU 63 HA GLU 63 5.459 22.071 6.500
477 HB2 GLU 63 2HB GLU 63 4.841 21.628 8.999
478 HB3 GLU 63 1HB GLU 63 6.542 21.233 9.189
479 HG2 GLU 63 2HG GLU 63 5.461 23.870 8.199
480 HG3 GLU 63 1HG GLU 63 6.004 23.542 9.840
481 H THR 64 H THR 64 7.579 19.862 8.310
482 HA THR 64 HA THR 64 9.963 20.673 6.951
483 HB THR 64 HB THR 64 11.054 18.843 8.167
484 HG1 THR 64 HG1 THR 64 8.681 18.097 9.453
485 HG21 THR 64 3HG2 THR 64 9.047 20.297 9.894
486 HG22 THR 64 1HG2 THR 64 10.631 20.907 9.410
487 HG23 THR 64 2HG2 THR 64 10.513 19.501 10.470
488 H GLY 65 H GLY 65 7.653 18.069 6.618
489 HA2 GLY 65 2HA GLY 65 7.175 16.951 4.603
490 HA3 GLY 65 1HA GLY 65 8.734 17.456 3.979
491 H ARG 66 H ARG 66 8.605 16.026 7.134
492 HA ARG 66 HA ARG 66 10.137 13.730 6.203
493 HE ARG 66 HE ARG 66 12.257 13.207 9.664
494 HB2 ARG 66 2HB ARG 66 9.246 14.407 9.017
495 HB3 ARG 66 1HB ARG 66 10.462 13.220 8.560
496 HG2 ARG 66 2HG ARG 66 11.841 15.054 7.621
497 HG3 ARG 66 1HG ARG 66 10.646 16.209 8.209
498 HD2 ARG 66 2HD ARG 66 12.406 16.138 9.815
499 HD3 ARG 66 1HD ARG 66 11.028 15.288 10.516
500 HH11 ARG 66 1HH1 ARG 66 13.807 16.059 10.804
501 HH12 ARG 66 2HH1 ARG 66 15.231 15.225 11.309
502 HH21 ARG 66 1HH2 ARG 66 14.088 12.136 10.308
503 HH22 ARG 66 2HH2 ARG 66 15.383 13.021 11.044
504 H SER 67 H SER 67 9.562 11.505 6.982
505 HA SER 67 HA SER 67 6.799 10.992 6.261
506 HG SER 67 HG SER 67 7.408 7.815 5.419
507 HB2 SER 67 2HB SER 67 8.572 9.594 5.301
508 HB3 SER 67 1HB SER 67 9.028 9.044 6.911
509 H LYS 68 H LYS 68 5.195 10.131 7.521
510 HA LYS 68 HA LYS 68 5.616 10.109 10.412
511 HB2 LYS 68 2HB LYS 68 3.093 9.838 8.760
512 HB3 LYS 68 1HB LYS 68 3.138 9.864 10.520
513 HG2 LYS 68 2HG LYS 68 4.018 12.128 10.494
514 HG3 LYS 68 1HG LYS 68 4.074 12.111 8.731
515 HD2 LYS 68 2HD LYS 68 2.114 13.327 9.530
516 HD3 LYS 68 1HD LYS 68 1.631 11.875 8.655
517 HE2 LYS 68 2HE LYS 68 0.283 12.160 10.666
518 HE3 LYS 68 1HE LYS 68 1.280 10.711 10.791
519 HZ1 LYS 68 3HZ LYS 68 2.830 11.925 12.178
520 HZ2 LYS 68 1HZ LYS 68 1.278 12.002 12.843
521 HZ3 LYS 68 2HZ LYS 68 1.912 13.337 12.025
522 H GLY 69 H GLY 69 5.884 7.895 7.958
523 HA2 GLY 69 2HA GLY 69 6.626 5.685 8.388
524 HA3 GLY 69 1HA GLY 69 5.762 5.706 9.911
525 H TYR 70 H TYR 70 3.528 6.861 7.838
526 HA TYR 70 HA TYR 70 2.721 4.287 6.722
527 HD1 TYR 70 HD1 TYR 70 -0.228 7.189 7.938
528 HD2 TYR 70 HD2 TYR 70 2.288 5.135 10.695
529 HE1 TYR 70 HE1 TYR 70 -0.594 8.970 9.594
530 HE2 TYR 70 HE2 TYR 70 1.926 6.911 12.354
531 HH TYR 70 HH TYR 70 1.264 9.213 12.482
532 HB2 TYR 70 2HB TYR 70 0.341 4.744 7.673
533 HB3 TYR 70 1HB TYR 70 1.557 4.029 8.720
534 H GLY 71 H GLY 71 0.982 4.410 5.157
535 HA2 GLY 71 2HA GLY 71 0.411 7.086 4.069
536 HA3 GLY 71 1HA GLY 71 1.269 5.946 3.048
537 H PHE 72 H PHE 72 -1.217 7.081 2.354
538 HA PHE 72 HA PHE 72 -3.003 4.732 2.459
539 HD1 PHE 72 HD2 PHE 72 -5.553 4.943 3.969
540 HD2 PHE 72 HD1 PHE 72 -2.834 8.177 4.528
541 HE1 PHE 72 HE2 PHE 72 -5.906 4.820 6.399
542 HE2 PHE 72 HE1 PHE 72 -3.186 8.052 6.961
543 HZ PHE 72 HZ PHE 72 -4.724 6.373 7.895
544 HB2 PHE 72 2HB PHE 72 -3.723 7.669 2.335
545 HB3 PHE 72 1HB PHE 72 -4.883 6.365 2.103
546 H ILE 73 H ILE 73 -3.152 3.700 0.575
547 HA ILE 73 HA ILE 73 -2.576 5.155 -1.932
548 HB ILE 73 HB ILE 73 -2.521 2.179 -1.372
549 HG12 ILE 73 2HG1 ILE 73 -0.254 4.143 -1.831
550 HG13 ILE 73 1HG1 ILE 73 -0.707 3.455 -0.279
551 HG21 ILE 73 1HG2 ILE 73 -1.759 3.700 -3.872
552 HG22 ILE 73 2HG2 ILE 73 -3.137 2.616 -3.683
553 HG23 ILE 73 3HG2 ILE 73 -1.498 1.976 -3.601
554 HD11 ILE 73 3HD1 ILE 73 0.315 1.922 -2.658
555 HD12 ILE 73 1HD1 ILE 73 -0.141 1.228 -1.103
556 HD13 ILE 73 2HD1 ILE 73 1.230 2.331 -1.208
557 H THR 74 H THR 74 -4.145 5.475 -3.411
558 HA THR 74 HA THR 74 -6.818 4.364 -2.849
559 HB THR 74 HB THR 74 -6.064 6.684 -4.652
560 HG1 THR 74 HG1 THR 74 -6.882 7.957 -2.931
561 HG21 THR 74 3HG2 THR 74 -8.168 5.630 -5.327
562 HG22 THR 74 1HG2 THR 74 -8.470 7.210 -4.599
563 HG23 THR 74 2HG2 THR 74 -8.767 5.740 -3.670
564 H PHE 75 H PHE 75 -7.475 2.671 -4.002
565 HA PHE 75 HA PHE 75 -6.428 2.196 -6.708
566 HD1 PHE 75 HD2 PHE 75 -5.943 1.035 -3.268
567 HD2 PHE 75 HD1 PHE 75 -5.590 -1.104 -6.935
568 HE1 PHE 75 HE2 PHE 75 -3.769 0.148 -2.542
569 HE2 PHE 75 HE1 PHE 75 -3.417 -1.994 -6.208
570 HZ PHE 75 HZ PHE 75 -2.507 -1.370 -4.013
571 HB2 PHE 75 2HB PHE 75 -7.946 0.428 -4.778
572 HB3 PHE 75 1HB PHE 75 -7.587 -0.044 -6.435
573 H SER 76 H SER 76 -7.801 1.796 -8.488
574 HA SER 76 HA SER 76 -10.304 3.249 -8.443
575 HG SER 76 HG SER 76 -10.495 2.652 -11.987
576 HB2 SER 76 2HB SER 76 -8.762 3.384 -10.386
577 HB3 SER 76 1HB SER 76 -9.047 1.677 -10.714
578 H ASP 77 H ASP 77 -9.527 0.186 -7.544
579 HA ASP 77 HA ASP 77 -12.276 -0.737 -7.898
580 HB2 ASP 77 2HB ASP 77 -11.103 -1.734 -9.771
581 HB3 ASP 77 1HB ASP 77 -9.831 -2.328 -8.707
582 H SER 78 H SER 78 -13.028 -2.077 -6.277
583 HA SER 78 HA SER 78 -11.636 -1.927 -3.770
584 HG SER 78 HG SER 78 -12.997 -2.978 -1.998
585 HB2 SER 78 2HB SER 78 -14.034 -1.715 -3.736
586 HB3 SER 78 1HB SER 78 -14.238 -3.267 -4.543
587 H GLU 79 H GLU 79 -12.419 -4.558 -6.017
588 HA GLU 79 HA GLU 79 -11.588 -6.687 -4.381
589 HB2 GLU 79 2HB GLU 79 -12.949 -7.099 -6.325
590 HB3 GLU 79 1HB GLU 79 -11.710 -6.447 -7.389
591 HG2 GLU 79 2HG GLU 79 -10.224 -8.297 -6.798
592 HG3 GLU 79 1HG GLU 79 -11.468 -8.957 -5.736
593 H CYS 80 H CYS 80 -9.775 -4.901 -6.897
594 HA CYS 80 HA CYS 80 -7.383 -6.359 -6.701
595 HG CYS 80 HG CYS 80 -7.356 -2.302 -6.230
596 HB2 CYS 80 2HB CYS 80 -6.300 -4.452 -7.782
597 HB3 CYS 80 1HB CYS 80 -7.856 -4.785 -8.533
598 H ALA 81 H ALA 81 -8.469 -3.498 -4.912
599 HA ALA 81 HA ALA 81 -6.117 -3.117 -3.379
600 HB1 ALA 81 3HB ALA 81 -7.534 -1.770 -1.902
601 HB2 ALA 81 1HB ALA 81 -8.975 -2.413 -2.690
602 HB3 ALA 81 2HB ALA 81 -7.850 -1.403 -3.597
603 H LYS 82 H LYS 82 -9.119 -4.887 -2.707
604 HA LYS 82 HA LYS 82 -8.493 -5.845 -0.149
605 HB2 LYS 82 2HB LYS 82 -10.737 -5.893 -1.224
606 HB3 LYS 82 1HB LYS 82 -10.180 -7.179 -2.282
607 HG2 LYS 82 2HG LYS 82 -9.841 -8.632 -0.336
608 HG3 LYS 82 1HG LYS 82 -10.405 -7.338 0.721
609 HD2 LYS 82 2HD LYS 82 -12.011 -8.706 -1.446
610 HD3 LYS 82 1HD LYS 82 -12.193 -8.944 0.291
611 HE2 LYS 82 2HE LYS 82 -12.846 -6.589 0.540
612 HE3 LYS 82 1HE LYS 82 -12.664 -6.355 -1.197
613 HZ1 LYS 82 3HZ LYS 82 -14.434 -7.943 -1.574
614 HZ2 LYS 82 1HZ LYS 82 -14.975 -6.701 -0.560
615 HZ3 LYS 82 2HZ LYS 82 -14.593 -8.216 0.085
616 H LYS 83 H LYS 83 -7.775 -7.147 -3.353
617 HA LYS 83 HA LYS 83 -6.653 -9.617 -2.502
618 HB2 LYS 83 2HB LYS 83 -7.446 -8.911 -4.866
619 HB3 LYS 83 1HB LYS 83 -5.865 -8.162 -5.030
620 HG2 LYS 83 2HG LYS 83 -5.752 -10.311 -6.046
621 HG3 LYS 83 1HG LYS 83 -4.841 -10.398 -4.535
622 HD2 LYS 83 2HD LYS 83 -6.762 -11.445 -3.427
623 HD3 LYS 83 1HD LYS 83 -7.698 -11.329 -4.919
624 HE2 LYS 83 2HE LYS 83 -6.887 -13.571 -4.741
625 HE3 LYS 83 1HE LYS 83 -5.970 -12.775 -6.018
626 HZ1 LYS 83 3HZ LYS 83 -5.042 -13.150 -3.231
627 HZ2 LYS 83 1HZ LYS 83 -4.146 -12.470 -4.494
628 HZ3 LYS 83 2HZ LYS 83 -4.572 -14.104 -4.546
629 H ALA 84 H ALA 84 -5.245 -6.439 -3.262
630 HA ALA 84 HA ALA 84 -2.541 -7.086 -2.889
631 HB1 ALA 84 3HB ALA 84 -3.884 -4.437 -2.329
632 HB2 ALA 84 1HB ALA 84 -3.330 -4.987 -3.911
633 HB3 ALA 84 2HB ALA 84 -2.164 -4.701 -2.618
634 H LEU 85 H LEU 85 -4.877 -5.723 -0.542
635 HA LEU 85 HA LEU 85 -3.285 -5.730 1.738
636 HG LEU 85 HG LEU 85 -4.677 -5.468 3.934
637 HB2 LEU 85 2HB LEU 85 -5.559 -4.772 1.611
638 HB3 LEU 85 1HB LEU 85 -6.239 -6.378 1.508
639 HD11 LEU 85 1HD1 LEU 85 -6.825 -4.948 4.992
640 HD12 LEU 85 2HD1 LEU 85 -7.653 -5.245 3.461
641 HD13 LEU 85 3HD1 LEU 85 -6.515 -3.904 3.605
642 HD21 LEU 85 3HD2 LEU 85 -5.001 -7.881 3.755
643 HD22 LEU 85 1HD2 LEU 85 -6.737 -7.651 3.535
644 HD23 LEU 85 2HD2 LEU 85 -5.976 -7.226 5.070
645 H GLU 86 H GLU 86 -5.440 -8.293 0.574
646 HA GLU 86 HA GLU 86 -5.131 -10.235 2.467
647 HB2 GLU 86 2HB GLU 86 -6.691 -10.393 0.614
648 HB3 GLU 86 1HB GLU 86 -5.367 -10.533 -0.536
649 HG2 GLU 86 2HG GLU 86 -4.737 -12.666 0.679
650 HG3 GLU 86 1HG GLU 86 -6.295 -12.544 1.493
651 H GLN 87 H GLN 87 -2.908 -9.516 -0.187
652 HA GLN 87 HA GLN 87 -1.244 -11.833 0.503
653 HB2 GLN 87 2HB GLN 87 -1.187 -9.956 -1.866
654 HB3 GLN 87 1HB GLN 87 -0.101 -11.323 -1.652
655 HG2 GLN 87 2HG GLN 87 -3.105 -11.552 -1.788
656 HG3 GLN 87 1HG GLN 87 -2.025 -11.764 -3.167
657 HE21 GLN 87 1HE2 GLN 87 -3.879 -13.619 -1.710
658 HE22 GLN 87 2HE2 GLN 87 -2.904 -14.992 -1.339
659 H LEU 88 H LEU 88 -1.098 -8.313 0.537
660 HA LEU 88 HA LEU 88 1.790 -8.348 0.998
661 HG LEU 88 HG LEU 88 0.226 -7.327 -1.463
662 HB2 LEU 88 2HB LEU 88 -0.110 -6.033 0.620
663 HB3 LEU 88 1HB LEU 88 1.630 -5.886 0.797
664 HD11 LEU 88 1HD1 LEU 88 1.620 -4.651 -1.418
665 HD12 LEU 88 2HD1 LEU 88 -0.110 -4.935 -1.617
666 HD13 LEU 88 3HD1 LEU 88 1.018 -5.474 -2.858
667 HD21 LEU 88 3HD2 LEU 88 3.153 -6.727 -1.017
668 HD22 LEU 88 1HD2 LEU 88 2.459 -7.409 -2.491
669 HD23 LEU 88 2HD2 LEU 88 2.391 -8.318 -0.980
670 H ASN 89 H ASN 89 -1.075 -8.143 2.898
671 HA ASN 89 HA ASN 89 -0.021 -6.658 5.083
672 HB2 ASN 89 2HB ASN 89 -2.463 -7.180 4.719
673 HB3 ASN 89 1HB ASN 89 -2.132 -8.832 5.232
674 HD21 ASN 89 1HD2 ASN 89 -3.883 -6.859 6.430
675 HD22 ASN 89 2HD2 ASN 89 -3.332 -6.646 8.051
676 H GLY 90 H GLY 90 1.997 -7.326 5.679
677 HA2 GLY 90 2HA GLY 90 3.162 -8.727 7.314
678 HA3 GLY 90 1HA GLY 90 2.299 -10.109 6.653
679 H PHE 91 H PHE 91 3.275 -7.973 4.233
680 HA PHE 91 HA PHE 91 5.213 -9.817 3.180
681 HD1 PHE 91 HD1 PHE 91 5.267 -10.205 0.474
682 HD2 PHE 91 HD2 PHE 91 6.137 -6.086 1.132
683 HE1 PHE 91 HE1 PHE 91 6.915 -10.261 -1.351
684 HE2 PHE 91 HE2 PHE 91 7.786 -6.141 -0.691
685 HZ PHE 91 HZ PHE 91 8.176 -8.227 -1.936
686 HB2 PHE 91 2HB PHE 91 3.684 -8.623 1.697
687 HB3 PHE 91 1HB PHE 91 4.320 -7.077 2.241
688 H GLU 92 H GLU 92 7.412 -9.696 3.250
689 HA GLU 92 HA GLU 92 8.641 -7.866 5.089
690 HB2 GLU 92 2HB GLU 92 9.869 -9.935 3.252
691 HB3 GLU 92 1HB GLU 92 10.750 -9.042 4.483
692 HG2 GLU 92 2HG GLU 92 8.433 -10.898 5.019
693 HG3 GLU 92 1HG GLU 92 10.135 -11.323 5.187
694 H LEU 93 H LEU 93 8.300 -5.809 4.158
695 HA LEU 93 HA LEU 93 9.670 -5.153 1.659
696 HG LEU 93 HG LEU 93 9.759 -2.085 2.369
697 HB2 LEU 93 2HB LEU 93 7.521 -4.101 2.059
698 HB3 LEU 93 1HB LEU 93 8.071 -3.479 3.604
699 HD11 LEU 93 1HD1 LEU 93 8.191 -2.956 -0.061
700 HD12 LEU 93 2HD1 LEU 93 9.855 -3.412 0.315
701 HD13 LEU 93 3HD1 LEU 93 9.455 -1.726 -0.022
702 HD21 LEU 93 3HD2 LEU 93 6.865 -1.599 1.649
703 HD22 LEU 93 1HD2 LEU 93 8.150 -0.394 1.669
704 HD23 LEU 93 2HD2 LEU 93 7.635 -1.155 3.174
705 H ALA 94 H ALA 94 11.724 -4.376 1.576
706 HA ALA 94 HA ALA 94 13.810 -3.752 2.253
707 HB1 ALA 94 3HB ALA 94 12.281 -2.083 4.258
708 HB2 ALA 94 1HB ALA 94 12.651 -1.617 2.597
709 HB3 ALA 94 2HB ALA 94 13.957 -1.837 3.761
710 H GLY 95 H GLY 95 12.567 -6.104 3.540
711 HA2 GLY 95 2HA GLY 95 13.400 -7.697 5.018
712 HA3 GLY 95 1HA GLY 95 14.513 -6.495 5.650
713 H ARG 96 H ARG 96 11.228 -5.504 5.549
714 HA ARG 96 HA ARG 96 10.734 -6.328 8.325
715 HE ARG 96 HE ARG 96 10.517 -2.647 10.382
716 HB2 ARG 96 2HB ARG 96 10.622 -3.474 7.320
717 HB3 ARG 96 1HB ARG 96 9.958 -4.000 8.862
718 HG2 ARG 96 2HG ARG 96 12.154 -4.653 9.631
719 HG3 ARG 96 1HG ARG 96 12.855 -4.241 8.064
720 HD2 ARG 96 2HD ARG 96 13.309 -2.444 9.579
721 HD3 ARG 96 1HD ARG 96 12.102 -1.890 8.422
722 HH11 ARG 96 1HH1 ARG 96 13.487 -0.916 10.545
723 HH12 ARG 96 2HH1 ARG 96 13.054 -0.096 12.003
724 HH21 ARG 96 1HH2 ARG 96 9.966 -1.583 12.253
725 HH22 ARG 96 2HH2 ARG 96 11.087 -0.467 12.953
726 HA PRO 97 HA PRO 97 6.671 -7.351 6.951
727 HB2 PRO 97 2HB PRO 97 5.240 -6.707 9.234
728 HB3 PRO 97 1HB PRO 97 6.161 -8.198 9.006
729 HG2 PRO 97 2HG PRO 97 6.986 -5.660 10.388
730 HG3 PRO 97 1HG PRO 97 7.206 -7.342 10.915
731 HD2 PRO 97 2HD PRO 97 9.222 -5.994 9.831
732 HD3 PRO 97 1HD PRO 97 8.959 -7.702 9.409
733 H MET 98 H MET 98 5.101 -6.391 5.801
734 HA MET 98 HA MET 98 4.673 -3.500 6.057
735 HB2 MET 98 2HB MET 98 5.218 -4.407 3.825
736 HB3 MET 98 1HB MET 98 3.796 -5.438 3.898
737 HG2 MET 98 2HG MET 98 2.399 -3.375 4.043
738 HG3 MET 98 1HG MET 98 3.861 -2.429 3.771
739 HE1 MET 98 3HE MET 98 5.308 -2.575 1.495
740 HE2 MET 98 1HE MET 98 4.894 -3.646 0.157
741 HE3 MET 98 2HE MET 98 5.431 -4.323 1.695
742 H LYS 99 H LYS 99 3.007 -2.868 7.325
743 HA LYS 99 HA LYS 99 0.779 -4.679 7.850
744 HB2 LYS 99 2HB LYS 99 1.377 -1.921 8.954
745 HB3 LYS 99 1HB LYS 99 0.090 -2.986 9.510
746 HG2 LYS 99 2HG LYS 99 3.048 -3.566 9.679
747 HG3 LYS 99 1HG LYS 99 2.024 -3.015 11.007
748 HD2 LYS 99 2HD LYS 99 0.656 -5.072 10.757
749 HD3 LYS 99 1HD LYS 99 1.765 -5.629 9.502
750 HE2 LYS 99 2HE LYS 99 2.285 -6.663 11.650
751 HE3 LYS 99 1HE LYS 99 3.607 -5.623 11.117
752 HZ1 LYS 99 3HZ LYS 99 3.049 -5.382 13.495
753 HZ2 LYS 99 1HZ LYS 99 1.519 -4.807 13.065
754 HZ3 LYS 99 2HZ LYS 99 2.901 -3.932 12.639
755 H VAL 100 H VAL 100 -0.655 -4.717 6.149
756 HA VAL 100 HA VAL 100 -1.593 -2.135 5.069
757 HB VAL 100 HB VAL 100 -1.928 -4.878 3.828
758 HG11 VAL 100 1HG1 VAL 100 -2.396 -2.106 2.707
759 HG12 VAL 100 2HG1 VAL 100 -3.642 -3.281 3.135
760 HG13 VAL 100 3HG1 VAL 100 -2.534 -3.615 1.804
761 HG21 VAL 100 3HG2 VAL 100 0.437 -4.278 3.900
762 HG22 VAL 100 1HG2 VAL 100 0.079 -2.708 3.179
763 HG23 VAL 100 2HG2 VAL 100 -0.169 -4.185 2.246
764 H GLY 101 H GLY 101 -3.467 -1.434 5.852
765 HA2 GLY 101 2HA GLY 101 -5.567 -3.385 6.591
766 HA3 GLY 101 1HA GLY 101 -5.388 -1.799 7.321
767 H HIS 102 H HIS 102 -7.833 -2.633 6.264
768 HA HIS 102 HA HIS 102 -8.028 -1.518 3.543
769 HD1 HIS 102 HD1 HIS 102 -11.489 -1.629 5.919
770 HD2 HIS 102 HD2 HIS 102 -9.483 -5.270 5.986
771 HE1 HIS 102 HE1 HIS 102 -12.326 -2.824 7.961
772 HE2 HIS 102 HE2 HIS 102 -10.977 -4.942 8.068
773 HB2 HIS 102 2HB HIS 102 -10.327 -2.498 3.572
774 HB3 HIS 102 1HB HIS 102 -9.054 -3.684 3.830
775 H VAL 103 H VAL 103 -7.592 0.399 5.560
776 HA VAL 103 HA VAL 103 -8.407 2.132 6.789
777 HB VAL 103 HB VAL 103 -9.723 3.776 5.592
778 HG11 VAL 103 1HG1 VAL 103 -7.705 2.399 3.826
779 HG12 VAL 103 2HG1 VAL 103 -7.372 3.617 5.059
780 HG13 VAL 103 3HG1 VAL 103 -8.289 4.052 3.615
781 HG21 VAL 103 3HG2 VAL 103 -10.205 1.646 3.501
782 HG22 VAL 103 1HG2 VAL 103 -10.627 3.353 3.345
783 HG23 VAL 103 2HG2 VAL 103 -11.418 2.357 4.565
784 H THR 104 H THR 104 -10.793 3.440 7.114
785 HA THR 104 HA THR 104 -12.680 3.404 8.395
786 HB THR 104 HB THR 104 -12.916 0.448 7.748
787 HG1 THR 104 HG1 THR 104 -14.538 2.379 6.523
788 HG21 THR 104 3HG2 THR 104 -14.236 1.115 9.710
789 HG22 THR 104 1HG2 THR 104 -15.283 0.738 8.340
790 HG23 THR 104 2HG2 THR 104 -14.973 2.419 8.776
791 H GLU 105 H GLU 105 -10.506 0.652 8.884
792 HA GLU 105 HA GLU 105 -10.974 0.118 11.564
793 HB2 GLU 105 2HB GLU 105 -8.352 -0.065 10.062
794 HB3 GLU 105 1HB GLU 105 -8.736 -0.893 11.568
795 HG2 GLU 105 2HG GLU 105 -10.472 -2.177 10.444
796 HG3 GLU 105 1HG GLU 105 -10.146 -1.320 8.937
797 H ARG 106 H ARG 106 -11.296 2.089 12.638
798 HA ARG 106 HA ARG 106 -8.775 3.343 13.526
799 HE ARG 106 HE ARG 106 -10.808 6.636 15.005
800 HB2 ARG 106 2HB ARG 106 -10.652 4.677 12.011
801 HB3 ARG 106 1HB ARG 106 -11.178 5.075 13.638
802 HG2 ARG 106 2HG ARG 106 -8.410 5.554 12.530
803 HG3 ARG 106 1HG ARG 106 -9.678 6.769 12.671
804 HD2 ARG 106 2HD ARG 106 -8.366 5.282 14.953
805 HD3 ARG 106 1HD ARG 106 -8.068 6.957 14.495
806 HH11 ARG 106 1HH1 ARG 106 -7.790 6.724 16.659
807 HH12 ARG 106 2HH1 ARG 106 -8.501 7.185 18.164
808 HH21 ARG 106 1HH2 ARG 106 -11.707 7.254 16.941
809 HH22 ARG 106 2HH2 ARG 106 -10.693 7.458 18.328
810 H THR 107 H THR 107 -11.504 1.606 14.279
811 HA THR 107 HA THR 107 -11.671 2.542 17.063
812 HB THR 107 HB THR 107 -13.738 1.289 17.252
813 HG1 THR 107 HG1 THR 107 -14.352 -0.189 15.815
814 HG21 THR 107 3HG2 THR 107 -15.124 2.414 15.549
815 HG22 THR 107 1HG2 THR 107 -13.663 2.840 14.657
816 HG23 THR 107 2HG2 THR 107 -13.942 3.510 16.264
817 H ASP 108 H ASP 108 -12.204 0.642 18.615
818 HA ASP 108 HA ASP 108 -9.965 -1.182 18.544
819 HB2 ASP 108 2HB ASP 108 -10.994 -1.907 20.803
820 HB3 ASP 108 1HB ASP 108 -10.328 -0.284 20.671
Start of MODEL 11
1 HA MET 1 HA MET 1 -8.078 -18.047 -6.259
2 H1 MET 1 1H MET 1 -6.685 -19.203 -3.909
3 H2 MET 1 2H MET 1 -6.382 -17.686 -4.588
4 H3 MET 1 3H MET 1 -6.059 -19.085 -5.479
5 HB2 MET 1 2HB MET 1 -8.625 -20.608 -4.730
6 HB3 MET 1 1HB MET 1 -9.581 -19.990 -6.072
7 HG2 MET 1 2HG MET 1 -8.163 -21.751 -6.860
8 HG3 MET 1 1HG MET 1 -7.598 -20.223 -7.534
9 HE1 MET 1 3HE MET 1 -6.881 -23.155 -5.047
10 HE2 MET 1 1HE MET 1 -7.104 -21.801 -3.937
11 HE3 MET 1 2HE MET 1 -5.511 -22.533 -4.125
12 H GLY 2 H GLY 2 -10.212 -17.288 -5.868
13 HA2 GLY 2 2HA GLY 2 -10.725 -16.158 -3.301
14 HA3 GLY 2 1HA GLY 2 -11.844 -16.201 -4.655
15 H HIS 3 H HIS 3 -12.335 -16.689 -1.769
16 HA HIS 3 HA HIS 3 -12.708 -19.493 -1.384
17 HD1 HIS 3 HD1 HIS 3 -12.111 -20.009 1.704
18 HD2 HIS 3 HD2 HIS 3 -11.169 -16.150 0.477
19 HE1 HIS 3 HE1 HIS 3 -9.871 -19.508 2.718
20 HE2 HIS 3 HE2 HIS 3 -9.254 -17.238 1.833
21 HB2 HIS 3 2HB HIS 3 -13.816 -17.114 0.116
22 HB3 HIS 3 1HB HIS 3 -14.068 -18.785 0.611
23 H HIS 4 H HIS 4 -13.804 -20.067 -3.307
24 HA HIS 4 HA HIS 4 -16.358 -19.098 -4.031
25 HD1 HIS 4 HD1 HIS 4 -15.964 -23.422 -3.983
26 HD2 HIS 4 HD2 HIS 4 -12.617 -21.368 -5.350
27 HE1 HIS 4 HE1 HIS 4 -14.048 -25.027 -3.754
28 HE2 HIS 4 HE2 HIS 4 -12.048 -23.792 -4.646
29 HB2 HIS 4 2HB HIS 4 -16.459 -21.221 -5.421
30 HB3 HIS 4 1HB HIS 4 -15.074 -20.176 -5.716
31 H HIS 5 H HIS 5 -18.059 -19.212 -2.719
32 HA HIS 5 HA HIS 5 -18.569 -21.656 -1.165
33 HD1 HIS 5 HD1 HIS 5 -17.638 -17.727 -0.499
34 HD2 HIS 5 HD2 HIS 5 -18.642 -20.845 2.060
35 HE1 HIS 5 HE1 HIS 5 -16.153 -17.460 1.501
36 HE2 HIS 5 HE2 HIS 5 -16.658 -19.447 2.948
37 HB2 HIS 5 2HB HIS 5 -19.876 -18.919 -1.086
38 HB3 HIS 5 1HB HIS 5 -20.354 -20.281 -0.075
39 H HIS 6 H HIS 6 -19.993 -19.608 -3.659
40 HA HIS 6 HA HIS 6 -22.247 -21.474 -3.983
41 HD1 HIS 6 HD1 HIS 6 -24.529 -20.066 -2.800
42 HD2 HIS 6 HD2 HIS 6 -21.603 -17.119 -2.963
43 HE1 HIS 6 HE1 HIS 6 -24.856 -18.676 -0.737
44 HE2 HIS 6 HE2 HIS 6 -23.008 -16.974 -0.800
45 HB2 HIS 6 2HB HIS 6 -21.891 -18.706 -5.164
46 HB3 HIS 6 1HB HIS 6 -23.356 -19.685 -5.194
47 H HIS 7 H HIS 7 -22.922 -22.044 -6.181
48 HA HIS 7 HA HIS 7 -20.621 -22.492 -7.938
49 HD1 HIS 7 HD1 HIS 7 -23.473 -25.186 -5.981
50 HD2 HIS 7 HD2 HIS 7 -19.749 -25.188 -7.825
51 HE1 HIS 7 HE1 HIS 7 -22.124 -26.921 -4.771
52 HE2 HIS 7 HE2 HIS 7 -19.829 -26.773 -5.783
53 HB2 HIS 7 2HB HIS 7 -23.409 -23.667 -7.952
54 HB3 HIS 7 1HB HIS 7 -22.169 -24.050 -9.141
55 H HIS 8 H HIS 8 -20.987 -22.323 -10.340
56 HA HIS 8 HA HIS 8 -21.682 -19.577 -10.839
57 HD1 HIS 8 HD1 HIS 8 -21.987 -21.568 -14.622
58 HD2 HIS 8 HD2 HIS 8 -19.264 -23.352 -12.040
59 HE1 HIS 8 HE1 HIS 8 -21.658 -23.893 -15.495
60 HE2 HIS 8 HE2 HIS 8 -19.915 -24.911 -13.996
61 HB2 HIS 8 2HB HIS 8 -20.736 -19.911 -13.054
62 HB3 HIS 8 1HB HIS 8 -19.674 -20.601 -11.834
63 H SER 9 H SER 9 -23.432 -22.503 -11.171
64 HA SER 9 HA SER 9 -24.982 -22.042 -13.449
65 HG SER 9 HG SER 9 -26.759 -23.014 -10.360
66 HB2 SER 9 2HB SER 9 -26.624 -23.588 -12.482
67 HB3 SER 9 1HB SER 9 -24.984 -24.185 -12.227
68 H HIS 10 H HIS 10 -25.969 -20.136 -13.841
69 HA HIS 10 HA HIS 10 -28.056 -19.291 -11.959
70 HD1 HIS 10 HD1 HIS 10 -27.820 -16.880 -9.948
71 HD2 HIS 10 HD2 HIS 10 -24.118 -18.362 -11.107
72 HE1 HIS 10 HE1 HIS 10 -26.460 -17.001 -7.847
73 HE2 HIS 10 HE2 HIS 10 -24.174 -17.721 -8.600
74 HB2 HIS 10 2HB HIS 10 -25.913 -17.494 -13.098
75 HB3 HIS 10 1HB HIS 10 -27.443 -16.863 -12.500
76 H MET 11 H MET 11 -27.075 -17.431 -14.788
77 HA MET 11 HA MET 11 -29.482 -18.347 -16.229
78 HB2 MET 11 2HB MET 11 -28.651 -15.455 -15.869
79 HB3 MET 11 1HB MET 11 -29.974 -16.015 -16.878
80 HG2 MET 11 2HG MET 11 -30.953 -15.189 -14.909
81 HG3 MET 11 1HG MET 11 -31.023 -16.945 -14.780
82 HE1 MET 11 3HE MET 11 -31.597 -16.525 -12.181
83 HE2 MET 11 1HE MET 11 -31.379 -14.783 -12.362
84 HE3 MET 11 2HE MET 11 -30.534 -15.651 -11.078
85 H ALA 12 H ALA 12 -29.428 -17.006 -18.490
86 HA ALA 12 HA ALA 12 -27.193 -17.983 -19.946
87 HB1 ALA 12 3HB ALA 12 -28.184 -16.836 -21.862
88 HB2 ALA 12 1HB ALA 12 -29.269 -15.951 -20.788
89 HB3 ALA 12 2HB ALA 12 -29.421 -17.700 -20.949
90 H ALA 13 H ALA 13 -25.207 -17.123 -20.054
91 HA ALA 13 HA ALA 13 -23.453 -15.676 -19.976
92 HB1 ALA 13 3HB ALA 13 -23.741 -13.488 -21.010
93 HB2 ALA 13 1HB ALA 13 -25.495 -13.646 -20.892
94 HB3 ALA 13 2HB ALA 13 -24.580 -14.729 -21.939
95 H ALA 14 H ALA 14 -25.080 -16.019 -17.532
96 HA ALA 14 HA ALA 14 -25.016 -13.439 -16.188
97 HB1 ALA 14 3HB ALA 14 -26.831 -15.008 -15.730
98 HB2 ALA 14 1HB ALA 14 -25.916 -14.646 -14.266
99 HB3 ALA 14 2HB ALA 14 -25.670 -16.180 -15.103
100 H MET 15 H MET 15 -22.470 -14.680 -17.135
101 HA MET 15 HA MET 15 -21.047 -15.470 -14.734
102 HB2 MET 15 2HB MET 15 -20.606 -16.471 -16.985
103 HB3 MET 15 1HB MET 15 -19.966 -14.922 -17.509
104 HG2 MET 15 2HG MET 15 -18.186 -15.078 -15.848
105 HG3 MET 15 1HG MET 15 -18.846 -16.611 -15.278
106 HE1 MET 15 3HE MET 15 -16.496 -17.782 -15.581
107 HE2 MET 15 1HE MET 15 -15.794 -16.267 -16.149
108 HE3 MET 15 2HE MET 15 -15.565 -17.748 -17.077
109 H ALA 16 H ALA 16 -22.029 -12.556 -15.893
110 HA ALA 16 HA ALA 16 -19.638 -11.032 -15.200
111 HB1 ALA 16 3HB ALA 16 -20.913 -9.078 -15.950
112 HB2 ALA 16 1HB ALA 16 -22.342 -10.088 -16.166
113 HB3 ALA 16 2HB ALA 16 -20.917 -10.352 -17.168
114 H ASN 17 H ASN 17 -19.284 -10.227 -13.212
115 HA ASN 17 HA ASN 17 -21.112 -10.524 -11.063
116 HB2 ASN 17 2HB ASN 17 -18.524 -9.006 -11.361
117 HB3 ASN 17 1HB ASN 17 -19.461 -8.941 -9.871
118 HD21 ASN 17 1HD2 ASN 17 -17.527 -10.955 -11.947
119 HD22 ASN 17 2HD2 ASN 17 -17.305 -12.232 -10.806
120 H ASN 18 H ASN 18 -22.952 -9.441 -10.890
121 HA ASN 18 HA ASN 18 -24.476 -7.773 -10.739
122 HB2 ASN 18 2HB ASN 18 -22.034 -5.986 -10.590
123 HB3 ASN 18 1HB ASN 18 -23.684 -5.467 -10.249
124 HD21 ASN 18 1HD2 ASN 18 -24.687 -6.166 -8.363
125 HD22 ASN 18 2HD2 ASN 18 -23.811 -6.903 -7.071
126 H LEU 19 H LEU 19 -22.159 -5.769 -12.483
127 HA LEU 19 HA LEU 19 -22.868 -5.991 -15.102
128 HG LEU 19 HG LEU 19 -24.548 -4.952 -16.662
129 HB2 LEU 19 2HB LEU 19 -25.231 -5.580 -14.261
130 HB3 LEU 19 1HB LEU 19 -24.726 -3.967 -13.809
131 HD11 LEU 19 1HD1 LEU 19 -26.707 -3.858 -17.066
132 HD12 LEU 19 2HD1 LEU 19 -26.881 -3.572 -15.332
133 HD13 LEU 19 3HD1 LEU 19 -26.852 -5.221 -15.956
134 HD21 LEU 19 3HD2 LEU 19 -24.683 -2.184 -15.453
135 HD22 LEU 19 1HD2 LEU 19 -24.678 -2.543 -17.180
136 HD23 LEU 19 2HD2 LEU 19 -23.271 -2.938 -16.196
137 H GLN 20 H GLN 20 -22.935 -3.378 -12.726
138 HA GLN 20 HA GLN 20 -21.875 -1.378 -12.549
139 HB2 GLN 20 2HB GLN 20 -19.514 -3.132 -13.224
140 HB3 GLN 20 1HB GLN 20 -19.424 -1.556 -12.445
141 HG2 GLN 20 2HG GLN 20 -20.973 -2.590 -10.661
142 HG3 GLN 20 1HG GLN 20 -20.494 -4.137 -11.361
143 HE21 GLN 20 1HE2 GLN 20 -19.451 -1.361 -9.571
144 HE22 GLN 20 2HE2 GLN 20 -17.943 -2.014 -9.050
145 H LYS 21 H LYS 21 -22.374 0.153 -13.967
146 HA LYS 21 HA LYS 21 -21.616 0.136 -16.721
147 HB2 LYS 21 2HB LYS 21 -22.646 2.395 -14.983
148 HB3 LYS 21 1HB LYS 21 -22.558 2.422 -16.741
149 HG2 LYS 21 2HG LYS 21 -24.249 0.794 -16.961
150 HG3 LYS 21 1HG LYS 21 -24.137 0.330 -15.263
151 HD2 LYS 21 2HD LYS 21 -26.150 1.645 -15.665
152 HD3 LYS 21 1HD LYS 21 -25.045 2.514 -14.604
153 HE2 LYS 21 2HE LYS 21 -24.297 3.885 -16.486
154 HE3 LYS 21 1HE LYS 21 -25.364 2.993 -17.571
155 HZ1 LYS 21 3HZ LYS 21 -26.198 4.701 -15.292
156 HZ2 LYS 21 1HZ LYS 21 -27.253 3.771 -16.228
157 HZ3 LYS 21 2HZ LYS 21 -26.398 5.044 -16.933
158 H GLY 22 H GLY 22 -19.363 -0.043 -16.846
159 HA2 GLY 22 2HA GLY 22 -17.257 0.899 -17.161
160 HA3 GLY 22 1HA GLY 22 -17.847 2.402 -16.465
161 H SER 23 H SER 23 -15.597 2.251 -15.467
162 HA SER 23 HA SER 23 -15.037 0.346 -13.441
163 HG SER 23 HG SER 23 -12.857 1.056 -12.264
164 HB2 SER 23 2HB SER 23 -13.238 1.675 -14.398
165 HB3 SER 23 1HB SER 23 -13.976 3.164 -13.809
166 H ALA 24 H ALA 24 -15.727 0.175 -11.385
167 HA ALA 24 HA ALA 24 -16.799 2.476 -9.961
168 HB1 ALA 24 3HB ALA 24 -18.540 0.072 -10.519
169 HB2 ALA 24 1HB ALA 24 -18.730 1.672 -11.236
170 HB3 ALA 24 2HB ALA 24 -18.963 1.449 -9.503
171 H GLY 25 H GLY 25 -16.468 2.357 -7.819
172 HA2 GLY 25 2HA GLY 25 -16.388 1.245 -5.714
173 HA3 GLY 25 1HA GLY 25 -16.015 -0.256 -6.544
174 HA PRO 26 HA PRO 26 -11.798 1.991 -6.258
175 HB2 PRO 26 2HB PRO 26 -11.624 4.542 -5.425
176 HB3 PRO 26 1HB PRO 26 -12.048 4.140 -7.095
177 HG2 PRO 26 2HG PRO 26 -13.823 4.984 -4.838
178 HG3 PRO 26 1HG PRO 26 -13.887 5.447 -6.547
179 HD2 PRO 26 2HD PRO 26 -15.486 3.511 -5.375
180 HD3 PRO 26 1HD PRO 26 -15.133 3.612 -7.111
181 H MET 27 H MET 27 -10.816 0.992 -4.579
182 HA MET 27 HA MET 27 -11.789 1.516 -1.842
183 HB2 MET 27 2HB MET 27 -11.856 -0.831 -2.809
184 HB3 MET 27 1HB MET 27 -10.101 -0.816 -2.763
185 HG2 MET 27 2HG MET 27 -10.148 -0.552 -0.343
186 HG3 MET 27 1HG MET 27 -11.913 -0.503 -0.375
187 HE1 MET 27 3HE MET 27 -12.295 -2.456 1.286
188 HE2 MET 27 1HE MET 27 -10.552 -2.500 1.565
189 HE3 MET 27 2HE MET 27 -11.430 -3.993 1.226
190 H ARG 28 H ARG 28 -10.419 2.195 -0.225
191 HA ARG 28 HA ARG 28 -7.697 2.979 -1.065
192 HE ARG 28 HE ARG 28 -8.796 6.981 -0.324
193 HB2 ARG 28 2HB ARG 28 -9.255 4.814 -0.420
194 HB3 ARG 28 1HB ARG 28 -9.386 4.108 1.183
195 HG2 ARG 28 2HG ARG 28 -6.935 4.449 1.478
196 HG3 ARG 28 1HG ARG 28 -6.904 5.279 -0.077
197 HD2 ARG 28 2HD ARG 28 -8.450 6.111 2.383
198 HD3 ARG 28 1HD ARG 28 -7.015 6.898 1.726
199 HH11 ARG 28 1HH1 ARG 28 -8.856 8.065 2.954
200 HH12 ARG 28 2HH1 ARG 28 -10.047 9.278 2.633
201 HH21 ARG 28 1HH2 ARG 28 -10.274 8.591 -0.711
202 HH22 ARG 28 2HH2 ARG 28 -10.790 9.609 0.592
203 H LEU 29 H LEU 29 -5.991 2.019 -0.132
204 HA LEU 29 HA LEU 29 -6.404 0.420 2.306
205 HG LEU 29 HG LEU 29 -6.246 -0.833 -0.587
206 HB2 LEU 29 2HB LEU 29 -4.232 0.283 0.209
207 HB3 LEU 29 1HB LEU 29 -4.247 -0.679 1.675
208 HD11 LEU 29 1HD1 LEU 29 -4.095 -1.853 -1.107
209 HD12 LEU 29 2HD1 LEU 29 -5.338 -3.087 -0.904
210 HD13 LEU 29 3HD1 LEU 29 -4.164 -2.798 0.383
211 HD21 LEU 29 3HD2 LEU 29 -7.361 -1.194 1.556
212 HD22 LEU 29 1HD2 LEU 29 -6.150 -2.399 1.997
213 HD23 LEU 29 2HD2 LEU 29 -7.245 -2.699 0.647
214 H TYR 30 H TYR 30 -5.246 0.756 4.121
215 HA TYR 30 HA TYR 30 -3.429 3.048 4.260
216 HD1 TYR 30 HD2 TYR 30 -3.218 4.700 6.671
217 HD2 TYR 30 HD1 TYR 30 -3.187 0.618 7.889
218 HE1 TYR 30 HE2 TYR 30 -1.600 5.241 8.440
219 HE2 TYR 30 HE1 TYR 30 -1.570 1.150 9.657
220 HH TYR 30 HH TYR 30 -0.935 4.262 10.677
221 HB2 TYR 30 2HB TYR 30 -5.039 3.081 6.011
222 HB3 TYR 30 1HB TYR 30 -4.828 1.369 6.350
223 H VAL 31 H VAL 31 -1.332 2.667 3.928
224 HA VAL 31 HA VAL 31 -0.221 0.014 4.602
225 HB VAL 31 HB VAL 31 0.938 2.071 2.705
226 HG11 VAL 31 1HG1 VAL 31 1.645 -0.839 3.142
227 HG12 VAL 31 2HG1 VAL 31 2.602 0.547 3.665
228 HG13 VAL 31 3HG1 VAL 31 2.371 0.238 1.945
229 HG21 VAL 31 3HG2 VAL 31 -1.212 1.241 1.878
230 HG22 VAL 31 1HG2 VAL 31 -0.647 -0.420 2.062
231 HG23 VAL 31 2HG2 VAL 31 0.126 0.651 0.891
232 H GLY 32 H GLY 32 0.502 0.207 6.671
233 HA2 GLY 32 2HA GLY 32 2.232 2.488 7.370
234 HA3 GLY 32 1HA GLY 32 1.485 1.381 8.505
235 H SER 33 H SER 33 4.112 1.832 6.248
236 HA SER 33 HA SER 33 5.960 0.359 7.801
237 HG SER 33 HG SER 33 6.584 -2.496 7.002
238 HB2 SER 33 2HB SER 33 4.704 -1.584 6.864
239 HB3 SER 33 1HB SER 33 5.126 -1.048 5.241
240 H LEU 34 H LEU 34 5.548 2.857 6.112
241 HA LEU 34 HA LEU 34 7.526 2.668 4.016
242 HG LEU 34 HG LEU 34 4.414 4.042 4.580
243 HB2 LEU 34 2HB LEU 34 6.398 5.218 5.174
244 HB3 LEU 34 1HB LEU 34 7.101 4.976 3.586
245 HD11 LEU 34 1HD1 LEU 34 3.577 5.341 2.689
246 HD12 LEU 34 2HD1 LEU 34 5.228 5.816 2.285
247 HD13 LEU 34 3HD1 LEU 34 4.506 6.336 3.807
248 HD21 LEU 34 3HD2 LEU 34 5.741 3.308 1.969
249 HD22 LEU 34 1HD2 LEU 34 4.084 2.927 2.444
250 HD23 LEU 34 2HD2 LEU 34 5.436 2.211 3.320
251 H HIS 35 H HIS 35 9.109 1.784 5.523
252 HA HIS 35 HA HIS 35 10.226 3.248 7.657
253 HD1 HIS 35 HD1 HIS 35 9.470 -0.782 6.541
254 HD2 HIS 35 HD2 HIS 35 12.359 1.144 4.254
255 HE1 HIS 35 HE1 HIS 35 9.595 -2.069 4.389
256 HE2 HIS 35 HE2 HIS 35 11.444 -0.973 3.076
257 HB2 HIS 35 2HB HIS 35 12.185 1.538 7.190
258 HB3 HIS 35 1HB HIS 35 10.638 0.991 7.826
259 H PHE 36 H PHE 36 10.484 5.367 6.564
260 HA PHE 36 HA PHE 36 11.811 7.040 5.739
261 HD1 PHE 36 HD1 PHE 36 12.814 8.813 7.141
262 HD2 PHE 36 HD2 PHE 36 16.079 6.191 6.350
263 HE1 PHE 36 HE1 PHE 36 14.325 10.745 6.965
264 HE2 PHE 36 HE2 PHE 36 17.587 8.124 6.172
265 HZ PHE 36 HZ PHE 36 16.713 10.401 6.481
266 HB2 PHE 36 2HB PHE 36 12.935 6.238 7.842
267 HB3 PHE 36 1HB PHE 36 14.016 5.283 6.840
268 H ASN 37 H ASN 37 11.175 5.234 3.670
269 HA ASN 37 HA ASN 37 13.252 5.721 1.776
270 HB2 ASN 37 2HB ASN 37 14.346 3.860 2.849
271 HB3 ASN 37 1HB ASN 37 12.885 2.882 2.757
272 HD21 ASN 37 1HD2 ASN 37 15.527 4.253 0.946
273 HD22 ASN 37 2HD2 ASN 37 15.343 3.246 -0.441
274 H ILE 38 H ILE 38 10.323 3.855 2.495
275 HA ILE 38 HA ILE 38 9.804 3.226 -0.247
276 HB ILE 38 HB ILE 38 7.819 3.084 2.023
277 HG12 ILE 38 2HG1 ILE 38 9.820 1.889 2.718
278 HG13 ILE 38 1HG1 ILE 38 8.575 0.721 2.285
279 HG21 ILE 38 1HG2 ILE 38 8.025 1.586 -0.595
280 HG22 ILE 38 2HG2 ILE 38 6.833 2.822 -0.186
281 HG23 ILE 38 3HG2 ILE 38 6.830 1.278 0.665
282 HD11 ILE 38 3HD1 ILE 38 10.898 1.539 0.548
283 HD12 ILE 38 1HD1 ILE 38 9.659 0.355 0.135
284 HD13 ILE 38 2HD1 ILE 38 10.764 0.044 1.474
285 H THR 39 H THR 39 9.439 4.904 -1.588
286 HA THR 39 HA THR 39 7.623 7.057 -0.812
287 HB THR 39 HB THR 39 8.286 8.191 -2.852
288 HG1 THR 39 HG1 THR 39 9.052 7.116 -4.505
289 HG21 THR 39 3HG2 THR 39 10.698 8.444 -2.458
290 HG22 THR 39 1HG2 THR 39 10.691 6.979 -1.473
291 HG23 THR 39 2HG2 THR 39 9.802 8.403 -0.939
292 H GLU 40 H GLU 40 6.160 7.835 -2.679
293 HA GLU 40 HA GLU 40 4.054 6.098 -3.064
294 HB2 GLU 40 2HB GLU 40 4.825 8.334 -4.953
295 HB3 GLU 40 1HB GLU 40 3.207 7.704 -4.660
296 HG2 GLU 40 2HG GLU 40 3.114 8.650 -2.503
297 HG3 GLU 40 1HG GLU 40 4.847 8.973 -2.482
298 H ASP 41 H ASP 41 6.807 6.684 -5.200
299 HA ASP 41 HA ASP 41 5.985 5.231 -7.446
300 HB2 ASP 41 2HB ASP 41 8.843 5.467 -6.488
301 HB3 ASP 41 1HB ASP 41 8.269 5.325 -8.148
302 H MET 42 H MET 42 7.961 4.153 -4.667
303 HA MET 42 HA MET 42 8.258 1.467 -5.503
304 HB2 MET 42 2HB MET 42 8.348 2.700 -2.741
305 HB3 MET 42 1HB MET 42 8.755 1.021 -3.071
306 HG2 MET 42 2HG MET 42 10.164 3.441 -4.189
307 HG3 MET 42 1HG MET 42 10.753 2.383 -2.903
308 HE1 MET 42 3HE MET 42 13.155 1.498 -5.875
309 HE2 MET 42 1HE MET 42 13.045 2.045 -4.203
310 HE3 MET 42 2HE MET 42 12.488 3.092 -5.511
311 H LEU 43 H LEU 43 5.861 3.067 -3.463
312 HA LEU 43 HA LEU 43 4.343 0.863 -2.696
313 HG LEU 43 HG LEU 43 5.094 3.257 -1.300
314 HB2 LEU 43 2HB LEU 43 3.551 3.721 -3.262
315 HB3 LEU 43 1HB LEU 43 2.451 2.542 -2.567
316 HD11 LEU 43 1HD1 LEU 43 3.829 4.666 0.256
317 HD12 LEU 43 2HD1 LEU 43 2.370 4.417 -0.708
318 HD13 LEU 43 3HD1 LEU 43 3.752 5.274 -1.398
319 HD21 LEU 43 3HD2 LEU 43 4.073 2.253 0.693
320 HD22 LEU 43 1HD2 LEU 43 4.182 1.106 -0.638
321 HD23 LEU 43 2HD2 LEU 43 2.636 1.857 -0.246
322 H ARG 44 H ARG 44 4.009 2.879 -5.636
323 HA ARG 44 HA ARG 44 1.907 1.431 -6.811
324 HE ARG 44 HE ARG 44 1.170 3.748 -10.023
325 HB2 ARG 44 2HB ARG 44 4.182 2.913 -8.139
326 HB3 ARG 44 1HB ARG 44 2.757 2.319 -8.981
327 HG2 ARG 44 2HG ARG 44 1.368 3.747 -7.487
328 HG3 ARG 44 1HG ARG 44 2.864 4.428 -6.845
329 HD2 ARG 44 2HD ARG 44 1.854 5.829 -8.617
330 HD3 ARG 44 1HD ARG 44 3.476 5.263 -9.025
331 HH11 ARG 44 1HH1 ARG 44 3.804 5.888 -10.652
332 HH12 ARG 44 2HH1 ARG 44 3.778 5.585 -12.354
333 HH21 ARG 44 1HH2 ARG 44 1.150 3.346 -12.180
334 HH22 ARG 44 2HH2 ARG 44 2.275 4.161 -13.218
335 H GLY 45 H GLY 45 5.424 1.013 -7.104
336 HA2 GLY 45 2HA GLY 45 5.431 -1.031 -8.992
337 HA3 GLY 45 1HA GLY 45 6.686 -0.768 -7.794
338 H ILE 46 H ILE 46 4.926 -1.243 -5.511
339 HA ILE 46 HA ILE 46 4.934 -4.153 -5.524
340 HB ILE 46 HB ILE 46 4.200 -2.229 -3.303
341 HG12 ILE 46 2HG1 ILE 46 6.791 -3.731 -3.799
342 HG13 ILE 46 1HG1 ILE 46 6.550 -2.009 -4.078
343 HG21 ILE 46 1HG2 ILE 46 4.519 -4.149 -1.806
344 HG22 ILE 46 2HG2 ILE 46 4.798 -5.191 -3.201
345 HG23 ILE 46 3HG2 ILE 46 3.219 -4.440 -2.964
346 HD11 ILE 46 3HD1 ILE 46 6.363 -3.389 -1.407
347 HD12 ILE 46 1HD1 ILE 46 6.174 -1.661 -1.703
348 HD13 ILE 46 2HD1 ILE 46 7.728 -2.438 -1.990
349 H PHE 47 H PHE 47 2.512 -1.583 -5.012
350 HA PHE 47 HA PHE 47 0.404 -3.520 -4.577
351 HD1 PHE 47 HD2 PHE 47 2.462 -1.075 -2.899
352 HD2 PHE 47 HD1 PHE 47 -1.567 -2.228 -2.131
353 HE1 PHE 47 HE2 PHE 47 3.000 -1.362 -0.517
354 HE2 PHE 47 HE1 PHE 47 -1.032 -2.514 0.253
355 HZ PHE 47 HZ PHE 47 1.255 -2.083 1.061
356 HB2 PHE 47 2HB PHE 47 0.493 -0.508 -4.463
357 HB3 PHE 47 1HB PHE 47 -0.995 -1.421 -4.242
358 H GLU 48 H GLU 48 1.195 -1.147 -7.117
359 HA GLU 48 HA GLU 48 -1.288 -1.152 -8.405
360 HB2 GLU 48 2HB GLU 48 0.586 0.482 -8.772
361 HB3 GLU 48 1HB GLU 48 1.367 -0.727 -9.780
362 HG2 GLU 48 2HG GLU 48 -0.398 -0.650 -11.380
363 HG3 GLU 48 1HG GLU 48 -1.402 0.325 -10.311
364 HA PRO 49 HA PRO 49 0.557 -4.943 -11.126
365 HB2 PRO 49 2HB PRO 49 1.679 -6.224 -8.662
366 HB3 PRO 49 1HB PRO 49 2.187 -6.393 -10.349
367 HG2 PRO 49 2HG PRO 49 3.587 -4.865 -8.704
368 HG3 PRO 49 1HG PRO 49 3.267 -4.322 -10.364
369 HD2 PRO 49 2HD PRO 49 1.995 -3.440 -7.799
370 HD3 PRO 49 1HD PRO 49 2.413 -2.489 -9.239
371 H PHE 50 H PHE 50 -0.988 -4.609 -8.029
372 HA PHE 50 HA PHE 50 -2.612 -7.020 -8.400
373 HD1 PHE 50 HD2 PHE 50 -3.070 -8.518 -5.923
374 HD2 PHE 50 HD1 PHE 50 -0.327 -5.278 -5.549
375 HE1 PHE 50 HE2 PHE 50 -1.521 -9.972 -4.687
376 HE2 PHE 50 HE1 PHE 50 1.223 -6.733 -4.313
377 HZ PHE 50 HZ PHE 50 0.624 -9.081 -3.877
378 HB2 PHE 50 2HB PHE 50 -2.597 -4.892 -6.247
379 HB3 PHE 50 1HB PHE 50 -3.770 -6.202 -6.297
380 H GLY 51 H GLY 51 -2.810 -3.566 -8.793
381 HA2 GLY 51 2HA GLY 51 -4.969 -3.636 -10.590
382 HA3 GLY 51 1HA GLY 51 -5.578 -3.199 -8.999
383 H ARG 52 H ARG 52 -4.997 -1.745 -11.711
384 HA ARG 52 HA ARG 52 -3.042 0.165 -11.454
385 HE ARG 52 HE ARG 52 -3.757 4.368 -11.964
386 HB2 ARG 52 2HB ARG 52 -4.394 -0.114 -13.487
387 HB3 ARG 52 1HB ARG 52 -5.792 0.570 -12.668
388 HG2 ARG 52 2HG ARG 52 -3.300 2.204 -12.789
389 HG3 ARG 52 1HG ARG 52 -4.242 2.018 -14.266
390 HD2 ARG 52 2HD ARG 52 -6.024 3.212 -13.444
391 HD3 ARG 52 1HD ARG 52 -5.688 2.778 -11.769
392 HH11 ARG 52 1HH1 ARG 52 -6.520 4.741 -13.986
393 HH12 ARG 52 2HH1 ARG 52 -6.374 6.465 -14.040
394 HH21 ARG 52 1HH2 ARG 52 -3.607 6.570 -12.018
395 HH22 ARG 52 2HH2 ARG 52 -4.756 7.485 -12.929
396 H ILE 53 H ILE 53 -2.676 1.930 -10.278
397 HA ILE 53 HA ILE 53 -4.553 2.540 -8.120
398 HB ILE 53 HB ILE 53 -1.651 3.310 -8.501
399 HG12 ILE 53 2HG1 ILE 53 -2.939 1.313 -6.610
400 HG13 ILE 53 1HG1 ILE 53 -2.089 0.892 -8.092
401 HG21 ILE 53 1HG2 ILE 53 -2.801 5.009 -7.192
402 HG22 ILE 53 2HG2 ILE 53 -1.731 4.063 -6.156
403 HG23 ILE 53 3HG2 ILE 53 -3.469 3.770 -6.129
404 HD11 ILE 53 3HD1 ILE 53 -0.907 2.168 -5.636
405 HD12 ILE 53 1HD1 ILE 53 -0.035 1.881 -7.145
406 HD13 ILE 53 2HD1 ILE 53 -0.661 0.517 -6.215
407 H GLU 54 H GLU 54 -5.696 4.356 -8.011
408 HA GLU 54 HA GLU 54 -5.698 6.289 -10.124
409 HB2 GLU 54 2HB GLU 54 -7.148 6.105 -7.475
410 HB3 GLU 54 1HB GLU 54 -7.392 7.437 -8.595
411 HG2 GLU 54 2HG GLU 54 -7.756 4.615 -9.525
412 HG3 GLU 54 1HG GLU 54 -9.027 5.409 -8.603
413 H SER 55 H SER 55 -5.068 6.577 -6.618
414 HA SER 55 HA SER 55 -2.957 8.509 -7.106
415 HG SER 55 HG SER 55 -3.718 10.255 -4.506
416 HB2 SER 55 2HB SER 55 -4.929 9.962 -7.039
417 HB3 SER 55 1HB SER 55 -5.409 9.268 -5.492
418 H ILE 56 H ILE 56 -1.520 8.756 -5.388
419 HA ILE 56 HA ILE 56 -2.032 7.109 -2.982
420 HB ILE 56 HB ILE 56 0.637 7.630 -4.327
421 HG12 ILE 56 2HG1 ILE 56 -1.001 5.098 -3.995
422 HG13 ILE 56 1HG1 ILE 56 -0.651 5.933 -5.503
423 HG21 ILE 56 1HG2 ILE 56 0.885 7.635 -1.901
424 HG22 ILE 56 2HG2 ILE 56 1.600 6.177 -2.585
425 HG23 ILE 56 3HG2 ILE 56 0.028 6.098 -1.791
426 HD11 ILE 56 3HD1 ILE 56 1.699 5.382 -5.288
427 HD12 ILE 56 1HD1 ILE 56 0.703 3.929 -5.226
428 HD13 ILE 56 2HD1 ILE 56 1.388 4.591 -3.741
429 H GLN 57 H GLN 57 -1.622 8.023 -1.010
430 HA GLN 57 HA GLN 57 -0.630 10.806 -0.966
431 HB2 GLN 57 2HB GLN 57 -3.097 10.592 -0.553
432 HB3 GLN 57 1HB GLN 57 -2.734 9.619 0.864
433 HG2 GLN 57 2HG GLN 57 -3.209 11.848 1.575
434 HG3 GLN 57 1HG GLN 57 -1.488 11.547 1.811
435 HE21 GLN 57 1HE2 GLN 57 -0.993 13.748 1.775
436 HE22 GLN 57 2HE2 GLN 57 -1.044 14.682 0.327
437 H LEU 58 H LEU 58 1.343 10.782 -0.056
438 HA LEU 58 HA LEU 58 1.996 8.752 1.972
439 HG LEU 58 HG LEU 58 4.228 7.745 1.532
440 HB2 LEU 58 2HB LEU 58 3.357 9.318 -0.206
441 HB3 LEU 58 1HB LEU 58 3.978 10.656 0.737
442 HD11 LEU 58 1HD1 LEU 58 6.574 7.940 0.861
443 HD12 LEU 58 2HD1 LEU 58 6.266 9.568 0.252
444 HD13 LEU 58 3HD1 LEU 58 5.484 8.178 -0.505
445 HD21 LEU 58 3HD2 LEU 58 5.896 8.560 3.131
446 HD22 LEU 58 1HD2 LEU 58 4.308 9.257 3.444
447 HD23 LEU 58 2HD2 LEU 58 5.553 10.221 2.646
448 H MET 59 H MET 59 2.342 9.304 4.100
449 HA MET 59 HA MET 59 1.756 12.088 4.779
450 HB2 MET 59 2HB MET 59 1.838 9.659 6.578
451 HB3 MET 59 1HB MET 59 1.310 11.270 7.043
452 HG2 MET 59 2HG MET 59 -0.442 11.047 5.197
453 HG3 MET 59 1HG MET 59 -0.028 9.333 5.178
454 HE1 MET 59 3HE MET 59 -0.209 11.888 8.173
455 HE2 MET 59 1HE MET 59 -1.823 11.559 8.804
456 HE3 MET 59 2HE MET 59 -1.632 12.281 7.207
457 H MET 60 H MET 60 3.669 13.138 4.471
458 HA MET 60 HA MET 60 5.802 12.561 6.432
459 HB2 MET 60 2HB MET 60 5.892 14.140 3.845
460 HB3 MET 60 1HB MET 60 7.210 14.091 5.006
461 HG2 MET 60 2HG MET 60 7.407 11.673 4.676
462 HG3 MET 60 1HG MET 60 6.096 11.732 3.497
463 HE1 MET 60 3HE MET 60 7.767 10.468 1.767
464 HE2 MET 60 1HE MET 60 9.044 10.503 2.985
465 HE3 MET 60 2HE MET 60 9.364 11.091 1.354
466 H ASP 61 H ASP 61 6.475 14.226 7.819
467 HA ASP 61 HA ASP 61 4.595 16.203 8.536
468 HB2 ASP 61 2HB ASP 61 7.511 15.821 9.228
469 HB3 ASP 61 1HB ASP 61 6.552 17.140 9.895
470 H SER 62 H SER 62 4.042 17.669 6.951
471 HA SER 62 HA SER 62 5.833 18.971 5.209
472 HG SER 62 HG SER 62 2.419 19.062 4.235
473 HB2 SER 62 2HB SER 62 3.148 19.938 6.234
474 HB3 SER 62 1HB SER 62 4.005 20.603 4.842
475 H GLU 63 H GLU 63 5.641 19.267 8.511
476 HA GLU 63 HA GLU 63 6.328 22.060 8.781
477 HB2 GLU 63 2HB GLU 63 5.113 20.774 10.543
478 HB3 GLU 63 1HB GLU 63 6.555 19.799 10.787
479 HG2 GLU 63 2HG GLU 63 7.766 21.944 11.351
480 HG3 GLU 63 1HG GLU 63 6.186 22.727 11.372
481 H THR 64 H THR 64 8.056 19.017 9.444
482 HA THR 64 HA THR 64 10.638 20.433 9.350
483 HB THR 64 HB THR 64 11.539 18.399 10.457
484 HG1 THR 64 HG1 THR 64 9.712 16.997 11.327
485 HG21 THR 64 3HG2 THR 64 9.127 19.592 11.840
486 HG22 THR 64 1HG2 THR 64 10.761 20.257 11.852
487 HG23 THR 64 2HG2 THR 64 10.432 18.710 12.633
488 H GLY 65 H GLY 65 8.827 17.854 7.820
489 HA2 GLY 65 2HA GLY 65 9.221 17.131 5.585
490 HA3 GLY 65 1HA GLY 65 10.906 17.606 5.750
491 H ARG 66 H ARG 66 9.269 15.739 8.221
492 HA ARG 66 HA ARG 66 11.168 13.553 7.722
493 HE ARG 66 HE ARG 66 12.916 12.742 10.933
494 HB2 ARG 66 2HB ARG 66 9.459 14.124 10.153
495 HB3 ARG 66 1HB ARG 66 10.635 12.823 10.017
496 HG2 ARG 66 2HG ARG 66 11.253 15.774 9.891
497 HG3 ARG 66 1HG ARG 66 11.532 14.713 11.273
498 HD2 ARG 66 2HD ARG 66 12.794 14.359 8.550
499 HD3 ARG 66 1HD ARG 66 13.573 15.148 9.920
500 HH11 ARG 66 1HH1 ARG 66 14.494 13.615 8.003
501 HH12 ARG 66 2HH1 ARG 66 15.534 12.241 8.016
502 HH21 ARG 66 1HH2 ARG 66 14.226 10.956 10.928
503 HH22 ARG 66 2HH2 ARG 66 15.388 10.740 9.668
504 H SER 67 H SER 67 10.480 11.320 7.945
505 HA SER 67 HA SER 67 7.887 10.912 6.628
506 HG SER 67 HG SER 67 10.689 10.620 5.461
507 HB2 SER 67 2HB SER 67 10.252 9.042 6.983
508 HB3 SER 67 1HB SER 67 8.769 8.633 6.117
509 H LYS 68 H LYS 68 6.172 10.431 7.904
510 HA LYS 68 HA LYS 68 6.506 9.330 10.538
511 HB2 LYS 68 2HB LYS 68 4.230 10.336 8.929
512 HB3 LYS 68 1HB LYS 68 3.839 9.161 10.178
513 HG2 LYS 68 2HG LYS 68 4.854 10.557 11.872
514 HG3 LYS 68 1HG LYS 68 5.392 11.702 10.645
515 HD2 LYS 68 2HD LYS 68 3.192 12.424 10.198
516 HD3 LYS 68 1HD LYS 68 2.482 11.038 11.030
517 HE2 LYS 68 2HE LYS 68 2.383 13.234 12.277
518 HE3 LYS 68 1HE LYS 68 3.084 11.880 13.160
519 HZ1 LYS 68 3HZ LYS 68 5.272 12.724 12.724
520 HZ2 LYS 68 1HZ LYS 68 4.346 13.963 13.403
521 HZ3 LYS 68 2HZ LYS 68 4.665 13.960 11.746
522 H GLY 69 H GLY 69 6.218 7.894 7.458
523 HA2 GLY 69 2HA GLY 69 6.866 5.657 7.136
524 HA3 GLY 69 1HA GLY 69 6.463 5.317 8.804
525 H TYR 70 H TYR 70 3.935 6.918 7.084
526 HA TYR 70 HA TYR 70 2.824 4.425 6.076
527 HD1 TYR 70 HD1 TYR 70 0.589 7.653 7.477
528 HD2 TYR 70 HD2 TYR 70 2.406 4.977 10.245
529 HE1 TYR 70 HE1 TYR 70 0.454 9.377 9.228
530 HE2 TYR 70 HE2 TYR 70 2.280 6.691 11.996
531 HH TYR 70 HH TYR 70 2.034 8.999 12.307
532 HB2 TYR 70 2HB TYR 70 0.582 5.005 7.252
533 HB3 TYR 70 1HB TYR 70 1.844 4.184 8.158
534 H GLY 71 H GLY 71 1.064 4.620 4.652
535 HA2 GLY 71 2HA GLY 71 0.271 7.298 3.768
536 HA3 GLY 71 1HA GLY 71 1.164 6.323 2.613
537 H PHE 72 H PHE 72 -1.444 7.284 2.158
538 HA PHE 72 HA PHE 72 -3.099 4.844 2.300
539 HD1 PHE 72 HD1 PHE 72 -5.674 5.174 3.824
540 HD2 PHE 72 HD2 PHE 72 -2.993 8.485 4.020
541 HE1 PHE 72 HE1 PHE 72 -6.022 5.311 6.257
542 HE2 PHE 72 HE2 PHE 72 -3.340 8.624 6.450
543 HZ PHE 72 HZ PHE 72 -4.854 7.035 7.573
544 HB2 PHE 72 2HB PHE 72 -3.907 7.736 1.897
545 HB3 PHE 72 1HB PHE 72 -5.022 6.375 1.817
546 H ILE 73 H ILE 73 -3.486 3.733 0.477
547 HA ILE 73 HA ILE 73 -2.871 5.020 -2.115
548 HB ILE 73 HB ILE 73 -2.794 2.074 -1.409
549 HG12 ILE 73 2HG1 ILE 73 -0.528 4.003 -1.997
550 HG13 ILE 73 1HG1 ILE 73 -0.964 3.413 -0.397
551 HG21 ILE 73 1HG2 ILE 73 -2.045 3.494 -3.973
552 HG22 ILE 73 2HG2 ILE 73 -3.429 2.426 -3.737
553 HG23 ILE 73 3HG2 ILE 73 -1.792 1.780 -3.639
554 HD11 ILE 73 3HD1 ILE 73 0.026 1.741 -2.695
555 HD12 ILE 73 1HD1 ILE 73 -0.427 1.134 -1.102
556 HD13 ILE 73 2HD1 ILE 73 0.951 2.222 -1.270
557 H THR 74 H THR 74 -4.436 5.167 -3.625
558 HA THR 74 HA THR 74 -7.027 3.844 -3.084
559 HB THR 74 HB THR 74 -6.479 6.320 -4.746
560 HG1 THR 74 HG1 THR 74 -6.383 6.896 -2.617
561 HG21 THR 74 3HG2 THR 74 -8.377 5.077 -5.653
562 HG22 THR 74 1HG2 THR 74 -8.933 6.545 -4.849
563 HG23 THR 74 2HG2 THR 74 -9.103 4.983 -4.048
564 H PHE 75 H PHE 75 -7.549 2.183 -4.355
565 HA PHE 75 HA PHE 75 -6.229 1.866 -6.967
566 HD1 PHE 75 HD2 PHE 75 -6.305 0.684 -3.407
567 HD2 PHE 75 HD1 PHE 75 -4.906 -1.292 -6.912
568 HE1 PHE 75 HE2 PHE 75 -4.258 0.027 -2.218
569 HE2 PHE 75 HE1 PHE 75 -2.857 -1.950 -5.721
570 HZ PHE 75 HZ PHE 75 -2.533 -1.291 -3.371
571 HB2 PHE 75 2HB PHE 75 -7.848 -0.107 -5.327
572 HB3 PHE 75 1HB PHE 75 -7.076 -0.465 -6.867
573 H SER 76 H SER 76 -7.410 1.445 -8.876
574 HA SER 76 HA SER 76 -9.967 2.738 -9.077
575 HG SER 76 HG SER 76 -8.289 3.766 -11.400
576 HB2 SER 76 2HB SER 76 -8.563 1.072 -11.182
577 HB3 SER 76 1HB SER 76 -9.799 2.300 -11.452
578 H ASP 77 H ASP 77 -9.474 -0.059 -7.674
579 HA ASP 77 HA ASP 77 -12.050 -1.163 -8.410
580 HB2 ASP 77 2HB ASP 77 -10.378 -2.170 -10.014
581 HB3 ASP 77 1HB ASP 77 -9.568 -2.894 -8.632
582 H SER 78 H SER 78 -12.930 -2.486 -6.796
583 HA SER 78 HA SER 78 -11.885 -2.091 -4.153
584 HG SER 78 HG SER 78 -14.153 -2.896 -2.494
585 HB2 SER 78 2HB SER 78 -14.276 -2.034 -4.432
586 HB3 SER 78 1HB SER 78 -14.284 -3.640 -5.159
587 H GLU 79 H GLU 79 -12.315 -4.964 -6.231
588 HA GLU 79 HA GLU 79 -11.429 -6.785 -4.209
589 HB2 GLU 79 2HB GLU 79 -11.675 -7.211 -7.195
590 HB3 GLU 79 1HB GLU 79 -11.476 -8.477 -5.986
591 HG2 GLU 79 2HG GLU 79 -13.627 -7.760 -4.964
592 HG3 GLU 79 1HG GLU 79 -13.835 -6.626 -6.297
593 H CYS 80 H CYS 80 -9.842 -5.076 -6.853
594 HA CYS 80 HA CYS 80 -7.358 -6.387 -6.803
595 HG CYS 80 HG CYS 80 -6.968 -5.538 -9.816
596 HB2 CYS 80 2HB CYS 80 -8.008 -3.486 -7.362
597 HB3 CYS 80 1HB CYS 80 -6.422 -4.202 -7.628
598 H ALA 81 H ALA 81 -8.480 -3.594 -4.896
599 HA ALA 81 HA ALA 81 -6.122 -3.326 -3.324
600 HB1 ALA 81 3HB ALA 81 -7.529 -1.932 -1.850
601 HB2 ALA 81 1HB ALA 81 -8.958 -2.455 -2.741
602 HB3 ALA 81 2HB ALA 81 -7.714 -1.499 -3.551
603 H LYS 82 H LYS 82 -9.225 -4.958 -2.753
604 HA LYS 82 HA LYS 82 -8.826 -5.948 -0.195
605 HB2 LYS 82 2HB LYS 82 -10.938 -6.080 -1.488
606 HB3 LYS 82 1HB LYS 82 -10.218 -7.313 -2.514
607 HG2 LYS 82 2HG LYS 82 -10.008 -8.796 -0.559
608 HG3 LYS 82 1HG LYS 82 -10.777 -7.559 0.440
609 HD2 LYS 82 2HD LYS 82 -12.018 -8.974 -1.929
610 HD3 LYS 82 1HD LYS 82 -12.409 -9.240 -0.229
611 HE2 LYS 82 2HE LYS 82 -13.243 -6.961 -0.038
612 HE3 LYS 82 1HE LYS 82 -12.795 -6.635 -1.711
613 HZ1 LYS 82 3HZ LYS 82 -15.142 -7.116 -1.514
614 HZ2 LYS 82 1HZ LYS 82 -14.811 -8.617 -0.811
615 HZ3 LYS 82 2HZ LYS 82 -14.376 -8.324 -2.417
616 H LYS 83 H LYS 83 -7.921 -7.459 -3.294
617 HA LYS 83 HA LYS 83 -6.680 -9.751 -2.175
618 HB2 LYS 83 2HB LYS 83 -7.439 -9.761 -4.473
619 HB3 LYS 83 1HB LYS 83 -6.355 -8.438 -4.881
620 HG2 LYS 83 2HG LYS 83 -4.421 -9.870 -4.480
621 HG3 LYS 83 1HG LYS 83 -5.487 -11.193 -4.008
622 HD2 LYS 83 2HD LYS 83 -5.748 -9.910 -6.715
623 HD3 LYS 83 1HD LYS 83 -4.522 -11.140 -6.421
624 HE2 LYS 83 2HE LYS 83 -6.480 -12.194 -7.349
625 HE3 LYS 83 1HE LYS 83 -6.300 -12.693 -5.668
626 HZ1 LYS 83 3HZ LYS 83 -8.600 -12.178 -6.246
627 HZ2 LYS 83 1HZ LYS 83 -8.167 -10.590 -6.640
628 HZ3 LYS 83 2HZ LYS 83 -8.027 -11.137 -5.047
629 H ALA 84 H ALA 84 -5.363 -6.630 -3.287
630 HA ALA 84 HA ALA 84 -2.654 -7.102 -2.910
631 HB1 ALA 84 3HB ALA 84 -4.140 -4.524 -2.364
632 HB2 ALA 84 1HB ALA 84 -3.537 -5.061 -3.934
633 HB3 ALA 84 2HB ALA 84 -2.404 -4.686 -2.637
634 H LEU 85 H LEU 85 -5.050 -5.977 -0.546
635 HA LEU 85 HA LEU 85 -3.391 -5.732 1.687
636 HG LEU 85 HG LEU 85 -4.667 -5.353 3.837
637 HB2 LEU 85 2HB LEU 85 -5.762 -4.967 1.510
638 HB3 LEU 85 1HB LEU 85 -6.284 -6.634 1.632
639 HD11 LEU 85 1HD1 LEU 85 -6.760 -4.791 4.964
640 HD12 LEU 85 2HD1 LEU 85 -7.674 -5.311 3.546
641 HD13 LEU 85 3HD1 LEU 85 -6.602 -3.912 3.442
642 HD21 LEU 85 3HD2 LEU 85 -6.633 -7.652 3.792
643 HD22 LEU 85 1HD2 LEU 85 -5.829 -7.023 5.232
644 HD23 LEU 85 2HD2 LEU 85 -4.880 -7.774 3.952
645 H GLU 86 H GLU 86 -5.315 -8.561 0.635
646 HA GLU 86 HA GLU 86 -4.658 -10.277 2.726
647 HB2 GLU 86 2HB GLU 86 -5.270 -10.969 -0.159
648 HB3 GLU 86 1HB GLU 86 -5.258 -12.127 1.164
649 HG2 GLU 86 2HG GLU 86 -7.097 -9.749 0.930
650 HG3 GLU 86 1HG GLU 86 -7.522 -11.417 0.556
651 H GLN 87 H GLN 87 -2.807 -9.543 -0.201
652 HA GLN 87 HA GLN 87 -0.994 -11.778 0.244
653 HB2 GLN 87 2HB GLN 87 -0.961 -9.616 -1.874
654 HB3 GLN 87 1HB GLN 87 0.077 -11.034 -1.845
655 HG2 GLN 87 2HG GLN 87 -2.929 -11.119 -2.038
656 HG3 GLN 87 1HG GLN 87 -1.832 -11.208 -3.413
657 HE21 GLN 87 1HE2 GLN 87 -2.528 -13.229 -4.019
658 HE22 GLN 87 2HE2 GLN 87 -2.149 -14.657 -3.128
659 H LEU 88 H LEU 88 -0.985 -8.274 0.593
660 HA LEU 88 HA LEU 88 1.891 -8.266 1.124
661 HG LEU 88 HG LEU 88 0.320 -7.233 -1.323
662 HB2 LEU 88 2HB LEU 88 -0.039 -5.968 0.787
663 HB3 LEU 88 1HB LEU 88 1.701 -5.820 0.966
664 HD11 LEU 88 1HD1 LEU 88 -0.073 -4.835 -1.396
665 HD12 LEU 88 2HD1 LEU 88 1.013 -5.341 -2.689
666 HD13 LEU 88 3HD1 LEU 88 1.660 -4.531 -1.259
667 HD21 LEU 88 3HD2 LEU 88 3.231 -6.571 -0.860
668 HD22 LEU 88 1HD2 LEU 88 2.558 -7.236 -2.350
669 HD23 LEU 88 2HD2 LEU 88 2.504 -8.180 -0.862
670 H ASN 89 H ASN 89 -1.054 -8.193 2.907
671 HA ASN 89 HA ASN 89 -0.175 -6.837 5.228
672 HB2 ASN 89 2HB ASN 89 -2.541 -7.422 4.820
673 HB3 ASN 89 1HB ASN 89 -2.150 -9.128 5.004
674 HD21 ASN 89 1HD2 ASN 89 -2.696 -6.130 6.619
675 HD22 ASN 89 2HD2 ASN 89 -2.693 -6.761 8.227
676 H GLY 90 H GLY 90 1.711 -7.352 6.184
677 HA2 GLY 90 2HA GLY 90 3.018 -8.690 7.629
678 HA3 GLY 90 1HA GLY 90 2.148 -10.112 7.077
679 H PHE 91 H PHE 91 3.208 -8.026 4.586
680 HA PHE 91 HA PHE 91 5.089 -9.952 3.574
681 HD1 PHE 91 HD2 PHE 91 5.173 -10.322 0.836
682 HD2 PHE 91 HD1 PHE 91 6.334 -6.298 1.632
683 HE1 PHE 91 HE2 PHE 91 6.894 -10.471 -0.917
684 HE2 PHE 91 HE1 PHE 91 8.053 -6.447 -0.119
685 HZ PHE 91 HZ PHE 91 8.338 -8.533 -1.397
686 HB2 PHE 91 2HB PHE 91 3.673 -8.672 2.046
687 HB3 PHE 91 1HB PHE 91 4.376 -7.164 2.619
688 H GLU 92 H GLU 92 7.287 -9.946 3.715
689 HA GLU 92 HA GLU 92 8.549 -8.096 5.532
690 HB2 GLU 92 2HB GLU 92 9.732 -10.322 3.856
691 HB3 GLU 92 1HB GLU 92 10.608 -9.410 5.078
692 HG2 GLU 92 2HG GLU 92 9.011 -10.243 6.781
693 HG3 GLU 92 1HG GLU 92 8.249 -11.231 5.533
694 H LEU 93 H LEU 93 8.502 -6.054 4.536
695 HA LEU 93 HA LEU 93 10.081 -5.757 2.068
696 HG LEU 93 HG LEU 93 10.139 -2.663 2.054
697 HB2 LEU 93 2HB LEU 93 7.856 -4.645 2.215
698 HB3 LEU 93 1HB LEU 93 8.459 -3.677 3.549
699 HD11 LEU 93 1HD1 LEU 93 9.987 -3.018 -0.372
700 HD12 LEU 93 2HD1 LEU 93 8.792 -4.291 -0.105
701 HD13 LEU 93 3HD1 LEU 93 10.443 -4.491 0.488
702 HD21 LEU 93 3HD2 LEU 93 8.601 -1.293 0.739
703 HD22 LEU 93 1HD2 LEU 93 7.970 -1.569 2.362
704 HD23 LEU 93 2HD2 LEU 93 7.312 -2.471 0.996
705 H ALA 94 H ALA 94 12.124 -5.017 2.112
706 HA ALA 94 HA ALA 94 14.151 -4.321 2.886
707 HB1 ALA 94 3HB ALA 94 12.572 -2.758 4.936
708 HB2 ALA 94 1HB ALA 94 13.002 -2.192 3.325
709 HB3 ALA 94 2HB ALA 94 14.265 -2.509 4.512
710 H GLY 95 H GLY 95 12.451 -6.558 4.272
711 HA2 GLY 95 2HA GLY 95 13.378 -8.298 5.599
712 HA3 GLY 95 1HA GLY 95 14.454 -7.132 6.346
713 H ARG 96 H ARG 96 11.409 -5.782 6.261
714 HA ARG 96 HA ARG 96 10.659 -6.880 8.893
715 HE ARG 96 HE ARG 96 13.124 -3.220 8.561
716 HB2 ARG 96 2HB ARG 96 10.181 -4.640 9.722
717 HB3 ARG 96 1HB ARG 96 11.858 -4.754 9.211
718 HG2 ARG 96 2HG ARG 96 11.120 -3.692 7.024
719 HG3 ARG 96 1HG ARG 96 9.585 -3.351 7.825
720 HD2 ARG 96 2HD ARG 96 10.976 -1.405 8.007
721 HD3 ARG 96 1HD ARG 96 10.851 -2.142 9.604
722 HH11 ARG 96 1HH1 ARG 96 12.036 -0.005 9.188
723 HH12 ARG 96 2HH1 ARG 96 13.641 0.626 9.273
724 HH21 ARG 96 1HH2 ARG 96 15.153 -2.405 8.719
725 HH22 ARG 96 2HH2 ARG 96 15.393 -0.717 9.016
726 HA PRO 97 HA PRO 97 6.632 -7.418 7.307
727 HB2 PRO 97 2HB PRO 97 5.002 -6.780 9.409
728 HB3 PRO 97 1HB PRO 97 5.972 -8.254 9.333
729 HG2 PRO 97 2HG PRO 97 6.571 -5.665 10.732
730 HG3 PRO 97 1HG PRO 97 6.761 -7.326 11.328
731 HD2 PRO 97 2HD PRO 97 8.857 -5.915 10.405
732 HD3 PRO 97 1HD PRO 97 8.727 -7.666 10.135
733 H MET 98 H MET 98 4.867 -6.481 6.344
734 HA MET 98 HA MET 98 4.681 -3.537 6.420
735 HB2 MET 98 2HB MET 98 5.246 -4.497 4.228
736 HB3 MET 98 1HB MET 98 3.804 -5.500 4.281
737 HG2 MET 98 2HG MET 98 2.437 -3.423 4.323
738 HG3 MET 98 1HG MET 98 3.919 -2.496 4.094
739 HE1 MET 98 3HE MET 98 5.479 -2.747 1.940
740 HE2 MET 98 1HE MET 98 5.087 -3.773 0.558
741 HE3 MET 98 2HE MET 98 5.522 -4.503 2.104
742 H LYS 99 H LYS 99 2.956 -2.718 7.497
743 HA LYS 99 HA LYS 99 0.636 -4.396 8.054
744 HB2 LYS 99 2HB LYS 99 1.418 -1.627 8.984
745 HB3 LYS 99 1HB LYS 99 -0.113 -2.381 9.405
746 HG2 LYS 99 2HG LYS 99 1.106 -4.221 10.495
747 HG3 LYS 99 1HG LYS 99 2.631 -3.420 10.103
748 HD2 LYS 99 2HD LYS 99 2.017 -1.511 11.472
749 HD3 LYS 99 1HD LYS 99 0.432 -2.215 11.797
750 HE2 LYS 99 2HE LYS 99 1.971 -2.531 13.685
751 HE3 LYS 99 1HE LYS 99 1.480 -4.073 12.986
752 HZ1 LYS 99 3HZ LYS 99 4.043 -2.685 12.417
753 HZ2 LYS 99 1HZ LYS 99 3.579 -4.201 11.827
754 HZ3 LYS 99 2HZ LYS 99 3.859 -3.985 13.481
755 H VAL 100 H VAL 100 -0.591 -4.579 6.216
756 HA VAL 100 HA VAL 100 -1.612 -2.085 5.011
757 HB VAL 100 HB VAL 100 -1.834 -4.878 3.868
758 HG11 VAL 100 1HG1 VAL 100 -2.361 -3.681 1.766
759 HG12 VAL 100 2HG1 VAL 100 -2.311 -2.151 2.644
760 HG13 VAL 100 3HG1 VAL 100 -3.538 -3.356 3.040
761 HG21 VAL 100 3HG2 VAL 100 0.517 -4.283 4.002
762 HG22 VAL 100 1HG2 VAL 100 0.195 -2.728 3.230
763 HG23 VAL 100 2HG2 VAL 100 -0.024 -4.227 2.323
764 H GLY 101 H GLY 101 -3.547 -1.458 5.746
765 HA2 GLY 101 2HA GLY 101 -5.662 -3.488 6.115
766 HA3 GLY 101 1HA GLY 101 -5.342 -2.342 7.406
767 H HIS 102 H HIS 102 -7.720 -2.827 5.537
768 HA HIS 102 HA HIS 102 -7.852 -0.470 3.887
769 HD1 HIS 102 HD1 HIS 102 -11.836 -1.437 5.396
770 HD2 HIS 102 HD2 HIS 102 -9.331 -4.705 4.816
771 HE1 HIS 102 HE1 HIS 102 -12.839 -3.302 6.743
772 HE2 HIS 102 HE2 HIS 102 -11.379 -5.294 6.281
773 HB2 HIS 102 2HB HIS 102 -10.171 -1.186 3.396
774 HB3 HIS 102 1HB HIS 102 -9.003 -2.479 3.153
775 H VAL 103 H VAL 103 -7.387 1.080 5.641
776 HA VAL 103 HA VAL 103 -7.951 2.652 7.207
777 HB VAL 103 HB VAL 103 -10.795 2.279 6.222
778 HG11 VAL 103 1HG1 VAL 103 -11.010 4.685 6.718
779 HG12 VAL 103 2HG1 VAL 103 -9.364 4.691 7.349
780 HG13 VAL 103 3HG1 VAL 103 -10.611 3.744 8.154
781 HG21 VAL 103 3HG2 VAL 103 -9.357 2.480 4.280
782 HG22 VAL 103 1HG2 VAL 103 -8.573 3.901 4.972
783 HG23 VAL 103 2HG2 VAL 103 -10.269 3.974 4.499
784 H THR 104 H THR 104 -7.771 0.033 8.144
785 HA THR 104 HA THR 104 -10.075 -0.783 9.646
786 HB THR 104 HB THR 104 -7.246 -1.838 9.909
787 HG1 THR 104 HG1 THR 104 -8.370 -3.473 8.358
788 HG21 THR 104 3HG2 THR 104 -8.780 -2.624 11.651
789 HG22 THR 104 1HG2 THR 104 -8.367 -3.937 10.548
790 HG23 THR 104 2HG2 THR 104 -9.934 -3.137 10.420
791 H GLU 105 H GLU 105 -7.584 1.443 10.319
792 HA GLU 105 HA GLU 105 -7.056 0.900 13.033
793 HB2 GLU 105 2HB GLU 105 -6.878 3.540 11.568
794 HB3 GLU 105 1HB GLU 105 -6.199 3.218 13.157
795 HG2 GLU 105 2HG GLU 105 -4.873 1.354 12.016
796 HG3 GLU 105 1HG GLU 105 -5.345 2.120 10.500
797 H ARG 106 H ARG 106 -8.274 1.095 14.767
798 HA ARG 106 HA ARG 106 -9.879 1.723 16.247
799 HE ARG 106 HE ARG 106 -9.337 5.368 18.077
800 HB2 ARG 106 2HB ARG 106 -9.750 4.404 14.849
801 HB3 ARG 106 1HB ARG 106 -10.273 4.097 16.502
802 HG2 ARG 106 2HG ARG 106 -8.004 3.382 17.092
803 HG3 ARG 106 1HG ARG 106 -7.483 3.677 15.431
804 HD2 ARG 106 2HD ARG 106 -6.816 5.569 16.688
805 HD3 ARG 106 1HD ARG 106 -8.214 6.069 15.739
806 HH11 ARG 106 1HH1 ARG 106 -6.690 7.421 17.282
807 HH12 ARG 106 2HH1 ARG 106 -6.874 8.385 18.705
808 HH21 ARG 106 1HH2 ARG 106 -9.565 6.614 19.900
809 HH22 ARG 106 2HH2 ARG 106 -8.480 7.936 20.168
810 H THR 107 H THR 107 -10.758 0.552 13.762
811 HA THR 107 HA THR 107 -12.621 -0.002 12.624
812 HB THR 107 HB THR 107 -14.803 0.197 13.671
813 HG1 THR 107 HG1 THR 107 -13.913 1.512 15.943
814 HG21 THR 107 3HG2 THR 107 -13.316 -1.538 14.525
815 HG22 THR 107 1HG2 THR 107 -14.326 -0.902 15.822
816 HG23 THR 107 2HG2 THR 107 -12.638 -0.407 15.695
817 H ASP 108 H ASP 108 -13.794 3.123 13.905
818 HA ASP 108 HA ASP 108 -13.984 4.084 11.116
819 HB2 ASP 108 2HB ASP 108 -16.204 3.391 12.067
820 HB3 ASP 108 1HB ASP 108 -16.021 4.643 13.293
Start of MODEL 12
1 HA MET 1 HA MET 1 -24.773 18.065 22.953
2 H1 MET 1 1H MET 1 -22.455 19.577 21.893
3 H2 MET 1 2H MET 1 -22.460 17.955 22.379
4 H3 MET 1 3H MET 1 -22.704 19.178 23.520
5 HB2 MET 1 2HB MET 1 -24.877 20.366 23.700
6 HB3 MET 1 1HB MET 1 -24.502 20.953 22.086
7 HG2 MET 1 2HG MET 1 -26.634 20.029 21.276
8 HG3 MET 1 1HG MET 1 -27.011 19.508 22.916
9 HE1 MET 1 3HE MET 1 -29.359 20.864 22.577
10 HE2 MET 1 1HE MET 1 -28.825 21.418 20.990
11 HE3 MET 1 2HE MET 1 -29.418 22.579 22.177
12 H GLY 2 H GLY 2 -25.907 16.968 21.437
13 HA2 GLY 2 2HA GLY 2 -27.050 16.662 19.433
14 HA3 GLY 2 1HA GLY 2 -26.267 18.089 18.789
15 H HIS 3 H HIS 3 -23.813 17.741 18.378
16 HA HIS 3 HA HIS 3 -22.113 16.693 17.301
17 HD1 HIS 3 HD1 HIS 3 -20.907 12.802 18.897
18 HD2 HIS 3 HD2 HIS 3 -21.840 16.712 19.941
19 HE1 HIS 3 HE1 HIS 3 -19.449 13.337 20.865
20 HE2 HIS 3 HE2 HIS 3 -19.852 15.775 21.306
21 HB2 HIS 3 2HB HIS 3 -23.595 14.252 18.230
22 HB3 HIS 3 1HB HIS 3 -22.257 14.089 17.100
23 H HIS 4 H HIS 4 -25.186 15.125 16.319
24 HA HIS 4 HA HIS 4 -24.344 14.329 13.788
25 HD1 HIS 4 HD1 HIS 4 -27.388 14.128 16.880
26 HD2 HIS 4 HD2 HIS 4 -28.424 16.489 13.617
27 HE1 HIS 4 HE1 HIS 4 -29.248 15.608 17.679
28 HE2 HIS 4 HE2 HIS 4 -29.804 17.082 15.721
29 HB2 HIS 4 2HB HIS 4 -26.788 14.166 13.231
30 HB3 HIS 4 1HB HIS 4 -26.312 13.352 14.714
31 H HIS 5 H HIS 5 -23.225 15.933 12.660
32 HA HIS 5 HA HIS 5 -24.940 18.018 11.467
33 HD1 HIS 5 HD1 HIS 5 -25.436 20.324 12.558
34 HD2 HIS 5 HD2 HIS 5 -22.511 18.943 15.168
35 HE1 HIS 5 HE1 HIS 5 -26.105 21.164 14.823
36 HE2 HIS 5 HE2 HIS 5 -24.258 20.432 16.358
37 HB2 HIS 5 2HB HIS 5 -22.136 18.418 12.526
38 HB3 HIS 5 1HB HIS 5 -22.968 19.576 11.491
39 H HIS 6 H HIS 6 -25.197 17.042 9.507
40 HA HIS 6 HA HIS 6 -23.185 17.641 7.604
41 HD1 HIS 6 HD1 HIS 6 -22.667 14.019 10.052
42 HD2 HIS 6 HD2 HIS 6 -25.313 13.671 6.872
43 HE1 HIS 6 HE1 HIS 6 -24.078 12.012 10.570
44 HE2 HIS 6 HE2 HIS 6 -25.518 11.702 8.532
45 HB2 HIS 6 2HB HIS 6 -22.931 15.316 6.648
46 HB3 HIS 6 1HB HIS 6 -22.117 15.589 8.181
47 H HIS 7 H HIS 7 -25.260 18.865 7.280
48 HA HIS 7 HA HIS 7 -27.215 19.318 6.190
49 HD1 HIS 7 HD1 HIS 7 -24.081 17.435 3.597
50 HD2 HIS 7 HD2 HIS 7 -26.267 20.954 3.911
51 HE1 HIS 7 HE1 HIS 7 -22.607 19.225 2.649
52 HE2 HIS 7 HE2 HIS 7 -23.858 21.363 3.059
53 HB2 HIS 7 2HB HIS 7 -26.371 17.021 4.396
54 HB3 HIS 7 1HB HIS 7 -27.551 18.262 3.997
55 H HIS 8 H HIS 8 -27.312 17.408 8.394
56 HA HIS 8 HA HIS 8 -28.569 15.821 9.399
57 HD1 HIS 8 HD1 HIS 8 -30.887 16.920 10.911
58 HD2 HIS 8 HD2 HIS 8 -30.707 19.131 7.395
59 HE1 HIS 8 HE1 HIS 8 -31.399 19.286 11.573
60 HE2 HIS 8 HE2 HIS 8 -31.156 20.625 9.460
61 HB2 HIS 8 2HB HIS 8 -30.558 16.382 7.185
62 HB3 HIS 8 1HB HIS 8 -30.902 15.495 8.666
63 H SER 9 H SER 9 -29.436 15.167 5.991
64 HA SER 9 HA SER 9 -29.328 13.266 4.732
65 HG SER 9 HG SER 9 -26.207 14.821 4.887
66 HB2 SER 9 2HB SER 9 -26.586 13.103 6.019
67 HB3 SER 9 1HB SER 9 -27.074 12.294 4.528
68 H HIS 10 H HIS 10 -30.392 12.938 7.461
69 HA HIS 10 HA HIS 10 -29.614 10.412 8.511
70 HD1 HIS 10 HD1 HIS 10 -30.260 10.543 11.720
71 HD2 HIS 10 HD2 HIS 10 -33.649 9.614 9.500
72 HE1 HIS 10 HE1 HIS 10 -31.491 8.818 13.060
73 HE2 HIS 10 HE2 HIS 10 -33.586 8.346 11.753
74 HB2 HIS 10 2HB HIS 10 -30.715 12.191 9.840
75 HB3 HIS 10 1HB HIS 10 -32.182 11.979 8.895
76 H MET 11 H MET 11 -30.409 8.368 8.090
77 HA MET 11 HA MET 11 -31.517 7.815 5.594
78 HB2 MET 11 2HB MET 11 -31.816 5.515 6.368
79 HB3 MET 11 1HB MET 11 -30.255 6.151 6.864
80 HG2 MET 11 2HG MET 11 -32.680 5.951 8.638
81 HG3 MET 11 1HG MET 11 -31.347 4.800 8.602
82 HE1 MET 11 3HE MET 11 -32.271 6.067 11.303
83 HE2 MET 11 1HE MET 11 -30.728 6.527 12.023
84 HE3 MET 11 2HE MET 11 -30.878 4.995 11.160
85 H ALA 12 H ALA 12 -33.526 7.584 4.799
86 HA ALA 12 HA ALA 12 -35.858 7.587 6.575
87 HB1 ALA 12 3HB ALA 12 -35.422 9.683 4.437
88 HB2 ALA 12 1HB ALA 12 -35.356 9.959 6.177
89 HB3 ALA 12 2HB ALA 12 -36.877 9.493 5.417
90 H ALA 13 H ALA 13 -37.669 8.229 4.357
91 HA ALA 13 HA ALA 13 -37.774 5.636 3.086
92 HB1 ALA 13 3HB ALA 13 -39.575 8.030 2.716
93 HB2 ALA 13 1HB ALA 13 -39.814 6.736 3.888
94 HB3 ALA 13 2HB ALA 13 -39.895 6.387 2.162
95 H ALA 14 H ALA 14 -35.763 7.965 2.378
96 HA ALA 14 HA ALA 14 -36.135 7.917 -0.543
97 HB1 ALA 14 3HB ALA 14 -34.453 9.703 -0.612
98 HB2 ALA 14 1HB ALA 14 -34.270 9.601 1.140
99 HB3 ALA 14 2HB ALA 14 -35.800 10.131 0.444
100 H MET 15 H MET 15 -34.486 7.154 -1.922
101 HA MET 15 HA MET 15 -32.739 5.168 -0.675
102 HB2 MET 15 2HB MET 15 -33.448 5.647 -3.574
103 HB3 MET 15 1HB MET 15 -32.400 4.356 -3.003
104 HG2 MET 15 2HG MET 15 -34.244 3.404 -1.722
105 HG3 MET 15 1HG MET 15 -35.299 4.712 -2.254
106 HE1 MET 15 3HE MET 15 -34.413 5.052 -5.322
107 HE2 MET 15 1HE MET 15 -36.082 5.059 -4.753
108 HE3 MET 15 2HE MET 15 -35.609 4.012 -6.091
109 H ALA 16 H ALA 16 -32.120 7.108 -3.583
110 HA ALA 16 HA ALA 16 -29.897 8.543 -2.573
111 HB1 ALA 16 3HB ALA 16 -28.065 7.323 -3.604
112 HB2 ALA 16 1HB ALA 16 -29.181 6.100 -4.211
113 HB3 ALA 16 2HB ALA 16 -28.919 6.273 -2.474
114 H ASN 17 H ASN 17 -28.376 9.121 -4.641
115 HA ASN 17 HA ASN 17 -30.119 10.382 -6.553
116 HB2 ASN 17 2HB ASN 17 -27.096 10.159 -6.569
117 HB3 ASN 17 1HB ASN 17 -28.061 11.281 -7.523
118 HD21 ASN 17 1HD2 ASN 17 -25.973 11.813 -5.562
119 HD22 ASN 17 2HD2 ASN 17 -26.691 12.836 -4.373
120 H ASN 18 H ASN 18 -27.896 7.643 -6.565
121 HA ASN 18 HA ASN 18 -29.196 6.654 -9.004
122 HB2 ASN 18 2HB ASN 18 -26.831 5.701 -9.607
123 HB3 ASN 18 1HB ASN 18 -27.232 7.366 -10.003
124 HD21 ASN 18 1HD2 ASN 18 -26.388 6.178 -6.776
125 HD22 ASN 18 2HD2 ASN 18 -24.926 7.083 -6.658
126 H LEU 19 H LEU 19 -29.740 4.524 -8.962
127 HA LEU 19 HA LEU 19 -28.983 3.039 -6.518
128 HG LEU 19 HG LEU 19 -31.088 0.777 -6.946
129 HB2 LEU 19 2HB LEU 19 -31.320 3.764 -6.503
130 HB3 LEU 19 1HB LEU 19 -31.586 2.970 -8.045
131 HD11 LEU 19 1HD1 LEU 19 -31.093 0.640 -4.512
132 HD12 LEU 19 2HD1 LEU 19 -31.155 2.399 -4.399
133 HD13 LEU 19 3HD1 LEU 19 -29.733 1.608 -5.086
134 HD21 LEU 19 3HD2 LEU 19 -33.388 1.513 -7.286
135 HD22 LEU 19 1HD2 LEU 19 -33.358 2.367 -5.742
136 HD23 LEU 19 2HD2 LEU 19 -33.235 0.606 -5.781
137 H GLN 20 H GLN 20 -30.181 2.472 -9.827
138 HA GLN 20 HA GLN 20 -29.405 -0.296 -9.752
139 HB2 GLN 20 2HB GLN 20 -30.386 1.403 -12.063
140 HB3 GLN 20 1HB GLN 20 -30.211 -0.348 -12.090
141 HG2 GLN 20 2HG GLN 20 -32.078 1.219 -10.311
142 HG3 GLN 20 1HG GLN 20 -32.532 0.307 -11.749
143 HE21 GLN 20 1HE2 GLN 20 -33.400 0.002 -8.957
144 HE22 GLN 20 2HE2 GLN 20 -33.025 -1.625 -8.522
145 H LYS 21 H LYS 21 -28.202 2.594 -11.434
146 HA LYS 21 HA LYS 21 -25.735 1.097 -12.072
147 HB2 LYS 21 2HB LYS 21 -27.078 3.326 -13.610
148 HB3 LYS 21 1HB LYS 21 -25.447 2.759 -13.948
149 HG2 LYS 21 2HG LYS 21 -26.308 0.528 -14.440
150 HG3 LYS 21 1HG LYS 21 -27.948 1.077 -14.084
151 HD2 LYS 21 2HD LYS 21 -27.860 2.641 -15.943
152 HD3 LYS 21 1HD LYS 21 -26.176 2.210 -16.258
153 HE2 LYS 21 2HE LYS 21 -26.831 -0.057 -16.826
154 HE3 LYS 21 1HE LYS 21 -28.510 0.299 -16.421
155 HZ1 LYS 21 3HZ LYS 21 -28.603 1.860 -18.239
156 HZ2 LYS 21 1HZ LYS 21 -28.076 0.360 -18.814
157 HZ3 LYS 21 2HZ LYS 21 -26.967 1.616 -18.593
158 H GLY 22 H GLY 22 -24.283 1.620 -10.582
159 HA2 GLY 22 2HA GLY 22 -23.723 4.489 -10.128
160 HA3 GLY 22 1HA GLY 22 -23.799 3.366 -8.777
161 H SER 23 H SER 23 -22.185 1.696 -8.620
162 HA SER 23 HA SER 23 -20.069 0.847 -8.682
163 HG SER 23 HG SER 23 -18.497 0.344 -11.890
164 HB2 SER 23 2HB SER 23 -20.805 0.176 -10.956
165 HB3 SER 23 1HB SER 23 -20.153 1.682 -11.601
166 H ALA 24 H ALA 24 -20.471 3.880 -8.322
167 HA ALA 24 HA ALA 24 -17.892 4.938 -9.217
168 HB1 ALA 24 3HB ALA 24 -20.174 6.335 -7.811
169 HB2 ALA 24 1HB ALA 24 -19.919 6.284 -9.555
170 HB3 ALA 24 2HB ALA 24 -18.756 7.108 -8.518
171 H GLY 25 H GLY 25 -18.109 2.919 -7.020
172 HA2 GLY 25 2HA GLY 25 -17.073 4.501 -4.743
173 HA3 GLY 25 1HA GLY 25 -17.818 2.919 -4.606
174 HA PRO 26 HA PRO 26 -13.206 2.277 -5.795
175 HB2 PRO 26 2HB PRO 26 -11.494 4.230 -5.139
176 HB3 PRO 26 1HB PRO 26 -12.403 4.288 -6.655
177 HG2 PRO 26 2HG PRO 26 -12.926 5.729 -4.079
178 HG3 PRO 26 1HG PRO 26 -13.028 6.336 -5.740
179 HD2 PRO 26 2HD PRO 26 -15.199 5.492 -4.250
180 HD3 PRO 26 1HD PRO 26 -15.160 5.544 -6.023
181 H MET 27 H MET 27 -11.305 1.743 -4.355
182 HA MET 27 HA MET 27 -12.071 1.841 -1.497
183 HB2 MET 27 2HB MET 27 -12.488 -0.388 -2.502
184 HB3 MET 27 1HB MET 27 -10.790 -0.494 -2.943
185 HG2 MET 27 2HG MET 27 -10.143 -0.504 -0.616
186 HG3 MET 27 1HG MET 27 -11.820 -0.260 -0.120
187 HE1 MET 27 3HE MET 27 -11.586 -2.380 1.527
188 HE2 MET 27 1HE MET 27 -9.922 -2.612 0.994
189 HE3 MET 27 2HE MET 27 -11.047 -3.970 0.985
190 H ARG 28 H ARG 28 -10.602 2.759 -0.227
191 HA ARG 28 HA ARG 28 -7.850 3.101 -1.222
192 HE ARG 28 HE ARG 28 -8.148 6.834 2.780
193 HB2 ARG 28 2HB ARG 28 -9.151 5.143 -0.740
194 HB3 ARG 28 1HB ARG 28 -9.342 4.624 0.928
195 HG2 ARG 28 2HG ARG 28 -6.957 4.828 1.302
196 HG3 ARG 28 1HG ARG 28 -6.697 5.226 -0.396
197 HD2 ARG 28 2HD ARG 28 -6.665 7.244 0.976
198 HD3 ARG 28 1HD ARG 28 -8.042 7.267 -0.125
199 HH11 ARG 28 1HH1 ARG 28 -9.775 7.484 -0.198
200 HH12 ARG 28 2HH1 ARG 28 -11.280 7.822 0.584
201 HH21 ARG 28 1HH2 ARG 28 -10.081 7.297 3.751
202 HH22 ARG 28 2HH2 ARG 28 -11.449 7.729 2.784
203 H LEU 29 H LEU 29 -6.128 2.309 -0.150
204 HA LEU 29 HA LEU 29 -6.641 0.689 2.254
205 HG LEU 29 HG LEU 29 -6.392 -0.259 -0.854
206 HB2 LEU 29 2HB LEU 29 -4.361 0.477 0.278
207 HB3 LEU 29 1HB LEU 29 -4.681 -0.612 1.615
208 HD11 LEU 29 1HD1 LEU 29 -4.344 -1.489 -1.276
209 HD12 LEU 29 2HD1 LEU 29 -5.735 -2.572 -1.331
210 HD13 LEU 29 3HD1 LEU 29 -4.682 -2.562 0.086
211 HD21 LEU 29 3HD2 LEU 29 -7.804 -0.699 1.077
212 HD22 LEU 29 1HD2 LEU 29 -6.792 -2.071 1.529
213 HD23 LEU 29 2HD2 LEU 29 -7.728 -2.120 0.036
214 H TYR 30 H TYR 30 -5.473 0.950 4.075
215 HA TYR 30 HA TYR 30 -3.563 3.172 4.236
216 HD1 TYR 30 HD2 TYR 30 -3.208 4.823 6.489
217 HD2 TYR 30 HD1 TYR 30 -3.868 0.932 8.090
218 HE1 TYR 30 HE2 TYR 30 -1.678 5.330 8.349
219 HE2 TYR 30 HE1 TYR 30 -2.342 1.431 9.950
220 HH TYR 30 HH TYR 30 -1.217 4.588 10.615
221 HB2 TYR 30 2HB TYR 30 -5.258 3.363 5.884
222 HB3 TYR 30 1HB TYR 30 -5.178 1.654 6.288
223 H VAL 31 H VAL 31 -1.458 2.701 4.093
224 HA VAL 31 HA VAL 31 -0.503 0.028 4.940
225 HB VAL 31 HB VAL 31 0.738 1.847 2.857
226 HG11 VAL 31 1HG1 VAL 31 1.381 -1.012 3.606
227 HG12 VAL 31 2HG1 VAL 31 2.370 0.404 3.965
228 HG13 VAL 31 3HG1 VAL 31 2.121 -0.096 2.291
229 HG21 VAL 31 3HG2 VAL 31 -0.083 0.225 1.199
230 HG22 VAL 31 1HG2 VAL 31 -1.406 1.000 2.067
231 HG23 VAL 31 2HG2 VAL 31 -0.929 -0.648 2.478
232 H GLY 32 H GLY 32 1.040 -0.073 6.495
233 HA2 GLY 32 2HA GLY 32 2.526 2.398 7.174
234 HA3 GLY 32 1HA GLY 32 1.742 1.445 8.418
235 H SER 33 H SER 33 4.560 1.876 6.551
236 HA SER 33 HA SER 33 6.131 0.263 8.270
237 HG SER 33 HG SER 33 6.920 -2.651 6.974
238 HB2 SER 33 2HB SER 33 5.097 -1.586 6.954
239 HB3 SER 33 1HB SER 33 5.791 -0.903 5.485
240 H LEU 34 H LEU 34 5.983 2.896 6.707
241 HA LEU 34 HA LEU 34 8.223 2.733 4.853
242 HG LEU 34 HG LEU 34 4.937 3.660 5.009
243 HB2 LEU 34 2HB LEU 34 6.718 5.247 5.531
244 HB3 LEU 34 1HB LEU 34 7.553 4.835 4.043
245 HD11 LEU 34 1HD1 LEU 34 3.971 4.796 3.076
246 HD12 LEU 34 2HD1 LEU 34 5.544 5.496 2.694
247 HD13 LEU 34 3HD1 LEU 34 4.721 5.941 4.189
248 HD21 LEU 34 3HD2 LEU 34 6.478 3.083 2.475
249 HD22 LEU 34 1HD2 LEU 34 4.855 2.507 2.851
250 HD23 LEU 34 2HD2 LEU 34 6.224 1.971 3.822
251 H HIS 35 H HIS 35 10.007 2.429 6.297
252 HA HIS 35 HA HIS 35 10.437 4.327 8.427
253 HD1 HIS 35 HD1 HIS 35 14.473 3.068 7.604
254 HD2 HIS 35 HD2 HIS 35 11.605 0.360 6.298
255 HE1 HIS 35 HE1 HIS 35 15.659 1.564 5.993
256 HE2 HIS 35 HE2 HIS 35 13.968 -0.184 5.383
257 HB2 HIS 35 2HB HIS 35 12.353 3.038 9.043
258 HB3 HIS 35 1HB HIS 35 11.077 1.917 8.606
259 H PHE 36 H PHE 36 10.287 6.055 6.588
260 HA PHE 36 HA PHE 36 11.266 7.790 5.495
261 HD1 PHE 36 HD1 PHE 36 12.060 10.043 5.714
262 HD2 PHE 36 HD2 PHE 36 15.623 7.980 6.809
263 HE1 PHE 36 HE1 PHE 36 13.408 11.901 4.831
264 HE2 PHE 36 HE2 PHE 36 16.973 9.840 5.928
265 HZ PHE 36 HZ PHE 36 15.863 11.800 4.936
266 HB2 PHE 36 2HB PHE 36 12.313 8.121 7.668
267 HB3 PHE 36 1HB PHE 36 13.598 6.993 7.257
268 H ASN 37 H ASN 37 11.933 4.811 4.592
269 HA ASN 37 HA ASN 37 13.942 5.597 2.575
270 HB2 ASN 37 2HB ASN 37 14.912 4.130 4.321
271 HB3 ASN 37 1HB ASN 37 13.704 2.906 3.947
272 HD21 ASN 37 1HD2 ASN 37 13.978 1.636 2.155
273 HD22 ASN 37 2HD2 ASN 37 15.402 1.663 1.188
274 H ILE 38 H ILE 38 10.800 4.702 2.991
275 HA ILE 38 HA ILE 38 10.675 3.178 0.465
276 HB ILE 38 HB ILE 38 8.443 3.372 2.496
277 HG12 ILE 38 2HG1 ILE 38 10.371 2.393 3.647
278 HG13 ILE 38 1HG1 ILE 38 9.155 1.158 3.345
279 HG21 ILE 38 1HG2 ILE 38 9.011 1.368 0.305
280 HG22 ILE 38 2HG2 ILE 38 7.827 2.671 0.227
281 HG23 ILE 38 3HG2 ILE 38 7.615 1.359 1.385
282 HD11 ILE 38 3HD1 ILE 38 11.661 1.579 1.732
283 HD12 ILE 38 1HD1 ILE 38 10.457 0.316 1.473
284 HD13 ILE 38 2HD1 ILE 38 11.409 0.338 2.958
285 H THR 39 H THR 39 9.881 4.203 -1.264
286 HA THR 39 HA THR 39 8.643 6.847 -0.917
287 HB THR 39 HB THR 39 9.183 7.266 -3.245
288 HG1 THR 39 HG1 THR 39 10.455 5.489 -4.332
289 HG21 THR 39 3HG2 THR 39 11.615 7.139 -3.179
290 HG22 THR 39 1HG2 THR 39 11.539 5.939 -1.889
291 HG23 THR 39 2HG2 THR 39 10.990 7.588 -1.593
292 H GLU 40 H GLU 40 6.847 7.472 -2.304
293 HA GLU 40 HA GLU 40 4.674 5.732 -2.469
294 HB2 GLU 40 2HB GLU 40 4.959 7.908 -4.524
295 HB3 GLU 40 1HB GLU 40 3.523 7.382 -3.665
296 HG2 GLU 40 2HG GLU 40 3.918 9.447 -2.738
297 HG3 GLU 40 1HG GLU 40 4.708 8.379 -1.580
298 H ASP 41 H ASP 41 7.252 6.378 -4.735
299 HA ASP 41 HA ASP 41 6.194 5.080 -7.003
300 HB2 ASP 41 2HB ASP 41 8.131 6.706 -6.918
301 HB3 ASP 41 1HB ASP 41 9.118 5.390 -6.293
302 H MET 42 H MET 42 8.230 3.902 -4.327
303 HA MET 42 HA MET 42 8.542 1.253 -5.341
304 HB2 MET 42 2HB MET 42 8.772 2.360 -2.534
305 HB3 MET 42 1HB MET 42 9.156 0.695 -2.955
306 HG2 MET 42 2HG MET 42 10.516 3.167 -4.012
307 HG3 MET 42 1HG MET 42 11.172 2.020 -2.841
308 HE1 MET 42 3HE MET 42 13.384 1.700 -4.289
309 HE2 MET 42 1HE MET 42 12.761 2.893 -5.432
310 HE3 MET 42 2HE MET 42 13.366 1.344 -6.017
311 H LEU 43 H LEU 43 6.280 2.697 -3.016
312 HA LEU 43 HA LEU 43 4.735 0.451 -2.420
313 HG LEU 43 HG LEU 43 5.633 2.913 -0.965
314 HB2 LEU 43 2HB LEU 43 3.889 3.338 -2.736
315 HB3 LEU 43 1HB LEU 43 2.906 2.092 -1.982
316 HD11 LEU 43 1HD1 LEU 43 4.472 4.155 0.781
317 HD12 LEU 43 2HD1 LEU 43 2.920 3.796 0.021
318 HD13 LEU 43 3HD1 LEU 43 4.104 4.806 -0.817
319 HD21 LEU 43 3HD2 LEU 43 4.934 1.728 1.066
320 HD22 LEU 43 1HD2 LEU 43 4.956 0.656 -0.332
321 HD23 LEU 43 2HD2 LEU 43 3.421 1.272 0.285
322 H ARG 44 H ARG 44 4.462 2.738 -5.120
323 HA ARG 44 HA ARG 44 2.227 1.616 -6.384
324 HE ARG 44 HE ARG 44 5.023 4.908 -9.343
325 HB2 ARG 44 2HB ARG 44 3.161 3.805 -6.992
326 HB3 ARG 44 1HB ARG 44 4.597 3.020 -7.633
327 HG2 ARG 44 2HG ARG 44 3.204 1.892 -9.322
328 HG3 ARG 44 1HG ARG 44 1.788 2.740 -8.693
329 HD2 ARG 44 2HD ARG 44 2.745 3.808 -10.715
330 HD3 ARG 44 1HD ARG 44 2.732 4.873 -9.311
331 HH11 ARG 44 1HH1 ARG 44 3.936 2.339 -11.377
332 HH12 ARG 44 2HH1 ARG 44 5.509 2.063 -12.036
333 HH21 ARG 44 1HH2 ARG 44 7.039 4.517 -10.209
334 HH22 ARG 44 2HH2 ARG 44 7.229 3.265 -11.387
335 H GLY 45 H GLY 45 5.697 0.988 -6.924
336 HA2 GLY 45 2HA GLY 45 5.473 -0.904 -8.959
337 HA3 GLY 45 1HA GLY 45 6.801 -0.815 -7.813
338 H ILE 46 H ILE 46 5.139 -1.353 -5.472
339 HA ILE 46 HA ILE 46 5.127 -4.239 -5.628
340 HB ILE 46 HB ILE 46 4.388 -2.393 -3.344
341 HG12 ILE 46 2HG1 ILE 46 6.742 -2.194 -3.998
342 HG13 ILE 46 1HG1 ILE 46 6.609 -3.002 -2.440
343 HG21 ILE 46 1HG2 ILE 46 4.630 -4.378 -1.903
344 HG22 ILE 46 2HG2 ILE 46 4.830 -5.382 -3.338
345 HG23 ILE 46 3HG2 ILE 46 3.304 -4.544 -3.053
346 HD11 ILE 46 3HD1 ILE 46 6.945 -5.163 -3.555
347 HD12 ILE 46 1HD1 ILE 46 8.291 -4.052 -3.814
348 HD13 ILE 46 2HD1 ILE 46 7.113 -4.323 -5.097
349 H PHE 47 H PHE 47 2.653 -1.711 -5.304
350 HA PHE 47 HA PHE 47 0.527 -3.654 -4.934
351 HD1 PHE 47 HD1 PHE 47 2.292 -1.361 -3.059
352 HD2 PHE 47 HD2 PHE 47 -1.917 -2.021 -2.981
353 HE1 PHE 47 HE1 PHE 47 2.368 -1.536 -0.608
354 HE2 PHE 47 HE2 PHE 47 -1.844 -2.199 -0.529
355 HZ PHE 47 HZ PHE 47 0.301 -1.958 0.661
356 HB2 PHE 47 2HB PHE 47 0.629 -0.648 -4.976
357 HB3 PHE 47 1HB PHE 47 -0.905 -1.503 -4.993
358 H GLU 48 H GLU 48 1.824 -1.816 -7.627
359 HA GLU 48 HA GLU 48 -0.445 -1.746 -9.263
360 HB2 GLU 48 2HB GLU 48 2.310 -1.098 -9.568
361 HB3 GLU 48 1HB GLU 48 1.837 -2.074 -10.951
362 HG2 GLU 48 2HG GLU 48 -0.077 -0.531 -11.320
363 HG3 GLU 48 1HG GLU 48 0.541 0.488 -10.022
364 HA PRO 49 HA PRO 49 1.154 -6.230 -10.959
365 HB2 PRO 49 2HB PRO 49 1.420 -7.085 -8.088
366 HB3 PRO 49 1HB PRO 49 2.186 -7.760 -9.532
367 HG2 PRO 49 2HG PRO 49 3.560 -6.139 -7.942
368 HG3 PRO 49 1HG PRO 49 3.712 -5.999 -9.706
369 HD2 PRO 49 2HD PRO 49 2.280 -4.231 -7.780
370 HD3 PRO 49 1HD PRO 49 3.082 -3.820 -9.307
371 H PHE 50 H PHE 50 -0.838 -5.107 -8.307
372 HA PHE 50 HA PHE 50 -2.821 -7.220 -8.734
373 HD1 PHE 50 HD1 PHE 50 -3.290 -8.581 -6.192
374 HD2 PHE 50 HD2 PHE 50 -0.541 -5.349 -5.836
375 HE1 PHE 50 HE1 PHE 50 -1.833 -9.984 -4.795
376 HE2 PHE 50 HE2 PHE 50 0.924 -6.747 -4.437
377 HZ PHE 50 HZ PHE 50 0.277 -9.066 -3.913
378 HB2 PHE 50 2HB PHE 50 -2.754 -4.982 -6.694
379 HB3 PHE 50 1HB PHE 50 -3.941 -6.283 -6.748
380 H GLY 51 H GLY 51 -2.373 -3.779 -9.371
381 HA2 GLY 51 2HA GLY 51 -4.607 -3.786 -11.177
382 HA3 GLY 51 1HA GLY 51 -4.918 -2.845 -9.729
383 H ARG 52 H ARG 52 -4.978 -0.838 -10.610
384 HA ARG 52 HA ARG 52 -2.737 0.062 -12.293
385 HE ARG 52 HE ARG 52 -6.619 1.663 -14.850
386 HB2 ARG 52 2HB ARG 52 -4.923 0.360 -13.298
387 HB3 ARG 52 1HB ARG 52 -5.496 1.235 -11.884
388 HG2 ARG 52 2HG ARG 52 -3.868 3.025 -12.350
389 HG3 ARG 52 1HG ARG 52 -3.339 2.151 -13.786
390 HD2 ARG 52 2HD ARG 52 -6.109 3.246 -13.281
391 HD3 ARG 52 1HD ARG 52 -4.907 3.921 -14.380
392 HH11 ARG 52 1HH1 ARG 52 -3.695 3.234 -15.748
393 HH12 ARG 52 2HH1 ARG 52 -3.615 2.451 -17.286
394 HH21 ARG 52 1HH2 ARG 52 -6.530 0.679 -16.835
395 HH22 ARG 52 2HH2 ARG 52 -5.215 1.027 -17.900
396 H ILE 53 H ILE 53 -4.464 0.835 -9.341
397 HA ILE 53 HA ILE 53 -4.103 2.262 -7.612
398 HB ILE 53 HB ILE 53 -1.367 2.698 -8.832
399 HG12 ILE 53 2HG1 ILE 53 -2.230 0.851 -6.585
400 HG13 ILE 53 1HG1 ILE 53 -1.815 0.339 -8.217
401 HG21 ILE 53 1HG2 ILE 53 -1.998 4.507 -7.329
402 HG22 ILE 53 2HG2 ILE 53 -0.739 3.511 -6.602
403 HG23 ILE 53 3HG2 ILE 53 -2.412 3.342 -6.072
404 HD11 ILE 53 3HD1 ILE 53 0.028 -0.060 -6.728
405 HD12 ILE 53 1HD1 ILE 53 0.032 1.629 -6.223
406 HD13 ILE 53 2HD1 ILE 53 0.462 1.201 -7.880
407 H GLU 54 H GLU 54 -5.410 3.990 -7.761
408 HA GLU 54 HA GLU 54 -5.242 5.825 -9.988
409 HB2 GLU 54 2HB GLU 54 -7.013 6.105 -7.557
410 HB3 GLU 54 1HB GLU 54 -7.267 6.778 -9.161
411 HG2 GLU 54 2HG GLU 54 -7.506 3.907 -8.297
412 HG3 GLU 54 1HG GLU 54 -8.777 4.970 -8.895
413 H SER 55 H SER 55 -4.641 5.955 -6.498
414 HA SER 55 HA SER 55 -2.900 8.260 -6.860
415 HG SER 55 HG SER 55 -4.931 7.781 -4.015
416 HB2 SER 55 2HB SER 55 -3.991 9.636 -5.168
417 HB3 SER 55 1HB SER 55 -5.150 9.251 -6.439
418 H ILE 56 H ILE 56 -1.244 8.350 -5.384
419 HA ILE 56 HA ILE 56 -1.452 6.617 -2.996
420 HB ILE 56 HB ILE 56 1.078 7.214 -4.554
421 HG12 ILE 56 2HG1 ILE 56 -0.539 4.671 -4.227
422 HG13 ILE 56 1HG1 ILE 56 -0.309 5.585 -5.713
423 HG21 ILE 56 1HG2 ILE 56 1.501 7.077 -2.150
424 HG22 ILE 56 2HG2 ILE 56 2.170 5.672 -2.979
425 HG23 ILE 56 3HG2 ILE 56 0.663 5.527 -2.076
426 HD11 ILE 56 3HD1 ILE 56 2.078 5.042 -5.662
427 HD12 ILE 56 1HD1 ILE 56 1.062 3.600 -5.705
428 HD13 ILE 56 2HD1 ILE 56 1.819 4.098 -4.193
429 H GLN 57 H GLN 57 -1.851 7.996 -1.366
430 HA GLN 57 HA GLN 57 -0.358 10.527 -1.240
431 HB2 GLN 57 2HB GLN 57 -2.774 10.730 -0.973
432 HB3 GLN 57 1HB GLN 57 -2.754 9.569 0.349
433 HG2 GLN 57 2HG GLN 57 -2.964 11.771 1.263
434 HG3 GLN 57 1HG GLN 57 -1.366 11.149 1.663
435 HE21 GLN 57 1HE2 GLN 57 -2.290 13.905 1.561
436 HE22 GLN 57 2HE2 GLN 57 -1.276 14.717 0.424
437 H LEU 58 H LEU 58 1.540 10.380 -0.209
438 HA LEU 58 HA LEU 58 1.850 8.468 2.003
439 HG LEU 58 HG LEU 58 4.146 7.595 2.309
440 HB2 LEU 58 2HB LEU 58 3.474 8.606 0.029
441 HB3 LEU 58 1HB LEU 58 4.003 10.139 0.687
442 HD11 LEU 58 1HD1 LEU 58 5.384 7.194 0.247
443 HD12 LEU 58 2HD1 LEU 58 6.485 7.379 1.612
444 HD13 LEU 58 3HD1 LEU 58 6.268 8.705 0.468
445 HD21 LEU 58 3HD2 LEU 58 5.666 10.204 2.462
446 HD22 LEU 58 1HD2 LEU 58 5.909 8.805 3.510
447 HD23 LEU 58 2HD2 LEU 58 4.382 9.684 3.555
448 H MET 59 H MET 59 2.146 9.150 4.100
449 HA MET 59 HA MET 59 1.649 11.995 4.562
450 HB2 MET 59 2HB MET 59 1.685 9.692 6.527
451 HB3 MET 59 1HB MET 59 1.209 11.345 6.893
452 HG2 MET 59 2HG MET 59 -0.588 11.055 5.109
453 HG3 MET 59 1HG MET 59 -0.203 9.333 5.171
454 HE1 MET 59 3HE MET 59 -0.139 11.912 8.144
455 HE2 MET 59 1HE MET 59 -1.774 11.740 8.781
456 HE3 MET 59 2HE MET 59 -1.521 12.436 7.180
457 H MET 60 H MET 60 3.306 13.281 4.787
458 HA MET 60 HA MET 60 5.636 12.443 6.367
459 HB2 MET 60 2HB MET 60 7.150 13.460 4.685
460 HB3 MET 60 1HB MET 60 6.281 12.069 4.056
461 HG2 MET 60 2HG MET 60 4.719 13.557 2.904
462 HG3 MET 60 1HG MET 60 5.584 14.956 3.536
463 HE1 MET 60 3HE MET 60 4.943 14.483 0.440
464 HE2 MET 60 1HE MET 60 6.475 14.947 -0.303
465 HE3 MET 60 2HE MET 60 5.816 15.902 1.026
466 H ASP 61 H ASP 61 6.457 14.042 7.670
467 HA ASP 61 HA ASP 61 5.047 16.523 7.903
468 HB2 ASP 61 2HB ASP 61 7.548 15.447 9.202
469 HB3 ASP 61 1HB ASP 61 6.938 17.064 9.542
470 H SER 62 H SER 62 5.238 17.448 5.837
471 HA SER 62 HA SER 62 7.560 17.779 4.344
472 HG SER 62 HG SER 62 4.628 18.232 2.487
473 HB2 SER 62 2HB SER 62 5.130 19.585 4.368
474 HB3 SER 62 1HB SER 62 6.346 19.519 3.093
475 H GLU 63 H GLU 63 6.648 19.501 7.186
476 HA GLU 63 HA GLU 63 8.038 21.891 6.979
477 HB2 GLU 63 2HB GLU 63 8.225 20.132 9.431
478 HB3 GLU 63 1HB GLU 63 8.212 21.887 9.356
479 HG2 GLU 63 2HG GLU 63 5.880 20.073 8.766
480 HG3 GLU 63 1HG GLU 63 6.129 20.983 10.250
481 H THR 64 H THR 64 9.222 18.698 7.837
482 HA THR 64 HA THR 64 11.612 18.545 6.608
483 HB THR 64 HB THR 64 12.347 20.608 7.763
484 HG1 THR 64 HG1 THR 64 14.301 19.459 8.778
485 HG21 THR 64 3HG2 THR 64 12.195 18.945 10.286
486 HG22 THR 64 1HG2 THR 64 11.135 20.298 9.887
487 HG23 THR 64 2HG2 THR 64 12.858 20.573 10.156
488 H GLY 65 H GLY 65 9.481 17.506 8.969
489 HA2 GLY 65 2HA GLY 65 11.091 15.577 10.337
490 HA3 GLY 65 1HA GLY 65 9.334 15.643 10.315
491 H ARG 66 H ARG 66 9.291 15.636 7.353
492 HA ARG 66 HA ARG 66 9.478 14.328 5.505
493 HE ARG 66 HE ARG 66 14.011 16.255 6.652
494 HB2 ARG 66 2HB ARG 66 11.529 12.799 7.113
495 HB3 ARG 66 1HB ARG 66 11.337 12.748 5.362
496 HG2 ARG 66 2HG ARG 66 12.167 14.918 5.082
497 HG3 ARG 66 1HG ARG 66 11.872 15.350 6.765
498 HD2 ARG 66 2HD ARG 66 13.645 13.500 7.269
499 HD3 ARG 66 1HD ARG 66 14.104 13.741 5.581
500 HH11 ARG 66 1HH1 ARG 66 15.754 13.372 7.359
501 HH12 ARG 66 2HH1 ARG 66 17.076 14.220 8.072
502 HH21 ARG 66 1HH2 ARG 66 15.696 17.324 7.592
503 HH22 ARG 66 2HH2 ARG 66 17.043 16.429 8.200
504 H SER 67 H SER 67 9.940 11.444 5.398
505 HA SER 67 HA SER 67 7.322 10.588 5.400
506 HG SER 67 HG SER 67 7.929 7.703 4.227
507 HB2 SER 67 2HB SER 67 9.111 9.428 4.185
508 HB3 SER 67 1HB SER 67 9.780 8.843 5.706
509 H LYS 68 H LYS 68 5.912 10.329 6.983
510 HA LYS 68 HA LYS 68 6.622 10.031 9.726
511 HB2 LYS 68 2HB LYS 68 3.974 9.806 8.287
512 HB3 LYS 68 1HB LYS 68 4.135 9.712 10.036
513 HG2 LYS 68 2HG LYS 68 4.867 11.960 10.188
514 HG3 LYS 68 1HG LYS 68 5.097 12.078 8.441
515 HD2 LYS 68 2HD LYS 68 2.732 11.956 8.056
516 HD3 LYS 68 1HD LYS 68 2.421 11.599 9.754
517 HE2 LYS 68 2HE LYS 68 3.608 14.178 8.725
518 HE3 LYS 68 1HE LYS 68 1.907 13.942 9.121
519 HZ1 LYS 68 3HZ LYS 68 4.186 13.706 11.008
520 HZ2 LYS 68 1HZ LYS 68 2.564 13.431 11.399
521 HZ3 LYS 68 2HZ LYS 68 3.078 14.975 10.944
522 H GLY 69 H GLY 69 5.736 7.744 7.205
523 HA2 GLY 69 2HA GLY 69 6.701 5.471 7.634
524 HA3 GLY 69 1HA GLY 69 5.917 5.549 9.198
525 H TYR 70 H TYR 70 3.700 6.938 7.256
526 HA TYR 70 HA TYR 70 2.541 4.425 6.293
527 HD1 TYR 70 HD1 TYR 70 0.355 7.873 7.526
528 HD2 TYR 70 HD2 TYR 70 2.337 5.305 10.288
529 HE1 TYR 70 HE1 TYR 70 0.456 9.709 9.158
530 HE2 TYR 70 HE2 TYR 70 2.440 7.136 11.925
531 HH TYR 70 HH TYR 70 2.336 9.493 12.060
532 HB2 TYR 70 2HB TYR 70 0.296 5.311 7.344
533 HB3 TYR 70 1HB TYR 70 1.439 4.393 8.316
534 H GLY 71 H GLY 71 0.887 4.611 4.739
535 HA2 GLY 71 2HA GLY 71 0.224 7.252 3.676
536 HA3 GLY 71 1HA GLY 71 1.140 6.193 2.613
537 H PHE 72 H PHE 72 -1.421 7.185 1.986
538 HA PHE 72 HA PHE 72 -3.142 4.795 2.199
539 HD1 PHE 72 HD2 PHE 72 -2.890 8.516 3.697
540 HD2 PHE 72 HD1 PHE 72 -5.739 5.349 3.749
541 HE1 PHE 72 HE2 PHE 72 -3.212 8.849 6.113
542 HE2 PHE 72 HE1 PHE 72 -6.066 5.679 6.165
543 HZ PHE 72 HZ PHE 72 -4.802 7.432 7.350
544 HB2 PHE 72 2HB PHE 72 -3.892 7.677 1.632
545 HB3 PHE 72 1HB PHE 72 -5.023 6.329 1.661
546 H ILE 73 H ILE 73 -3.335 3.588 0.421
547 HA ILE 73 HA ILE 73 -2.804 4.805 -2.223
548 HB ILE 73 HB ILE 73 -2.611 1.894 -1.407
549 HG12 ILE 73 2HG1 ILE 73 -0.428 3.886 -2.096
550 HG13 ILE 73 1HG1 ILE 73 -0.832 3.358 -0.468
551 HG21 ILE 73 1HG2 ILE 73 -1.918 3.232 -4.028
552 HG22 ILE 73 2HG2 ILE 73 -3.283 2.150 -3.746
553 HG23 ILE 73 3HG2 ILE 73 -1.634 1.537 -3.628
554 HD11 ILE 73 3HD1 ILE 73 -0.175 1.084 -1.031
555 HD12 ILE 73 1HD1 ILE 73 1.139 2.221 -1.333
556 HD13 ILE 73 2HD1 ILE 73 0.192 1.590 -2.680
557 H THR 74 H THR 74 -4.494 5.066 -3.528
558 HA THR 74 HA THR 74 -7.042 3.765 -2.837
559 HB THR 74 HB THR 74 -6.578 6.166 -4.629
560 HG1 THR 74 HG1 THR 74 -7.257 7.376 -2.851
561 HG21 THR 74 3HG2 THR 74 -8.656 4.957 -5.153
562 HG22 THR 74 1HG2 THR 74 -8.996 6.525 -4.410
563 HG23 THR 74 2HG2 THR 74 -9.136 5.048 -3.457
564 H PHE 75 H PHE 75 -7.830 2.177 -4.045
565 HA PHE 75 HA PHE 75 -6.992 1.902 -6.863
566 HD1 PHE 75 HD2 PHE 75 -6.198 0.217 -3.489
567 HD2 PHE 75 HD1 PHE 75 -5.902 -1.044 -7.550
568 HE1 PHE 75 HE2 PHE 75 -3.922 -0.615 -3.066
569 HE2 PHE 75 HE1 PHE 75 -3.629 -1.879 -7.127
570 HZ PHE 75 HZ PHE 75 -2.641 -1.666 -4.885
571 HB2 PHE 75 2HB PHE 75 -8.206 -0.088 -4.933
572 HB3 PHE 75 1HB PHE 75 -8.007 -0.410 -6.650
573 H SER 76 H SER 76 -8.521 1.815 -8.519
574 HA SER 76 HA SER 76 -11.073 3.019 -8.100
575 HG SER 76 HG SER 76 -11.983 3.442 -10.764
576 HB2 SER 76 2HB SER 76 -9.920 3.230 -10.255
577 HB3 SER 76 1HB SER 76 -10.015 1.488 -10.498
578 H ASP 77 H ASP 77 -9.952 -0.284 -8.279
579 HA ASP 77 HA ASP 77 -12.709 -1.300 -8.104
580 HB2 ASP 77 2HB ASP 77 -11.348 -2.095 -10.015
581 HB3 ASP 77 1HB ASP 77 -10.170 -2.756 -8.887
582 H SER 78 H SER 78 -13.375 -2.383 -6.327
583 HA SER 78 HA SER 78 -11.814 -2.262 -3.942
584 HG SER 78 HG SER 78 -12.978 -3.194 -2.101
585 HB2 SER 78 2HB SER 78 -14.233 -1.988 -3.828
586 HB3 SER 78 1HB SER 78 -14.474 -3.615 -4.462
587 H GLU 79 H GLU 79 -12.585 -4.878 -6.191
588 HA GLU 79 HA GLU 79 -11.786 -7.018 -4.489
589 HB2 GLU 79 2HB GLU 79 -11.833 -6.970 -7.518
590 HB3 GLU 79 1HB GLU 79 -11.843 -8.400 -6.492
591 HG2 GLU 79 2HG GLU 79 -14.040 -7.732 -5.606
592 HG3 GLU 79 1HG GLU 79 -14.032 -6.328 -6.670
593 H CYS 80 H CYS 80 -10.106 -5.234 -7.073
594 HA CYS 80 HA CYS 80 -7.623 -6.542 -6.915
595 HG CYS 80 HG CYS 80 -9.544 -5.866 -9.174
596 HB2 CYS 80 2HB CYS 80 -8.164 -3.642 -7.613
597 HB3 CYS 80 1HB CYS 80 -6.686 -4.524 -7.982
598 H ALA 81 H ALA 81 -8.974 -3.871 -5.046
599 HA ALA 81 HA ALA 81 -6.646 -3.222 -3.564
600 HB1 ALA 81 3HB ALA 81 -8.156 -2.049 -2.048
601 HB2 ALA 81 1HB ALA 81 -9.541 -2.854 -2.788
602 HB3 ALA 81 2HB ALA 81 -8.575 -1.719 -3.730
603 H LYS 82 H LYS 82 -9.384 -5.391 -2.849
604 HA LYS 82 HA LYS 82 -8.535 -6.280 -0.318
605 HB2 LYS 82 2HB LYS 82 -10.217 -7.597 -2.452
606 HB3 LYS 82 1HB LYS 82 -9.906 -8.361 -0.901
607 HG2 LYS 82 2HG LYS 82 -10.990 -6.544 0.261
608 HG3 LYS 82 1HG LYS 82 -11.220 -5.670 -1.254
609 HD2 LYS 82 2HD LYS 82 -13.278 -6.809 -0.541
610 HD3 LYS 82 1HD LYS 82 -12.682 -7.443 -2.077
611 HE2 LYS 82 2HE LYS 82 -11.666 -9.346 -0.874
612 HE3 LYS 82 1HE LYS 82 -12.307 -8.716 0.643
613 HZ1 LYS 82 3HZ LYS 82 -13.948 -9.542 -1.690
614 HZ2 LYS 82 1HZ LYS 82 -14.531 -9.022 -0.193
615 HZ3 LYS 82 2HZ LYS 82 -13.683 -10.477 -0.308
616 H LYS 83 H LYS 83 -7.933 -7.669 -3.542
617 HA LYS 83 HA LYS 83 -6.413 -9.875 -2.745
618 HB2 LYS 83 2HB LYS 83 -7.292 -9.539 -5.024
619 HB3 LYS 83 1HB LYS 83 -6.138 -8.235 -5.274
620 HG2 LYS 83 2HG LYS 83 -4.287 -9.814 -5.069
621 HG3 LYS 83 1HG LYS 83 -5.428 -11.129 -4.767
622 HD2 LYS 83 2HD LYS 83 -6.403 -10.800 -6.993
623 HD3 LYS 83 1HD LYS 83 -5.289 -9.462 -7.288
624 HE2 LYS 83 2HE LYS 83 -3.394 -10.977 -7.157
625 HE3 LYS 83 1HE LYS 83 -4.466 -12.322 -6.762
626 HZ1 LYS 83 3HZ LYS 83 -4.552 -10.777 -9.296
627 HZ2 LYS 83 1HZ LYS 83 -5.484 -12.136 -8.917
628 HZ3 LYS 83 2HZ LYS 83 -3.810 -12.286 -9.114
629 H ALA 84 H ALA 84 -5.357 -6.563 -3.526
630 HA ALA 84 HA ALA 84 -2.593 -6.952 -3.090
631 HB1 ALA 84 3HB ALA 84 -4.219 -4.428 -2.726
632 HB2 ALA 84 1HB ALA 84 -3.499 -4.983 -4.239
633 HB3 ALA 84 2HB ALA 84 -2.465 -4.516 -2.888
634 H LEU 85 H LEU 85 -5.097 -5.652 -0.906
635 HA LEU 85 HA LEU 85 -3.560 -5.216 1.354
636 HG LEU 85 HG LEU 85 -4.964 -4.877 3.489
637 HB2 LEU 85 2HB LEU 85 -5.870 -4.446 1.058
638 HB3 LEU 85 1HB LEU 85 -6.453 -6.092 1.170
639 HD11 LEU 85 1HD1 LEU 85 -6.668 -3.236 2.930
640 HD12 LEU 85 2HD1 LEU 85 -7.100 -4.088 4.410
641 HD13 LEU 85 3HD1 LEU 85 -7.903 -4.495 2.891
642 HD21 LEU 85 3HD2 LEU 85 -7.166 -6.944 3.290
643 HD22 LEU 85 1HD2 LEU 85 -6.412 -6.390 4.785
644 HD23 LEU 85 2HD2 LEU 85 -5.459 -7.266 3.592
645 H GLU 86 H GLU 86 -5.394 -8.146 0.529
646 HA GLU 86 HA GLU 86 -4.746 -9.537 2.899
647 HB2 GLU 86 2HB GLU 86 -6.726 -9.978 1.458
648 HB3 GLU 86 1HB GLU 86 -5.657 -10.682 0.252
649 HG2 GLU 86 2HG GLU 86 -5.000 -12.424 1.822
650 HG3 GLU 86 1HG GLU 86 -6.023 -11.704 3.065
651 H GLN 87 H GLN 87 -3.139 -9.413 -0.251
652 HA GLN 87 HA GLN 87 -1.443 -11.683 0.420
653 HB2 GLN 87 2HB GLN 87 -1.928 -10.062 -2.038
654 HB3 GLN 87 1HB GLN 87 -0.400 -10.920 -1.900
655 HG2 GLN 87 2HG GLN 87 -2.195 -12.150 -3.128
656 HG3 GLN 87 1HG GLN 87 -1.485 -13.024 -1.773
657 HE21 GLN 87 1HE2 GLN 87 -4.319 -11.412 -2.959
658 HE22 GLN 87 2HE2 GLN 87 -5.402 -12.022 -1.763
659 H LEU 88 H LEU 88 -1.244 -8.210 0.489
660 HA LEU 88 HA LEU 88 1.668 -8.295 0.775
661 HG LEU 88 HG LEU 88 -0.015 -7.152 -1.533
662 HB2 LEU 88 2HB LEU 88 -0.212 -5.941 0.623
663 HB3 LEU 88 1HB LEU 88 1.537 -5.834 0.706
664 HD11 LEU 88 1HD1 LEU 88 0.719 -5.256 -2.891
665 HD12 LEU 88 2HD1 LEU 88 1.422 -4.502 -1.459
666 HD13 LEU 88 3HD1 LEU 88 -0.322 -4.751 -1.561
667 HD21 LEU 88 3HD2 LEU 88 2.939 -6.588 -1.263
668 HD22 LEU 88 1HD2 LEU 88 2.135 -7.261 -2.683
669 HD23 LEU 88 2HD2 LEU 88 2.173 -8.175 -1.176
670 H ASN 89 H ASN 89 -1.132 -8.142 2.795
671 HA ASN 89 HA ASN 89 -0.051 -7.084 5.132
672 HB2 ASN 89 2HB ASN 89 -2.167 -9.070 4.513
673 HB3 ASN 89 1HB ASN 89 -1.507 -9.141 6.143
674 HD21 ASN 89 1HD2 ASN 89 -4.158 -8.303 5.138
675 HD22 ASN 89 2HD2 ASN 89 -4.387 -6.709 5.763
676 H GLY 90 H GLY 90 1.964 -7.512 5.733
677 HA2 GLY 90 2HA GLY 90 3.578 -8.805 6.862
678 HA3 GLY 90 1HA GLY 90 2.691 -10.260 6.435
679 H PHE 91 H PHE 91 3.510 -7.871 4.028
680 HA PHE 91 HA PHE 91 5.388 -9.699 2.745
681 HD1 PHE 91 HD2 PHE 91 5.068 -10.080 -0.072
682 HD2 PHE 91 HD1 PHE 91 6.141 -6.037 0.738
683 HE1 PHE 91 HE2 PHE 91 6.598 -10.098 -2.002
684 HE2 PHE 91 HE1 PHE 91 7.667 -6.051 -1.189
685 HZ PHE 91 HZ PHE 91 7.898 -8.082 -2.564
686 HB2 PHE 91 2HB PHE 91 3.672 -8.600 1.367
687 HB3 PHE 91 1HB PHE 91 4.280 -7.020 1.846
688 H GLU 92 H GLU 92 7.389 -9.633 3.673
689 HA GLU 92 HA GLU 92 8.466 -7.281 4.874
690 HB2 GLU 92 2HB GLU 92 9.674 -9.967 4.230
691 HB3 GLU 92 1HB GLU 92 10.629 -8.664 4.920
692 HG2 GLU 92 2HG GLU 92 9.931 -10.130 6.678
693 HG3 GLU 92 1HG GLU 92 9.086 -8.594 6.851
694 H LEU 93 H LEU 93 8.377 -5.712 3.241
695 HA LEU 93 HA LEU 93 9.831 -5.973 0.781
696 HG LEU 93 HG LEU 93 10.396 -2.832 0.501
697 HB2 LEU 93 2HB LEU 93 7.901 -4.489 0.951
698 HB3 LEU 93 1HB LEU 93 8.713 -3.533 2.176
699 HD11 LEU 93 1HD1 LEU 93 8.685 -4.390 -1.439
700 HD12 LEU 93 2HD1 LEU 93 10.344 -4.760 -0.968
701 HD13 LEU 93 3HD1 LEU 93 9.995 -3.295 -1.881
702 HD21 LEU 93 3HD2 LEU 93 7.526 -2.337 -0.301
703 HD22 LEU 93 1HD2 LEU 93 8.913 -1.371 -0.809
704 HD23 LEU 93 2HD2 LEU 93 8.454 -1.427 0.892
705 H ALA 94 H ALA 94 10.345 -3.625 3.403
706 HA ALA 94 HA ALA 94 13.175 -3.425 2.765
707 HB1 ALA 94 3HB ALA 94 13.189 -1.647 4.460
708 HB2 ALA 94 1HB ALA 94 11.518 -2.034 4.877
709 HB3 ALA 94 2HB ALA 94 11.904 -1.407 3.274
710 H GLY 95 H GLY 95 12.484 -6.014 3.683
711 HA2 GLY 95 2HA GLY 95 13.061 -7.621 5.231
712 HA3 GLY 95 1HA GLY 95 14.228 -6.467 5.860
713 H ARG 96 H ARG 96 10.886 -5.605 5.741
714 HA ARG 96 HA ARG 96 10.518 -6.085 8.614
715 HE ARG 96 HE ARG 96 11.513 -1.420 10.567
716 HB2 ARG 96 2HB ARG 96 10.266 -3.391 7.239
717 HB3 ARG 96 1HB ARG 96 9.681 -3.725 8.863
718 HG2 ARG 96 2HG ARG 96 11.852 -3.995 9.718
719 HG3 ARG 96 1HG ARG 96 12.556 -4.152 8.108
720 HD2 ARG 96 2HD ARG 96 13.119 -1.984 8.932
721 HD3 ARG 96 1HD ARG 96 11.902 -1.769 7.677
722 HH11 ARG 96 1HH1 ARG 96 10.205 -1.209 7.384
723 HH12 ARG 96 2HH1 ARG 96 8.978 -0.086 7.838
724 HH21 ARG 96 1HH2 ARG 96 9.965 0.033 11.133
725 HH22 ARG 96 2HH2 ARG 96 8.858 0.637 9.946
726 HA PRO 97 HA PRO 97 6.484 -7.466 7.434
727 HB2 PRO 97 2HB PRO 97 5.076 -6.472 9.637
728 HB3 PRO 97 1HB PRO 97 5.907 -8.028 9.553
729 HG2 PRO 97 2HG PRO 97 6.859 -5.430 10.699
730 HG3 PRO 97 1HG PRO 97 7.078 -7.077 11.321
731 HD2 PRO 97 2HD PRO 97 9.070 -5.818 10.083
732 HD3 PRO 97 1HD PRO 97 8.785 -7.550 9.793
733 H MET 98 H MET 98 4.755 -6.735 6.302
734 HA MET 98 HA MET 98 4.450 -3.831 5.971
735 HB2 MET 98 2HB MET 98 4.813 -5.244 3.960
736 HB3 MET 98 1HB MET 98 3.327 -6.108 4.315
737 HG2 MET 98 2HG MET 98 2.750 -4.575 2.650
738 HG3 MET 98 1HG MET 98 2.159 -3.852 4.146
739 HE1 MET 98 3HE MET 98 5.831 -2.482 1.737
740 HE2 MET 98 1HE MET 98 4.671 -3.706 1.224
741 HE3 MET 98 2HE MET 98 5.788 -4.048 2.546
742 H LYS 99 H LYS 99 2.787 -2.801 6.921
743 HA LYS 99 HA LYS 99 0.522 -4.362 7.970
744 HB2 LYS 99 2HB LYS 99 1.198 -1.464 8.521
745 HB3 LYS 99 1HB LYS 99 0.104 -2.499 9.437
746 HG2 LYS 99 2HG LYS 99 1.977 -3.841 10.204
747 HG3 LYS 99 1HG LYS 99 3.087 -2.889 9.213
748 HD2 LYS 99 2HD LYS 99 2.204 -0.861 10.550
749 HD3 LYS 99 1HD LYS 99 1.583 -2.064 11.687
750 HE2 LYS 99 2HE LYS 99 3.766 -1.283 12.403
751 HE3 LYS 99 1HE LYS 99 3.862 -2.978 11.923
752 HZ1 LYS 99 3HZ LYS 99 5.722 -1.776 11.029
753 HZ2 LYS 99 1HZ LYS 99 4.705 -0.634 10.303
754 HZ3 LYS 99 2HZ LYS 99 4.713 -2.232 9.754
755 H VAL 100 H VAL 100 -1.007 -4.567 6.364
756 HA VAL 100 HA VAL 100 -1.830 -2.090 4.967
757 HB VAL 100 HB VAL 100 -2.088 -4.918 3.917
758 HG11 VAL 100 1HG1 VAL 100 -2.529 -2.211 2.621
759 HG12 VAL 100 2HG1 VAL 100 -3.764 -3.413 3.003
760 HG13 VAL 100 3HG1 VAL 100 -2.556 -3.753 1.764
761 HG21 VAL 100 3HG2 VAL 100 -0.032 -2.807 3.248
762 HG22 VAL 100 1HG2 VAL 100 -0.265 -4.314 2.361
763 HG23 VAL 100 2HG2 VAL 100 0.256 -4.354 4.046
764 H GLY 101 H GLY 101 -3.673 -1.384 5.914
765 HA2 GLY 101 2HA GLY 101 -5.854 -3.354 6.327
766 HA3 GLY 101 1HA GLY 101 -5.509 -2.099 7.507
767 H HIS 102 H HIS 102 -8.017 -2.561 6.089
768 HA HIS 102 HA HIS 102 -8.326 -0.584 4.050
769 HD1 HIS 102 HD1 HIS 102 -11.959 0.048 6.098
770 HD2 HIS 102 HD2 HIS 102 -10.327 -3.674 6.980
771 HE1 HIS 102 HE1 HIS 102 -13.053 -0.679 8.233
772 HE2 HIS 102 HE2 HIS 102 -11.965 -2.868 8.812
773 HB2 HIS 102 2HB HIS 102 -10.660 -1.044 4.125
774 HB3 HIS 102 1HB HIS 102 -9.860 -2.579 4.433
775 H VAL 103 H VAL 103 -9.218 1.507 4.170
776 HA VAL 103 HA VAL 103 -8.740 3.019 6.496
777 HB VAL 103 HB VAL 103 -10.043 4.831 5.381
778 HG11 VAL 103 1HG1 VAL 103 -8.042 3.396 3.627
779 HG12 VAL 103 2HG1 VAL 103 -7.672 4.554 4.902
780 HG13 VAL 103 3HG1 VAL 103 -8.529 5.083 3.456
781 HG21 VAL 103 3HG2 VAL 103 -10.506 2.761 3.224
782 HG22 VAL 103 1HG2 VAL 103 -10.920 4.474 3.120
783 HG23 VAL 103 2HG2 VAL 103 -11.742 3.436 4.287
784 H THR 104 H THR 104 -10.023 3.666 8.179
785 HA THR 104 HA THR 104 -12.367 2.078 8.744
786 HB THR 104 HB THR 104 -12.417 3.194 10.906
787 HG1 THR 104 HG1 THR 104 -11.127 5.157 9.554
788 HG21 THR 104 3HG2 THR 104 -10.788 1.383 10.626
789 HG22 THR 104 1HG2 THR 104 -10.179 2.611 11.735
790 HG23 THR 104 2HG2 THR 104 -9.579 2.545 10.078
791 H GLU 105 H GLU 105 -14.492 2.703 8.778
792 HA GLU 105 HA GLU 105 -15.293 5.460 8.705
793 HB2 GLU 105 2HB GLU 105 -14.595 4.845 6.287
794 HB3 GLU 105 1HB GLU 105 -16.056 3.873 6.246
795 HG2 GLU 105 2HG GLU 105 -16.046 6.824 6.857
796 HG3 GLU 105 1HG GLU 105 -16.213 6.171 5.231
797 H ARG 106 H ARG 106 -17.170 2.966 7.074
798 HA ARG 106 HA ARG 106 -18.626 2.362 9.556
799 HE ARG 106 HE ARG 106 -22.944 4.402 10.447
800 HB2 ARG 106 2HB ARG 106 -19.699 4.208 7.998
801 HB3 ARG 106 1HB ARG 106 -20.209 2.819 7.046
802 HG2 ARG 106 2HG ARG 106 -21.381 1.901 8.968
803 HG3 ARG 106 1HG ARG 106 -20.818 3.238 9.971
804 HD2 ARG 106 2HD ARG 106 -21.986 4.748 8.232
805 HD3 ARG 106 1HD ARG 106 -22.812 3.272 7.724
806 HH11 ARG 106 1HH1 ARG 106 -24.417 2.699 7.833
807 HH12 ARG 106 2HH1 ARG 106 -25.902 2.480 8.693
808 HH21 ARG 106 1HH2 ARG 106 -24.822 4.105 11.516
809 HH22 ARG 106 2HH2 ARG 106 -26.125 3.252 10.762
810 H THR 107 H THR 107 -16.837 1.169 7.237
811 HA THR 107 HA THR 107 -18.371 -1.164 6.432
812 HB THR 107 HB THR 107 -16.269 -1.867 5.317
813 HG1 THR 107 HG1 THR 107 -14.978 -0.650 7.045
814 HG21 THR 107 3HG2 THR 107 -17.792 -0.364 4.114
815 HG22 THR 107 1HG2 THR 107 -16.114 -0.017 3.702
816 HG23 THR 107 2HG2 THR 107 -16.981 1.036 4.821
817 H ASP 108 H ASP 108 -16.335 -0.216 8.989
818 HA ASP 108 HA ASP 108 -14.982 -2.562 9.669
819 HB2 ASP 108 2HB ASP 108 -15.934 -0.334 11.488
820 HB3 ASP 108 1HB ASP 108 -14.638 -1.474 11.839
Start of MODEL 13
1 HA MET 1 HA MET 1 -32.396 -0.329 -5.395
2 H1 MET 1 1H MET 1 -34.589 1.011 -3.929
3 H2 MET 1 2H MET 1 -34.769 -0.093 -5.194
4 H3 MET 1 3H MET 1 -34.052 1.408 -5.485
5 HB2 MET 1 2HB MET 1 -32.365 1.626 -3.085
6 HB3 MET 1 1HB MET 1 -30.966 0.679 -3.578
7 HG2 MET 1 2HG MET 1 -30.905 2.959 -4.470
8 HG3 MET 1 1HG MET 1 -30.963 1.745 -5.748
9 HE1 MET 1 3HE MET 1 -31.522 4.694 -6.521
10 HE2 MET 1 1HE MET 1 -32.993 4.537 -7.481
11 HE3 MET 1 2HE MET 1 -31.706 3.343 -7.639
12 H GLY 2 H GLY 2 -31.569 -2.166 -4.472
13 HA2 GLY 2 2HA GLY 2 -31.367 -3.348 -2.201
14 HA3 GLY 2 1HA GLY 2 -33.124 -3.293 -2.226
15 H HIS 3 H HIS 3 -33.618 -5.438 -2.397
16 HA HIS 3 HA HIS 3 -32.210 -7.305 -3.977
17 HD1 HIS 3 HD1 HIS 3 -35.580 -5.605 -3.873
18 HD2 HIS 3 HD2 HIS 3 -36.281 -8.786 -1.288
19 HE1 HIS 3 HE1 HIS 3 -37.882 -5.232 -2.954
20 HE2 HIS 3 HE2 HIS 3 -38.349 -7.257 -1.542
21 HB2 HIS 3 2HB HIS 3 -34.189 -8.785 -3.623
22 HB3 HIS 3 1HB HIS 3 -33.548 -8.089 -2.142
23 H HIS 4 H HIS 4 -32.382 -7.950 -6.057
24 HA HIS 4 HA HIS 4 -34.150 -6.428 -7.819
25 HD1 HIS 4 HD1 HIS 4 -31.906 -5.299 -10.377
26 HD2 HIS 4 HD2 HIS 4 -30.503 -6.372 -6.618
27 HE1 HIS 4 HE1 HIS 4 -30.259 -3.519 -9.742
28 HE2 HIS 4 HE2 HIS 4 -29.275 -4.303 -7.568
29 HB2 HIS 4 2HB HIS 4 -31.869 -8.323 -8.431
30 HB3 HIS 4 1HB HIS 4 -32.818 -7.482 -9.652
31 H HIS 5 H HIS 5 -35.404 -7.506 -9.499
32 HA HIS 5 HA HIS 5 -36.975 -9.574 -8.260
33 HD1 HIS 5 HD1 HIS 5 -39.951 -8.549 -8.269
34 HD2 HIS 5 HD2 HIS 5 -37.248 -5.632 -9.464
35 HE1 HIS 5 HE1 HIS 5 -40.652 -6.457 -7.077
36 HE2 HIS 5 HE2 HIS 5 -38.846 -4.789 -7.617
37 HB2 HIS 5 2HB HIS 5 -37.323 -8.082 -10.865
38 HB3 HIS 5 1HB HIS 5 -38.478 -9.261 -10.245
39 H HIS 6 H HIS 6 -37.177 -11.643 -8.755
40 HA HIS 6 HA HIS 6 -36.384 -12.858 -11.198
41 HD1 HIS 6 HD1 HIS 6 -35.966 -13.572 -7.324
42 HD2 HIS 6 HD2 HIS 6 -32.255 -12.208 -8.622
43 HE1 HIS 6 HE1 HIS 6 -34.717 -12.928 -5.250
44 HE2 HIS 6 HE2 HIS 6 -32.446 -12.217 -6.046
45 HB2 HIS 6 2HB HIS 6 -34.591 -14.337 -10.063
46 HB3 HIS 6 1HB HIS 6 -34.132 -12.710 -10.549
47 H HIS 7 H HIS 7 -37.202 -14.953 -11.380
48 HA HIS 7 HA HIS 7 -39.340 -15.553 -9.597
49 HD1 HIS 7 HD1 HIS 7 -41.797 -16.214 -11.088
50 HD2 HIS 7 HD2 HIS 7 -39.484 -19.663 -11.019
51 HE1 HIS 7 HE1 HIS 7 -43.405 -18.094 -10.673
52 HE2 HIS 7 HE2 HIS 7 -42.003 -20.177 -10.802
53 HB2 HIS 7 2HB HIS 7 -39.343 -15.961 -12.076
54 HB3 HIS 7 1HB HIS 7 -38.255 -17.317 -11.804
55 H HIS 8 H HIS 8 -36.230 -16.039 -8.933
56 HA HIS 8 HA HIS 8 -35.142 -17.230 -7.335
57 HD1 HIS 8 HD1 HIS 8 -35.247 -16.864 -4.380
58 HD2 HIS 8 HD2 HIS 8 -36.997 -20.548 -5.177
59 HE1 HIS 8 HE1 HIS 8 -34.434 -18.396 -2.570
60 HE2 HIS 8 HE2 HIS 8 -35.609 -20.581 -2.993
61 HB2 HIS 8 2HB HIS 8 -37.272 -16.811 -6.073
62 HB3 HIS 8 1HB HIS 8 -37.865 -18.365 -6.636
63 H SER 9 H SER 9 -34.960 -18.272 -9.846
64 HA SER 9 HA SER 9 -35.472 -21.123 -9.803
65 HG SER 9 HG SER 9 -35.194 -21.879 -12.316
66 HB2 SER 9 2HB SER 9 -35.401 -19.753 -11.928
67 HB3 SER 9 1HB SER 9 -33.660 -19.599 -11.699
68 H HIS 10 H HIS 10 -34.343 -22.306 -8.362
69 HA HIS 10 HA HIS 10 -31.923 -21.390 -7.198
70 HD1 HIS 10 HD1 HIS 10 -35.535 -23.615 -6.932
71 HD2 HIS 10 HD2 HIS 10 -32.199 -26.054 -7.376
72 HE1 HIS 10 HE1 HIS 10 -36.419 -25.831 -7.696
73 HE2 HIS 10 HE2 HIS 10 -34.399 -27.308 -7.900
74 HB2 HIS 10 2HB HIS 10 -31.915 -23.604 -6.020
75 HB3 HIS 10 1HB HIS 10 -33.394 -22.673 -5.838
76 H MET 11 H MET 11 -30.430 -21.121 -8.881
77 HA MET 11 HA MET 11 -29.101 -23.634 -9.695
78 HB2 MET 11 2HB MET 11 -29.324 -21.109 -11.357
79 HB3 MET 11 1HB MET 11 -28.473 -22.576 -11.821
80 HG2 MET 11 2HG MET 11 -31.442 -22.276 -11.407
81 HG3 MET 11 1HG MET 11 -30.601 -22.457 -12.946
82 HE1 MET 11 3HE MET 11 -32.297 -24.446 -13.561
83 HE2 MET 11 1HE MET 11 -33.084 -24.244 -11.996
84 HE3 MET 11 2HE MET 11 -32.562 -25.845 -12.516
85 H ALA 12 H ALA 12 -28.669 -21.678 -7.442
86 HA ALA 12 HA ALA 12 -26.220 -20.277 -8.099
87 HB1 ALA 12 3HB ALA 12 -27.860 -19.249 -6.618
88 HB2 ALA 12 1HB ALA 12 -26.314 -19.467 -5.794
89 HB3 ALA 12 2HB ALA 12 -27.657 -20.564 -5.458
90 H ALA 13 H ALA 13 -25.621 -22.836 -8.603
91 HA ALA 13 HA ALA 13 -24.313 -23.998 -6.253
92 HB1 ALA 13 3HB ALA 13 -25.613 -25.469 -7.731
93 HB2 ALA 13 1HB ALA 13 -23.917 -25.949 -7.648
94 HB3 ALA 13 2HB ALA 13 -24.522 -25.086 -9.064
95 H ALA 14 H ALA 14 -23.519 -22.048 -8.969
96 HA ALA 14 HA ALA 14 -20.797 -22.733 -9.331
97 HB1 ALA 14 3HB ALA 14 -22.044 -21.440 -10.977
98 HB2 ALA 14 1HB ALA 14 -20.600 -20.566 -10.466
99 HB3 ALA 14 2HB ALA 14 -22.182 -20.097 -9.842
100 H MET 15 H MET 15 -22.385 -20.916 -6.866
101 HA MET 15 HA MET 15 -21.694 -19.997 -4.920
102 HB2 MET 15 2HB MET 15 -19.019 -21.272 -5.528
103 HB3 MET 15 1HB MET 15 -19.539 -20.656 -3.965
104 HG2 MET 15 2HG MET 15 -20.706 -22.995 -5.461
105 HG3 MET 15 1HG MET 15 -19.714 -23.056 -4.003
106 HE1 MET 15 3HE MET 15 -23.229 -24.194 -2.709
107 HE2 MET 15 1HE MET 15 -21.515 -24.595 -2.806
108 HE3 MET 15 2HE MET 15 -22.496 -24.560 -4.271
109 H ALA 16 H ALA 16 -18.603 -19.742 -6.653
110 HA ALA 16 HA ALA 16 -18.099 -17.115 -5.738
111 HB1 ALA 16 3HB ALA 16 -16.164 -17.152 -7.209
112 HB2 ALA 16 1HB ALA 16 -16.813 -18.555 -8.059
113 HB3 ALA 16 2HB ALA 16 -16.324 -18.697 -6.371
114 H ASN 17 H ASN 17 -18.531 -15.133 -6.564
115 HA ASN 17 HA ASN 17 -19.172 -14.723 -9.344
116 HB2 ASN 17 2HB ASN 17 -21.435 -13.885 -9.028
117 HB3 ASN 17 1HB ASN 17 -21.335 -15.549 -8.465
118 HD21 ASN 17 1HD2 ASN 17 -21.335 -15.935 -6.204
119 HD22 ASN 17 2HD2 ASN 17 -21.982 -14.771 -5.106
120 H ASN 18 H ASN 18 -19.350 -12.466 -9.914
121 HA ASN 18 HA ASN 18 -17.867 -10.747 -8.068
122 HB2 ASN 18 2HB ASN 18 -18.679 -10.284 -10.952
123 HB3 ASN 18 1HB ASN 18 -17.614 -9.247 -10.006
124 HD21 ASN 18 1HD2 ASN 18 -15.504 -9.898 -9.630
125 HD22 ASN 18 2HD2 ASN 18 -14.785 -11.234 -10.458
126 H LEU 19 H LEU 19 -19.330 -10.010 -6.538
127 HA LEU 19 HA LEU 19 -21.967 -9.103 -7.245
128 HG LEU 19 HG LEU 19 -22.450 -7.322 -4.734
129 HB2 LEU 19 2HB LEU 19 -21.431 -10.157 -5.060
130 HB3 LEU 19 1HB LEU 19 -20.432 -8.774 -4.657
131 HD11 LEU 19 1HD1 LEU 19 -23.798 -8.626 -6.295
132 HD12 LEU 19 2HD1 LEU 19 -24.673 -8.354 -4.789
133 HD13 LEU 19 3HD1 LEU 19 -23.939 -9.926 -5.112
134 HD21 LEU 19 3HD2 LEU 19 -23.448 -8.125 -2.651
135 HD22 LEU 19 1HD2 LEU 19 -21.690 -8.256 -2.607
136 HD23 LEU 19 2HD2 LEU 19 -22.675 -9.695 -2.877
137 H GLN 20 H GLN 20 -18.956 -7.567 -6.196
138 HA GLN 20 HA GLN 20 -20.018 -4.944 -6.944
139 HB2 GLN 20 2HB GLN 20 -17.875 -4.089 -5.900
140 HB3 GLN 20 1HB GLN 20 -18.983 -4.901 -4.803
141 HG2 GLN 20 2HG GLN 20 -17.615 -6.962 -5.035
142 HG3 GLN 20 1HG GLN 20 -16.471 -6.045 -6.010
143 HE21 GLN 20 1HE2 GLN 20 -18.134 -4.640 -3.283
144 HE22 GLN 20 2HE2 GLN 20 -16.752 -4.538 -2.255
145 H LYS 21 H LYS 21 -19.847 -6.265 -9.156
146 HA LYS 21 HA LYS 21 -17.415 -6.567 -10.495
147 HB2 LYS 21 2HB LYS 21 -19.549 -7.515 -11.270
148 HB3 LYS 21 1HB LYS 21 -20.139 -5.901 -11.640
149 HG2 LYS 21 2HG LYS 21 -18.401 -5.650 -13.350
150 HG3 LYS 21 1HG LYS 21 -17.805 -7.273 -12.979
151 HD2 LYS 21 2HD LYS 21 -20.576 -6.600 -13.997
152 HD3 LYS 21 1HD LYS 21 -19.258 -7.255 -14.971
153 HE2 LYS 21 2HE LYS 21 -19.251 -9.294 -13.662
154 HE3 LYS 21 1HE LYS 21 -20.459 -8.632 -12.560
155 HZ1 LYS 21 3HZ LYS 21 -22.060 -8.622 -14.316
156 HZ2 LYS 21 1HZ LYS 21 -21.385 -10.168 -14.215
157 HZ3 LYS 21 2HZ LYS 21 -20.911 -9.119 -15.452
158 H GLY 22 H GLY 22 -15.954 -4.930 -10.502
159 HA2 GLY 22 2HA GLY 22 -14.979 -3.063 -11.508
160 HA3 GLY 22 1HA GLY 22 -16.557 -2.574 -12.098
161 H SER 23 H SER 23 -17.178 -3.158 -8.992
162 HA SER 23 HA SER 23 -17.551 -1.916 -7.133
163 HG SER 23 HG SER 23 -15.056 -1.913 -5.684
164 HB2 SER 23 2HB SER 23 -15.025 -0.511 -8.036
165 HB3 SER 23 1HB SER 23 -15.843 -0.153 -6.516
166 H ALA 24 H ALA 24 -19.037 -0.396 -6.665
167 HA ALA 24 HA ALA 24 -19.704 1.661 -8.597
168 HB1 ALA 24 3HB ALA 24 -20.859 1.127 -5.855
169 HB2 ALA 24 1HB ALA 24 -21.472 0.480 -7.376
170 HB3 ALA 24 2HB ALA 24 -21.531 2.216 -7.070
171 H GLY 25 H GLY 25 -17.953 1.413 -5.584
172 HA2 GLY 25 2HA GLY 25 -17.231 4.276 -5.823
173 HA3 GLY 25 1HA GLY 25 -17.547 3.537 -4.259
174 HA PRO 26 HA PRO 26 -13.012 2.971 -5.693
175 HB2 PRO 26 2HB PRO 26 -11.760 5.045 -4.505
176 HB3 PRO 26 1HB PRO 26 -12.516 5.191 -6.097
177 HG2 PRO 26 2HG PRO 26 -13.571 6.028 -3.416
178 HG3 PRO 26 1HG PRO 26 -13.611 6.907 -4.956
179 HD2 PRO 26 2HD PRO 26 -15.741 5.501 -3.970
180 HD3 PRO 26 1HD PRO 26 -15.463 5.758 -5.705
181 H MET 27 H MET 27 -11.494 1.900 -4.473
182 HA MET 27 HA MET 27 -12.101 1.504 -1.619
183 HB2 MET 27 2HB MET 27 -12.191 -0.512 -2.976
184 HB3 MET 27 1HB MET 27 -10.577 -0.204 -3.600
185 HG2 MET 27 2HG MET 27 -10.488 -1.945 -1.950
186 HG3 MET 27 1HG MET 27 -9.664 -0.514 -1.334
187 HE1 MET 27 3HE MET 27 -11.262 -2.238 1.837
188 HE2 MET 27 1HE MET 27 -9.758 -1.762 1.047
189 HE3 MET 27 2HE MET 27 -10.721 -3.088 0.389
190 H ARG 28 H ARG 28 -10.772 2.400 -0.153
191 HA ARG 28 HA ARG 28 -8.095 3.292 -0.987
192 HE ARG 28 HE ARG 28 -9.914 6.737 1.259
193 HB2 ARG 28 2HB ARG 28 -9.599 4.952 0.078
194 HB3 ARG 28 1HB ARG 28 -9.662 3.948 1.523
195 HG2 ARG 28 2HG ARG 28 -7.191 4.229 1.752
196 HG3 ARG 28 1HG ARG 28 -7.242 5.362 0.400
197 HD2 ARG 28 2HD ARG 28 -8.628 5.658 3.069
198 HD3 ARG 28 1HD ARG 28 -7.237 6.577 2.496
199 HH11 ARG 28 1HH1 ARG 28 -6.994 8.228 2.329
200 HH12 ARG 28 2HH1 ARG 28 -7.498 9.813 1.862
201 HH21 ARG 28 1HH2 ARG 28 -10.548 8.786 0.664
202 HH22 ARG 28 2HH2 ARG 28 -9.488 10.122 0.944
203 H LEU 29 H LEU 29 -6.230 2.539 -0.065
204 HA LEU 29 HA LEU 29 -6.457 0.518 2.075
205 HG LEU 29 HG LEU 29 -6.583 -0.383 -0.962
206 HB2 LEU 29 2HB LEU 29 -4.488 0.617 -0.217
207 HB3 LEU 29 1HB LEU 29 -4.391 -0.510 1.121
208 HD11 LEU 29 1HD1 LEU 29 -4.518 -1.359 -1.794
209 HD12 LEU 29 2HD1 LEU 29 -5.752 -2.603 -1.599
210 HD13 LEU 29 3HD1 LEU 29 -4.454 -2.455 -0.415
211 HD21 LEU 29 3HD2 LEU 29 -7.539 -0.991 1.190
212 HD22 LEU 29 1HD2 LEU 29 -6.293 -2.217 1.424
213 HD23 LEU 29 2HD2 LEU 29 -7.479 -2.399 0.132
214 H TYR 30 H TYR 30 -5.391 0.932 3.887
215 HA TYR 30 HA TYR 30 -3.509 3.154 4.051
216 HD1 TYR 30 HD1 TYR 30 -3.186 4.711 6.450
217 HD2 TYR 30 HD2 TYR 30 -3.380 0.641 7.689
218 HE1 TYR 30 HE1 TYR 30 -1.554 5.176 8.228
219 HE2 TYR 30 HE2 TYR 30 -1.749 1.099 9.469
220 HH TYR 30 HH TYR 30 -0.887 4.195 10.442
221 HB2 TYR 30 2HB TYR 30 -5.104 3.176 5.800
222 HB3 TYR 30 1HB TYR 30 -4.935 1.451 6.096
223 H VAL 31 H VAL 31 -1.420 2.718 3.589
224 HA VAL 31 HA VAL 31 -0.272 0.135 4.426
225 HB VAL 31 HB VAL 31 0.905 2.213 2.555
226 HG11 VAL 31 1HG1 VAL 31 1.810 -0.599 3.207
227 HG12 VAL 31 2HG1 VAL 31 2.623 0.892 3.681
228 HG13 VAL 31 3HG1 VAL 31 2.519 0.447 1.979
229 HG21 VAL 31 3HG2 VAL 31 -1.077 1.185 1.577
230 HG22 VAL 31 1HG2 VAL 31 -0.440 -0.423 1.928
231 HG23 VAL 31 2HG2 VAL 31 0.377 0.615 0.759
232 H GLY 32 H GLY 32 0.308 0.373 6.547
233 HA2 GLY 32 2HA GLY 32 1.843 2.778 7.318
234 HA3 GLY 32 1HA GLY 32 0.968 1.735 8.423
235 H SER 33 H SER 33 3.886 2.112 6.531
236 HA SER 33 HA SER 33 5.488 0.749 8.407
237 HG SER 33 HG SER 33 6.181 -2.200 7.839
238 HB2 SER 33 2HB SER 33 4.364 -1.254 7.460
239 HB3 SER 33 1HB SER 33 5.003 -0.841 5.871
240 H LEU 34 H LEU 34 5.417 3.149 6.557
241 HA LEU 34 HA LEU 34 7.634 2.862 4.766
242 HG LEU 34 HG LEU 34 4.707 4.490 4.906
243 HB2 LEU 34 2HB LEU 34 6.629 5.420 6.037
244 HB3 LEU 34 1HB LEU 34 7.609 5.281 4.590
245 HD11 LEU 34 1HD1 LEU 34 5.050 6.874 4.641
246 HD12 LEU 34 2HD1 LEU 34 4.346 6.199 3.173
247 HD13 LEU 34 3HD1 LEU 34 6.064 6.598 3.224
248 HD21 LEU 34 3HD2 LEU 34 6.510 4.128 2.508
249 HD22 LEU 34 1HD2 LEU 34 4.765 3.870 2.533
250 HD23 LEU 34 2HD2 LEU 34 5.823 2.841 3.500
251 H HIS 35 H HIS 35 9.617 2.340 5.510
252 HA HIS 35 HA HIS 35 10.343 2.791 8.265
253 HD1 HIS 35 HD1 HIS 35 9.627 0.318 8.623
254 HD2 HIS 35 HD2 HIS 35 11.261 -0.568 4.907
255 HE1 HIS 35 HE1 HIS 35 8.490 -1.786 7.874
256 HE2 HIS 35 HE2 HIS 35 9.581 -2.375 5.685
257 HB2 HIS 35 2HB HIS 35 12.144 1.688 6.098
258 HB3 HIS 35 1HB HIS 35 12.235 1.401 7.830
259 H PHE 36 H PHE 36 10.013 5.276 7.152
260 HA PHE 36 HA PHE 36 10.943 7.315 6.840
261 HD1 PHE 36 HD1 PHE 36 11.498 9.016 9.181
262 HD2 PHE 36 HD2 PHE 36 12.177 4.872 9.898
263 HE1 PHE 36 HE1 PHE 36 10.330 9.199 11.339
264 HE2 PHE 36 HE2 PHE 36 11.010 5.052 12.056
265 HZ PHE 36 HZ PHE 36 10.084 7.218 12.780
266 HB2 PHE 36 2HB PHE 36 13.357 6.020 8.139
267 HB3 PHE 36 1HB PHE 36 13.155 7.751 7.885
268 H ASN 37 H ASN 37 11.429 5.043 4.831
269 HA ASN 37 HA ASN 37 13.242 6.547 3.104
270 HB2 ASN 37 2HB ASN 37 14.577 4.593 2.526
271 HB3 ASN 37 1HB ASN 37 14.661 4.885 4.260
272 HD21 ASN 37 1HD2 ASN 37 15.127 2.443 2.741
273 HD22 ASN 37 2HD2 ASN 37 14.041 1.267 3.392
274 H ILE 38 H ILE 38 10.832 4.013 3.464
275 HA ILE 38 HA ILE 38 10.565 3.237 0.787
276 HB ILE 38 HB ILE 38 8.372 3.276 2.875
277 HG12 ILE 38 2HG1 ILE 38 10.357 2.094 3.716
278 HG13 ILE 38 1HG1 ILE 38 9.052 0.962 3.386
279 HG21 ILE 38 1HG2 ILE 38 8.698 1.620 0.365
280 HG22 ILE 38 2HG2 ILE 38 7.514 2.901 0.629
281 HG23 ILE 38 3HG2 ILE 38 7.423 1.410 1.567
282 HD11 ILE 38 3HD1 ILE 38 11.189 0.074 2.672
283 HD12 ILE 38 1HD1 ILE 38 11.442 1.469 1.625
284 HD13 ILE 38 2HD1 ILE 38 10.135 0.335 1.284
285 H THR 39 H THR 39 9.551 4.090 -0.944
286 HA THR 39 HA THR 39 8.040 6.608 -0.579
287 HB THR 39 HB THR 39 8.777 7.261 -2.838
288 HG1 THR 39 HG1 THR 39 10.737 5.879 -3.526
289 HG21 THR 39 3HG2 THR 39 11.130 7.727 -2.308
290 HG22 THR 39 1HG2 THR 39 11.067 6.556 -0.991
291 HG23 THR 39 2HG2 THR 39 10.087 8.021 -0.917
292 H GLU 40 H GLU 40 6.582 7.086 -2.503
293 HA GLU 40 HA GLU 40 4.610 5.097 -2.712
294 HB2 GLU 40 2HB GLU 40 3.743 6.656 -4.612
295 HB3 GLU 40 1HB GLU 40 3.767 7.242 -2.954
296 HG2 GLU 40 2HG GLU 40 5.649 8.589 -3.336
297 HG3 GLU 40 1HG GLU 40 6.020 7.788 -4.868
298 H ASP 41 H ASP 41 7.366 5.819 -4.755
299 HA ASP 41 HA ASP 41 6.594 4.470 -7.098
300 HB2 ASP 41 2HB ASP 41 9.372 4.749 -5.920
301 HB3 ASP 41 1HB ASP 41 9.001 4.333 -7.594
302 H MET 42 H MET 42 8.121 3.260 -4.140
303 HA MET 42 HA MET 42 8.578 0.603 -5.027
304 HB2 MET 42 2HB MET 42 8.092 1.586 -2.200
305 HB3 MET 42 1HB MET 42 8.831 0.054 -2.651
306 HG2 MET 42 2HG MET 42 10.715 1.247 -3.647
307 HG3 MET 42 1HG MET 42 9.966 2.788 -3.221
308 HE1 MET 42 3HE MET 42 12.942 2.066 -2.404
309 HE2 MET 42 1HE MET 42 12.980 2.600 -0.724
310 HE3 MET 42 2HE MET 42 12.158 3.578 -1.940
311 H LEU 43 H LEU 43 6.013 1.970 -2.983
312 HA LEU 43 HA LEU 43 4.372 -0.266 -2.751
313 HG LEU 43 HG LEU 43 5.298 2.274 -1.195
314 HB2 LEU 43 2HB LEU 43 3.509 2.629 -2.926
315 HB3 LEU 43 1HB LEU 43 2.602 1.320 -2.186
316 HD11 LEU 43 1HD1 LEU 43 4.087 3.375 0.614
317 HD12 LEU 43 2HD1 LEU 43 2.551 2.947 -0.142
318 HD13 LEU 43 3HD1 LEU 43 3.658 4.054 -0.956
319 HD21 LEU 43 3HD2 LEU 43 4.807 -0.033 -0.611
320 HD22 LEU 43 1HD2 LEU 43 3.235 0.442 0.036
321 HD23 LEU 43 2HD2 LEU 43 4.716 0.995 0.819
322 H ARG 44 H ARG 44 4.022 2.428 -5.064
323 HA ARG 44 HA ARG 44 2.001 1.517 -6.678
324 HE ARG 44 HE ARG 44 2.317 3.874 -11.244
325 HB2 ARG 44 2HB ARG 44 3.062 3.716 -6.876
326 HB3 ARG 44 1HB ARG 44 4.523 2.973 -7.498
327 HG2 ARG 44 2HG ARG 44 3.326 2.263 -9.505
328 HG3 ARG 44 1HG ARG 44 1.837 2.976 -8.873
329 HD2 ARG 44 2HD ARG 44 2.874 5.186 -8.869
330 HD3 ARG 44 1HD ARG 44 4.393 4.491 -9.434
331 HH11 ARG 44 1HH1 ARG 44 4.207 6.550 -10.157
332 HH12 ARG 44 2HH1 ARG 44 4.139 7.358 -11.683
333 HH21 ARG 44 1HH2 ARG 44 2.222 4.937 -13.195
334 HH22 ARG 44 2HH2 ARG 44 3.031 6.454 -13.384
335 H GLY 45 H GLY 45 5.473 0.760 -6.998
336 HA2 GLY 45 2HA GLY 45 5.319 -0.828 -9.303
337 HA3 GLY 45 1HA GLY 45 6.576 -0.930 -8.083
338 H ILE 46 H ILE 46 4.752 -1.712 -5.926
339 HA ILE 46 HA ILE 46 4.598 -4.550 -6.552
340 HB ILE 46 HB ILE 46 3.993 -3.119 -3.952
341 HG12 ILE 46 2HG1 ILE 46 6.501 -4.582 -4.849
342 HG13 ILE 46 1HG1 ILE 46 6.338 -2.836 -4.685
343 HG21 ILE 46 1HG2 ILE 46 4.236 -5.342 -2.924
344 HG22 ILE 46 2HG2 ILE 46 4.430 -6.056 -4.526
345 HG23 ILE 46 3HG2 ILE 46 2.902 -5.296 -4.078
346 HD11 ILE 46 3HD1 ILE 46 7.516 -3.787 -2.796
347 HD12 ILE 46 1HD1 ILE 46 6.150 -4.848 -2.451
348 HD13 ILE 46 2HD1 ILE 46 5.974 -3.100 -2.280
349 H PHE 47 H PHE 47 2.333 -1.940 -5.740
350 HA PHE 47 HA PHE 47 0.054 -3.685 -5.559
351 HD1 PHE 47 HD1 PHE 47 1.903 -1.201 -3.536
352 HD2 PHE 47 HD2 PHE 47 -2.205 -2.324 -3.611
353 HE1 PHE 47 HE1 PHE 47 1.933 -1.458 -1.092
354 HE2 PHE 47 HE2 PHE 47 -2.182 -2.584 -1.166
355 HZ PHE 47 HZ PHE 47 -0.111 -2.147 0.097
356 HB2 PHE 47 2HB PHE 47 0.392 -0.693 -5.497
357 HB3 PHE 47 1HB PHE 47 -1.205 -1.427 -5.551
358 H GLU 48 H GLU 48 1.462 -1.693 -8.105
359 HA GLU 48 HA GLU 48 -0.693 -1.393 -9.814
360 HB2 GLU 48 2HB GLU 48 1.654 -0.441 -10.042
361 HB3 GLU 48 1HB GLU 48 2.114 -1.967 -10.776
362 HG2 GLU 48 2HG GLU 48 -0.128 -0.288 -11.866
363 HG3 GLU 48 1HG GLU 48 1.551 0.000 -12.307
364 HA PRO 49 HA PRO 49 0.539 -5.888 -11.775
365 HB2 PRO 49 2HB PRO 49 1.067 -6.943 -9.010
366 HB3 PRO 49 1HB PRO 49 1.682 -7.517 -10.568
367 HG2 PRO 49 2HG PRO 49 3.223 -6.031 -8.999
368 HG3 PRO 49 1HG PRO 49 3.215 -5.770 -10.754
369 HD2 PRO 49 2HD PRO 49 2.000 -4.123 -8.588
370 HD3 PRO 49 1HD PRO 49 2.671 -3.617 -10.152
371 H PHE 50 H PHE 50 -1.038 -5.120 -8.706
372 HA PHE 50 HA PHE 50 -3.117 -7.117 -9.058
373 HD1 PHE 50 HD2 PHE 50 -3.597 -8.431 -6.478
374 HD2 PHE 50 HD1 PHE 50 -0.598 -5.407 -6.285
375 HE1 PHE 50 HE2 PHE 50 -2.181 -9.921 -5.126
376 HE2 PHE 50 HE1 PHE 50 0.817 -6.894 -4.932
377 HZ PHE 50 HZ PHE 50 0.026 -9.155 -4.347
378 HB2 PHE 50 2HB PHE 50 -2.819 -4.877 -7.039
379 HB3 PHE 50 1HB PHE 50 -4.102 -6.079 -7.014
380 H GLY 51 H GLY 51 -2.897 -3.555 -9.194
381 HA2 GLY 51 2HA GLY 51 -4.964 -3.341 -11.138
382 HA3 GLY 51 1HA GLY 51 -5.538 -2.886 -9.537
383 H ARG 52 H ARG 52 -5.173 -1.271 -11.945
384 HA ARG 52 HA ARG 52 -2.906 0.407 -11.729
385 HE ARG 52 HE ARG 52 -4.867 4.454 -14.592
386 HB2 ARG 52 2HB ARG 52 -4.626 0.088 -13.693
387 HB3 ARG 52 1HB ARG 52 -5.509 1.383 -12.899
388 HG2 ARG 52 2HG ARG 52 -2.614 1.657 -13.689
389 HG3 ARG 52 1HG ARG 52 -3.931 2.021 -14.800
390 HD2 ARG 52 2HD ARG 52 -3.834 3.303 -12.086
391 HD3 ARG 52 1HD ARG 52 -2.856 3.936 -13.406
392 HH11 ARG 52 1HH1 ARG 52 -5.433 3.385 -11.365
393 HH12 ARG 52 2HH1 ARG 52 -6.949 4.202 -11.257
394 HH21 ARG 52 1HH2 ARG 52 -6.807 5.512 -14.415
395 HH22 ARG 52 2HH2 ARG 52 -7.706 5.400 -12.938
396 H ILE 53 H ILE 53 -2.446 1.750 -10.097
397 HA ILE 53 HA ILE 53 -4.297 2.465 -8.074
398 HB ILE 53 HB ILE 53 -1.564 3.624 -8.665
399 HG12 ILE 53 2HG1 ILE 53 -0.975 2.240 -6.570
400 HG13 ILE 53 1HG1 ILE 53 -2.504 1.412 -6.826
401 HG21 ILE 53 1HG2 ILE 53 -2.860 5.214 -7.377
402 HG22 ILE 53 2HG2 ILE 53 -1.626 4.482 -6.353
403 HG23 ILE 53 3HG2 ILE 53 -3.304 3.958 -6.221
404 HD11 ILE 53 3HD1 ILE 53 -0.205 1.517 -8.770
405 HD12 ILE 53 1HD1 ILE 53 -1.733 0.667 -9.015
406 HD13 ILE 53 2HD1 ILE 53 -0.636 0.159 -7.731
407 H GLU 54 H GLU 54 -5.520 4.271 -7.743
408 HA GLU 54 HA GLU 54 -5.779 6.266 -9.816
409 HB2 GLU 54 2HB GLU 54 -7.054 5.983 -7.087
410 HB3 GLU 54 1HB GLU 54 -7.420 7.300 -8.190
411 HG2 GLU 54 2HG GLU 54 -7.816 4.394 -8.870
412 HG3 GLU 54 1HG GLU 54 -9.066 5.416 -8.166
413 H SER 55 H SER 55 -4.888 6.383 -6.357
414 HA SER 55 HA SER 55 -2.909 8.448 -6.884
415 HG SER 55 HG SER 55 -6.357 9.286 -5.125
416 HB2 SER 55 2HB SER 55 -3.834 9.971 -5.137
417 HB3 SER 55 1HB SER 55 -4.898 9.808 -6.533
418 H ILE 56 H ILE 56 -1.218 8.392 -5.476
419 HA ILE 56 HA ILE 56 -1.517 6.794 -3.003
420 HB ILE 56 HB ILE 56 1.045 7.319 -4.538
421 HG12 ILE 56 2HG1 ILE 56 -0.627 4.800 -4.302
422 HG13 ILE 56 1HG1 ILE 56 -0.415 5.772 -5.753
423 HG21 ILE 56 1HG2 ILE 56 2.044 5.686 -2.989
424 HG22 ILE 56 2HG2 ILE 56 0.515 5.585 -2.116
425 HG23 ILE 56 3HG2 ILE 56 1.422 7.098 -2.136
426 HD11 ILE 56 3HD1 ILE 56 1.956 5.201 -5.791
427 HD12 ILE 56 1HD1 ILE 56 0.935 3.762 -5.827
428 HD13 ILE 56 2HD1 ILE 56 1.747 4.230 -4.331
429 H GLN 57 H GLN 57 -0.851 7.685 -1.079
430 HA GLN 57 HA GLN 57 0.202 10.437 -1.149
431 HB2 GLN 57 2HB GLN 57 -2.244 10.413 -0.673
432 HB3 GLN 57 1HB GLN 57 -1.939 9.401 0.731
433 HG2 GLN 57 2HG GLN 57 -2.090 11.456 1.717
434 HG3 GLN 57 1HG GLN 57 -0.356 11.367 1.436
435 HE21 GLN 57 1HE2 GLN 57 -0.704 11.881 -1.476
436 HE22 GLN 57 2HE2 GLN 57 -1.080 13.554 -1.596
437 H LEU 58 H LEU 58 2.135 10.504 -0.142
438 HA LEU 58 HA LEU 58 2.702 8.637 2.057
439 HG LEU 58 HG LEU 58 3.997 9.044 -0.914
440 HB2 LEU 58 2HB LEU 58 4.500 10.721 0.793
441 HB3 LEU 58 1HB LEU 58 4.994 9.463 1.910
442 HD11 LEU 58 1HD1 LEU 58 6.747 8.696 0.276
443 HD12 LEU 58 2HD1 LEU 58 6.241 10.009 -0.787
444 HD13 LEU 58 3HD1 LEU 58 6.276 8.356 -1.387
445 HD21 LEU 58 3HD2 LEU 58 4.608 6.690 -0.575
446 HD22 LEU 58 1HD2 LEU 58 3.317 7.191 0.517
447 HD23 LEU 58 2HD2 LEU 58 4.968 7.028 1.119
448 H MET 59 H MET 59 2.704 9.251 4.171
449 HA MET 59 HA MET 59 1.927 12.008 4.769
450 HB2 MET 59 2HB MET 59 2.039 9.575 6.567
451 HB3 MET 59 1HB MET 59 1.386 11.146 7.011
452 HG2 MET 59 2HG MET 59 0.314 9.359 4.833
453 HG3 MET 59 1HG MET 59 -0.373 9.533 6.445
454 HE1 MET 59 3HE MET 59 -0.027 12.644 6.982
455 HE2 MET 59 1HE MET 59 -1.523 11.777 7.336
456 HE3 MET 59 2HE MET 59 -1.569 13.272 6.402
457 H MET 60 H MET 60 3.666 13.301 4.827
458 HA MET 60 HA MET 60 6.101 12.442 6.218
459 HB2 MET 60 2HB MET 60 5.581 14.849 4.448
460 HB3 MET 60 1HB MET 60 7.133 14.438 5.167
461 HG2 MET 60 2HG MET 60 7.107 12.305 3.916
462 HG3 MET 60 1HG MET 60 5.608 12.813 3.138
463 HE1 MET 60 3HE MET 60 6.630 12.482 0.718
464 HE2 MET 60 1HE MET 60 8.130 11.902 1.444
465 HE3 MET 60 2HE MET 60 8.177 13.157 0.207
466 H ASP 61 H ASP 61 7.164 13.861 7.752
467 HA ASP 61 HA ASP 61 5.354 15.036 9.638
468 HB2 ASP 61 2HB ASP 61 8.380 15.102 9.547
469 HB3 ASP 61 1HB ASP 61 7.391 15.593 10.918
470 H SER 62 H SER 62 4.392 16.938 9.140
471 HA SER 62 HA SER 62 5.438 18.994 7.529
472 HG SER 62 HG SER 62 3.175 20.134 10.457
473 HB2 SER 62 2HB SER 62 3.647 20.401 8.432
474 HB3 SER 62 1HB SER 62 3.031 18.778 8.103
475 H GLU 63 H GLU 63 6.293 18.077 10.666
476 HA GLU 63 HA GLU 63 6.973 20.589 11.821
477 HB2 GLU 63 2HB GLU 63 6.610 18.470 13.097
478 HB3 GLU 63 1HB GLU 63 8.108 17.842 12.423
479 HG2 GLU 63 2HG GLU 63 8.458 18.635 14.682
480 HG3 GLU 63 1HG GLU 63 9.360 19.630 13.537
481 H THR 64 H THR 64 8.598 18.373 9.699
482 HA THR 64 HA THR 64 10.934 20.141 9.478
483 HB THR 64 HB THR 64 12.452 18.155 9.564
484 HG1 THR 64 HG1 THR 64 10.981 16.456 10.961
485 HG21 THR 64 3HG2 THR 64 12.180 19.584 11.558
486 HG22 THR 64 1HG2 THR 64 12.477 17.903 11.993
487 HG23 THR 64 2HG2 THR 64 10.846 18.562 12.098
488 H GLY 65 H GLY 65 9.424 17.131 8.345
489 HA2 GLY 65 2HA GLY 65 8.777 17.160 5.904
490 HA3 GLY 65 1HA GLY 65 10.432 17.673 5.613
491 H ARG 66 H ARG 66 9.841 15.375 8.128
492 HA ARG 66 HA ARG 66 11.399 13.364 6.698
493 HE ARG 66 HE ARG 66 13.657 12.017 9.239
494 HB2 ARG 66 2HB ARG 66 10.269 13.314 9.510
495 HB3 ARG 66 1HB ARG 66 11.456 12.197 8.853
496 HG2 ARG 66 2HG ARG 66 11.890 15.161 9.219
497 HG3 ARG 66 1HG ARG 66 12.448 13.908 10.327
498 HD2 ARG 66 2HD ARG 66 13.237 14.109 7.421
499 HD3 ARG 66 1HD ARG 66 14.202 14.718 8.763
500 HH11 ARG 66 1HH1 ARG 66 15.404 13.952 6.986
501 HH12 ARG 66 2HH1 ARG 66 16.623 12.750 6.732
502 HH21 ARG 66 1HH2 ARG 66 15.247 10.479 8.902
503 HH22 ARG 66 2HH2 ARG 66 16.542 10.828 7.807
504 H SER 67 H SER 67 10.305 11.010 7.900
505 HA SER 67 HA SER 67 7.695 10.850 6.510
506 HG SER 67 HG SER 67 8.115 7.821 5.193
507 HB2 SER 67 2HB SER 67 9.436 9.464 5.458
508 HB3 SER 67 1HB SER 67 9.703 8.628 6.988
509 H LYS 68 H LYS 68 5.930 10.290 7.668
510 HA LYS 68 HA LYS 68 6.218 9.780 10.501
511 HB2 LYS 68 2HB LYS 68 3.795 10.076 8.725
512 HB3 LYS 68 1HB LYS 68 3.692 9.757 10.455
513 HG2 LYS 68 2HG LYS 68 4.944 11.828 10.893
514 HG3 LYS 68 1HG LYS 68 4.978 12.156 9.159
515 HD2 LYS 68 2HD LYS 68 2.576 12.352 9.096
516 HD3 LYS 68 1HD LYS 68 2.450 11.838 10.781
517 HE2 LYS 68 2HE LYS 68 3.627 13.833 11.506
518 HE3 LYS 68 1HE LYS 68 3.853 14.338 9.832
519 HZ1 LYS 68 3HZ LYS 68 2.024 15.508 10.869
520 HZ2 LYS 68 1HZ LYS 68 1.243 14.047 11.214
521 HZ3 LYS 68 2HZ LYS 68 1.460 14.534 9.610
522 H GLY 69 H GLY 69 6.188 7.792 7.790
523 HA2 GLY 69 2HA GLY 69 6.706 5.496 7.997
524 HA3 GLY 69 1HA GLY 69 5.938 5.474 9.572
525 H TYR 70 H TYR 70 3.873 6.987 7.338
526 HA TYR 70 HA TYR 70 2.749 4.496 6.346
527 HD1 TYR 70 HD2 TYR 70 2.620 6.539 9.873
528 HD2 TYR 70 HD1 TYR 70 -0.758 6.928 7.302
529 HE1 TYR 70 HE2 TYR 70 1.950 8.584 11.061
530 HE2 TYR 70 HE1 TYR 70 -1.432 8.968 8.494
531 HH TYR 70 HH TYR 70 0.600 10.519 10.820
532 HB2 TYR 70 2HB TYR 70 0.505 4.908 7.292
533 HB3 TYR 70 1HB TYR 70 1.718 4.596 8.522
534 H GLY 71 H GLY 71 1.072 4.722 4.796
535 HA2 GLY 71 2HA GLY 71 0.492 7.381 3.738
536 HA3 GLY 71 1HA GLY 71 1.378 6.287 2.685
537 H PHE 72 H PHE 72 -1.132 7.342 1.992
538 HA PHE 72 HA PHE 72 -2.922 4.993 2.241
539 HD1 PHE 72 HD1 PHE 72 -2.529 8.565 3.907
540 HD2 PHE 72 HD2 PHE 72 -5.554 5.563 3.849
541 HE1 PHE 72 HE1 PHE 72 -2.798 8.792 6.341
542 HE2 PHE 72 HE2 PHE 72 -5.826 5.790 6.284
543 HZ PHE 72 HZ PHE 72 -4.451 7.405 7.532
544 HB2 PHE 72 2HB PHE 72 -3.647 7.903 1.816
545 HB3 PHE 72 1HB PHE 72 -4.799 6.573 1.802
546 H ILE 73 H ILE 73 -3.750 4.062 0.413
547 HA ILE 73 HA ILE 73 -3.056 5.282 -2.193
548 HB ILE 73 HB ILE 73 -3.140 2.323 -1.537
549 HG12 ILE 73 2HG1 ILE 73 -0.776 4.128 -2.142
550 HG13 ILE 73 1HG1 ILE 73 -1.179 3.460 -0.566
551 HG21 ILE 73 1HG2 ILE 73 -2.252 2.003 -3.809
552 HG22 ILE 73 2HG2 ILE 73 -2.388 3.736 -4.103
553 HG23 ILE 73 3HG2 ILE 73 -3.839 2.770 -3.833
554 HD11 ILE 73 3HD1 ILE 73 -0.348 1.907 -3.004
555 HD12 ILE 73 1HD1 ILE 73 -0.823 1.196 -1.461
556 HD13 ILE 73 2HD1 ILE 73 0.616 2.211 -1.561
557 H THR 74 H THR 74 -4.594 5.165 -3.841
558 HA THR 74 HA THR 74 -7.309 4.294 -3.014
559 HB THR 74 HB THR 74 -6.664 6.466 -5.034
560 HG1 THR 74 HG1 THR 74 -6.213 7.551 -3.255
561 HG21 THR 74 3HG2 THR 74 -8.848 5.389 -5.354
562 HG22 THR 74 1HG2 THR 74 -9.040 7.046 -4.781
563 HG23 THR 74 2HG2 THR 74 -9.256 5.696 -3.665
564 H PHE 75 H PHE 75 -8.385 2.873 -4.272
565 HA PHE 75 HA PHE 75 -7.405 2.343 -7.014
566 HD1 PHE 75 HD1 PHE 75 -5.938 -0.211 -7.626
567 HD2 PHE 75 HD2 PHE 75 -6.488 0.624 -3.482
568 HE1 PHE 75 HE1 PHE 75 -3.588 -0.780 -7.201
569 HE2 PHE 75 HE2 PHE 75 -4.131 0.058 -3.057
570 HZ PHE 75 HZ PHE 75 -2.681 -0.644 -4.917
571 HB2 PHE 75 2HB PHE 75 -8.385 0.336 -4.962
572 HB3 PHE 75 1HB PHE 75 -8.160 -0.040 -6.665
573 H SER 76 H SER 76 -8.971 1.935 -8.597
574 HA SER 76 HA SER 76 -11.737 2.632 -7.921
575 HG SER 76 HG SER 76 -10.399 4.400 -10.676
576 HB2 SER 76 2HB SER 76 -10.324 2.258 -10.576
577 HB3 SER 76 1HB SER 76 -12.056 2.572 -10.435
578 H ASP 77 H ASP 77 -10.216 -0.066 -7.508
579 HA ASP 77 HA ASP 77 -12.495 -1.732 -8.277
580 HB2 ASP 77 2HB ASP 77 -10.722 -1.911 -10.056
581 HB3 ASP 77 1HB ASP 77 -9.634 -2.561 -8.833
582 H SER 78 H SER 78 -13.191 -2.456 -6.356
583 HA SER 78 HA SER 78 -11.613 -2.551 -4.013
584 HG SER 78 HG SER 78 -14.226 -1.545 -3.082
585 HB2 SER 78 2HB SER 78 -14.288 -3.880 -4.509
586 HB3 SER 78 1HB SER 78 -13.572 -3.543 -2.934
587 H GLU 79 H GLU 79 -12.359 -5.035 -6.393
588 HA GLU 79 HA GLU 79 -11.824 -7.294 -4.764
589 HB2 GLU 79 2HB GLU 79 -11.571 -7.085 -7.776
590 HB3 GLU 79 1HB GLU 79 -11.725 -8.569 -6.845
591 HG2 GLU 79 2HG GLU 79 -13.972 -7.775 -6.092
592 HG3 GLU 79 1HG GLU 79 -13.807 -6.421 -7.210
593 H CYS 80 H CYS 80 -9.795 -5.826 -7.329
594 HA CYS 80 HA CYS 80 -7.457 -7.276 -6.813
595 HG CYS 80 HG CYS 80 -9.084 -3.627 -7.653
596 HB2 CYS 80 2HB CYS 80 -6.269 -5.525 -8.034
597 HB3 CYS 80 1HB CYS 80 -7.794 -5.889 -8.832
598 H ALA 81 H ALA 81 -8.616 -4.247 -5.383
599 HA ALA 81 HA ALA 81 -6.344 -3.657 -3.826
600 HB1 ALA 81 3HB ALA 81 -7.823 -2.214 -2.521
601 HB2 ALA 81 1HB ALA 81 -9.232 -2.976 -3.263
602 HB3 ALA 81 2HB ALA 81 -8.119 -2.028 -4.250
603 H LYS 82 H LYS 82 -9.236 -5.611 -3.089
604 HA LYS 82 HA LYS 82 -8.629 -6.213 -0.410
605 HB2 LYS 82 2HB LYS 82 -10.825 -6.713 -1.378
606 HB3 LYS 82 1HB LYS 82 -10.102 -7.899 -2.459
607 HG2 LYS 82 2HG LYS 82 -9.380 -9.191 -0.433
608 HG3 LYS 82 1HG LYS 82 -10.317 -8.063 0.548
609 HD2 LYS 82 2HD LYS 82 -11.453 -9.767 -1.677
610 HD3 LYS 82 1HD LYS 82 -11.513 -10.184 0.034
611 HE2 LYS 82 2HE LYS 82 -12.808 -8.128 0.469
612 HE3 LYS 82 1HE LYS 82 -12.783 -7.765 -1.257
613 HZ1 LYS 82 3HZ LYS 82 -14.013 -10.162 -0.009
614 HZ2 LYS 82 1HZ LYS 82 -13.975 -9.833 -1.667
615 HZ3 LYS 82 2HZ LYS 82 -14.850 -8.831 -0.623
616 H LYS 83 H LYS 83 -7.734 -7.873 -3.416
617 HA LYS 83 HA LYS 83 -6.321 -10.013 -2.224
618 HB2 LYS 83 2HB LYS 83 -7.097 -10.057 -4.565
619 HB3 LYS 83 1HB LYS 83 -5.944 -8.789 -4.970
620 HG2 LYS 83 2HG LYS 83 -4.093 -10.275 -4.387
621 HG3 LYS 83 1HG LYS 83 -5.243 -11.542 -3.957
622 HD2 LYS 83 2HD LYS 83 -6.071 -11.529 -6.294
623 HD3 LYS 83 1HD LYS 83 -4.842 -10.325 -6.696
624 HE2 LYS 83 2HE LYS 83 -4.060 -12.525 -7.336
625 HE3 LYS 83 1HE LYS 83 -3.089 -11.920 -5.994
626 HZ1 LYS 83 3HZ LYS 83 -4.499 -13.268 -4.493
627 HZ2 LYS 83 1HZ LYS 83 -3.632 -14.200 -5.605
628 HZ3 LYS 83 2HZ LYS 83 -5.278 -13.920 -5.845
629 H ALA 84 H ALA 84 -5.173 -6.909 -3.568
630 HA ALA 84 HA ALA 84 -2.451 -7.156 -3.119
631 HB1 ALA 84 3HB ALA 84 -4.125 -4.661 -2.786
632 HB2 ALA 84 1HB ALA 84 -3.462 -5.265 -4.305
633 HB3 ALA 84 2HB ALA 84 -2.379 -4.712 -3.028
634 H LEU 85 H LEU 85 -4.876 -5.799 -0.892
635 HA LEU 85 HA LEU 85 -3.260 -5.407 1.337
636 HG LEU 85 HG LEU 85 -4.610 -5.018 3.503
637 HB2 LEU 85 2HB LEU 85 -5.570 -4.590 1.103
638 HB3 LEU 85 1HB LEU 85 -6.171 -6.228 1.224
639 HD11 LEU 85 1HD1 LEU 85 -7.568 -4.689 2.988
640 HD12 LEU 85 2HD1 LEU 85 -6.356 -3.407 2.989
641 HD13 LEU 85 3HD1 LEU 85 -6.730 -4.267 4.482
642 HD21 LEU 85 3HD2 LEU 85 -5.994 -6.552 4.840
643 HD22 LEU 85 1HD2 LEU 85 -5.062 -7.413 3.617
644 HD23 LEU 85 2HD2 LEU 85 -6.782 -7.120 3.368
645 H GLU 86 H GLU 86 -5.193 -8.287 0.505
646 HA GLU 86 HA GLU 86 -4.582 -9.751 2.825
647 HB2 GLU 86 2HB GLU 86 -6.485 -10.130 1.198
648 HB3 GLU 86 1HB GLU 86 -5.326 -10.922 0.138
649 HG2 GLU 86 2HG GLU 86 -6.582 -12.553 1.408
650 HG3 GLU 86 1HG GLU 86 -4.881 -12.591 1.875
651 H GLN 87 H GLN 87 -2.780 -9.405 -0.175
652 HA GLN 87 HA GLN 87 -1.065 -11.694 0.430
653 HB2 GLN 87 2HB GLN 87 -1.576 -10.007 -1.940
654 HB3 GLN 87 1HB GLN 87 0.104 -10.468 -1.736
655 HG2 GLN 87 2HG GLN 87 -0.688 -12.147 -3.077
656 HG3 GLN 87 1HG GLN 87 -0.823 -12.873 -1.482
657 HE21 GLN 87 1HE2 GLN 87 -3.260 -11.322 -0.830
658 HE22 GLN 87 2HE2 GLN 87 -4.523 -12.045 -1.746
659 H LEU 88 H LEU 88 -0.901 -8.168 0.442
660 HA LEU 88 HA LEU 88 1.983 -8.230 0.883
661 HG LEU 88 HG LEU 88 0.193 -7.203 -1.518
662 HB2 LEU 88 2HB LEU 88 0.144 -5.858 0.557
663 HB3 LEU 88 1HB LEU 88 1.896 -5.817 0.562
664 HD11 LEU 88 1HD1 LEU 88 0.033 -4.782 -1.685
665 HD12 LEU 88 2HD1 LEU 88 0.956 -5.446 -3.032
666 HD13 LEU 88 3HD1 LEU 88 1.793 -4.651 -1.696
667 HD21 LEU 88 3HD2 LEU 88 3.183 -6.824 -1.366
668 HD22 LEU 88 1HD2 LEU 88 2.301 -7.494 -2.739
669 HD23 LEU 88 2HD2 LEU 88 2.313 -8.347 -1.196
670 H ASN 89 H ASN 89 -0.906 -7.746 2.771
671 HA ASN 89 HA ASN 89 0.316 -6.255 4.872
672 HB2 ASN 89 2HB ASN 89 -2.154 -6.363 4.472
673 HB3 ASN 89 1HB ASN 89 -2.139 -8.020 5.065
674 HD21 ASN 89 1HD2 ASN 89 -3.625 -7.262 6.670
675 HD22 ASN 89 2HD2 ASN 89 -3.044 -6.431 8.061
676 H GLY 90 H GLY 90 2.074 -7.067 5.848
677 HA2 GLY 90 2HA GLY 90 2.837 -8.614 7.620
678 HA3 GLY 90 1HA GLY 90 2.033 -9.901 6.731
679 H PHE 91 H PHE 91 3.089 -8.371 4.232
680 HA PHE 91 HA PHE 91 5.410 -9.971 3.797
681 HD1 PHE 91 HD2 PHE 91 5.706 -10.831 1.043
682 HD2 PHE 91 HD1 PHE 91 6.225 -6.608 1.323
683 HE1 PHE 91 HE2 PHE 91 7.572 -10.956 -0.551
684 HE2 PHE 91 HE1 PHE 91 8.094 -6.735 -0.276
685 HZ PHE 91 HZ PHE 91 8.767 -8.908 -1.213
686 HB2 PHE 91 2HB PHE 91 3.935 -9.346 1.954
687 HB3 PHE 91 1HB PHE 91 4.267 -7.641 2.227
688 H GLU 92 H GLU 92 7.492 -9.525 4.289
689 HA GLU 92 HA GLU 92 8.102 -7.073 5.663
690 HB2 GLU 92 2HB GLU 92 9.826 -9.448 4.957
691 HB3 GLU 92 1HB GLU 92 10.383 -8.073 5.903
692 HG2 GLU 92 2HG GLU 92 8.573 -8.553 7.550
693 HG3 GLU 92 1HG GLU 92 8.195 -10.012 6.637
694 H LEU 93 H LEU 93 7.921 -5.435 4.157
695 HA LEU 93 HA LEU 93 9.532 -5.423 1.755
696 HG LEU 93 HG LEU 93 9.613 -2.310 1.477
697 HB2 LEU 93 2HB LEU 93 7.352 -4.298 1.809
698 HB3 LEU 93 1HB LEU 93 7.929 -3.217 3.067
699 HD11 LEU 93 1HD1 LEU 93 9.381 -2.796 -0.917
700 HD12 LEU 93 2HD1 LEU 93 8.184 -4.038 -0.544
701 HD13 LEU 93 3HD1 LEU 93 9.849 -4.223 0.008
702 HD21 LEU 93 3HD2 LEU 93 6.743 -2.144 0.531
703 HD22 LEU 93 1HD2 LEU 93 8.029 -1.003 0.133
704 HD23 LEU 93 2HD2 LEU 93 7.477 -1.162 1.798
705 H ALA 94 H ALA 94 11.507 -4.525 1.480
706 HA ALA 94 HA ALA 94 13.567 -3.705 1.978
707 HB1 ALA 94 3HB ALA 94 12.092 -1.945 3.944
708 HB2 ALA 94 1HB ALA 94 12.363 -1.579 2.240
709 HB3 ALA 94 2HB ALA 94 13.732 -1.690 3.345
710 H GLY 95 H GLY 95 12.424 -5.987 3.493
711 HA2 GLY 95 2HA GLY 95 13.268 -7.462 5.059
712 HA3 GLY 95 1HA GLY 95 14.545 -6.305 5.405
713 H ARG 96 H ARG 96 11.115 -5.535 5.639
714 HA ARG 96 HA ARG 96 10.970 -6.035 8.477
715 HE ARG 96 HE ARG 96 10.963 -3.007 12.154
716 HB2 ARG 96 2HB ARG 96 12.246 -3.808 8.136
717 HB3 ARG 96 1HB ARG 96 10.697 -3.147 7.638
718 HG2 ARG 96 2HG ARG 96 9.737 -3.661 9.803
719 HG3 ARG 96 1HG ARG 96 11.234 -4.447 10.305
720 HD2 ARG 96 2HD ARG 96 12.385 -2.224 9.932
721 HD3 ARG 96 1HD ARG 96 10.779 -1.512 9.751
722 HH11 ARG 96 1HH1 ARG 96 11.871 0.020 10.781
723 HH12 ARG 96 2HH1 ARG 96 12.065 0.782 12.318
724 HH21 ARG 96 1HH2 ARG 96 11.220 -2.033 14.109
725 HH22 ARG 96 2HH2 ARG 96 11.691 -0.372 14.198
726 HA PRO 97 HA PRO 97 6.867 -7.040 7.265
727 HB2 PRO 97 2HB PRO 97 6.119 -5.977 9.964
728 HB3 PRO 97 1HB PRO 97 5.696 -7.516 9.201
729 HG2 PRO 97 2HG PRO 97 7.584 -7.434 11.060
730 HG3 PRO 97 1HG PRO 97 7.794 -8.444 9.616
731 HD2 PRO 97 2HD PRO 97 9.049 -5.811 10.289
732 HD3 PRO 97 1HD PRO 97 9.742 -7.208 9.437
733 H MET 98 H MET 98 5.489 -6.004 5.973
734 HA MET 98 HA MET 98 4.954 -3.146 6.372
735 HB2 MET 98 2HB MET 98 5.796 -3.786 4.178
736 HB3 MET 98 1HB MET 98 4.488 -4.946 3.986
737 HG2 MET 98 2HG MET 98 2.864 -3.190 3.843
738 HG3 MET 98 1HG MET 98 4.072 -1.974 4.261
739 HE1 MET 98 3HE MET 98 4.138 -4.355 0.300
740 HE2 MET 98 1HE MET 98 2.967 -4.635 1.587
741 HE3 MET 98 2HE MET 98 4.665 -5.043 1.835
742 H LYS 99 H LYS 99 3.124 -2.563 7.356
743 HA LYS 99 HA LYS 99 0.912 -4.439 7.609
744 HB2 LYS 99 2HB LYS 99 1.207 -1.661 8.774
745 HB3 LYS 99 1HB LYS 99 0.008 -2.865 9.229
746 HG2 LYS 99 2HG LYS 99 1.747 -4.301 10.129
747 HG3 LYS 99 1HG LYS 99 2.987 -3.158 9.602
748 HD2 LYS 99 2HD LYS 99 1.966 -1.436 11.070
749 HD3 LYS 99 1HD LYS 99 0.820 -2.647 11.645
750 HE2 LYS 99 2HE LYS 99 2.625 -3.969 12.574
751 HE3 LYS 99 1HE LYS 99 3.823 -2.860 11.902
752 HZ1 LYS 99 3HZ LYS 99 3.449 -2.429 14.242
753 HZ2 LYS 99 1HZ LYS 99 1.798 -2.180 13.967
754 HZ3 LYS 99 2HZ LYS 99 2.933 -1.110 13.318
755 H VAL 100 H VAL 100 -0.387 -4.504 5.848
756 HA VAL 100 HA VAL 100 -1.348 -1.958 4.703
757 HB VAL 100 HB VAL 100 -1.610 -4.735 3.520
758 HG11 VAL 100 1HG1 VAL 100 -2.105 -1.998 2.322
759 HG12 VAL 100 2HG1 VAL 100 -3.336 -3.188 2.750
760 HG13 VAL 100 3HG1 VAL 100 -2.193 -3.530 1.451
761 HG21 VAL 100 3HG2 VAL 100 0.739 -4.109 3.618
762 HG22 VAL 100 1HG2 VAL 100 0.380 -2.549 2.875
763 HG23 VAL 100 2HG2 VAL 100 0.167 -4.036 1.950
764 H GLY 101 H GLY 101 -3.042 -1.380 5.996
765 HA2 GLY 101 2HA GLY 101 -5.215 -3.345 6.440
766 HA3 GLY 101 1HA GLY 101 -4.938 -1.908 7.416
767 H HIS 102 H HIS 102 -7.464 -2.511 6.276
768 HA HIS 102 HA HIS 102 -8.061 -1.269 3.860
769 HD1 HIS 102 HD1 HIS 102 -11.435 -2.695 3.573
770 HD2 HIS 102 HD2 HIS 102 -8.644 -4.151 6.281
771 HE1 HIS 102 HE1 HIS 102 -11.577 -5.195 3.407
772 HE2 HIS 102 HE2 HIS 102 -10.064 -6.035 5.232
773 HB2 HIS 102 2HB HIS 102 -9.721 -1.348 6.396
774 HB3 HIS 102 1HB HIS 102 -10.341 -0.871 4.820
775 H VAL 103 H VAL 103 -9.230 0.429 6.716
776 HA VAL 103 HA VAL 103 -7.421 2.696 6.243
777 HB VAL 103 HB VAL 103 -10.385 3.119 6.787
778 HG11 VAL 103 1HG1 VAL 103 -9.901 5.455 6.172
779 HG12 VAL 103 2HG1 VAL 103 -8.199 5.040 5.957
780 HG13 VAL 103 3HG1 VAL 103 -8.940 4.928 7.556
781 HG21 VAL 103 3HG2 VAL 103 -8.948 3.362 4.133
782 HG22 VAL 103 1HG2 VAL 103 -10.618 3.841 4.449
783 HG23 VAL 103 2HG2 VAL 103 -10.153 2.144 4.557
784 H THR 104 H THR 104 -6.884 0.886 8.101
785 HA THR 104 HA THR 104 -6.664 0.333 10.307
786 HB THR 104 HB THR 104 -7.860 3.024 11.053
787 HG1 THR 104 HG1 THR 104 -6.277 3.876 9.927
788 HG21 THR 104 3HG2 THR 104 -5.689 1.342 12.333
789 HG22 THR 104 1HG2 THR 104 -7.342 1.509 12.918
790 HG23 THR 104 2HG2 THR 104 -6.264 2.904 12.923
791 H GLU 105 H GLU 105 -8.220 0.460 12.533
792 HA GLU 105 HA GLU 105 -10.232 0.211 13.561
793 HB2 GLU 105 2HB GLU 105 -11.385 1.026 10.885
794 HB3 GLU 105 1HB GLU 105 -12.340 0.781 12.340
795 HG2 GLU 105 2HG GLU 105 -10.118 2.801 12.094
796 HG3 GLU 105 1HG GLU 105 -11.822 3.159 11.816
797 H ARG 106 H ARG 106 -11.330 -0.880 10.345
798 HA ARG 106 HA ARG 106 -12.354 -3.258 11.706
799 HE ARG 106 HE ARG 106 -16.644 -1.087 11.719
800 HB2 ARG 106 2HB ARG 106 -13.092 -1.947 9.097
801 HB3 ARG 106 1HB ARG 106 -13.732 -3.512 9.584
802 HG2 ARG 106 2HG ARG 106 -14.639 -2.456 11.633
803 HG3 ARG 106 1HG ARG 106 -14.083 -0.891 11.037
804 HD2 ARG 106 2HD ARG 106 -15.568 -0.976 9.180
805 HD3 ARG 106 1HD ARG 106 -15.953 -2.672 9.480
806 HH11 ARG 106 1HH1 ARG 106 -17.676 -1.799 8.517
807 HH12 ARG 106 2HH1 ARG 106 -19.346 -1.540 8.875
808 HH21 ARG 106 1HH2 ARG 106 -18.780 -0.743 12.179
809 HH22 ARG 106 2HH2 ARG 106 -19.963 -0.928 10.933
810 H THR 107 H THR 107 -10.708 -4.711 11.773
811 HA THR 107 HA THR 107 -10.117 -5.982 9.167
812 HB THR 107 HB THR 107 -8.369 -6.086 11.649
813 HG1 THR 107 HG1 THR 107 -7.831 -4.188 10.763
814 HG21 THR 107 3HG2 THR 107 -7.992 -7.301 8.904
815 HG22 THR 107 1HG2 THR 107 -8.252 -8.176 10.412
816 HG23 THR 107 2HG2 THR 107 -6.762 -7.263 10.168
817 H ASP 108 H ASP 108 -10.174 -6.780 12.657
818 HA ASP 108 HA ASP 108 -11.993 -9.013 12.046
819 HB2 ASP 108 2HB ASP 108 -10.807 -10.342 13.849
820 HB3 ASP 108 1HB ASP 108 -9.913 -10.108 12.355
Start of MODEL 14
1 HA MET 1 HA MET 1 -35.254 -10.229 -10.057
2 H1 MET 1 1H MET 1 -37.232 -9.655 -8.785
3 H2 MET 1 2H MET 1 -37.387 -9.238 -10.417
4 H3 MET 1 3H MET 1 -37.085 -8.037 -9.265
5 HB2 MET 1 2HB MET 1 -35.462 -8.406 -11.713
6 HB3 MET 1 1HB MET 1 -35.055 -7.230 -10.471
7 HG2 MET 1 2HG MET 1 -32.842 -8.250 -10.229
8 HG3 MET 1 1HG MET 1 -33.252 -9.425 -11.481
9 HE1 MET 1 3HE MET 1 -30.651 -7.111 -13.292
10 HE2 MET 1 1HE MET 1 -31.032 -8.753 -12.774
11 HE3 MET 1 2HE MET 1 -30.632 -7.520 -11.576
12 H GLY 2 H GLY 2 -34.358 -10.967 -8.215
13 HA2 GLY 2 2HA GLY 2 -33.957 -9.441 -5.854
14 HA3 GLY 2 1HA GLY 2 -33.240 -11.004 -6.205
15 H HIS 3 H HIS 3 -32.895 -7.536 -6.745
16 HA HIS 3 HA HIS 3 -30.282 -7.720 -7.904
17 HD1 HIS 3 HD1 HIS 3 -33.972 -5.561 -7.697
18 HD2 HIS 3 HD2 HIS 3 -31.083 -4.155 -5.060
19 HE1 HIS 3 HE1 HIS 3 -35.224 -4.274 -5.952
20 HE2 HIS 3 HE2 HIS 3 -33.445 -3.256 -4.502
21 HB2 HIS 3 2HB HIS 3 -30.285 -5.205 -7.585
22 HB3 HIS 3 1HB HIS 3 -31.596 -5.856 -8.557
23 H HIS 4 H HIS 4 -28.327 -7.676 -6.978
24 HA HIS 4 HA HIS 4 -28.149 -7.146 -4.083
25 HD1 HIS 4 HD1 HIS 4 -24.770 -9.733 -5.859
26 HD2 HIS 4 HD2 HIS 4 -28.749 -10.341 -6.878
27 HE1 HIS 4 HE1 HIS 4 -24.722 -11.101 -7.960
28 HE2 HIS 4 HE2 HIS 4 -27.135 -11.631 -8.433
29 HB2 HIS 4 2HB HIS 4 -26.351 -8.975 -4.058
30 HB3 HIS 4 1HB HIS 4 -28.025 -9.495 -4.196
31 H HIS 5 H HIS 5 -27.337 -5.076 -4.346
32 HA HIS 5 HA HIS 5 -24.730 -4.795 -5.694
33 HD1 HIS 5 HD1 HIS 5 -25.342 -1.678 -7.806
34 HD2 HIS 5 HD2 HIS 5 -28.238 -4.469 -6.737
35 HE1 HIS 5 HE1 HIS 5 -26.729 -2.041 -9.869
36 HE2 HIS 5 HE2 HIS 5 -28.430 -3.778 -9.223
37 HB2 HIS 5 2HB HIS 5 -26.701 -2.707 -4.724
38 HB3 HIS 5 1HB HIS 5 -25.134 -2.334 -5.431
39 H HIS 6 H HIS 6 -23.004 -3.608 -4.557
40 HA HIS 6 HA HIS 6 -22.754 -4.767 -1.922
41 HD1 HIS 6 HD1 HIS 6 -18.987 -2.266 -2.125
42 HD2 HIS 6 HD2 HIS 6 -20.438 -5.877 -0.666
43 HE1 HIS 6 HE1 HIS 6 -17.609 -2.772 -0.090
44 HE2 HIS 6 HE2 HIS 6 -18.621 -4.864 0.869
45 HB2 HIS 6 2HB HIS 6 -20.911 -4.943 -3.505
46 HB3 HIS 6 1HB HIS 6 -20.775 -3.189 -3.578
47 H HIS 7 H HIS 7 -23.605 -1.606 -3.033
48 HA HIS 7 HA HIS 7 -22.358 -0.074 -1.020
49 HD1 HIS 7 HD1 HIS 7 -24.696 -0.069 -4.740
50 HD2 HIS 7 HD2 HIS 7 -26.717 1.291 -1.376
51 HE1 HIS 7 HE1 HIS 7 -27.129 -0.158 -5.334
52 HE2 HIS 7 HE2 HIS 7 -28.309 0.840 -3.356
53 HB2 HIS 7 2HB HIS 7 -23.923 1.740 -1.606
54 HB3 HIS 7 1HB HIS 7 -23.169 1.016 -3.017
55 H HIS 8 H HIS 8 -22.599 -1.002 0.982
56 HA HIS 8 HA HIS 8 -25.109 -0.325 2.339
57 HD1 HIS 8 HD1 HIS 8 -24.677 -4.315 0.523
58 HD2 HIS 8 HD2 HIS 8 -27.558 -1.813 2.176
59 HE1 HIS 8 HE1 HIS 8 -26.788 -4.785 -0.748
60 HE2 HIS 8 HE2 HIS 8 -28.459 -3.139 0.144
61 HB2 HIS 8 2HB HIS 8 -23.802 -3.056 2.471
62 HB3 HIS 8 1HB HIS 8 -25.027 -2.504 3.607
63 H SER 9 H SER 9 -22.168 0.552 2.222
64 HA SER 9 HA SER 9 -21.112 -0.172 4.834
65 HG SER 9 HG SER 9 -19.647 -0.158 1.743
66 HB2 SER 9 2HB SER 9 -19.966 1.680 2.724
67 HB3 SER 9 1HB SER 9 -19.115 1.075 4.143
68 H HIS 10 H HIS 10 -23.526 1.702 4.426
69 HA HIS 10 HA HIS 10 -24.482 3.350 5.663
70 HD1 HIS 10 HD1 HIS 10 -24.755 3.196 9.225
71 HD2 HIS 10 HD2 HIS 10 -22.769 6.386 7.448
72 HE1 HIS 10 HE1 HIS 10 -25.503 5.235 10.480
73 HE2 HIS 10 HE2 HIS 10 -24.411 7.159 9.288
74 HB2 HIS 10 2HB HIS 10 -23.109 2.433 7.538
75 HB3 HIS 10 1HB HIS 10 -21.840 3.577 7.128
76 H MET 11 H MET 11 -21.109 4.219 4.808
77 HA MET 11 HA MET 11 -21.472 6.985 4.627
78 HB2 MET 11 2HB MET 11 -19.521 5.195 3.164
79 HB3 MET 11 1HB MET 11 -19.432 6.949 3.171
80 HG2 MET 11 2HG MET 11 -19.151 6.911 5.612
81 HG3 MET 11 1HG MET 11 -19.198 5.148 5.577
82 HE1 MET 11 3HE MET 11 -16.871 5.118 6.901
83 HE2 MET 11 1HE MET 11 -16.814 6.880 6.887
84 HE3 MET 11 2HE MET 11 -15.419 5.949 6.341
85 H ALA 12 H ALA 12 -22.808 8.062 3.375
86 HA ALA 12 HA ALA 12 -22.856 7.647 0.505
87 HB1 ALA 12 3HB ALA 12 -24.574 6.067 1.252
88 HB2 ALA 12 1HB ALA 12 -25.294 7.409 0.360
89 HB3 ALA 12 2HB ALA 12 -25.398 7.362 2.120
90 H ALA 13 H ALA 13 -24.871 9.265 -0.266
91 HA ALA 13 HA ALA 13 -24.025 11.875 0.682
92 HB1 ALA 13 3HB ALA 13 -24.336 11.482 -1.717
93 HB2 ALA 13 1HB ALA 13 -25.395 12.764 -1.129
94 HB3 ALA 13 2HB ALA 13 -26.049 11.157 -1.445
95 H ALA 14 H ALA 14 -24.864 11.493 2.866
96 HA ALA 14 HA ALA 14 -27.430 10.902 3.629
97 HB1 ALA 14 3HB ALA 14 -25.529 11.120 5.165
98 HB2 ALA 14 1HB ALA 14 -26.956 11.978 5.743
99 HB3 ALA 14 2HB ALA 14 -25.621 12.875 5.016
100 H MET 15 H MET 15 -26.222 14.176 2.861
101 HA MET 15 HA MET 15 -28.573 15.558 3.570
102 HB2 MET 15 2HB MET 15 -26.359 16.638 3.223
103 HB3 MET 15 1HB MET 15 -26.519 16.359 1.494
104 HG2 MET 15 2HG MET 15 -28.472 17.806 1.422
105 HG3 MET 15 1HG MET 15 -28.371 18.053 3.165
106 HE1 MET 15 3HE MET 15 -28.534 20.495 1.156
107 HE2 MET 15 1HE MET 15 -27.299 21.555 1.834
108 HE3 MET 15 2HE MET 15 -28.379 20.662 2.907
109 H ALA 16 H ALA 16 -27.455 14.480 0.371
110 HA ALA 16 HA ALA 16 -30.051 13.768 -0.529
111 HB1 ALA 16 3HB ALA 16 -30.343 16.209 -0.664
112 HB2 ALA 16 1HB ALA 16 -30.400 15.456 -2.259
113 HB3 ALA 16 2HB ALA 16 -28.949 16.314 -1.741
114 H ASN 17 H ASN 17 -27.659 15.345 -2.595
115 HA ASN 17 HA ASN 17 -26.076 13.032 -3.095
116 HB2 ASN 17 2HB ASN 17 -28.188 12.473 -4.378
117 HB3 ASN 17 1HB ASN 17 -27.863 13.875 -5.395
118 HD21 ASN 17 1HD2 ASN 17 -26.856 10.665 -4.538
119 HD22 ASN 17 2HD2 ASN 17 -25.792 10.429 -5.878
120 H ASN 18 H ASN 18 -27.132 15.549 -5.363
121 HA ASN 18 HA ASN 18 -26.178 17.410 -6.217
122 HB2 ASN 18 2HB ASN 18 -24.612 17.465 -3.625
123 HB3 ASN 18 1HB ASN 18 -24.852 18.822 -4.721
124 HD21 ASN 18 1HD2 ASN 18 -25.873 20.090 -3.208
125 HD22 ASN 18 2HD2 ASN 18 -27.455 19.747 -2.611
126 H LEU 19 H LEU 19 -23.324 16.222 -4.447
127 HA LEU 19 HA LEU 19 -21.701 16.644 -6.835
128 HG LEU 19 HG LEU 19 -21.883 18.087 -3.961
129 HB2 LEU 19 2HB LEU 19 -20.836 15.852 -4.046
130 HB3 LEU 19 1HB LEU 19 -19.792 16.394 -5.347
131 HD11 LEU 19 1HD1 LEU 19 -19.975 17.597 -2.514
132 HD12 LEU 19 2HD1 LEU 19 -19.991 19.291 -2.999
133 HD13 LEU 19 3HD1 LEU 19 -18.869 18.168 -3.766
134 HD21 LEU 19 3HD2 LEU 19 -20.899 19.951 -5.214
135 HD22 LEU 19 1HD2 LEU 19 -21.597 18.741 -6.291
136 HD23 LEU 19 2HD2 LEU 19 -19.848 18.822 -6.071
137 H GLN 20 H GLN 20 -22.313 14.853 -8.133
138 HA GLN 20 HA GLN 20 -21.978 12.172 -7.076
139 HB2 GLN 20 2HB GLN 20 -23.828 12.616 -8.613
140 HB3 GLN 20 1HB GLN 20 -22.694 13.095 -9.869
141 HG2 GLN 20 2HG GLN 20 -21.762 10.815 -9.871
142 HG3 GLN 20 1HG GLN 20 -22.946 10.344 -8.655
143 HE21 GLN 20 1HE2 GLN 20 -23.849 8.788 -10.002
144 HE22 GLN 20 2HE2 GLN 20 -24.816 9.201 -11.370
145 H LYS 21 H LYS 21 -19.776 12.004 -6.621
146 HA LYS 21 HA LYS 21 -18.051 11.752 -9.005
147 HB2 LYS 21 2HB LYS 21 -17.358 12.258 -6.111
148 HB3 LYS 21 1HB LYS 21 -16.159 11.717 -7.278
149 HG2 LYS 21 2HG LYS 21 -16.637 13.728 -8.644
150 HG3 LYS 21 1HG LYS 21 -17.743 14.282 -7.385
151 HD2 LYS 21 2HD LYS 21 -15.938 14.402 -5.782
152 HD3 LYS 21 1HD LYS 21 -14.812 13.687 -6.937
153 HE2 LYS 21 2HE LYS 21 -16.201 16.350 -7.262
154 HE3 LYS 21 1HE LYS 21 -14.531 16.123 -6.746
155 HZ1 LYS 21 3HZ LYS 21 -14.520 16.621 -9.048
156 HZ2 LYS 21 1HZ LYS 21 -15.699 15.455 -9.386
157 HZ3 LYS 21 2HZ LYS 21 -14.153 14.978 -8.903
158 H GLY 22 H GLY 22 -18.813 10.204 -5.883
159 HA2 GLY 22 2HA GLY 22 -17.432 7.777 -6.448
160 HA3 GLY 22 1HA GLY 22 -18.608 8.026 -5.172
161 H SER 23 H SER 23 -18.334 7.413 -8.663
162 HA SER 23 HA SER 23 -21.008 6.541 -9.038
163 HG SER 23 HG SER 23 -20.953 5.916 -11.909
164 HB2 SER 23 2HB SER 23 -19.584 7.187 -10.934
165 HB3 SER 23 1HB SER 23 -18.527 5.810 -10.624
166 H ALA 24 H ALA 24 -18.049 4.555 -8.905
167 HA ALA 24 HA ALA 24 -19.624 2.266 -7.983
168 HB1 ALA 24 3HB ALA 24 -18.010 1.882 -9.778
169 HB2 ALA 24 1HB ALA 24 -17.587 0.958 -8.336
170 HB3 ALA 24 2HB ALA 24 -16.702 2.433 -8.731
171 H GLY 25 H GLY 25 -16.363 3.369 -7.027
172 HA2 GLY 25 2HA GLY 25 -16.684 4.353 -4.545
173 HA3 GLY 25 1HA GLY 25 -16.902 2.633 -4.267
174 HA PRO 26 HA PRO 26 -12.240 3.577 -5.484
175 HB2 PRO 26 2HB PRO 26 -11.366 5.866 -4.257
176 HB3 PRO 26 1HB PRO 26 -11.923 5.811 -5.933
177 HG2 PRO 26 2HG PRO 26 -13.408 6.658 -3.469
178 HG3 PRO 26 1HG PRO 26 -13.373 7.421 -5.072
179 HD2 PRO 26 2HD PRO 26 -15.430 5.861 -4.279
180 HD3 PRO 26 1HD PRO 26 -14.883 5.902 -5.968
181 H MET 27 H MET 27 -11.223 2.155 -4.176
182 HA MET 27 HA MET 27 -11.751 2.250 -1.283
183 HB2 MET 27 2HB MET 27 -12.210 0.145 -2.583
184 HB3 MET 27 1HB MET 27 -10.481 0.011 -2.883
185 HG2 MET 27 2HG MET 27 -11.166 -1.426 -1.050
186 HG3 MET 27 1HG MET 27 -10.074 -0.163 -0.481
187 HE1 MET 27 3HE MET 27 -12.530 -0.731 2.555
188 HE2 MET 27 1HE MET 27 -10.852 -0.785 2.014
189 HE3 MET 27 2HE MET 27 -12.010 -1.970 1.414
190 H ARG 28 H ARG 28 -10.183 2.710 0.167
191 HA ARG 28 HA ARG 28 -7.515 3.353 -0.917
192 HE ARG 28 HE ARG 28 -5.715 7.632 0.178
193 HB2 ARG 28 2HB ARG 28 -9.096 5.167 0.042
194 HB3 ARG 28 1HB ARG 28 -8.684 4.498 1.617
195 HG2 ARG 28 2HG ARG 28 -6.326 4.991 1.222
196 HG3 ARG 28 1HG ARG 28 -6.718 5.622 -0.381
197 HD2 ARG 28 2HD ARG 28 -8.303 7.229 0.860
198 HD3 ARG 28 1HD ARG 28 -7.420 6.764 2.313
199 HH11 ARG 28 1HH1 ARG 28 -7.644 8.682 2.831
200 HH12 ARG 28 2HH1 ARG 28 -6.826 10.198 2.974
201 HH21 ARG 28 1HH2 ARG 28 -4.663 9.559 0.372
202 HH22 ARG 28 2HH2 ARG 28 -5.142 10.685 1.594
203 H LEU 29 H LEU 29 -5.792 2.287 -0.142
204 HA LEU 29 HA LEU 29 -6.127 0.516 2.175
205 HG LEU 29 HG LEU 29 -6.047 -0.362 -0.870
206 HB2 LEU 29 2HB LEU 29 -3.983 0.580 0.046
207 HB3 LEU 29 1HB LEU 29 -4.031 -0.557 1.380
208 HD11 LEU 29 1HD1 LEU 29 -3.917 -1.338 -1.549
209 HD12 LEU 29 2HD1 LEU 29 -5.189 -2.558 -1.509
210 HD13 LEU 29 3HD1 LEU 29 -4.001 -2.482 -0.207
211 HD21 LEU 29 3HD2 LEU 29 -7.164 -1.000 1.195
212 HD22 LEU 29 1HD2 LEU 29 -5.951 -2.247 1.494
213 HD23 LEU 29 2HD2 LEU 29 -7.041 -2.386 0.113
214 H TYR 30 H TYR 30 -4.753 0.535 3.912
215 HA TYR 30 HA TYR 30 -3.095 2.944 4.257
216 HD1 TYR 30 HD1 TYR 30 -3.037 4.612 6.446
217 HD2 TYR 30 HD2 TYR 30 -3.228 0.685 8.071
218 HE1 TYR 30 HE1 TYR 30 -1.619 5.324 8.320
219 HE2 TYR 30 HE2 TYR 30 -1.805 1.386 9.949
220 HH TYR 30 HH TYR 30 -1.166 4.635 10.642
221 HB2 TYR 30 2HB TYR 30 -4.889 2.907 5.845
222 HB3 TYR 30 1HB TYR 30 -4.585 1.223 6.247
223 H VAL 31 H VAL 31 -1.050 2.408 3.753
224 HA VAL 31 HA VAL 31 0.119 -0.091 4.767
225 HB VAL 31 HB VAL 31 1.325 1.955 2.880
226 HG11 VAL 31 1HG1 VAL 31 3.004 0.624 4.069
227 HG12 VAL 31 2HG1 VAL 31 2.959 0.207 2.357
228 HG13 VAL 31 3HG1 VAL 31 2.209 -0.862 3.542
229 HG21 VAL 31 3HG2 VAL 31 -0.648 0.920 1.880
230 HG22 VAL 31 1HG2 VAL 31 -0.008 -0.684 2.245
231 HG23 VAL 31 2HG2 VAL 31 0.823 0.355 1.088
232 H GLY 32 H GLY 32 0.629 0.261 6.920
233 HA2 GLY 32 2HA GLY 32 2.208 2.700 7.532
234 HA3 GLY 32 1HA GLY 32 1.087 1.963 8.659
235 H SER 33 H SER 33 4.216 1.685 7.126
236 HA SER 33 HA SER 33 5.480 0.696 9.442
237 HG SER 33 HG SER 33 5.671 -2.206 6.752
238 HB2 SER 33 2HB SER 33 6.109 -1.579 8.690
239 HB3 SER 33 1HB SER 33 4.367 -1.426 8.909
240 H LEU 34 H LEU 34 5.809 2.687 7.354
241 HA LEU 34 HA LEU 34 8.043 1.827 5.688
242 HG LEU 34 HG LEU 34 4.987 3.117 5.287
243 HB2 LEU 34 2HB LEU 34 6.831 4.589 5.887
244 HB3 LEU 34 1HB LEU 34 7.811 3.944 4.581
245 HD11 LEU 34 1HD1 LEU 34 4.413 4.052 3.102
246 HD12 LEU 34 2HD1 LEU 34 6.085 4.567 2.877
247 HD13 LEU 34 3HD1 LEU 34 5.110 5.272 4.167
248 HD21 LEU 34 3HD2 LEU 34 6.802 2.058 3.116
249 HD22 LEU 34 1HD2 LEU 34 5.087 1.687 3.291
250 HD23 LEU 34 2HD2 LEU 34 6.229 1.173 4.530
251 H HIS 35 H HIS 35 10.175 2.307 6.041
252 HA HIS 35 HA HIS 35 10.829 3.392 8.650
253 HD1 HIS 35 HD1 HIS 35 14.567 3.477 6.380
254 HD2 HIS 35 HD2 HIS 35 11.817 0.627 5.121
255 HE1 HIS 35 HE1 HIS 35 15.277 2.835 4.060
256 HE2 HIS 35 HE2 HIS 35 13.709 0.995 3.394
257 HB2 HIS 35 2HB HIS 35 13.088 2.580 8.270
258 HB3 HIS 35 1HB HIS 35 11.923 1.325 7.875
259 H PHE 36 H PHE 36 9.918 5.528 7.722
260 HA PHE 36 HA PHE 36 10.237 7.719 7.214
261 HD1 PHE 36 HD2 PHE 36 10.011 9.052 8.946
262 HD2 PHE 36 HD1 PHE 36 13.260 6.679 10.363
263 HE1 PHE 36 HE2 PHE 36 9.201 9.319 11.252
264 HE2 PHE 36 HE1 PHE 36 12.451 6.949 12.668
265 HZ PHE 36 HZ PHE 36 10.417 8.267 13.116
266 HB2 PHE 36 2HB PHE 36 13.034 7.007 8.101
267 HB3 PHE 36 1HB PHE 36 12.537 8.655 7.741
268 H ASN 37 H ASN 37 11.206 5.528 5.065
269 HA ASN 37 HA ASN 37 11.678 7.490 3.032
270 HB2 ASN 37 2HB ASN 37 13.947 7.247 4.106
271 HB3 ASN 37 1HB ASN 37 13.958 5.570 3.567
272 HD21 ASN 37 1HD2 ASN 37 14.150 5.132 1.354
273 HD22 ASN 37 2HD2 ASN 37 14.675 6.335 0.227
274 H ILE 38 H ILE 38 9.635 6.083 2.732
275 HA ILE 38 HA ILE 38 10.360 4.190 0.584
276 HB ILE 38 HB ILE 38 7.962 3.938 2.427
277 HG12 ILE 38 2HG1 ILE 38 10.107 3.150 3.421
278 HG13 ILE 38 1HG1 ILE 38 8.961 1.839 3.171
279 HG21 ILE 38 1HG2 ILE 38 8.760 2.266 0.040
280 HG22 ILE 38 2HG2 ILE 38 7.362 3.334 0.152
281 HG23 ILE 38 3HG2 ILE 38 7.447 1.888 1.156
282 HD11 ILE 38 3HD1 ILE 38 11.230 1.186 2.578
283 HD12 ILE 38 1HD1 ILE 38 11.303 2.485 1.389
284 HD13 ILE 38 2HD1 ILE 38 10.167 1.152 1.172
285 H THR 39 H THR 39 9.710 4.945 -1.351
286 HA THR 39 HA THR 39 8.035 7.340 -1.389
287 HB THR 39 HB THR 39 8.874 7.802 -3.556
288 HG1 THR 39 HG1 THR 39 10.441 5.708 -4.127
289 HG21 THR 39 3HG2 THR 39 11.316 7.678 -3.293
290 HG22 THR 39 1HG2 THR 39 11.114 6.521 -1.978
291 HG23 THR 39 2HG2 THR 39 10.530 8.176 -1.794
292 H GLU 40 H GLU 40 6.467 7.663 -3.128
293 HA GLU 40 HA GLU 40 4.478 5.689 -3.238
294 HB2 GLU 40 2HB GLU 40 4.893 8.000 -5.150
295 HB3 GLU 40 1HB GLU 40 3.390 7.122 -4.897
296 HG2 GLU 40 2HG GLU 40 3.370 7.923 -2.550
297 HG3 GLU 40 1HG GLU 40 4.811 8.877 -2.897
298 H ASP 41 H ASP 41 7.215 6.288 -5.329
299 HA ASP 41 HA ASP 41 6.277 4.919 -7.629
300 HB2 ASP 41 2HB ASP 41 8.201 6.573 -7.522
301 HB3 ASP 41 1HB ASP 41 9.176 5.274 -6.837
302 H MET 42 H MET 42 8.421 3.860 -4.956
303 HA MET 42 HA MET 42 8.777 1.212 -5.862
304 HB2 MET 42 2HB MET 42 8.879 2.405 -3.086
305 HB3 MET 42 1HB MET 42 9.233 0.713 -3.399
306 HG2 MET 42 2HG MET 42 11.276 1.987 -3.242
307 HG3 MET 42 1HG MET 42 11.067 1.368 -4.878
308 HE1 MET 42 3HE MET 42 12.946 3.038 -5.745
309 HE2 MET 42 1HE MET 42 13.155 3.676 -4.114
310 HE3 MET 42 2HE MET 42 12.909 4.779 -5.468
311 H LEU 43 H LEU 43 6.439 2.570 -3.557
312 HA LEU 43 HA LEU 43 4.983 0.289 -2.937
313 HG LEU 43 HG LEU 43 5.797 2.753 -1.482
314 HB2 LEU 43 2HB LEU 43 4.036 3.142 -3.259
315 HB3 LEU 43 1HB LEU 43 3.091 1.868 -2.505
316 HD11 LEU 43 1HD1 LEU 43 4.556 3.959 0.261
317 HD12 LEU 43 2HD1 LEU 43 3.048 3.623 -0.591
318 HD13 LEU 43 3HD1 LEU 43 4.287 4.631 -1.346
319 HD21 LEU 43 3HD2 LEU 43 5.112 1.582 0.553
320 HD22 LEU 43 1HD2 LEU 43 5.125 0.490 -0.831
321 HD23 LEU 43 2HD2 LEU 43 3.594 1.114 -0.214
322 H ARG 44 H ARG 44 4.350 2.628 -5.570
323 HA ARG 44 HA ARG 44 2.128 1.441 -6.720
324 HE ARG 44 HE ARG 44 3.755 2.406 -11.527
325 HB2 ARG 44 2HB ARG 44 3.239 3.630 -7.370
326 HB3 ARG 44 1HB ARG 44 4.386 2.681 -8.306
327 HG2 ARG 44 2HG ARG 44 2.392 1.726 -9.535
328 HG3 ARG 44 1HG ARG 44 1.424 2.969 -8.751
329 HD2 ARG 44 2HD ARG 44 1.992 3.898 -10.828
330 HD3 ARG 44 1HD ARG 44 3.138 4.633 -9.701
331 HH11 ARG 44 1HH1 ARG 44 4.771 5.140 -9.692
332 HH12 ARG 44 2HH1 ARG 44 6.398 5.054 -10.273
333 HH21 ARG 44 1HH2 ARG 44 5.820 2.311 -12.268
334 HH22 ARG 44 2HH2 ARG 44 6.984 3.467 -11.718
335 H GLY 45 H GLY 45 5.552 0.869 -7.558
336 HA2 GLY 45 2HA GLY 45 5.200 -1.059 -9.528
337 HA3 GLY 45 1HA GLY 45 6.613 -0.940 -8.493
338 H ILE 46 H ILE 46 5.093 -1.481 -6.029
339 HA ILE 46 HA ILE 46 5.099 -4.365 -6.169
340 HB ILE 46 HB ILE 46 4.383 -2.525 -3.871
341 HG12 ILE 46 2HG1 ILE 46 6.957 -4.023 -4.462
342 HG13 ILE 46 1HG1 ILE 46 6.721 -2.291 -4.667
343 HG21 ILE 46 1HG2 ILE 46 4.729 -4.500 -2.438
344 HG22 ILE 46 2HG2 ILE 46 4.934 -5.496 -3.879
345 HG23 ILE 46 3HG2 ILE 46 3.383 -4.720 -3.558
346 HD11 ILE 46 3HD1 ILE 46 7.923 -2.768 -2.624
347 HD12 ILE 46 1HD1 ILE 46 6.608 -3.800 -2.063
348 HD13 ILE 46 2HD1 ILE 46 6.347 -2.066 -2.259
349 H PHE 47 H PHE 47 2.625 -1.849 -5.779
350 HA PHE 47 HA PHE 47 0.521 -3.773 -5.291
351 HD1 PHE 47 HD1 PHE 47 2.388 -1.431 -3.672
352 HD2 PHE 47 HD2 PHE 47 -1.819 -1.949 -3.255
353 HE1 PHE 47 HE1 PHE 47 2.634 -1.423 -1.225
354 HE2 PHE 47 HE2 PHE 47 -1.577 -1.943 -0.807
355 HZ PHE 47 HZ PHE 47 0.649 -1.679 0.211
356 HB2 PHE 47 2HB PHE 47 0.569 -0.771 -5.516
357 HB3 PHE 47 1HB PHE 47 -0.940 -1.663 -5.374
358 H GLU 48 H GLU 48 1.723 -2.070 -8.104
359 HA GLU 48 HA GLU 48 -0.547 -2.008 -9.703
360 HB2 GLU 48 2HB GLU 48 2.365 -2.245 -10.402
361 HB3 GLU 48 1HB GLU 48 1.134 -2.241 -11.657
362 HG2 GLU 48 2HG GLU 48 0.326 -0.057 -10.672
363 HG3 GLU 48 1HG GLU 48 1.799 -0.058 -9.703
364 HA PRO 49 HA PRO 49 0.806 -6.533 -11.411
365 HB2 PRO 49 2HB PRO 49 1.484 -7.504 -8.652
366 HB3 PRO 49 1HB PRO 49 2.097 -8.049 -10.219
367 HG2 PRO 49 2HG PRO 49 3.584 -6.457 -8.720
368 HG3 PRO 49 1HG PRO 49 3.484 -6.187 -10.472
369 HD2 PRO 49 2HD PRO 49 2.183 -4.674 -8.242
370 HD3 PRO 49 1HD PRO 49 2.840 -4.076 -9.779
371 H PHE 50 H PHE 50 -0.895 -5.606 -8.487
372 HA PHE 50 HA PHE 50 -2.672 -7.897 -8.543
373 HD1 PHE 50 HD2 PHE 50 -3.007 -8.839 -5.809
374 HD2 PHE 50 HD1 PHE 50 -0.516 -5.396 -6.127
375 HE1 PHE 50 HE2 PHE 50 -1.374 -9.881 -4.297
376 HE2 PHE 50 HE1 PHE 50 1.121 -6.441 -4.619
377 HZ PHE 50 HZ PHE 50 0.694 -8.687 -3.702
378 HB2 PHE 50 2HB PHE 50 -2.791 -5.339 -6.924
379 HB3 PHE 50 1HB PHE 50 -3.863 -6.720 -6.709
380 H GLY 51 H GLY 51 -2.823 -4.496 -9.470
381 HA2 GLY 51 2HA GLY 51 -4.843 -5.068 -11.454
382 HA3 GLY 51 1HA GLY 51 -5.434 -4.078 -10.124
383 H ARG 52 H ARG 52 -5.020 -1.928 -10.141
384 HA ARG 52 HA ARG 52 -2.603 -0.881 -11.268
385 HE ARG 52 HE ARG 52 -4.030 2.725 -12.529
386 HB2 ARG 52 2HB ARG 52 -4.465 -1.106 -13.175
387 HB3 ARG 52 1HB ARG 52 -5.024 0.405 -12.470
388 HG2 ARG 52 2HG ARG 52 -2.414 0.991 -12.719
389 HG3 ARG 52 1HG ARG 52 -2.571 -0.174 -14.033
390 HD2 ARG 52 2HD ARG 52 -2.972 1.950 -14.990
391 HD3 ARG 52 1HD ARG 52 -4.558 1.195 -14.822
392 HH11 ARG 52 1HH1 ARG 52 -4.720 3.148 -15.869
393 HH12 ARG 52 2HH1 ARG 52 -5.434 4.702 -15.636
394 HH21 ARG 52 1HH2 ARG 52 -4.920 4.716 -12.237
395 HH22 ARG 52 2HH2 ARG 52 -5.541 5.587 -13.595
396 H ILE 53 H ILE 53 -2.268 1.365 -10.698
397 HA ILE 53 HA ILE 53 -3.632 2.050 -8.230
398 HB ILE 53 HB ILE 53 -1.170 3.036 -9.625
399 HG12 ILE 53 2HG1 ILE 53 -0.151 2.606 -7.407
400 HG13 ILE 53 1HG1 ILE 53 -1.731 2.160 -6.775
401 HG21 ILE 53 1HG2 ILE 53 -2.304 5.104 -9.064
402 HG22 ILE 53 2HG2 ILE 53 -0.919 4.862 -7.999
403 HG23 ILE 53 3HG2 ILE 53 -2.551 4.550 -7.407
404 HD11 ILE 53 3HD1 ILE 53 -0.267 0.713 -8.970
405 HD12 ILE 53 1HD1 ILE 53 -1.807 0.245 -8.255
406 HD13 ILE 53 2HD1 ILE 53 -0.339 0.217 -7.279
407 H GLU 54 H GLU 54 -4.980 3.744 -7.859
408 HA GLU 54 HA GLU 54 -5.902 5.327 -10.154
409 HB2 GLU 54 2HB GLU 54 -7.479 4.094 -8.562
410 HB3 GLU 54 1HB GLU 54 -7.043 5.284 -7.349
411 HG2 GLU 54 2HG GLU 54 -8.262 6.000 -10.012
412 HG3 GLU 54 1HG GLU 54 -9.209 5.673 -8.566
413 H SER 55 H SER 55 -5.152 5.964 -6.704
414 HA SER 55 HA SER 55 -3.365 8.137 -7.465
415 HG SER 55 HG SER 55 -4.638 10.883 -6.169
416 HB2 SER 55 2HB SER 55 -5.499 9.316 -7.287
417 HB3 SER 55 1HB SER 55 -5.773 8.629 -5.687
418 H ILE 56 H ILE 56 -1.588 8.084 -6.201
419 HA ILE 56 HA ILE 56 -1.687 6.551 -3.684
420 HB ILE 56 HB ILE 56 0.756 7.508 -5.206
421 HG12 ILE 56 2HG1 ILE 56 -0.520 4.758 -5.120
422 HG13 ILE 56 1HG1 ILE 56 -0.555 5.856 -6.495
423 HG21 ILE 56 1HG2 ILE 56 1.197 7.166 -2.832
424 HG22 ILE 56 2HG2 ILE 56 1.977 5.905 -3.787
425 HG23 ILE 56 3HG2 ILE 56 0.485 5.554 -2.914
426 HD11 ILE 56 3HD1 ILE 56 1.889 4.554 -5.313
427 HD12 ILE 56 1HD1 ILE 56 1.891 5.699 -6.657
428 HD13 ILE 56 2HD1 ILE 56 1.097 4.134 -6.831
429 H GLN 57 H GLN 57 -0.843 7.386 -1.729
430 HA GLN 57 HA GLN 57 0.110 10.139 -1.643
431 HB2 GLN 57 2HB GLN 57 -2.333 10.350 -1.425
432 HB3 GLN 57 1HB GLN 57 -2.319 9.214 -0.089
433 HG2 GLN 57 2HG GLN 57 -2.553 11.542 0.655
434 HG3 GLN 57 1HG GLN 57 -1.098 10.778 1.291
435 HE21 GLN 57 1HE2 GLN 57 0.873 11.626 0.772
436 HE22 GLN 57 2HE2 GLN 57 1.086 13.052 -0.179
437 H LEU 58 H LEU 58 1.695 10.354 -0.150
438 HA LEU 58 HA LEU 58 2.093 8.196 1.802
439 HG LEU 58 HG LEU 58 3.853 8.776 -0.692
440 HB2 LEU 58 2HB LEU 58 3.857 10.535 1.035
441 HB3 LEU 58 1HB LEU 58 4.272 9.339 2.248
442 HD11 LEU 58 1HD1 LEU 58 6.400 8.811 0.930
443 HD12 LEU 58 2HD1 LEU 58 5.906 10.041 -0.235
444 HD13 LEU 58 3HD1 LEU 58 6.250 8.399 -0.780
445 HD21 LEU 58 3HD2 LEU 58 4.691 6.534 -0.178
446 HD22 LEU 58 1HD2 LEU 58 3.200 6.878 0.699
447 HD23 LEU 58 2HD2 LEU 58 4.752 6.944 1.536
448 H MET 59 H MET 59 2.081 8.519 4.021
449 HA MET 59 HA MET 59 0.738 10.955 4.932
450 HB2 MET 59 2HB MET 59 -0.158 8.730 5.593
451 HB3 MET 59 1HB MET 59 1.339 8.398 6.449
452 HG2 MET 59 2HG MET 59 -0.430 9.087 7.968
453 HG3 MET 59 1HG MET 59 0.903 10.243 7.971
454 HE1 MET 59 3HE MET 59 -0.823 11.916 9.240
455 HE2 MET 59 1HE MET 59 -2.126 10.737 9.079
456 HE3 MET 59 2HE MET 59 -2.372 12.401 8.551
457 H MET 60 H MET 60 2.339 12.480 4.989
458 HA MET 60 HA MET 60 4.744 11.893 6.593
459 HB2 MET 60 2HB MET 60 5.876 13.661 5.284
460 HB3 MET 60 1HB MET 60 5.301 12.339 4.277
461 HG2 MET 60 2HG MET 60 3.361 13.695 3.627
462 HG3 MET 60 1HG MET 60 3.971 15.024 4.612
463 HE1 MET 60 3HE MET 60 6.197 13.382 0.908
464 HE2 MET 60 1HE MET 60 4.656 12.740 1.473
465 HE3 MET 60 2HE MET 60 6.108 12.526 2.449
466 H ASP 61 H ASP 61 5.784 14.083 7.367
467 HA ASP 61 HA ASP 61 3.778 15.323 9.063
468 HB2 ASP 61 2HB ASP 61 5.708 16.246 10.286
469 HB3 ASP 61 1HB ASP 61 5.811 14.497 10.109
470 H SER 62 H SER 62 3.283 17.508 9.117
471 HA SER 62 HA SER 62 3.713 18.953 6.655
472 HG SER 62 HG SER 62 2.495 20.690 9.785
473 HB2 SER 62 2HB SER 62 2.214 20.655 7.652
474 HB3 SER 62 1HB SER 62 1.526 19.035 7.745
475 H GLU 63 H GLU 63 5.749 18.572 9.135
476 HA GLU 63 HA GLU 63 6.527 21.370 9.486
477 HB2 GLU 63 2HB GLU 63 7.684 18.845 10.696
478 HB3 GLU 63 1HB GLU 63 8.119 20.491 11.145
479 HG2 GLU 63 2HG GLU 63 5.894 20.895 11.983
480 HG3 GLU 63 1HG GLU 63 5.361 19.310 11.425
481 H THR 64 H THR 64 8.376 18.389 8.836
482 HA THR 64 HA THR 64 10.227 19.944 7.158
483 HB THR 64 HB THR 64 11.854 18.192 7.460
484 HG1 THR 64 HG1 THR 64 9.711 16.770 8.690
485 HG21 THR 64 3HG2 THR 64 10.479 18.803 10.085
486 HG22 THR 64 1HG2 THR 64 11.692 19.806 9.287
487 HG23 THR 64 2HG2 THR 64 12.134 18.215 9.907
488 H GLY 65 H GLY 65 7.648 17.779 6.877
489 HA2 GLY 65 2HA GLY 65 6.672 16.806 5.035
490 HA3 GLY 65 1HA GLY 65 7.806 17.709 4.044
491 H ARG 66 H ARG 66 8.190 15.078 6.443
492 HA ARG 66 HA ARG 66 9.848 13.673 4.434
493 HE ARG 66 HE ARG 66 13.104 16.409 7.846
494 HB2 ARG 66 2HB ARG 66 9.950 13.472 7.448
495 HB3 ARG 66 1HB ARG 66 10.954 12.548 6.335
496 HG2 ARG 66 2HG ARG 66 11.925 14.641 5.492
497 HG3 ARG 66 1HG ARG 66 10.944 15.547 6.644
498 HD2 ARG 66 2HD ARG 66 12.058 14.332 8.491
499 HD3 ARG 66 1HD ARG 66 13.080 13.515 7.307
500 HH11 ARG 66 1HH1 ARG 66 14.675 13.540 6.757
501 HH12 ARG 66 2HH1 ARG 66 16.206 14.323 6.581
502 HH21 ARG 66 1HH2 ARG 66 15.079 17.388 7.621
503 HH22 ARG 66 2HH2 ARG 66 16.436 16.461 7.083
504 H SER 67 H SER 67 8.303 12.437 7.388
505 HA SER 67 HA SER 67 6.228 11.004 6.182
506 HG SER 67 HG SER 67 6.685 8.127 5.247
507 HB2 SER 67 2HB SER 67 7.975 9.752 4.995
508 HB3 SER 67 1HB SER 67 8.724 9.318 6.530
509 H LYS 68 H LYS 68 4.904 10.149 7.681
510 HA LYS 68 HA LYS 68 5.797 9.891 10.448
511 HB2 LYS 68 2HB LYS 68 3.094 9.651 9.109
512 HB3 LYS 68 1HB LYS 68 3.346 9.264 10.806
513 HG2 LYS 68 2HG LYS 68 3.987 11.533 11.289
514 HG3 LYS 68 1HG LYS 68 3.947 11.951 9.574
515 HD2 LYS 68 2HD LYS 68 1.936 12.712 10.838
516 HD3 LYS 68 1HD LYS 68 1.563 11.643 9.486
517 HE2 LYS 68 2HE LYS 68 0.232 11.087 11.463
518 HE3 LYS 68 1HE LYS 68 1.304 9.763 11.022
519 HZ1 LYS 68 3HZ LYS 68 2.834 10.525 12.773
520 HZ2 LYS 68 1HZ LYS 68 1.323 10.079 13.386
521 HZ3 LYS 68 2HZ LYS 68 1.721 11.713 13.220
522 H GLY 69 H GLY 69 5.939 7.999 7.768
523 HA2 GLY 69 2HA GLY 69 6.745 5.787 7.726
524 HA3 GLY 69 1HA GLY 69 6.121 5.538 9.348
525 H TYR 70 H TYR 70 3.912 6.981 7.139
526 HA TYR 70 HA TYR 70 2.635 4.367 6.618
527 HD1 TYR 70 HD1 TYR 70 1.939 3.778 9.233
528 HD2 TYR 70 HD2 TYR 70 1.323 7.989 9.125
529 HE1 TYR 70 HE1 TYR 70 2.376 3.900 11.650
530 HE2 TYR 70 HE2 TYR 70 1.759 8.116 11.541
531 HH TYR 70 HH TYR 70 3.030 5.483 13.339
532 HB2 TYR 70 2HB TYR 70 0.934 6.770 7.208
533 HB3 TYR 70 1HB TYR 70 0.539 5.064 7.359
534 H GLY 71 H GLY 71 1.074 4.382 4.831
535 HA2 GLY 71 2HA GLY 71 1.104 6.707 3.051
536 HA3 GLY 71 1HA GLY 71 1.782 5.215 2.415
537 H PHE 72 H PHE 72 -0.769 6.946 1.930
538 HA PHE 72 HA PHE 72 -2.760 4.777 2.107
539 HD1 PHE 72 HD1 PHE 72 -1.995 8.253 3.876
540 HD2 PHE 72 HD2 PHE 72 -5.313 5.580 3.668
541 HE1 PHE 72 HE1 PHE 72 -2.285 8.427 6.309
542 HE2 PHE 72 HE2 PHE 72 -5.603 5.753 6.105
543 HZ PHE 72 HZ PHE 72 -4.092 7.180 7.428
544 HB2 PHE 72 2HB PHE 72 -3.119 7.764 1.749
545 HB3 PHE 72 1HB PHE 72 -4.435 6.600 1.674
546 H ILE 73 H ILE 73 -3.009 3.627 0.277
547 HA ILE 73 HA ILE 73 -2.615 4.987 -2.326
548 HB ILE 73 HB ILE 73 -2.433 2.020 -1.745
549 HG12 ILE 73 2HG1 ILE 73 -0.219 4.024 -2.273
550 HG13 ILE 73 1HG1 ILE 73 -0.611 3.345 -0.701
551 HG21 ILE 73 1HG2 ILE 73 -1.781 3.602 -4.240
552 HG22 ILE 73 2HG2 ILE 73 -3.126 2.480 -4.034
553 HG23 ILE 73 3HG2 ILE 73 -1.468 1.882 -4.010
554 HD11 ILE 73 3HD1 ILE 73 0.393 1.824 -3.094
555 HD12 ILE 73 1HD1 ILE 73 -0.042 1.109 -1.542
556 HD13 ILE 73 2HD1 ILE 73 1.310 2.238 -1.647
557 H THR 74 H THR 74 -4.339 5.263 -3.582
558 HA THR 74 HA THR 74 -6.873 3.961 -2.838
559 HB THR 74 HB THR 74 -6.419 6.387 -4.606
560 HG1 THR 74 HG1 THR 74 -6.077 7.192 -2.640
561 HG21 THR 74 3HG2 THR 74 -8.491 5.204 -5.174
562 HG22 THR 74 1HG2 THR 74 -8.846 6.738 -4.377
563 HG23 THR 74 2HG2 THR 74 -8.979 5.226 -3.478
564 H PHE 75 H PHE 75 -7.872 2.524 -4.115
565 HA PHE 75 HA PHE 75 -6.963 2.173 -6.910
566 HD1 PHE 75 HD2 PHE 75 -6.139 0.659 -3.451
567 HD2 PHE 75 HD1 PHE 75 -5.540 -0.698 -7.449
568 HE1 PHE 75 HE2 PHE 75 -3.816 0.079 -2.905
569 HE2 PHE 75 HE1 PHE 75 -3.213 -1.276 -6.902
570 HZ PHE 75 HZ PHE 75 -2.353 -0.888 -4.630
571 HB2 PHE 75 2HB PHE 75 -8.043 0.111 -4.969
572 HB3 PHE 75 1HB PHE 75 -7.733 -0.201 -6.673
573 H SER 76 H SER 76 -8.557 1.649 -8.507
574 HA SER 76 HA SER 76 -11.100 2.929 -8.104
575 HG SER 76 HG SER 76 -12.234 1.260 -10.573
576 HB2 SER 76 2HB SER 76 -10.078 3.083 -10.297
577 HB3 SER 76 1HB SER 76 -10.006 1.327 -10.435
578 H ASP 77 H ASP 77 -9.941 -0.382 -8.232
579 HA ASP 77 HA ASP 77 -12.670 -1.412 -7.904
580 HB2 ASP 77 2HB ASP 77 -11.332 -2.451 -9.661
581 HB3 ASP 77 1HB ASP 77 -10.075 -2.853 -8.498
582 H SER 78 H SER 78 -13.405 -1.969 -5.979
583 HA SER 78 HA SER 78 -11.953 -1.856 -3.582
584 HG SER 78 HG SER 78 -14.680 -1.084 -4.518
585 HB2 SER 78 2HB SER 78 -14.533 -3.335 -4.171
586 HB3 SER 78 1HB SER 78 -13.909 -2.998 -2.557
587 H GLU 79 H GLU 79 -12.622 -4.557 -5.753
588 HA GLU 79 HA GLU 79 -11.753 -6.579 -3.936
589 HB2 GLU 79 2HB GLU 79 -12.133 -6.664 -6.934
590 HB3 GLU 79 1HB GLU 79 -11.797 -8.071 -5.930
591 HG2 GLU 79 2HG GLU 79 -13.884 -7.515 -4.637
592 HG3 GLU 79 1HG GLU 79 -14.245 -6.317 -5.879
593 H CYS 80 H CYS 80 -10.164 -5.162 -6.841
594 HA CYS 80 HA CYS 80 -7.705 -6.439 -6.623
595 HG CYS 80 HG CYS 80 -9.443 -6.027 -8.969
596 HB2 CYS 80 2HB CYS 80 -8.283 -3.614 -7.543
597 HB3 CYS 80 1HB CYS 80 -6.733 -4.422 -7.757
598 H ALA 81 H ALA 81 -8.805 -3.481 -4.987
599 HA ALA 81 HA ALA 81 -6.447 -2.915 -3.567
600 HB1 ALA 81 3HB ALA 81 -9.305 -2.384 -2.740
601 HB2 ALA 81 1HB ALA 81 -8.308 -1.335 -3.749
602 HB3 ALA 81 2HB ALA 81 -7.870 -1.611 -2.064
603 H LYS 82 H LYS 82 -9.285 -4.873 -2.609
604 HA LYS 82 HA LYS 82 -8.308 -5.608 -0.073
605 HB2 LYS 82 2HB LYS 82 -10.679 -5.839 -0.761
606 HB3 LYS 82 1HB LYS 82 -10.223 -7.159 -1.829
607 HG2 LYS 82 2HG LYS 82 -9.499 -8.490 0.073
608 HG3 LYS 82 1HG LYS 82 -9.855 -7.155 1.166
609 HD2 LYS 82 2HD LYS 82 -11.677 -8.665 1.339
610 HD3 LYS 82 1HD LYS 82 -12.256 -7.299 0.387
611 HE2 LYS 82 2HE LYS 82 -11.247 -9.882 -0.811
612 HE3 LYS 82 1HE LYS 82 -12.943 -9.562 -0.461
613 HZ1 LYS 82 3HZ LYS 82 -12.497 -9.110 -2.750
614 HZ2 LYS 82 1HZ LYS 82 -11.225 -8.066 -2.359
615 HZ3 LYS 82 2HZ LYS 82 -12.816 -7.649 -1.969
616 H LYS 83 H LYS 83 -7.777 -7.028 -3.271
617 HA LYS 83 HA LYS 83 -6.502 -9.401 -2.348
618 HB2 LYS 83 2HB LYS 83 -7.358 -9.226 -4.647
619 HB3 LYS 83 1HB LYS 83 -6.174 -7.971 -5.002
620 HG2 LYS 83 2HG LYS 83 -4.359 -9.578 -4.600
621 HG3 LYS 83 1HG LYS 83 -5.553 -10.834 -4.270
622 HD2 LYS 83 2HD LYS 83 -6.400 -10.649 -6.553
623 HD3 LYS 83 1HD LYS 83 -5.255 -9.344 -6.884
624 HE2 LYS 83 2HE LYS 83 -4.411 -11.440 -7.781
625 HE3 LYS 83 1HE LYS 83 -3.391 -10.897 -6.452
626 HZ1 LYS 83 3HZ LYS 83 -5.473 -13.007 -6.312
627 HZ2 LYS 83 1HZ LYS 83 -4.565 -12.456 -4.995
628 HZ3 LYS 83 2HZ LYS 83 -3.800 -13.244 -6.277
629 H ALA 84 H ALA 84 -5.189 -6.289 -3.524
630 HA ALA 84 HA ALA 84 -2.484 -6.733 -3.093
631 HB1 ALA 84 3HB ALA 84 -4.024 -4.172 -2.642
632 HB2 ALA 84 1HB ALA 84 -3.335 -4.720 -4.171
633 HB3 ALA 84 2HB ALA 84 -2.273 -4.294 -2.827
634 H LEU 85 H LEU 85 -4.890 -5.497 -0.793
635 HA LEU 85 HA LEU 85 -3.310 -5.372 1.506
636 HG LEU 85 HG LEU 85 -4.770 -5.322 3.698
637 HB2 LEU 85 2HB LEU 85 -5.546 -4.422 1.364
638 HB3 LEU 85 1HB LEU 85 -6.251 -6.011 1.164
639 HD11 LEU 85 1HD1 LEU 85 -7.668 -4.712 3.107
640 HD12 LEU 85 2HD1 LEU 85 -6.385 -3.527 3.358
641 HD13 LEU 85 3HD1 LEU 85 -6.882 -4.580 4.682
642 HD21 LEU 85 3HD2 LEU 85 -6.346 -6.951 4.677
643 HD22 LEU 85 1HD2 LEU 85 -5.378 -7.665 3.387
644 HD23 LEU 85 2HD2 LEU 85 -7.054 -7.212 3.082
645 H GLU 86 H GLU 86 -5.348 -8.048 0.349
646 HA GLU 86 HA GLU 86 -4.952 -9.797 2.480
647 HB2 GLU 86 2HB GLU 86 -6.711 -9.942 0.689
648 HB3 GLU 86 1HB GLU 86 -5.480 -10.565 -0.400
649 HG2 GLU 86 2HG GLU 86 -6.683 -12.424 0.401
650 HG3 GLU 86 1HG GLU 86 -5.128 -12.446 1.228
651 H GLN 87 H GLN 87 -2.931 -9.225 -0.343
652 HA GLN 87 HA GLN 87 -1.294 -11.585 0.232
653 HB2 GLN 87 2HB GLN 87 -1.626 -9.776 -2.095
654 HB3 GLN 87 1HB GLN 87 -0.004 -10.392 -1.838
655 HG2 GLN 87 2HG GLN 87 -0.841 -11.970 -3.256
656 HG3 GLN 87 1HG GLN 87 -1.199 -12.709 -1.702
657 HE21 GLN 87 1HE2 GLN 87 -3.500 -10.918 -1.221
658 HE22 GLN 87 2HE2 GLN 87 -4.747 -11.498 -2.252
659 H LEU 88 H LEU 88 -0.999 -8.040 0.244
660 HA LEU 88 HA LEU 88 1.846 -8.200 0.776
661 HG LEU 88 HG LEU 88 0.251 -7.057 -1.601
662 HB2 LEU 88 2HB LEU 88 0.023 -5.811 0.530
663 HB3 LEU 88 1HB LEU 88 1.773 -5.739 0.658
664 HD11 LEU 88 1HD1 LEU 88 -0.034 -4.647 -1.647
665 HD12 LEU 88 2HD1 LEU 88 1.012 -5.178 -2.962
666 HD13 LEU 88 3HD1 LEU 88 1.713 -4.418 -1.533
667 HD21 LEU 88 3HD2 LEU 88 3.207 -6.520 -1.273
668 HD22 LEU 88 1HD2 LEU 88 2.431 -7.197 -2.706
669 HD23 LEU 88 2HD2 LEU 88 2.422 -8.098 -1.190
670 H ASN 89 H ASN 89 -1.051 -7.765 2.666
671 HA ASN 89 HA ASN 89 0.110 -6.493 4.904
672 HB2 ASN 89 2HB ASN 89 -2.347 -6.767 4.539
673 HB3 ASN 89 1HB ASN 89 -2.183 -8.473 4.933
674 HD21 ASN 89 1HD2 ASN 89 -3.711 -6.361 6.242
675 HD22 ASN 89 2HD2 ASN 89 -3.187 -6.353 7.887
676 H GLY 90 H GLY 90 1.927 -7.247 5.781
677 HA2 GLY 90 2HA GLY 90 2.857 -8.771 7.430
678 HA3 GLY 90 1HA GLY 90 2.052 -10.091 6.600
679 H PHE 91 H PHE 91 3.058 -8.449 4.069
680 HA PHE 91 HA PHE 91 5.205 -10.191 3.457
681 HD1 PHE 91 HD2 PHE 91 5.673 -10.862 0.899
682 HD2 PHE 91 HD1 PHE 91 6.092 -6.623 1.045
683 HE1 PHE 91 HE2 PHE 91 7.524 -10.988 -0.716
684 HE2 PHE 91 HE1 PHE 91 7.942 -6.747 -0.569
685 HZ PHE 91 HZ PHE 91 8.659 -8.929 -1.455
686 HB2 PHE 91 2HB PHE 91 3.808 -9.271 1.700
687 HB3 PHE 91 1HB PHE 91 4.282 -7.631 2.126
688 H GLU 92 H GLU 92 7.339 -10.048 3.856
689 HA GLU 92 HA GLU 92 8.361 -7.687 5.236
690 HB2 GLU 92 2HB GLU 92 8.803 -10.026 6.050
691 HB3 GLU 92 1HB GLU 92 9.798 -10.277 4.625
692 HG2 GLU 92 2HG GLU 92 11.354 -8.599 5.343
693 HG3 GLU 92 1HG GLU 92 10.307 -8.141 6.687
694 H LEU 93 H LEU 93 8.822 -6.071 3.841
695 HA LEU 93 HA LEU 93 10.035 -6.616 1.253
696 HG LEU 93 HG LEU 93 10.862 -3.621 0.722
697 HB2 LEU 93 2HB LEU 93 8.239 -4.958 1.447
698 HB3 LEU 93 1HB LEU 93 9.224 -4.011 2.547
699 HD11 LEU 93 1HD1 LEU 93 10.268 -4.155 -1.582
700 HD12 LEU 93 2HD1 LEU 93 8.829 -5.009 -1.024
701 HD13 LEU 93 3HD1 LEU 93 10.433 -5.617 -0.612
702 HD21 LEU 93 3HD2 LEU 93 9.495 -2.040 -0.543
703 HD22 LEU 93 1HD2 LEU 93 9.102 -1.982 1.176
704 HD23 LEU 93 2HD2 LEU 93 8.027 -2.816 0.051
705 H ALA 94 H ALA 94 10.908 -3.942 3.413
706 HA ALA 94 HA ALA 94 13.722 -4.351 2.794
707 HB1 ALA 94 3HB ALA 94 12.349 -2.188 4.397
708 HB2 ALA 94 1HB ALA 94 12.789 -2.097 2.690
709 HB3 ALA 94 2HB ALA 94 14.048 -2.194 3.920
710 H GLY 95 H GLY 95 13.095 -6.515 4.167
711 HA2 GLY 95 2HA GLY 95 13.511 -7.776 6.048
712 HA3 GLY 95 1HA GLY 95 14.566 -6.472 6.584
713 H ARG 96 H ARG 96 11.375 -5.551 5.923
714 HA ARG 96 HA ARG 96 10.508 -5.829 8.712
715 HE ARG 96 HE ARG 96 13.779 -1.833 9.417
716 HB2 ARG 96 2HB ARG 96 10.458 -3.283 7.069
717 HB3 ARG 96 1HB ARG 96 9.575 -3.497 8.576
718 HG2 ARG 96 2HG ARG 96 11.659 -3.821 9.781
719 HG3 ARG 96 1HG ARG 96 12.573 -3.666 8.277
720 HD2 ARG 96 2HD ARG 96 11.672 -1.369 8.019
721 HD3 ARG 96 1HD ARG 96 10.862 -1.542 9.578
722 HH11 ARG 96 1HH1 ARG 96 11.025 -0.101 10.536
723 HH12 ARG 96 2HH1 ARG 96 11.942 0.850 11.650
724 HH21 ARG 96 1HH2 ARG 96 14.948 -0.610 10.828
725 HH22 ARG 96 2HH2 ARG 96 14.147 0.566 11.817
726 HA PRO 97 HA PRO 97 6.699 -7.242 6.862
727 HB2 PRO 97 2HB PRO 97 5.006 -6.501 8.918
728 HB3 PRO 97 1HB PRO 97 5.980 -7.976 8.907
729 HG2 PRO 97 2HG PRO 97 6.574 -5.327 10.201
730 HG3 PRO 97 1HG PRO 97 6.774 -6.964 10.861
731 HD2 PRO 97 2HD PRO 97 8.862 -5.608 9.922
732 HD3 PRO 97 1HD PRO 97 8.711 -7.352 9.618
733 H MET 98 H MET 98 5.074 -6.378 5.623
734 HA MET 98 HA MET 98 4.730 -3.465 5.630
735 HB2 MET 98 2HB MET 98 5.264 -4.618 3.492
736 HB3 MET 98 1HB MET 98 3.768 -5.531 3.631
737 HG2 MET 98 2HG MET 98 2.502 -3.416 3.529
738 HG3 MET 98 1HG MET 98 4.018 -2.542 3.317
739 HE1 MET 98 3HE MET 98 5.640 -2.934 1.226
740 HE2 MET 98 1HE MET 98 5.241 -3.968 -0.148
741 HE3 MET 98 2HE MET 98 5.594 -4.685 1.423
742 H LYS 99 H LYS 99 3.144 -2.763 6.970
743 HA LYS 99 HA LYS 99 0.886 -4.509 7.585
744 HB2 LYS 99 2HB LYS 99 1.665 -1.805 8.705
745 HB3 LYS 99 1HB LYS 99 0.313 -2.774 9.273
746 HG2 LYS 99 2HG LYS 99 3.218 -3.592 9.368
747 HG3 LYS 99 1HG LYS 99 2.274 -2.978 10.727
748 HD2 LYS 99 2HD LYS 99 0.751 -4.906 10.524
749 HD3 LYS 99 1HD LYS 99 1.720 -5.522 9.184
750 HE2 LYS 99 2HE LYS 99 3.648 -5.747 10.674
751 HE3 LYS 99 1HE LYS 99 2.699 -5.102 12.013
752 HZ1 LYS 99 3HZ LYS 99 1.202 -7.003 11.797
753 HZ2 LYS 99 1HZ LYS 99 2.788 -7.500 12.111
754 HZ3 LYS 99 2HZ LYS 99 2.153 -7.633 10.549
755 H VAL 100 H VAL 100 -0.396 -4.500 5.759
756 HA VAL 100 HA VAL 100 -1.477 -1.916 4.839
757 HB VAL 100 HB VAL 100 -1.671 -4.615 3.476
758 HG11 VAL 100 1HG1 VAL 100 -2.354 -1.834 2.496
759 HG12 VAL 100 2HG1 VAL 100 -3.496 -3.129 2.857
760 HG13 VAL 100 3HG1 VAL 100 -2.373 -3.295 1.508
761 HG21 VAL 100 3HG2 VAL 100 0.646 -3.855 3.566
762 HG22 VAL 100 1HG2 VAL 100 0.176 -2.294 2.892
763 HG23 VAL 100 2HG2 VAL 100 0.023 -3.759 1.919
764 H GLY 101 H GLY 101 -3.243 -1.415 6.043
765 HA2 GLY 101 2HA GLY 101 -5.363 -3.477 6.312
766 HA3 GLY 101 1HA GLY 101 -5.127 -2.160 7.450
767 H HIS 102 H HIS 102 -7.583 -2.798 6.008
768 HA HIS 102 HA HIS 102 -7.828 -0.836 3.897
769 HD1 HIS 102 HD1 HIS 102 -11.009 -1.225 6.574
770 HD2 HIS 102 HD2 HIS 102 -9.820 -4.952 5.178
771 HE1 HIS 102 HE1 HIS 102 -11.957 -2.884 8.200
772 HE2 HIS 102 HE2 HIS 102 -11.097 -5.114 7.419
773 HB2 HIS 102 2HB HIS 102 -10.242 -1.482 3.878
774 HB3 HIS 102 1HB HIS 102 -9.137 -2.830 3.657
775 H VAL 103 H VAL 103 -6.953 0.716 5.741
776 HA VAL 103 HA VAL 103 -7.233 2.443 7.188
777 HB VAL 103 HB VAL 103 -9.824 2.821 5.662
778 HG11 VAL 103 1HG1 VAL 103 -9.616 5.182 6.281
779 HG12 VAL 103 2HG1 VAL 103 -8.171 4.819 7.224
780 HG13 VAL 103 3HG1 VAL 103 -9.734 4.163 7.716
781 HG21 VAL 103 3HG2 VAL 103 -7.931 2.678 4.142
782 HG22 VAL 103 1HG2 VAL 103 -7.044 3.868 5.095
783 HG23 VAL 103 2HG2 VAL 103 -8.508 4.343 4.233
784 H THR 104 H THR 104 -7.410 1.301 9.124
785 HA THR 104 HA THR 104 -10.003 1.559 10.429
786 HB THR 104 HB THR 104 -8.567 -1.116 10.427
787 HG1 THR 104 HG1 THR 104 -10.506 -0.064 8.795
788 HG21 THR 104 3HG2 THR 104 -9.684 -0.640 12.562
789 HG22 THR 104 1HG2 THR 104 -10.531 -1.913 11.683
790 HG23 THR 104 2HG2 THR 104 -11.183 -0.274 11.706
791 H GLU 105 H GLU 105 -9.019 3.154 11.615
792 HA GLU 105 HA GLU 105 -7.306 2.329 13.835
793 HB2 GLU 105 2HB GLU 105 -5.694 4.169 13.353
794 HB3 GLU 105 1HB GLU 105 -5.694 2.931 12.100
795 HG2 GLU 105 2HG GLU 105 -7.152 4.350 10.713
796 HG3 GLU 105 1HG GLU 105 -7.113 5.593 11.961
797 H ARG 106 H ARG 106 -10.055 3.597 13.115
798 HA ARG 106 HA ARG 106 -10.218 5.706 15.031
799 HE ARG 106 HE ARG 106 -9.839 10.766 14.044
800 HB2 ARG 106 2HB ARG 106 -8.852 6.682 13.109
801 HB3 ARG 106 1HB ARG 106 -10.302 6.563 12.128
802 HG2 ARG 106 2HG ARG 106 -11.449 8.111 13.658
803 HG3 ARG 106 1HG ARG 106 -9.968 8.239 14.616
804 HD2 ARG 106 2HD ARG 106 -8.781 9.069 12.603
805 HD3 ARG 106 1HD ARG 106 -10.301 9.017 11.714
806 HH11 ARG 106 1HH1 ARG 106 -11.201 10.197 10.926
807 HH12 ARG 106 2HH1 ARG 106 -11.844 11.793 10.796
808 HH21 ARG 106 1HH2 ARG 106 -10.623 12.821 13.837
809 HH22 ARG 106 2HH2 ARG 106 -11.519 13.261 12.422
810 H THR 107 H THR 107 -11.627 3.268 13.754
811 HA THR 107 HA THR 107 -14.190 4.485 12.940
812 HB THR 107 HB THR 107 -14.774 2.319 11.961
813 HG1 THR 107 HG1 THR 107 -13.627 0.556 12.333
814 HG21 THR 107 3HG2 THR 107 -13.136 2.256 10.148
815 HG22 THR 107 1HG2 THR 107 -12.001 3.191 11.121
816 HG23 THR 107 2HG2 THR 107 -13.512 3.924 10.582
817 H ASP 108 H ASP 108 -12.825 2.031 15.120
818 HA ASP 108 HA ASP 108 -15.166 2.338 16.852
819 HB2 ASP 108 2HB ASP 108 -15.618 0.419 15.303
820 HB3 ASP 108 1HB ASP 108 -14.201 -0.395 15.959
Start of MODEL 15
1 HA MET 1 HA MET 1 -46.514 -0.140 -16.690
2 H1 MET 1 1H MET 1 -48.721 -0.802 -16.072
3 H2 MET 1 2H MET 1 -48.781 0.635 -16.957
4 H3 MET 1 3H MET 1 -48.988 0.669 -15.282
5 HB2 MET 1 2HB MET 1 -47.043 2.277 -16.875
6 HB3 MET 1 1HB MET 1 -47.122 2.382 -15.124
7 HG2 MET 1 2HG MET 1 -44.758 1.787 -14.973
8 HG3 MET 1 1HG MET 1 -44.677 1.654 -16.730
9 HE1 MET 1 3HE MET 1 -42.612 3.328 -16.773
10 HE2 MET 1 1HE MET 1 -42.675 3.477 -15.018
11 HE3 MET 1 2HE MET 1 -42.629 4.925 -16.024
12 H GLY 2 H GLY 2 -45.652 -1.743 -15.498
13 HA2 GLY 2 2HA GLY 2 -45.776 -1.528 -12.543
14 HA3 GLY 2 1HA GLY 2 -45.665 -3.041 -13.428
15 H HIS 3 H HIS 3 -43.847 -3.190 -11.708
16 HA HIS 3 HA HIS 3 -41.448 -1.706 -12.292
17 HD1 HIS 3 HD1 HIS 3 -40.325 -5.722 -10.805
18 HD2 HIS 3 HD2 HIS 3 -43.951 -4.206 -9.456
19 HE1 HIS 3 HE1 HIS 3 -41.593 -7.697 -9.932
20 HE2 HIS 3 HE2 HIS 3 -43.842 -6.784 -9.284
21 HB2 HIS 3 2HB HIS 3 -40.360 -3.172 -10.620
22 HB3 HIS 3 1HB HIS 3 -41.821 -2.411 -10.007
23 H HIS 4 H HIS 4 -41.422 -2.239 -14.607
24 HA HIS 4 HA HIS 4 -40.121 -4.844 -15.130
25 HD1 HIS 4 HD1 HIS 4 -41.744 -6.944 -16.302
26 HD2 HIS 4 HD2 HIS 4 -44.306 -3.722 -15.739
27 HE1 HIS 4 HE1 HIS 4 -43.912 -7.940 -15.527
28 HE2 HIS 4 HE2 HIS 4 -45.492 -5.992 -15.403
29 HB2 HIS 4 2HB HIS 4 -41.899 -3.233 -16.975
30 HB3 HIS 4 1HB HIS 4 -41.000 -4.668 -17.456
31 H HIS 5 H HIS 5 -38.110 -3.709 -14.574
32 HA HIS 5 HA HIS 5 -37.032 -2.278 -16.923
33 HD1 HIS 5 HD1 HIS 5 -33.373 -1.779 -14.596
34 HD2 HIS 5 HD2 HIS 5 -35.975 0.369 -17.023
35 HE1 HIS 5 HE1 HIS 5 -31.933 -0.164 -15.860
36 HE2 HIS 5 HE2 HIS 5 -33.504 1.026 -17.416
37 HB2 HIS 5 2HB HIS 5 -36.914 -1.148 -14.633
38 HB3 HIS 5 1HB HIS 5 -35.753 -2.391 -14.181
39 H HIS 6 H HIS 6 -37.230 -5.246 -15.533
40 HA HIS 6 HA HIS 6 -35.324 -6.344 -17.373
41 HD1 HIS 6 HD1 HIS 6 -34.604 -4.855 -13.310
42 HD2 HIS 6 HD2 HIS 6 -35.336 -8.933 -13.610
43 HE1 HIS 6 HE1 HIS 6 -35.256 -5.591 -11.003
44 HE2 HIS 6 HE2 HIS 6 -35.857 -8.019 -11.248
45 HB2 HIS 6 2HB HIS 6 -33.996 -7.606 -15.726
46 HB3 HIS 6 1HB HIS 6 -33.798 -5.872 -15.511
47 H HIS 7 H HIS 7 -36.051 -8.302 -18.077
48 HA HIS 7 HA HIS 7 -38.170 -9.609 -16.483
49 HD1 HIS 7 HD1 HIS 7 -39.659 -9.161 -21.141
50 HD2 HIS 7 HD2 HIS 7 -35.787 -9.064 -19.640
51 HE1 HIS 7 HE1 HIS 7 -38.187 -8.667 -23.107
52 HE2 HIS 7 HE2 HIS 7 -35.881 -8.426 -22.146
53 HB2 HIS 7 2HB HIS 7 -39.125 -10.415 -18.675
54 HB3 HIS 7 1HB HIS 7 -39.262 -8.692 -18.373
55 H HIS 8 H HIS 8 -35.100 -10.029 -17.115
56 HA HIS 8 HA HIS 8 -35.317 -12.888 -16.571
57 HD1 HIS 8 HD1 HIS 8 -34.976 -15.276 -18.396
58 HD2 HIS 8 HD2 HIS 8 -35.812 -11.895 -20.662
59 HE1 HIS 8 HE1 HIS 8 -36.632 -16.019 -20.121
60 HE2 HIS 8 HE2 HIS 8 -37.232 -13.934 -21.385
61 HB2 HIS 8 2HB HIS 8 -33.708 -11.762 -18.870
62 HB3 HIS 8 1HB HIS 8 -33.273 -13.284 -18.103
63 H SER 9 H SER 9 -33.471 -13.716 -15.411
64 HA SER 9 HA SER 9 -31.300 -11.910 -14.756
65 HG SER 9 HG SER 9 -34.113 -13.244 -13.070
66 HB2 SER 9 2HB SER 9 -31.705 -11.936 -12.321
67 HB3 SER 9 1HB SER 9 -33.027 -11.149 -13.187
68 H HIS 10 H HIS 10 -29.475 -12.968 -14.301
69 HA HIS 10 HA HIS 10 -29.594 -15.715 -13.213
70 HD1 HIS 10 HD1 HIS 10 -29.209 -18.141 -15.310
71 HD2 HIS 10 HD2 HIS 10 -29.873 -14.516 -17.229
72 HE1 HIS 10 HE1 HIS 10 -30.810 -18.649 -17.172
73 HE2 HIS 10 HE2 HIS 10 -31.006 -16.493 -18.447
74 HB2 HIS 10 2HB HIS 10 -27.731 -14.728 -15.399
75 HB3 HIS 10 1HB HIS 10 -27.592 -16.287 -14.593
76 H MET 11 H MET 11 -29.139 -12.936 -12.167
77 HA MET 11 HA MET 11 -26.323 -12.712 -11.543
78 HB2 MET 11 2HB MET 11 -27.018 -10.621 -10.412
79 HB3 MET 11 1HB MET 11 -27.604 -10.716 -12.068
80 HG2 MET 11 2HG MET 11 -29.805 -11.461 -11.200
81 HG3 MET 11 1HG MET 11 -29.200 -11.225 -9.562
82 HE1 MET 11 3HE MET 11 -28.340 -8.820 -8.673
83 HE2 MET 11 1HE MET 11 -28.485 -7.336 -9.614
84 HE3 MET 11 2HE MET 11 -27.356 -8.592 -10.121
85 H ALA 12 H ALA 12 -27.739 -15.037 -10.408
86 HA ALA 12 HA ALA 12 -27.369 -14.476 -7.528
87 HB1 ALA 12 3HB ALA 12 -29.427 -16.311 -8.759
88 HB2 ALA 12 1HB ALA 12 -29.743 -14.722 -8.058
89 HB3 ALA 12 2HB ALA 12 -29.177 -16.042 -7.033
90 H ALA 13 H ALA 13 -25.600 -15.718 -9.710
91 HA ALA 13 HA ALA 13 -25.286 -18.470 -8.897
92 HB1 ALA 13 3HB ALA 13 -23.343 -18.480 -10.377
93 HB2 ALA 13 1HB ALA 13 -23.447 -16.726 -10.546
94 HB3 ALA 13 2HB ALA 13 -24.736 -17.752 -11.176
95 H ALA 14 H ALA 14 -23.372 -15.492 -8.432
96 HA ALA 14 HA ALA 14 -21.635 -16.793 -6.496
97 HB1 ALA 14 3HB ALA 14 -21.717 -13.909 -7.390
98 HB2 ALA 14 1HB ALA 14 -20.697 -15.175 -8.078
99 HB3 ALA 14 2HB ALA 14 -20.456 -14.660 -6.410
100 H MET 15 H MET 15 -22.832 -17.276 -4.674
101 HA MET 15 HA MET 15 -24.524 -15.265 -3.444
102 HB2 MET 15 2HB MET 15 -25.102 -17.721 -3.487
103 HB3 MET 15 1HB MET 15 -23.788 -17.993 -2.348
104 HG2 MET 15 2HG MET 15 -26.229 -16.283 -1.868
105 HG3 MET 15 1HG MET 15 -25.944 -17.895 -1.218
106 HE1 MET 15 3HE MET 15 -26.725 -15.285 0.517
107 HE2 MET 15 1HE MET 15 -25.661 -15.479 1.908
108 HE3 MET 15 2HE MET 15 -26.500 -16.879 1.239
109 H ALA 16 H ALA 16 -23.453 -13.640 -2.477
110 HA ALA 16 HA ALA 16 -21.638 -14.345 -0.268
111 HB1 ALA 16 3HB ALA 16 -21.148 -12.114 -2.252
112 HB2 ALA 16 1HB ALA 16 -20.226 -13.611 -2.125
113 HB3 ALA 16 2HB ALA 16 -20.185 -12.437 -0.809
114 H ASN 17 H ASN 17 -23.106 -11.444 -1.740
115 HA ASN 17 HA ASN 17 -24.508 -9.849 -0.974
116 HB2 ASN 17 2HB ASN 17 -25.215 -11.916 1.117
117 HB3 ASN 17 1HB ASN 17 -26.104 -10.418 0.848
118 HD21 ASN 17 1HD2 ASN 17 -25.403 -13.579 -0.361
119 HD22 ASN 17 2HD2 ASN 17 -26.602 -13.590 -1.605
120 H ASN 18 H ASN 18 -22.011 -10.951 1.130
121 HA ASN 18 HA ASN 18 -22.187 -9.155 3.254
122 HB2 ASN 18 2HB ASN 18 -20.510 -10.955 3.160
123 HB3 ASN 18 1HB ASN 18 -19.683 -10.127 1.843
124 HD21 ASN 18 1HD2 ASN 18 -18.517 -8.235 2.301
125 HD22 ASN 18 2HD2 ASN 18 -18.043 -7.834 3.912
126 H LEU 19 H LEU 19 -22.533 -7.017 3.067
127 HA LEU 19 HA LEU 19 -22.678 -4.929 2.208
128 HG LEU 19 HG LEU 19 -19.904 -5.606 3.536
129 HB2 LEU 19 2HB LEU 19 -19.938 -5.559 1.084
130 HB3 LEU 19 1HB LEU 19 -20.669 -3.963 1.112
131 HD11 LEU 19 1HD1 LEU 19 -17.965 -4.709 2.388
132 HD12 LEU 19 2HD1 LEU 19 -18.230 -3.853 3.908
133 HD13 LEU 19 3HD1 LEU 19 -18.687 -3.100 2.379
134 HD21 LEU 19 3HD2 LEU 19 -21.889 -4.278 4.000
135 HD22 LEU 19 1HD2 LEU 19 -21.099 -2.833 3.366
136 HD23 LEU 19 2HD2 LEU 19 -20.491 -3.601 4.834
137 H GLN 20 H GLN 20 -24.428 -5.643 0.931
138 HA GLN 20 HA GLN 20 -24.104 -6.896 -1.603
139 HB2 GLN 20 2HB GLN 20 -26.585 -6.459 -1.842
140 HB3 GLN 20 1HB GLN 20 -26.108 -7.394 -0.432
141 HG2 GLN 20 2HG GLN 20 -26.329 -4.462 -0.070
142 HG3 GLN 20 1HG GLN 20 -27.828 -5.345 -0.334
143 HE21 GLN 20 1HE2 GLN 20 -25.217 -6.975 1.281
144 HE22 GLN 20 2HE2 GLN 20 -25.893 -6.896 2.865
145 H LYS 21 H LYS 21 -24.179 -3.580 -0.639
146 HA LYS 21 HA LYS 21 -24.182 -2.783 -3.486
147 HB2 LYS 21 2HB LYS 21 -24.951 -1.089 -1.090
148 HB3 LYS 21 1HB LYS 21 -24.906 -0.543 -2.763
149 HG2 LYS 21 2HG LYS 21 -26.636 -2.315 -3.267
150 HG3 LYS 21 1HG LYS 21 -26.788 -2.547 -1.524
151 HD2 LYS 21 2HD LYS 21 -27.259 0.042 -3.017
152 HD3 LYS 21 1HD LYS 21 -28.513 -1.030 -2.397
153 HE2 LYS 21 2HE LYS 21 -26.443 0.366 -0.699
154 HE3 LYS 21 1HE LYS 21 -28.090 0.938 -0.955
155 HZ1 LYS 21 3HZ LYS 21 -27.350 -1.653 0.293
156 HZ2 LYS 21 1HZ LYS 21 -28.923 -1.071 0.075
157 HZ3 LYS 21 2HZ LYS 21 -27.862 -0.272 1.122
158 H GLY 22 H GLY 22 -22.014 -2.962 -3.880
159 HA2 GLY 22 2HA GLY 22 -20.266 -0.919 -3.468
160 HA3 GLY 22 1HA GLY 22 -20.031 -1.926 -2.046
161 H SER 23 H SER 23 -17.952 -2.554 -2.528
162 HA SER 23 HA SER 23 -16.296 -3.851 -3.368
163 HG SER 23 HG SER 23 -16.974 -6.838 -5.260
164 HB2 SER 23 2HB SER 23 -17.887 -5.706 -3.381
165 HB3 SER 23 1HB SER 23 -18.477 -5.210 -4.968
166 H ALA 24 H ALA 24 -18.429 -3.415 -6.195
167 HA ALA 24 HA ALA 24 -16.243 -2.830 -7.941
168 HB1 ALA 24 3HB ALA 24 -18.300 -3.887 -8.756
169 HB2 ALA 24 1HB ALA 24 -17.958 -2.391 -9.627
170 HB3 ALA 24 2HB ALA 24 -19.207 -2.422 -8.382
171 H GLY 25 H GLY 25 -15.345 -1.110 -6.516
172 HA2 GLY 25 2HA GLY 25 -15.885 1.493 -7.531
173 HA3 GLY 25 1HA GLY 25 -16.554 1.322 -5.914
174 HA PRO 26 HA PRO 26 -11.896 2.380 -6.014
175 HB2 PRO 26 2HB PRO 26 -11.972 4.948 -5.148
176 HB3 PRO 26 1HB PRO 26 -12.151 4.513 -6.854
177 HG2 PRO 26 2HG PRO 26 -14.275 5.168 -4.831
178 HG3 PRO 26 1HG PRO 26 -14.122 5.723 -6.509
179 HD2 PRO 26 2HD PRO 26 -15.778 3.696 -5.785
180 HD3 PRO 26 1HD PRO 26 -14.984 3.760 -7.372
181 H MET 27 H MET 27 -10.815 1.649 -4.288
182 HA MET 27 HA MET 27 -11.806 2.304 -1.582
183 HB2 MET 27 2HB MET 27 -12.364 -0.026 -2.228
184 HB3 MET 27 1HB MET 27 -10.655 -0.351 -2.475
185 HG2 MET 27 2HG MET 27 -10.208 0.016 -0.127
186 HG3 MET 27 1HG MET 27 -11.890 0.463 0.150
187 HE1 MET 27 3HE MET 27 -12.157 -1.270 2.110
188 HE2 MET 27 1HE MET 27 -10.463 -1.728 1.937
189 HE3 MET 27 2HE MET 27 -11.712 -2.971 1.989
190 H ARG 28 H ARG 28 -10.347 3.257 -0.313
191 HA ARG 28 HA ARG 28 -7.521 3.233 -1.115
192 HE ARG 28 HE ARG 28 -8.988 7.180 0.565
193 HB2 ARG 28 2HB ARG 28 -8.282 5.440 -0.914
194 HB3 ARG 28 1HB ARG 28 -9.199 5.101 0.543
195 HG2 ARG 28 2HG ARG 28 -7.331 5.211 1.908
196 HG3 ARG 28 1HG ARG 28 -6.215 4.889 0.581
197 HD2 ARG 28 2HD ARG 28 -6.333 7.283 1.530
198 HD3 ARG 28 1HD ARG 28 -6.327 7.071 -0.219
199 HH11 ARG 28 1HH1 ARG 28 -6.245 9.257 0.730
200 HH12 ARG 28 2HH1 ARG 28 -7.178 10.689 0.480
201 HH21 ARG 28 1HH2 ARG 28 -10.178 9.051 0.286
202 HH22 ARG 28 2HH2 ARG 28 -9.364 10.576 0.268
203 H LEU 29 H LEU 29 -5.873 2.571 0.211
204 HA LEU 29 HA LEU 29 -6.697 0.964 2.555
205 HG LEU 29 HG LEU 29 -6.287 0.133 -0.678
206 HB2 LEU 29 2HB LEU 29 -4.336 0.388 0.766
207 HB3 LEU 29 1HB LEU 29 -5.056 -0.666 1.967
208 HD11 LEU 29 1HD1 LEU 29 -4.473 -1.466 -0.909
209 HD12 LEU 29 2HD1 LEU 29 -6.025 -2.229 -1.248
210 HD13 LEU 29 3HD1 LEU 29 -5.220 -2.516 0.296
211 HD21 LEU 29 3HD2 LEU 29 -8.062 -0.086 0.915
212 HD22 LEU 29 1HD2 LEU 29 -7.379 -1.585 1.547
213 HD23 LEU 29 2HD2 LEU 29 -8.042 -1.538 -0.085
214 H TYR 30 H TYR 30 -5.396 0.947 4.381
215 HA TYR 30 HA TYR 30 -3.409 3.059 4.666
216 HD1 TYR 30 HD2 TYR 30 -3.164 4.424 7.300
217 HD2 TYR 30 HD1 TYR 30 -3.034 0.216 7.941
218 HE1 TYR 30 HE2 TYR 30 -1.509 4.749 9.088
219 HE2 TYR 30 HE1 TYR 30 -1.380 0.533 9.728
220 HH TYR 30 HH TYR 30 -0.674 3.593 11.060
221 HB2 TYR 30 2HB TYR 30 -4.968 2.902 6.463
222 HB3 TYR 30 1HB TYR 30 -4.765 1.161 6.589
223 H VAL 31 H VAL 31 -1.341 2.632 4.134
224 HA VAL 31 HA VAL 31 -0.252 -0.074 4.624
225 HB VAL 31 HB VAL 31 0.793 2.054 2.733
226 HG11 VAL 31 1HG1 VAL 31 2.567 0.600 3.590
227 HG12 VAL 31 2HG1 VAL 31 2.268 0.291 1.879
228 HG13 VAL 31 3HG1 VAL 31 1.649 -0.822 3.098
229 HG21 VAL 31 3HG2 VAL 31 -1.336 1.151 1.953
230 HG22 VAL 31 1HG2 VAL 31 -0.722 -0.493 2.136
231 HG23 VAL 31 2HG2 VAL 31 -0.011 0.586 0.934
232 H GLY 32 H GLY 32 0.551 0.040 6.681
233 HA2 GLY 32 2HA GLY 32 2.238 2.347 7.418
234 HA3 GLY 32 1HA GLY 32 1.421 1.287 8.550
235 H SER 33 H SER 33 4.223 1.732 6.551
236 HA SER 33 HA SER 33 5.874 0.332 8.374
237 HG SER 33 HG SER 33 6.726 -2.684 7.245
238 HB2 SER 33 2HB SER 33 4.866 -1.654 7.268
239 HB3 SER 33 1HB SER 33 5.501 -1.091 5.722
240 H LEU 34 H LEU 34 5.595 2.741 6.347
241 HA LEU 34 HA LEU 34 7.757 2.477 4.506
242 HG LEU 34 HG LEU 34 4.601 3.752 4.824
243 HB2 LEU 34 2HB LEU 34 6.531 5.080 5.413
244 HB3 LEU 34 1HB LEU 34 7.305 4.728 3.878
245 HD11 LEU 34 1HD1 LEU 34 3.768 5.018 2.903
246 HD12 LEU 34 2HD1 LEU 34 5.412 5.545 2.535
247 HD13 LEU 34 3HD1 LEU 34 4.638 6.055 4.035
248 HD21 LEU 34 3HD2 LEU 34 5.715 1.957 3.599
249 HD22 LEU 34 1HD2 LEU 34 6.060 3.064 2.270
250 HD23 LEU 34 2HD2 LEU 34 4.392 2.640 2.656
251 H HIS 35 H HIS 35 9.687 2.026 5.590
252 HA HIS 35 HA HIS 35 10.465 3.525 7.907
253 HD1 HIS 35 HD1 HIS 35 13.858 0.144 7.001
254 HD2 HIS 35 HD2 HIS 35 11.461 2.091 4.229
255 HE1 HIS 35 HE1 HIS 35 14.723 -0.562 4.759
256 HE2 HIS 35 HE2 HIS 35 13.433 0.837 3.124
257 HB2 HIS 35 2HB HIS 35 12.466 2.173 7.955
258 HB3 HIS 35 1HB HIS 35 11.072 1.154 7.645
259 H PHE 36 H PHE 36 10.214 5.621 6.656
260 HA PHE 36 HA PHE 36 11.167 7.562 5.946
261 HD1 PHE 36 HD1 PHE 36 11.803 9.517 7.473
262 HD2 PHE 36 HD2 PHE 36 15.489 7.672 6.398
263 HE1 PHE 36 HE1 PHE 36 12.860 11.733 7.291
264 HE2 PHE 36 HE2 PHE 36 16.549 9.881 6.211
265 HZ PHE 36 HZ PHE 36 15.233 11.914 6.659
266 HB2 PHE 36 2HB PHE 36 12.448 7.037 8.042
267 HB3 PHE 36 1HB PHE 36 13.712 6.334 7.043
268 H ASN 37 H ASN 37 10.998 5.625 3.838
269 HA ASN 37 HA ASN 37 12.666 6.929 1.943
270 HB2 ASN 37 2HB ASN 37 14.362 5.435 2.958
271 HB3 ASN 37 1HB ASN 37 13.404 4.041 2.470
272 HD21 ASN 37 1HD2 ASN 37 15.066 3.250 1.179
273 HD22 ASN 37 2HD2 ASN 37 15.481 3.980 -0.329
274 H ILE 38 H ILE 38 10.486 4.260 2.632
275 HA ILE 38 HA ILE 38 10.027 3.448 -0.035
276 HB ILE 38 HB ILE 38 8.064 3.231 2.257
277 HG12 ILE 38 2HG1 ILE 38 10.236 2.296 2.923
278 HG13 ILE 38 1HG1 ILE 38 9.056 1.012 2.688
279 HG21 ILE 38 1HG2 ILE 38 8.377 1.614 -0.279
280 HG22 ILE 38 2HG2 ILE 38 7.083 2.759 0.079
281 HG23 ILE 38 3HG2 ILE 38 7.230 1.273 1.018
282 HD11 ILE 38 3HD1 ILE 38 11.204 1.809 0.734
283 HD12 ILE 38 1HD1 ILE 38 10.030 0.510 0.513
284 HD13 ILE 38 2HD1 ILE 38 11.231 0.405 1.801
285 H THR 39 H THR 39 9.617 5.106 -1.423
286 HA THR 39 HA THR 39 7.566 7.100 -0.836
287 HB THR 39 HB THR 39 8.327 8.181 -2.931
288 HG1 THR 39 HG1 THR 39 10.226 7.267 -3.941
289 HG21 THR 39 3HG2 THR 39 10.573 7.435 -1.046
290 HG22 THR 39 1HG2 THR 39 9.432 8.761 -0.825
291 HG23 THR 39 2HG2 THR 39 10.578 8.798 -2.164
292 H GLU 40 H GLU 40 6.381 7.808 -3.027
293 HA GLU 40 HA GLU 40 4.352 6.002 -3.565
294 HB2 GLU 40 2HB GLU 40 5.260 8.016 -5.624
295 HB3 GLU 40 1HB GLU 40 3.633 7.432 -5.320
296 HG2 GLU 40 2HG GLU 40 3.396 9.415 -4.287
297 HG3 GLU 40 1HG GLU 40 4.156 8.577 -2.939
298 H ASP 41 H ASP 41 7.345 6.546 -5.338
299 HA ASP 41 HA ASP 41 6.966 4.961 -7.574
300 HB2 ASP 41 2HB ASP 41 9.515 5.362 -5.985
301 HB3 ASP 41 1HB ASP 41 9.427 4.805 -7.654
302 H MET 42 H MET 42 8.370 3.989 -4.442
303 HA MET 42 HA MET 42 8.894 1.297 -5.117
304 HB2 MET 42 2HB MET 42 8.316 2.385 -2.348
305 HB3 MET 42 1HB MET 42 9.247 0.946 -2.748
306 HG2 MET 42 2HG MET 42 10.023 3.781 -3.417
307 HG3 MET 42 1HG MET 42 10.677 2.818 -2.092
308 HE1 MET 42 3HE MET 42 12.348 4.330 -4.444
309 HE2 MET 42 1HE MET 42 13.599 3.129 -4.757
310 HE3 MET 42 2HE MET 42 13.119 3.489 -3.100
311 H LEU 43 H LEU 43 6.247 2.734 -3.242
312 HA LEU 43 HA LEU 43 4.725 0.459 -2.763
313 HG LEU 43 HG LEU 43 5.432 2.943 -1.292
314 HB2 LEU 43 2HB LEU 43 3.811 3.304 -3.222
315 HB3 LEU 43 1HB LEU 43 2.823 2.039 -2.517
316 HD11 LEU 43 1HD1 LEU 43 4.082 4.245 0.294
317 HD12 LEU 43 2HD1 LEU 43 2.637 3.891 -0.656
318 HD13 LEU 43 3HD1 LEU 43 3.940 4.855 -1.355
319 HD21 LEU 43 3HD2 LEU 43 4.559 1.844 0.703
320 HD22 LEU 43 1HD2 LEU 43 4.645 0.713 -0.645
321 HD23 LEU 43 2HD2 LEU 43 3.092 1.398 -0.167
322 H ARG 44 H ARG 44 4.438 2.747 -5.490
323 HA ARG 44 HA ARG 44 2.301 1.531 -6.802
324 HE ARG 44 HE ARG 44 1.673 3.236 -11.421
325 HB2 ARG 44 2HB ARG 44 3.280 3.779 -7.321
326 HB3 ARG 44 1HB ARG 44 4.616 2.963 -8.120
327 HG2 ARG 44 2HG ARG 44 3.084 1.981 -9.730
328 HG3 ARG 44 1HG ARG 44 1.720 2.742 -8.915
329 HD2 ARG 44 2HD ARG 44 2.727 4.964 -9.399
330 HD3 ARG 44 1HD ARG 44 3.994 4.148 -10.318
331 HH11 ARG 44 1HH1 ARG 44 3.068 6.349 -10.937
332 HH12 ARG 44 2HH1 ARG 44 2.213 7.054 -12.263
333 HH21 ARG 44 1HH2 ARG 44 0.611 4.128 -13.125
334 HH22 ARG 44 2HH2 ARG 44 0.860 5.789 -13.524
335 H GLY 45 H GLY 45 5.804 1.044 -7.336
336 HA2 GLY 45 2HA GLY 45 5.645 -0.823 -9.405
337 HA3 GLY 45 1HA GLY 45 6.979 -0.693 -8.275
338 H ILE 46 H ILE 46 5.294 -1.346 -5.947
339 HA ILE 46 HA ILE 46 5.395 -4.238 -6.196
340 HB ILE 46 HB ILE 46 4.674 -2.503 -3.820
341 HG12 ILE 46 2HG1 ILE 46 7.255 -3.945 -4.497
342 HG13 ILE 46 1HG1 ILE 46 6.998 -2.210 -4.630
343 HG21 ILE 46 1HG2 ILE 46 5.039 -4.530 -2.472
344 HG22 ILE 46 2HG2 ILE 46 5.280 -5.465 -3.949
345 HG23 ILE 46 3HG2 ILE 46 3.708 -4.738 -3.612
346 HD11 ILE 46 3HD1 ILE 46 8.226 -2.765 -2.622
347 HD12 ILE 46 1HD1 ILE 46 6.914 -3.815 -2.087
348 HD13 ILE 46 2HD1 ILE 46 6.653 -2.076 -2.220
349 H PHE 47 H PHE 47 2.892 -1.765 -5.835
350 HA PHE 47 HA PHE 47 0.829 -3.727 -5.275
351 HD1 PHE 47 HD2 PHE 47 2.667 -1.546 -3.594
352 HD2 PHE 47 HD1 PHE 47 -1.566 -1.860 -3.236
353 HE1 PHE 47 HE2 PHE 47 2.883 -1.644 -1.147
354 HE2 PHE 47 HE1 PHE 47 -1.354 -1.961 -0.788
355 HZ PHE 47 HZ PHE 47 0.872 -1.856 0.258
356 HB2 PHE 47 2HB PHE 47 0.865 -0.721 -5.434
357 HB3 PHE 47 1HB PHE 47 -0.653 -1.604 -5.336
358 H GLU 48 H GLU 48 1.815 -1.804 -8.101
359 HA GLU 48 HA GLU 48 -0.557 -2.071 -9.574
360 HB2 GLU 48 2HB GLU 48 2.282 -1.737 -10.532
361 HB3 GLU 48 1HB GLU 48 0.899 -1.754 -11.621
362 HG2 GLU 48 2HG GLU 48 -0.048 0.125 -10.175
363 HG3 GLU 48 1HG GLU 48 1.567 0.249 -9.484
364 HA PRO 49 HA PRO 49 1.462 -6.370 -11.278
365 HB2 PRO 49 2HB PRO 49 2.051 -7.094 -8.421
366 HB3 PRO 49 1HB PRO 49 2.785 -7.708 -9.910
367 HG2 PRO 49 2HG PRO 49 4.053 -5.884 -8.454
368 HG3 PRO 49 1HG PRO 49 4.065 -5.786 -10.225
369 HD2 PRO 49 2HD PRO 49 2.568 -4.137 -8.247
370 HD3 PRO 49 1HD PRO 49 3.204 -3.688 -9.841
371 H PHE 50 H PHE 50 -0.441 -5.413 -8.484
372 HA PHE 50 HA PHE 50 -2.239 -7.703 -8.730
373 HD1 PHE 50 HD1 PHE 50 -2.905 -8.792 -6.063
374 HD2 PHE 50 HD2 PHE 50 -0.117 -5.571 -5.969
375 HE1 PHE 50 HE1 PHE 50 -1.531 -10.038 -4.457
376 HE2 PHE 50 HE2 PHE 50 1.265 -6.822 -4.361
377 HZ PHE 50 HZ PHE 50 0.559 -9.059 -3.599
378 HB2 PHE 50 2HB PHE 50 -2.313 -5.277 -6.921
379 HB3 PHE 50 1HB PHE 50 -3.505 -6.570 -6.887
380 H GLY 51 H GLY 51 -2.150 -4.270 -9.520
381 HA2 GLY 51 2HA GLY 51 -4.164 -4.494 -11.513
382 HA3 GLY 51 1HA GLY 51 -4.837 -3.763 -10.063
383 H ARG 52 H ARG 52 -4.936 -1.599 -10.265
384 HA ARG 52 HA ARG 52 -2.526 -0.144 -11.019
385 HE ARG 52 HE ARG 52 -5.145 2.772 -14.050
386 HB2 ARG 52 2HB ARG 52 -4.030 -0.605 -13.098
387 HB3 ARG 52 1HB ARG 52 -5.090 0.620 -12.418
388 HG2 ARG 52 2HG ARG 52 -2.177 1.180 -12.887
389 HG3 ARG 52 1HG ARG 52 -3.353 1.313 -14.192
390 HD2 ARG 52 2HD ARG 52 -3.749 2.745 -11.580
391 HD3 ARG 52 1HD ARG 52 -2.750 3.428 -12.860
392 HH11 ARG 52 1HH1 ARG 52 -4.147 4.816 -11.461
393 HH12 ARG 52 2HH1 ARG 52 -5.382 5.987 -11.773
394 HH21 ARG 52 1HH2 ARG 52 -6.700 4.312 -14.453
395 HH22 ARG 52 2HH2 ARG 52 -6.811 5.699 -13.426
396 H ILE 53 H ILE 53 -2.252 1.600 -9.762
397 HA ILE 53 HA ILE 53 -4.304 2.201 -7.789
398 HB ILE 53 HB ILE 53 -1.463 3.223 -8.034
399 HG12 ILE 53 2HG1 ILE 53 -1.208 1.799 -5.899
400 HG13 ILE 53 1HG1 ILE 53 -2.717 1.030 -6.373
401 HG21 ILE 53 1HG2 ILE 53 -2.821 4.862 -6.893
402 HG22 ILE 53 2HG2 ILE 53 -1.769 4.056 -5.730
403 HG23 ILE 53 3HG2 ILE 53 -3.476 3.623 -5.821
404 HD11 ILE 53 3HD1 ILE 53 -0.172 1.086 -7.980
405 HD12 ILE 53 1HD1 ILE 53 -1.683 0.314 -8.469
406 HD13 ILE 53 2HD1 ILE 53 -0.806 -0.280 -7.060
407 H GLU 54 H GLU 54 -5.423 4.099 -7.591
408 HA GLU 54 HA GLU 54 -5.402 5.965 -9.802
409 HB2 GLU 54 2HB GLU 54 -6.972 6.096 -7.213
410 HB3 GLU 54 1HB GLU 54 -7.265 7.061 -8.654
411 HG2 GLU 54 2HG GLU 54 -7.715 4.895 -9.866
412 HG3 GLU 54 1HG GLU 54 -7.683 4.103 -8.289
413 H SER 55 H SER 55 -4.709 6.127 -6.313
414 HA SER 55 HA SER 55 -2.858 8.338 -6.763
415 HG SER 55 HG SER 55 -6.217 9.037 -4.600
416 HB2 SER 55 2HB SER 55 -3.878 9.778 -5.058
417 HB3 SER 55 1HB SER 55 -5.033 9.453 -6.351
418 H ILE 56 H ILE 56 -1.219 8.462 -5.238
419 HA ILE 56 HA ILE 56 -1.319 6.533 -2.991
420 HB ILE 56 HB ILE 56 1.171 7.379 -4.508
421 HG12 ILE 56 2HG1 ILE 56 -0.348 4.749 -4.616
422 HG13 ILE 56 1HG1 ILE 56 -0.307 5.957 -5.896
423 HG21 ILE 56 1HG2 ILE 56 2.263 5.581 -3.241
424 HG22 ILE 56 2HG2 ILE 56 0.753 5.270 -2.382
425 HG23 ILE 56 3HG2 ILE 56 1.586 6.808 -2.170
426 HD11 ILE 56 3HD1 ILE 56 2.033 4.366 -4.874
427 HD12 ILE 56 1HD1 ILE 56 2.110 5.607 -6.126
428 HD13 ILE 56 2HD1 ILE 56 1.182 4.132 -6.400
429 H GLN 57 H GLN 57 -1.681 7.743 -1.204
430 HA GLN 57 HA GLN 57 -0.411 10.396 -0.986
431 HB2 GLN 57 2HB GLN 57 -2.633 9.263 0.726
432 HB3 GLN 57 1HB GLN 57 -2.102 10.936 0.646
433 HG2 GLN 57 2HG GLN 57 -3.535 9.377 -1.498
434 HG3 GLN 57 1HG GLN 57 -4.175 10.706 -0.534
435 HE21 GLN 57 1HE2 GLN 57 -4.030 10.490 -3.402
436 HE22 GLN 57 2HE2 GLN 57 -3.069 11.818 -3.951
437 H LEU 58 H LEU 58 1.501 10.357 0.114
438 HA LEU 58 HA LEU 58 1.803 8.497 2.374
439 HG LEU 58 HG LEU 58 3.543 7.160 1.248
440 HB2 LEU 58 2HB LEU 58 3.807 10.141 0.833
441 HB3 LEU 58 1HB LEU 58 4.215 9.329 2.332
442 HD11 LEU 58 1HD1 LEU 58 3.480 8.865 -1.238
443 HD12 LEU 58 2HD1 LEU 58 2.120 8.006 -0.516
444 HD13 LEU 58 3HD1 LEU 58 3.464 7.101 -1.211
445 HD21 LEU 58 3HD2 LEU 58 5.615 6.939 -0.020
446 HD22 LEU 58 1HD2 LEU 58 5.879 7.830 1.477
447 HD23 LEU 58 2HD2 LEU 58 5.790 8.694 -0.059
448 H MET 59 H MET 59 2.148 9.161 4.457
449 HA MET 59 HA MET 59 1.402 11.932 5.027
450 HB2 MET 59 2HB MET 59 1.655 9.565 6.893
451 HB3 MET 59 1HB MET 59 1.002 11.141 7.315
452 HG2 MET 59 2HG MET 59 -0.202 9.383 5.189
453 HG3 MET 59 1HG MET 59 -0.673 9.311 6.882
454 HE1 MET 59 3HE MET 59 -1.168 10.992 3.489
455 HE2 MET 59 1HE MET 59 -0.032 12.176 4.134
456 HE3 MET 59 2HE MET 59 -1.716 12.624 3.865
457 H MET 60 H MET 60 3.171 13.203 4.897
458 HA MET 60 HA MET 60 5.256 12.804 6.884
459 HB2 MET 60 2HB MET 60 7.078 13.184 5.221
460 HB3 MET 60 1HB MET 60 6.247 11.650 5.031
461 HG2 MET 60 2HG MET 60 4.976 12.559 3.153
462 HG3 MET 60 1HG MET 60 5.784 14.115 3.355
463 HE1 MET 60 3HE MET 60 5.675 12.496 0.598
464 HE2 MET 60 1HE MET 60 7.331 12.710 0.030
465 HE3 MET 60 2HE MET 60 6.475 14.056 0.779
466 H ASP 61 H ASP 61 5.224 14.650 7.968
467 HA ASP 61 HA ASP 61 4.465 17.153 6.739
468 HB2 ASP 61 2HB ASP 61 5.447 16.509 9.531
469 HB3 ASP 61 1HB ASP 61 4.808 18.073 9.020
470 H SER 62 H SER 62 6.139 17.278 5.155
471 HA SER 62 HA SER 62 8.818 16.878 5.439
472 HG SER 62 HG SER 62 8.100 16.788 2.316
473 HB2 SER 62 2HB SER 62 7.547 18.963 3.652
474 HB3 SER 62 1HB SER 62 9.138 18.237 3.428
475 H GLU 63 H GLU 63 7.106 19.776 6.454
476 HA GLU 63 HA GLU 63 9.234 21.553 6.652
477 HB2 GLU 63 2HB GLU 63 6.952 22.279 7.038
478 HB3 GLU 63 1HB GLU 63 6.839 21.279 8.481
479 HG2 GLU 63 2HG GLU 63 8.527 22.643 9.586
480 HG3 GLU 63 1HG GLU 63 8.711 23.622 8.133
481 H THR 64 H THR 64 8.199 19.105 9.012
482 HA THR 64 HA THR 64 10.784 18.912 10.206
483 HB THR 64 HB THR 64 10.235 21.023 11.229
484 HG1 THR 64 HG1 THR 64 10.732 20.432 13.267
485 HG21 THR 64 3HG2 THR 64 7.756 19.682 12.331
486 HG22 THR 64 1HG2 THR 64 7.787 20.925 11.078
487 HG23 THR 64 2HG2 THR 64 8.308 21.312 12.719
488 H GLY 65 H GLY 65 7.410 18.051 10.171
489 HA2 GLY 65 2HA GLY 65 7.509 16.132 12.304
490 HA3 GLY 65 1HA GLY 65 6.237 16.284 11.097
491 H ARG 66 H ARG 66 8.057 16.086 8.862
492 HA ARG 66 HA ARG 66 9.157 14.650 7.512
493 HE ARG 66 HE ARG 66 12.618 12.710 11.067
494 HB2 ARG 66 2HB ARG 66 9.986 13.269 10.064
495 HB3 ARG 66 1HB ARG 66 10.798 13.168 8.504
496 HG2 ARG 66 2HG ARG 66 11.309 15.586 8.649
497 HG3 ARG 66 1HG ARG 66 10.550 15.634 10.239
498 HD2 ARG 66 2HD ARG 66 13.063 14.189 9.413
499 HD3 ARG 66 1HD ARG 66 12.893 15.481 10.598
500 HH11 ARG 66 1HH1 ARG 66 11.185 15.705 12.032
501 HH12 ARG 66 2HH1 ARG 66 10.769 15.107 13.597
502 HH21 ARG 66 1HH2 ARG 66 12.124 11.996 13.083
503 HH22 ARG 66 2HH2 ARG 66 11.291 13.039 14.183
504 H SER 67 H SER 67 9.593 11.970 7.439
505 HA SER 67 HA SER 67 7.146 10.880 6.659
506 HG SER 67 HG SER 67 8.535 7.765 7.315
507 HB2 SER 67 2HB SER 67 9.188 9.956 5.777
508 HB3 SER 67 1HB SER 67 9.739 9.498 7.387
509 H LYS 68 H LYS 68 5.443 10.412 7.901
510 HA LYS 68 HA LYS 68 5.698 9.700 10.678
511 HB2 LYS 68 2HB LYS 68 3.256 9.650 8.883
512 HB3 LYS 68 1HB LYS 68 3.242 9.480 10.634
513 HG2 LYS 68 2HG LYS 68 4.248 11.757 10.798
514 HG3 LYS 68 1HG LYS 68 4.054 11.911 9.052
515 HD2 LYS 68 2HD LYS 68 2.149 12.968 9.876
516 HD3 LYS 68 1HD LYS 68 1.563 11.347 9.509
517 HE2 LYS 68 2HE LYS 68 2.428 12.294 12.249
518 HE3 LYS 68 1HE LYS 68 0.761 12.226 11.690
519 HZ1 LYS 68 3HZ LYS 68 0.948 9.848 11.475
520 HZ2 LYS 68 1HZ LYS 68 1.365 10.312 13.043
521 HZ3 LYS 68 2HZ LYS 68 2.571 9.887 11.942
522 H GLY 69 H GLY 69 5.930 7.918 7.811
523 HA2 GLY 69 2HA GLY 69 6.776 5.708 7.860
524 HA3 GLY 69 1HA GLY 69 6.030 5.473 9.426
525 H TYR 70 H TYR 70 3.686 6.812 7.421
526 HA TYR 70 HA TYR 70 2.905 4.242 6.266
527 HD1 TYR 70 HD2 TYR 70 2.550 6.057 9.871
528 HD2 TYR 70 HD1 TYR 70 -0.777 6.373 7.233
529 HE1 TYR 70 HE2 TYR 70 1.763 8.025 11.110
530 HE2 TYR 70 HE1 TYR 70 -1.572 8.343 8.467
531 HH TYR 70 HH TYR 70 -1.345 9.365 10.663
532 HB2 TYR 70 2HB TYR 70 0.599 4.427 7.183
533 HB3 TYR 70 1HB TYR 70 1.827 4.153 8.414
534 H GLY 71 H GLY 71 1.448 4.320 4.565
535 HA2 GLY 71 2HA GLY 71 0.633 6.980 3.576
536 HA3 GLY 71 1HA GLY 71 1.536 5.899 2.526
537 H PHE 72 H PHE 72 -1.228 7.005 2.322
538 HA PHE 72 HA PHE 72 -2.846 4.561 2.396
539 HD1 PHE 72 HD2 PHE 72 -2.525 8.146 4.065
540 HD2 PHE 72 HD1 PHE 72 -5.438 5.035 4.014
541 HE1 PHE 72 HE2 PHE 72 -2.761 8.332 6.506
542 HE2 PHE 72 HE1 PHE 72 -5.677 5.217 6.456
543 HZ PHE 72 HZ PHE 72 -4.340 6.868 7.708
544 HB2 PHE 72 2HB PHE 72 -3.636 7.455 1.984
545 HB3 PHE 72 1HB PHE 72 -4.761 6.101 1.979
546 H ILE 73 H ILE 73 -3.154 3.417 0.590
547 HA ILE 73 HA ILE 73 -2.615 4.690 -2.024
548 HB ILE 73 HB ILE 73 -2.387 1.789 -1.195
549 HG12 ILE 73 2HG1 ILE 73 -0.284 3.803 -2.043
550 HG13 ILE 73 1HG1 ILE 73 -0.574 3.262 -0.394
551 HG21 ILE 73 1HG2 ILE 73 -1.817 3.015 -3.896
552 HG22 ILE 73 2HG2 ILE 73 -3.197 1.986 -3.509
553 HG23 ILE 73 3HG2 ILE 73 -1.562 1.332 -3.437
554 HD11 ILE 73 3HD1 ILE 73 0.353 1.533 -2.679
555 HD12 ILE 73 1HD1 ILE 73 0.086 0.998 -1.018
556 HD13 ILE 73 2HD1 ILE 73 1.357 2.164 -1.376
557 H THR 74 H THR 74 -4.253 4.887 -3.438
558 HA THR 74 HA THR 74 -6.839 3.649 -2.750
559 HB THR 74 HB THR 74 -6.328 5.945 -4.656
560 HG1 THR 74 HG1 THR 74 -6.378 7.223 -2.962
561 HG21 THR 74 3HG2 THR 74 -8.441 4.745 -5.058
562 HG22 THR 74 1HG2 THR 74 -8.740 6.357 -4.404
563 HG23 THR 74 2HG2 THR 74 -8.879 4.943 -3.360
564 H PHE 75 H PHE 75 -7.480 1.932 -3.865
565 HA PHE 75 HA PHE 75 -6.635 1.552 -6.659
566 HD1 PHE 75 HD1 PHE 75 -5.793 -0.021 -3.297
567 HD2 PHE 75 HD2 PHE 75 -5.693 -1.410 -7.326
568 HE1 PHE 75 HE1 PHE 75 -3.505 -0.848 -2.956
569 HE2 PHE 75 HE2 PHE 75 -3.402 -2.239 -6.986
570 HZ PHE 75 HZ PHE 75 -2.312 -1.960 -4.797
571 HB2 PHE 75 2HB PHE 75 -7.860 -0.321 -4.629
572 HB3 PHE 75 1HB PHE 75 -7.753 -0.734 -6.336
573 H SER 76 H SER 76 -8.194 1.028 -8.308
574 HA SER 76 HA SER 76 -10.524 2.714 -8.153
575 HG SER 76 HG SER 76 -11.220 3.203 -10.589
576 HB2 SER 76 2HB SER 76 -9.157 2.493 -10.227
577 HB3 SER 76 1HB SER 76 -9.698 0.822 -10.376
578 H ASP 77 H ASP 77 -9.928 -0.543 -7.423
579 HA ASP 77 HA ASP 77 -12.815 -1.102 -7.276
580 HB2 ASP 77 2HB ASP 77 -11.980 -2.181 -9.294
581 HB3 ASP 77 1HB ASP 77 -10.692 -2.956 -8.379
582 H SER 78 H SER 78 -13.479 -2.222 -5.482
583 HA SER 78 HA SER 78 -11.734 -2.251 -3.228
584 HG SER 78 HG SER 78 -13.174 -2.873 -1.126
585 HB2 SER 78 2HB SER 78 -14.074 -1.797 -2.862
586 HB3 SER 78 1HB SER 78 -14.536 -3.344 -3.572
587 H GLU 79 H GLU 79 -12.664 -4.739 -5.527
588 HA GLU 79 HA GLU 79 -11.761 -6.873 -3.789
589 HB2 GLU 79 2HB GLU 79 -13.571 -6.993 -5.675
590 HB3 GLU 79 1HB GLU 79 -12.193 -7.239 -6.741
591 HG2 GLU 79 2HG GLU 79 -13.221 -9.354 -6.010
592 HG3 GLU 79 1HG GLU 79 -11.534 -9.215 -5.513
593 H CYS 80 H CYS 80 -10.515 -5.237 -6.706
594 HA CYS 80 HA CYS 80 -7.979 -6.467 -6.761
595 HG CYS 80 HG CYS 80 -6.226 -5.107 -9.184
596 HB2 CYS 80 2HB CYS 80 -8.760 -5.021 -8.583
597 HB3 CYS 80 1HB CYS 80 -8.724 -3.625 -7.513
598 H ALA 81 H ALA 81 -9.184 -3.678 -4.940
599 HA ALA 81 HA ALA 81 -6.821 -2.968 -3.615
600 HB1 ALA 81 3HB ALA 81 -8.254 -1.907 -1.947
601 HB2 ALA 81 1HB ALA 81 -9.652 -2.781 -2.574
602 HB3 ALA 81 2HB ALA 81 -8.839 -1.581 -3.580
603 H LYS 82 H LYS 82 -9.399 -5.241 -2.580
604 HA LYS 82 HA LYS 82 -8.032 -6.066 -0.222
605 HB2 LYS 82 2HB LYS 82 -10.281 -7.346 -1.776
606 HB3 LYS 82 1HB LYS 82 -9.622 -8.050 -0.303
607 HG2 LYS 82 2HG LYS 82 -10.149 -5.911 0.865
608 HG3 LYS 82 1HG LYS 82 -10.986 -5.380 -0.594
609 HD2 LYS 82 2HD LYS 82 -11.675 -7.733 1.173
610 HD3 LYS 82 1HD LYS 82 -12.611 -6.256 0.950
611 HE2 LYS 82 2HE LYS 82 -12.079 -8.365 -1.146
612 HE3 LYS 82 1HE LYS 82 -13.594 -8.119 -0.281
613 HZ1 LYS 82 3HZ LYS 82 -13.806 -5.956 -1.321
614 HZ2 LYS 82 1HZ LYS 82 -13.634 -7.158 -2.504
615 HZ3 LYS 82 2HZ LYS 82 -12.327 -6.152 -2.114
616 H LYS 83 H LYS 83 -7.804 -7.073 -3.552
617 HA LYS 83 HA LYS 83 -6.466 -9.526 -3.166
618 HB2 LYS 83 2HB LYS 83 -7.393 -8.681 -5.335
619 HB3 LYS 83 1HB LYS 83 -6.054 -7.548 -5.421
620 HG2 LYS 83 2HG LYS 83 -4.473 -9.406 -5.509
621 HG3 LYS 83 1HG LYS 83 -5.808 -10.553 -5.393
622 HD2 LYS 83 2HD LYS 83 -5.341 -8.568 -7.627
623 HD3 LYS 83 1HD LYS 83 -5.095 -10.314 -7.714
624 HE2 LYS 83 2HE LYS 83 -7.499 -10.658 -7.292
625 HE3 LYS 83 1HE LYS 83 -7.733 -8.911 -7.235
626 HZ1 LYS 83 3HZ LYS 83 -6.786 -10.461 -9.581
627 HZ2 LYS 83 1HZ LYS 83 -6.983 -8.781 -9.533
628 HZ3 LYS 83 2HZ LYS 83 -8.329 -9.797 -9.384
629 H ALA 84 H ALA 84 -5.107 -6.294 -3.863
630 HA ALA 84 HA ALA 84 -2.423 -6.901 -3.280
631 HB1 ALA 84 3HB ALA 84 -3.852 -4.249 -2.989
632 HB2 ALA 84 1HB ALA 84 -3.129 -4.874 -4.471
633 HB3 ALA 84 2HB ALA 84 -2.105 -4.482 -3.091
634 H LEU 85 H LEU 85 -4.905 -5.397 -1.233
635 HA LEU 85 HA LEU 85 -3.568 -5.042 1.137
636 HG LEU 85 HG LEU 85 -5.182 -4.232 2.962
637 HB2 LEU 85 2HB LEU 85 -5.934 -4.397 0.538
638 HB3 LEU 85 1HB LEU 85 -6.413 -6.045 0.873
639 HD11 LEU 85 1HD1 LEU 85 -7.257 -3.249 2.135
640 HD12 LEU 85 2HD1 LEU 85 -7.450 -3.854 3.779
641 HD13 LEU 85 3HD1 LEU 85 -8.101 -4.769 2.418
642 HD21 LEU 85 3HD2 LEU 85 -6.191 -5.804 4.547
643 HD22 LEU 85 1HD2 LEU 85 -5.036 -6.609 3.485
644 HD23 LEU 85 2HD2 LEU 85 -6.766 -6.792 3.202
645 H GLU 86 H GLU 86 -5.545 -7.914 0.383
646 HA GLU 86 HA GLU 86 -4.855 -9.252 2.771
647 HB2 GLU 86 2HB GLU 86 -6.259 -10.124 0.255
648 HB3 GLU 86 1HB GLU 86 -6.006 -11.221 1.610
649 HG2 GLU 86 2HG GLU 86 -7.414 -8.569 1.860
650 HG3 GLU 86 1HG GLU 86 -8.249 -10.078 1.498
651 H GLN 87 H GLN 87 -3.260 -9.206 -0.343
652 HA GLN 87 HA GLN 87 -1.660 -11.544 0.409
653 HB2 GLN 87 2HB GLN 87 -1.962 -9.965 -2.113
654 HB3 GLN 87 1HB GLN 87 -0.491 -10.893 -1.865
655 HG2 GLN 87 2HG GLN 87 -1.996 -12.226 -3.132
656 HG3 GLN 87 1HG GLN 87 -1.889 -12.920 -1.518
657 HE21 GLN 87 1HE2 GLN 87 -3.916 -11.348 -3.828
658 HE22 GLN 87 2HE2 GLN 87 -5.400 -11.545 -2.968
659 H LEU 88 H LEU 88 -1.476 -8.159 0.801
660 HA LEU 88 HA LEU 88 1.468 -8.278 1.002
661 HG LEU 88 HG LEU 88 0.070 -7.220 -1.509
662 HB2 LEU 88 2HB LEU 88 -0.341 -5.909 0.542
663 HB3 LEU 88 1HB LEU 88 1.387 -5.791 0.810
664 HD11 LEU 88 1HD1 LEU 88 0.977 -5.419 -2.878
665 HD12 LEU 88 2HD1 LEU 88 1.601 -4.621 -1.433
666 HD13 LEU 88 3HD1 LEU 88 -0.141 -4.795 -1.665
667 HD21 LEU 88 3HD2 LEU 88 2.991 -6.739 -0.904
668 HD22 LEU 88 1HD2 LEU 88 2.353 -7.413 -2.404
669 HD23 LEU 88 2HD2 LEU 88 2.161 -8.296 -0.888
670 H ASN 89 H ASN 89 -1.338 -7.928 2.977
671 HA ASN 89 HA ASN 89 -0.101 -6.433 5.070
672 HB2 ASN 89 2HB ASN 89 -1.957 -7.464 6.513
673 HB3 ASN 89 1HB ASN 89 -2.433 -6.421 5.181
674 HD21 ASN 89 1HD2 ASN 89 -4.453 -7.321 5.110
675 HD22 ASN 89 2HD2 ASN 89 -4.749 -8.882 4.440
676 H GLY 90 H GLY 90 1.796 -7.144 5.755
677 HA2 GLY 90 2HA GLY 90 2.860 -8.577 7.445
678 HA3 GLY 90 1HA GLY 90 2.002 -9.936 6.732
679 H PHE 91 H PHE 91 2.859 -8.123 4.173
680 HA PHE 91 HA PHE 91 4.898 -9.843 3.248
681 HD1 PHE 91 HD2 PHE 91 4.932 -10.168 0.427
682 HD2 PHE 91 HD1 PHE 91 6.009 -6.151 1.352
683 HE1 PHE 91 HE2 PHE 91 6.630 -10.217 -1.351
684 HE2 PHE 91 HE1 PHE 91 7.707 -6.197 -0.427
685 HZ PHE 91 HZ PHE 91 8.021 -8.231 -1.781
686 HB2 PHE 91 2HB PHE 91 3.425 -8.632 1.723
687 HB3 PHE 91 1HB PHE 91 4.051 -7.092 2.294
688 H GLU 92 H GLU 92 7.049 -9.830 3.579
689 HA GLU 92 HA GLU 92 8.231 -7.842 5.288
690 HB2 GLU 92 2HB GLU 92 8.875 -10.204 5.457
691 HB3 GLU 92 1HB GLU 92 9.502 -10.167 3.816
692 HG2 GLU 92 2HG GLU 92 11.261 -8.674 4.446
693 HG3 GLU 92 1HG GLU 92 10.561 -8.440 6.046
694 H LEU 93 H LEU 93 8.296 -5.886 4.281
695 HA LEU 93 HA LEU 93 9.632 -5.637 1.680
696 HG LEU 93 HG LEU 93 9.736 -2.429 2.056
697 HB2 LEU 93 2HB LEU 93 7.523 -4.487 1.883
698 HB3 LEU 93 1HB LEU 93 8.046 -3.687 3.352
699 HD11 LEU 93 1HD1 LEU 93 9.621 -2.427 -0.399
700 HD12 LEU 93 2HD1 LEU 93 8.475 -3.766 -0.337
701 HD13 LEU 93 3HD1 LEU 93 10.124 -3.989 0.245
702 HD21 LEU 93 3HD2 LEU 93 8.167 -0.935 0.912
703 HD22 LEU 93 1HD2 LEU 93 7.547 -1.436 2.484
704 HD23 LEU 93 2HD2 LEU 93 6.912 -2.169 1.010
705 H ALA 94 H ALA 94 11.737 -5.165 1.596
706 HA ALA 94 HA ALA 94 13.828 -4.431 2.112
707 HB1 ALA 94 3HB ALA 94 14.038 -2.231 3.130
708 HB2 ALA 94 1HB ALA 94 12.363 -2.305 3.680
709 HB3 ALA 94 2HB ALA 94 12.724 -2.244 1.954
710 H GLY 95 H GLY 95 12.350 -6.281 4.002
711 HA2 GLY 95 2HA GLY 95 13.331 -7.566 5.729
712 HA3 GLY 95 1HA GLY 95 14.333 -6.192 6.164
713 H ARG 96 H ARG 96 11.137 -5.222 5.726
714 HA ARG 96 HA ARG 96 10.482 -5.588 8.581
715 HE ARG 96 HE ARG 96 8.991 -1.688 11.206
716 HB2 ARG 96 2HB ARG 96 11.376 -3.293 8.088
717 HB3 ARG 96 1HB ARG 96 10.022 -3.047 6.995
718 HG2 ARG 96 2HG ARG 96 8.473 -3.368 8.906
719 HG3 ARG 96 1HG ARG 96 9.871 -3.500 9.975
720 HD2 ARG 96 2HD ARG 96 10.576 -1.219 9.126
721 HD3 ARG 96 1HD ARG 96 8.990 -1.105 8.363
722 HH11 ARG 96 1HH1 ARG 96 8.652 0.683 8.736
723 HH12 ARG 96 2HH1 ARG 96 8.017 1.870 9.813
724 HH21 ARG 96 1HH2 ARG 96 8.147 -0.173 12.571
725 HH22 ARG 96 2HH2 ARG 96 7.740 1.397 11.971
726 HA PRO 97 HA PRO 97 6.610 -7.156 6.881
727 HB2 PRO 97 2HB PRO 97 5.092 -6.803 9.172
728 HB3 PRO 97 1HB PRO 97 6.127 -8.198 8.855
729 HG2 PRO 97 2HG PRO 97 6.700 -5.748 10.479
730 HG3 PRO 97 1HG PRO 97 7.088 -7.444 10.836
731 HD2 PRO 97 2HD PRO 97 8.957 -5.756 9.919
732 HD3 PRO 97 1HD PRO 97 8.922 -7.453 9.395
733 H MET 98 H MET 98 5.044 -6.163 5.721
734 HA MET 98 HA MET 98 4.589 -3.299 6.177
735 HB2 MET 98 2HB MET 98 5.371 -3.973 3.952
736 HB3 MET 98 1HB MET 98 3.980 -5.032 3.770
737 HG2 MET 98 2HG MET 98 2.485 -3.193 3.666
738 HG3 MET 98 1HG MET 98 3.744 -2.059 4.151
739 HE1 MET 98 3HE MET 98 3.756 -4.239 0.077
740 HE2 MET 98 1HE MET 98 2.580 -4.555 1.351
741 HE3 MET 98 2HE MET 98 4.267 -5.016 1.578
742 H LYS 99 H LYS 99 2.814 -2.671 7.191
743 HA LYS 99 HA LYS 99 0.623 -4.550 7.597
744 HB2 LYS 99 2HB LYS 99 1.174 -1.824 8.796
745 HB3 LYS 99 1HB LYS 99 -0.143 -2.895 9.278
746 HG2 LYS 99 2HG LYS 99 1.484 -4.577 10.002
747 HG3 LYS 99 1HG LYS 99 2.806 -3.518 9.509
748 HD2 LYS 99 2HD LYS 99 2.002 -1.829 11.145
749 HD3 LYS 99 1HD LYS 99 0.761 -2.968 11.669
750 HE2 LYS 99 2HE LYS 99 2.509 -4.559 12.338
751 HE3 LYS 99 1HE LYS 99 3.747 -3.413 11.825
752 HZ1 LYS 99 3HZ LYS 99 3.402 -3.312 14.204
753 HZ2 LYS 99 1HZ LYS 99 1.762 -2.971 13.987
754 HZ3 LYS 99 2HZ LYS 99 2.928 -1.855 13.492
755 H VAL 100 H VAL 100 -0.788 -4.596 5.914
756 HA VAL 100 HA VAL 100 -1.855 -2.027 4.891
757 HB VAL 100 HB VAL 100 -1.974 -4.720 3.496
758 HG11 VAL 100 1HG1 VAL 100 -2.449 -1.911 2.468
759 HG12 VAL 100 2HG1 VAL 100 -3.697 -3.111 2.813
760 HG13 VAL 100 3HG1 VAL 100 -2.537 -3.394 1.515
761 HG21 VAL 100 3HG2 VAL 100 0.361 -4.040 3.731
762 HG22 VAL 100 1HG2 VAL 100 -0.013 -2.452 3.060
763 HG23 VAL 100 2HG2 VAL 100 -0.161 -3.894 2.053
764 H GLY 101 H GLY 101 -3.827 -1.566 5.815
765 HA2 GLY 101 2HA GLY 101 -5.886 -3.653 5.689
766 HA3 GLY 101 1HA GLY 101 -5.511 -3.033 7.282
767 H HIS 102 H HIS 102 -6.631 -2.030 4.056
768 HA HIS 102 HA HIS 102 -7.974 -0.306 3.352
769 HD1 HIS 102 HD1 HIS 102 -10.682 0.180 6.802
770 HD2 HIS 102 HD2 HIS 102 -9.144 -3.637 6.231
771 HE1 HIS 102 HE1 HIS 102 -10.988 -1.000 8.989
772 HE2 HIS 102 HE2 HIS 102 -9.885 -3.236 8.678
773 HB2 HIS 102 2HB HIS 102 -10.240 -0.424 4.323
774 HB3 HIS 102 1HB HIS 102 -9.573 -2.011 3.982
775 H VAL 103 H VAL 103 -9.839 1.390 4.606
776 HA VAL 103 HA VAL 103 -8.148 3.271 6.016
777 HB VAL 103 HB VAL 103 -11.154 3.409 5.620
778 HG11 VAL 103 1HG1 VAL 103 -9.132 5.565 6.261
779 HG12 VAL 103 2HG1 VAL 103 -10.309 4.881 7.386
780 HG13 VAL 103 3HG1 VAL 103 -10.857 5.813 5.992
781 HG21 VAL 103 3HG2 VAL 103 -10.014 3.238 3.460
782 HG22 VAL 103 1HG2 VAL 103 -8.946 4.570 3.908
783 HG23 VAL 103 2HG2 VAL 103 -10.674 4.857 3.697
784 H THR 104 H THR 104 -7.791 3.227 8.143
785 HA THR 104 HA THR 104 -8.367 0.980 9.616
786 HB THR 104 HB THR 104 -7.505 2.202 11.610
787 HG1 THR 104 HG1 THR 104 -6.734 4.399 11.124
788 HG21 THR 104 3HG2 THR 104 -5.939 2.597 9.050
789 HG22 THR 104 1HG2 THR 104 -5.946 1.144 10.051
790 HG23 THR 104 2HG2 THR 104 -5.269 2.645 10.680
791 H GLU 105 H GLU 105 -9.432 4.072 11.050
792 HA GLU 105 HA GLU 105 -11.216 2.519 12.693
793 HB2 GLU 105 2HB GLU 105 -10.736 5.502 12.706
794 HB3 GLU 105 1HB GLU 105 -11.545 4.574 13.962
795 HG2 GLU 105 2HG GLU 105 -8.638 4.513 13.195
796 HG3 GLU 105 1HG GLU 105 -9.349 5.001 14.732
797 H ARG 106 H ARG 106 -13.421 3.014 13.145
798 HA ARG 106 HA ARG 106 -14.941 4.360 11.012
799 HE ARG 106 HE ARG 106 -17.551 -1.082 13.034
800 HB2 ARG 106 2HB ARG 106 -16.465 2.495 10.782
801 HB3 ARG 106 1HB ARG 106 -14.828 1.909 10.519
802 HG2 ARG 106 2HG ARG 106 -14.785 1.051 12.835
803 HG3 ARG 106 1HG ARG 106 -16.449 1.595 13.046
804 HD2 ARG 106 2HD ARG 106 -17.085 0.111 11.127
805 HD3 ARG 106 1HD ARG 106 -15.438 -0.520 11.140
806 HH11 ARG 106 1HH1 ARG 106 -14.156 -1.215 12.412
807 HH12 ARG 106 2HH1 ARG 106 -13.879 -2.421 13.619
808 HH21 ARG 106 1HH2 ARG 106 -17.176 -2.654 14.541
809 HH22 ARG 106 2HH2 ARG 106 -15.569 -3.239 14.787
810 H THR 107 H THR 107 -17.516 3.794 11.906
811 HA THR 107 HA THR 107 -17.703 5.407 14.284
812 HB THR 107 HB THR 107 -19.953 3.907 12.917
813 HG1 THR 107 HG1 THR 107 -19.997 6.488 12.303
814 HG21 THR 107 3HG2 THR 107 -20.543 4.719 15.142
815 HG22 THR 107 1HG2 THR 107 -21.371 5.671 13.912
816 HG23 THR 107 2HG2 THR 107 -19.956 6.330 14.733
817 H ASP 108 H ASP 108 -16.625 4.138 15.873
818 HA ASP 108 HA ASP 108 -16.514 2.779 17.684
819 HB2 ASP 108 2HB ASP 108 -18.692 4.002 18.069
820 HB3 ASP 108 1HB ASP 108 -19.526 2.577 17.452
Start of MODEL 16
1 HA MET 1 HA MET 1 -40.440 16.717 12.970
2 H1 MET 1 1H MET 1 -39.705 17.250 15.788
3 H2 MET 1 2H MET 1 -41.071 16.423 15.234
4 H3 MET 1 3H MET 1 -40.906 18.077 14.935
5 HB2 MET 1 2HB MET 1 -38.366 17.841 12.340
6 HB3 MET 1 1HB MET 1 -39.400 18.946 13.236
7 HG2 MET 1 2HG MET 1 -38.053 18.757 15.188
8 HG3 MET 1 1HG MET 1 -37.148 17.405 14.514
9 HE1 MET 1 3HE MET 1 -37.846 21.274 14.285
10 HE2 MET 1 1HE MET 1 -38.224 20.707 12.658
11 HE3 MET 1 2HE MET 1 -36.814 21.731 12.927
12 H GLY 2 H GLY 2 -38.508 15.570 11.878
13 HA2 GLY 2 2HA GLY 2 -37.733 13.248 13.368
14 HA3 GLY 2 1HA GLY 2 -37.160 13.695 11.765
15 H HIS 3 H HIS 3 -36.698 14.228 15.212
16 HA HIS 3 HA HIS 3 -34.519 16.003 15.039
17 HD1 HIS 3 HD1 HIS 3 -33.611 13.243 18.482
18 HD2 HIS 3 HD2 HIS 3 -37.511 13.467 17.064
19 HE1 HIS 3 HE1 HIS 3 -34.754 11.181 19.333
20 HE2 HIS 3 HE2 HIS 3 -37.144 11.411 18.588
21 HB2 HIS 3 2HB HIS 3 -34.117 15.460 17.424
22 HB3 HIS 3 1HB HIS 3 -35.804 15.826 17.084
23 H HIS 4 H HIS 4 -33.068 15.160 13.476
24 HA HIS 4 HA HIS 4 -31.540 12.770 14.220
25 HD1 HIS 4 HD1 HIS 4 -33.930 13.974 11.147
26 HD2 HIS 4 HD2 HIS 4 -31.557 10.617 11.752
27 HE1 HIS 4 HE1 HIS 4 -35.273 12.038 10.288
28 HE2 HIS 4 HE2 HIS 4 -33.903 10.011 10.854
29 HB2 HIS 4 2HB HIS 4 -31.484 14.519 11.751
30 HB3 HIS 4 1HB HIS 4 -30.392 13.165 12.010
31 H HIS 5 H HIS 5 -30.745 16.104 13.175
32 HA HIS 5 HA HIS 5 -29.183 17.606 13.858
33 HD1 HIS 5 HD1 HIS 5 -31.217 15.989 17.589
34 HD2 HIS 5 HD2 HIS 5 -30.625 19.431 15.331
35 HE1 HIS 5 HE1 HIS 5 -33.224 17.436 18.022
36 HE2 HIS 5 HE2 HIS 5 -32.764 19.570 16.772
37 HB2 HIS 5 2HB HIS 5 -29.080 15.918 16.364
38 HB3 HIS 5 1HB HIS 5 -28.374 17.520 16.196
39 H HIS 6 H HIS 6 -28.289 14.375 13.378
40 HA HIS 6 HA HIS 6 -25.525 14.646 14.206
41 HD1 HIS 6 HD1 HIS 6 -24.401 12.421 15.648
42 HD2 HIS 6 HD2 HIS 6 -24.662 11.082 11.721
43 HE1 HIS 6 HE1 HIS 6 -22.322 11.074 15.256
44 HE2 HIS 6 HE2 HIS 6 -22.587 10.139 12.938
45 HB2 HIS 6 2HB HIS 6 -26.834 12.536 14.516
46 HB3 HIS 6 1HB HIS 6 -26.865 12.338 12.767
47 H HIS 7 H HIS 7 -25.491 16.548 12.556
48 HA HIS 7 HA HIS 7 -24.781 15.621 9.850
49 HD1 HIS 7 HD1 HIS 7 -26.704 18.632 7.876
50 HD2 HIS 7 HD2 HIS 7 -27.796 16.204 11.066
51 HE1 HIS 7 HE1 HIS 7 -29.109 18.042 7.480
52 HE2 HIS 7 HE2 HIS 7 -29.684 16.418 9.308
53 HB2 HIS 7 2HB HIS 7 -25.383 18.373 10.961
54 HB3 HIS 7 1HB HIS 7 -24.766 18.108 9.334
55 H HIS 8 H HIS 8 -22.676 15.396 9.311
56 HA HIS 8 HA HIS 8 -20.648 16.281 11.187
57 HD1 HIS 8 HD1 HIS 8 -22.222 13.660 8.242
58 HD2 HIS 8 HD2 HIS 8 -18.531 15.203 7.109
59 HE1 HIS 8 HE1 HIS 8 -22.049 13.252 5.773
60 HE2 HIS 8 HE2 HIS 8 -19.741 14.037 5.147
61 HB2 HIS 8 2HB HIS 8 -19.047 15.044 9.792
62 HB3 HIS 8 1HB HIS 8 -20.427 14.047 10.227
63 H SER 9 H SER 9 -20.606 18.505 11.064
64 HA SER 9 HA SER 9 -20.405 19.979 8.653
65 HG SER 9 HG SER 9 -21.610 21.844 11.433
66 HB2 SER 9 2HB SER 9 -19.584 20.782 11.459
67 HB3 SER 9 1HB SER 9 -19.720 21.886 10.090
68 H HIS 10 H HIS 10 -18.834 18.966 7.413
69 HA HIS 10 HA HIS 10 -16.136 19.946 7.831
70 HD1 HIS 10 HD1 HIS 10 -14.864 15.762 6.498
71 HD2 HIS 10 HD2 HIS 10 -13.482 19.220 8.344
72 HE1 HIS 10 HE1 HIS 10 -12.399 15.830 6.036
73 HE2 HIS 10 HE2 HIS 10 -11.561 17.806 7.341
74 HB2 HIS 10 2HB HIS 10 -16.120 17.800 9.059
75 HB3 HIS 10 1HB HIS 10 -16.685 16.967 7.618
76 H MET 11 H MET 11 -14.871 19.902 5.874
77 HA MET 11 HA MET 11 -16.181 20.517 3.543
78 HB2 MET 11 2HB MET 11 -13.823 21.038 3.971
79 HB3 MET 11 1HB MET 11 -13.403 19.340 3.799
80 HG2 MET 11 2HG MET 11 -14.076 19.391 1.460
81 HG3 MET 11 1HG MET 11 -14.570 21.075 1.623
82 HE1 MET 11 3HE MET 11 -11.138 22.863 2.258
83 HE2 MET 11 1HE MET 11 -12.278 22.274 3.465
84 HE3 MET 11 2HE MET 11 -12.872 23.090 2.019
85 H ALA 12 H ALA 12 -15.050 17.320 4.524
86 HA ALA 12 HA ALA 12 -15.827 16.031 2.085
87 HB1 ALA 12 3HB ALA 12 -15.239 14.824 4.789
88 HB2 ALA 12 1HB ALA 12 -14.061 15.118 3.510
89 HB3 ALA 12 2HB ALA 12 -15.357 13.949 3.260
90 H ALA 13 H ALA 13 -18.005 16.803 1.852
91 HA ALA 13 HA ALA 13 -19.934 15.196 3.411
92 HB1 ALA 13 3HB ALA 13 -20.375 18.026 2.447
93 HB2 ALA 13 1HB ALA 13 -20.088 17.539 4.116
94 HB3 ALA 13 2HB ALA 13 -21.556 17.021 3.286
95 H ALA 14 H ALA 14 -19.795 13.632 1.748
96 HA ALA 14 HA ALA 14 -21.704 13.759 -0.304
97 HB1 ALA 14 3HB ALA 14 -20.308 13.827 -2.314
98 HB2 ALA 14 1HB ALA 14 -18.874 14.094 -1.320
99 HB3 ALA 14 2HB ALA 14 -20.142 15.317 -1.386
100 H MET 15 H MET 15 -18.668 12.362 0.794
101 HA MET 15 HA MET 15 -17.924 10.245 1.060
102 HB2 MET 15 2HB MET 15 -20.125 9.845 2.101
103 HB3 MET 15 1HB MET 15 -20.788 9.420 0.530
104 HG2 MET 15 2HG MET 15 -19.291 7.503 0.400
105 HG3 MET 15 1HG MET 15 -18.575 7.944 1.950
106 HE1 MET 15 3HE MET 15 -22.402 8.120 0.924
107 HE2 MET 15 1HE MET 15 -22.944 6.519 1.431
108 HE3 MET 15 2HE MET 15 -21.794 6.682 0.102
109 H ALA 16 H ALA 16 -20.385 9.693 -1.468
110 HA ALA 16 HA ALA 16 -18.342 8.377 -3.123
111 HB1 ALA 16 3HB ALA 16 -20.232 7.468 -4.382
112 HB2 ALA 16 1HB ALA 16 -21.351 8.416 -3.402
113 HB3 ALA 16 2HB ALA 16 -20.396 7.132 -2.660
114 H ASN 17 H ASN 17 -18.071 11.132 -3.014
115 HA ASN 17 HA ASN 17 -17.880 13.027 -4.245
116 HB2 ASN 17 2HB ASN 17 -18.225 11.034 -6.494
117 HB3 ASN 17 1HB ASN 17 -17.879 12.736 -6.772
118 HD21 ASN 17 1HD2 ASN 17 -15.867 13.551 -6.241
119 HD22 ASN 17 2HD2 ASN 17 -14.515 12.528 -5.915
120 H ASN 18 H ASN 18 -19.128 14.066 -6.459
121 HA ASN 18 HA ASN 18 -21.881 14.335 -5.459
122 HB2 ASN 18 2HB ASN 18 -20.220 16.227 -7.139
123 HB3 ASN 18 1HB ASN 18 -21.875 16.531 -6.609
124 HD21 ASN 18 1HD2 ASN 18 -22.267 16.931 -4.422
125 HD22 ASN 18 2HD2 ASN 18 -20.996 17.382 -3.342
126 H LEU 19 H LEU 19 -20.070 13.466 -8.339
127 HA LEU 19 HA LEU 19 -22.643 12.920 -9.670
128 HG LEU 19 HG LEU 19 -19.363 14.558 -10.115
129 HB2 LEU 19 2HB LEU 19 -21.663 13.651 -11.833
130 HB3 LEU 19 1HB LEU 19 -21.885 14.938 -10.665
131 HD11 LEU 19 1HD1 LEU 19 -19.519 13.323 -12.864
132 HD12 LEU 19 2HD1 LEU 19 -19.016 12.523 -11.375
133 HD13 LEU 19 3HD1 LEU 19 -18.034 13.820 -12.053
134 HD21 LEU 19 3HD2 LEU 19 -18.718 16.160 -11.838
135 HD22 LEU 19 1HD2 LEU 19 -20.267 16.590 -11.118
136 HD23 LEU 19 2HD2 LEU 19 -20.215 15.839 -12.714
137 H GLN 20 H GLN 20 -20.237 11.353 -8.369
138 HA GLN 20 HA GLN 20 -19.400 9.599 -10.494
139 HB2 GLN 20 2HB GLN 20 -17.965 9.963 -8.542
140 HB3 GLN 20 1HB GLN 20 -19.194 9.270 -7.491
141 HG2 GLN 20 2HG GLN 20 -18.958 7.118 -8.680
142 HG3 GLN 20 1HG GLN 20 -17.676 7.825 -9.661
143 HE21 GLN 20 1HE2 GLN 20 -16.565 9.339 -7.417
144 HE22 GLN 20 2HE2 GLN 20 -15.770 8.189 -6.415
145 H LYS 21 H LYS 21 -20.659 8.088 -11.392
146 HA LYS 21 HA LYS 21 -23.032 7.118 -10.014
147 HB2 LYS 21 2HB LYS 21 -23.547 5.988 -12.163
148 HB3 LYS 21 1HB LYS 21 -23.301 7.720 -12.334
149 HG2 LYS 21 2HG LYS 21 -21.071 7.351 -13.217
150 HG3 LYS 21 1HG LYS 21 -21.239 5.610 -12.971
151 HD2 LYS 21 2HD LYS 21 -23.092 5.566 -14.580
152 HD3 LYS 21 1HD LYS 21 -22.937 7.307 -14.818
153 HE2 LYS 21 2HE LYS 21 -20.687 7.002 -15.702
154 HE3 LYS 21 1HE LYS 21 -20.788 5.267 -15.413
155 HZ1 LYS 21 3HZ LYS 21 -22.605 6.757 -17.222
156 HZ2 LYS 21 1HZ LYS 21 -22.511 5.080 -17.032
157 HZ3 LYS 21 2HZ LYS 21 -21.226 5.925 -17.738
158 H GLY 22 H GLY 22 -23.055 5.342 -8.812
159 HA2 GLY 22 2HA GLY 22 -22.408 2.813 -9.303
160 HA3 GLY 22 1HA GLY 22 -20.818 3.462 -8.934
161 H SER 23 H SER 23 -21.728 1.431 -7.412
162 HA SER 23 HA SER 23 -22.618 2.691 -4.889
163 HG SER 23 HG SER 23 -24.463 1.908 -5.970
164 HB2 SER 23 2HB SER 23 -22.770 -0.209 -5.755
165 HB3 SER 23 1HB SER 23 -23.258 0.397 -4.171
166 H ALA 24 H ALA 24 -20.014 1.007 -6.405
167 HA ALA 24 HA ALA 24 -18.278 1.542 -4.181
168 HB1 ALA 24 3HB ALA 24 -17.598 -0.757 -3.730
169 HB2 ALA 24 1HB ALA 24 -18.791 -1.354 -4.883
170 HB3 ALA 24 2HB ALA 24 -19.319 -0.546 -3.407
171 H GLY 25 H GLY 25 -16.236 1.865 -4.885
172 HA2 GLY 25 2HA GLY 25 -15.137 0.484 -7.169
173 HA3 GLY 25 1HA GLY 25 -15.518 2.166 -7.501
174 HA PRO 26 HA PRO 26 -11.615 3.445 -5.900
175 HB2 PRO 26 2HB PRO 26 -12.204 5.677 -4.426
176 HB3 PRO 26 1HB PRO 26 -12.182 5.646 -6.193
177 HG2 PRO 26 2HG PRO 26 -14.518 5.434 -4.322
178 HG3 PRO 26 1HG PRO 26 -14.365 6.370 -5.822
179 HD2 PRO 26 2HD PRO 26 -15.669 4.012 -5.755
180 HD3 PRO 26 1HD PRO 26 -14.723 4.515 -7.170
181 H MET 27 H MET 27 -10.902 1.863 -4.538
182 HA MET 27 HA MET 27 -11.802 1.825 -1.738
183 HB2 MET 27 2HB MET 27 -11.671 -0.236 -3.341
184 HB3 MET 27 1HB MET 27 -9.949 -0.187 -3.000
185 HG2 MET 27 2HG MET 27 -12.149 -0.506 -0.967
186 HG3 MET 27 1HG MET 27 -11.107 -1.788 -1.582
187 HE1 MET 27 3HE MET 27 -11.516 -1.244 1.535
188 HE2 MET 27 1HE MET 27 -9.850 -1.434 2.081
189 HE3 MET 27 2HE MET 27 -10.503 -2.514 0.851
190 H ARG 28 H ARG 28 -10.321 2.042 -0.003
191 HA ARG 28 HA ARG 28 -7.719 3.230 -0.755
192 HE ARG 28 HE ARG 28 -8.579 7.859 1.117
193 HB2 ARG 28 2HB ARG 28 -9.362 4.894 0.068
194 HB3 ARG 28 1HB ARG 28 -9.481 4.008 1.580
195 HG2 ARG 28 2HG ARG 28 -6.992 4.398 1.858
196 HG3 ARG 28 1HG ARG 28 -7.114 5.523 0.505
197 HD2 ARG 28 2HD ARG 28 -8.643 5.705 3.107
198 HD3 ARG 28 1HD ARG 28 -7.245 6.678 2.662
199 HH11 ARG 28 1HH1 ARG 28 -10.393 5.490 2.844
200 HH12 ARG 28 2HH1 ARG 28 -11.906 6.244 2.508
201 HH21 ARG 28 1HH2 ARG 28 -10.521 8.836 0.725
202 HH22 ARG 28 2HH2 ARG 28 -11.979 8.115 1.316
203 H LEU 29 H LEU 29 -6.073 1.991 -0.127
204 HA LEU 29 HA LEU 29 -6.322 0.278 2.245
205 HG LEU 29 HG LEU 29 -6.181 -0.514 -0.917
206 HB2 LEU 29 2HB LEU 29 -4.159 0.335 0.130
207 HB3 LEU 29 1HB LEU 29 -4.298 -0.836 1.428
208 HD11 LEU 29 1HD1 LEU 29 -5.395 -2.737 -1.535
209 HD12 LEU 29 2HD1 LEU 29 -4.307 -2.755 -0.148
210 HD13 LEU 29 3HD1 LEU 29 -4.054 -1.596 -1.455
211 HD21 LEU 29 3HD2 LEU 29 -7.441 -1.106 1.086
212 HD22 LEU 29 1HD2 LEU 29 -6.327 -2.435 1.408
213 HD23 LEU 29 2HD2 LEU 29 -7.354 -2.473 -0.025
214 H TYR 30 H TYR 30 -5.353 0.777 4.106
215 HA TYR 30 HA TYR 30 -3.439 2.978 4.231
216 HD1 TYR 30 HD1 TYR 30 -2.723 4.413 6.359
217 HD2 TYR 30 HD2 TYR 30 -3.995 0.803 8.229
218 HE1 TYR 30 HE1 TYR 30 -1.152 4.815 8.202
219 HE2 TYR 30 HE2 TYR 30 -2.419 1.200 10.075
220 HH TYR 30 HH TYR 30 -0.354 2.419 10.481
221 HB2 TYR 30 2HB TYR 30 -5.067 3.174 5.915
222 HB3 TYR 30 1HB TYR 30 -5.036 1.455 6.282
223 H VAL 31 H VAL 31 -1.350 2.552 3.982
224 HA VAL 31 HA VAL 31 -0.263 -0.056 4.835
225 HB VAL 31 HB VAL 31 0.945 1.959 2.919
226 HG11 VAL 31 1HG1 VAL 31 1.823 -0.847 3.627
227 HG12 VAL 31 2HG1 VAL 31 2.644 0.646 4.083
228 HG13 VAL 31 3HG1 VAL 31 2.549 0.174 2.386
229 HG21 VAL 31 3HG2 VAL 31 -1.059 0.932 1.973
230 HG22 VAL 31 1HG2 VAL 31 -0.436 -0.676 2.356
231 HG23 VAL 31 2HG2 VAL 31 0.383 0.327 1.160
232 H GLY 32 H GLY 32 0.544 0.079 6.864
233 HA2 GLY 32 2HA GLY 32 2.062 2.510 7.621
234 HA3 GLY 32 1HA GLY 32 1.208 1.475 8.752
235 H SER 33 H SER 33 4.064 1.793 6.746
236 HA SER 33 HA SER 33 5.741 0.567 8.670
237 HG SER 33 HG SER 33 5.856 -1.594 5.408
238 HB2 SER 33 2HB SER 33 6.450 -1.440 7.406
239 HB3 SER 33 1HB SER 33 4.748 -1.524 7.861
240 H LEU 34 H LEU 34 5.493 2.849 6.640
241 HA LEU 34 HA LEU 34 7.669 2.394 4.772
242 HG LEU 34 HG LEU 34 4.422 3.425 4.803
243 HB2 LEU 34 2HB LEU 34 6.211 4.994 5.228
244 HB3 LEU 34 1HB LEU 34 7.070 4.475 3.789
245 HD11 LEU 34 1HD1 LEU 34 3.572 4.309 2.668
246 HD12 LEU 34 2HD1 LEU 34 5.172 4.971 2.320
247 HD13 LEU 34 3HD1 LEU 34 4.248 5.570 3.698
248 HD21 LEU 34 3HD2 LEU 34 6.031 2.502 2.420
249 HD22 LEU 34 1HD2 LEU 34 4.384 2.002 2.808
250 HD23 LEU 34 2HD2 LEU 34 5.711 1.575 3.887
251 H HIS 35 H HIS 35 9.430 2.157 6.307
252 HA HIS 35 HA HIS 35 9.954 4.312 8.148
253 HD1 HIS 35 HD1 HIS 35 13.910 2.421 7.571
254 HD2 HIS 35 HD2 HIS 35 10.617 0.042 6.696
255 HE1 HIS 35 HE1 HIS 35 14.803 0.518 6.207
256 HE2 HIS 35 HE2 HIS 35 12.827 -0.975 5.802
257 HB2 HIS 35 2HB HIS 35 11.854 3.030 8.922
258 HB3 HIS 35 1HB HIS 35 10.447 1.994 8.774
259 H PHE 36 H PHE 36 10.029 5.976 6.522
260 HA PHE 36 HA PHE 36 11.012 7.443 5.088
261 HD1 PHE 36 HD1 PHE 36 14.916 6.457 6.301
262 HD2 PHE 36 HD2 PHE 36 11.893 7.302 9.183
263 HE1 PHE 36 HE1 PHE 36 16.218 5.267 8.009
264 HE2 PHE 36 HE2 PHE 36 13.194 6.106 10.895
265 HZ PHE 36 HZ PHE 36 15.360 5.087 10.310
266 HB2 PHE 36 2HB PHE 36 13.199 8.332 6.029
267 HB3 PHE 36 1HB PHE 36 11.803 8.333 7.092
268 H ASN 37 H ASN 37 11.589 4.646 4.186
269 HA ASN 37 HA ASN 37 13.648 5.460 2.255
270 HB2 ASN 37 2HB ASN 37 13.640 2.848 3.779
271 HB3 ASN 37 1HB ASN 37 14.545 3.084 2.288
272 HD21 ASN 37 1HD2 ASN 37 14.309 3.927 5.648
273 HD22 ASN 37 2HD2 ASN 37 15.884 4.617 5.780
274 H ILE 38 H ILE 38 10.577 4.772 2.554
275 HA ILE 38 HA ILE 38 10.405 3.090 0.129
276 HB ILE 38 HB ILE 38 8.393 3.256 2.395
277 HG12 ILE 38 2HG1 ILE 38 8.954 0.733 2.536
278 HG13 ILE 38 1HG1 ILE 38 10.395 1.130 1.607
279 HG21 ILE 38 1HG2 ILE 38 8.337 1.617 -0.138
280 HG22 ILE 38 2HG2 ILE 38 7.278 2.970 0.266
281 HG23 ILE 38 3HG2 ILE 38 7.194 1.477 1.200
282 HD11 ILE 38 3HD1 ILE 38 10.820 0.996 4.013
283 HD12 ILE 38 1HD1 ILE 38 9.671 2.306 4.283
284 HD13 ILE 38 2HD1 ILE 38 11.152 2.604 3.372
285 H THR 39 H THR 39 9.517 4.055 -1.600
286 HA THR 39 HA THR 39 8.210 6.681 -1.236
287 HB THR 39 HB THR 39 8.852 7.172 -3.533
288 HG1 THR 39 HG1 THR 39 10.272 5.516 -4.567
289 HG21 THR 39 3HG2 THR 39 10.521 7.640 -1.803
290 HG22 THR 39 1HG2 THR 39 11.304 7.144 -3.305
291 HG23 THR 39 2HG2 THR 39 11.164 6.005 -1.964
292 H GLU 40 H GLU 40 6.708 7.249 -3.172
293 HA GLU 40 HA GLU 40 4.411 5.681 -3.182
294 HB2 GLU 40 2HB GLU 40 5.429 7.749 -5.121
295 HB3 GLU 40 1HB GLU 40 3.910 6.919 -5.409
296 HG2 GLU 40 2HG GLU 40 3.077 7.744 -3.240
297 HG3 GLU 40 1HG GLU 40 4.583 8.635 -3.030
298 H ASP 41 H ASP 41 7.018 5.768 -5.608
299 HA ASP 41 HA ASP 41 5.693 3.931 -7.351
300 HB2 ASP 41 2HB ASP 41 8.524 4.992 -7.350
301 HB3 ASP 41 1HB ASP 41 7.830 4.005 -8.636
302 H MET 42 H MET 42 7.793 3.499 -4.628
303 HA MET 42 HA MET 42 8.614 0.830 -5.266
304 HB2 MET 42 2HB MET 42 9.785 2.139 -3.547
305 HB3 MET 42 1HB MET 42 8.324 2.191 -2.568
306 HG2 MET 42 2HG MET 42 9.944 0.538 -1.755
307 HG3 MET 42 1HG MET 42 8.414 -0.199 -2.230
308 HE1 MET 42 3HE MET 42 10.990 -2.987 -3.176
309 HE2 MET 42 1HE MET 42 9.537 -2.586 -2.256
310 HE3 MET 42 2HE MET 42 11.094 -1.897 -1.795
311 H LEU 43 H LEU 43 6.105 2.112 -3.075
312 HA LEU 43 HA LEU 43 4.731 -0.282 -2.584
313 HG LEU 43 HG LEU 43 5.491 2.167 -1.017
314 HB2 LEU 43 2HB LEU 43 3.678 2.550 -2.741
315 HB3 LEU 43 1HB LEU 43 2.813 1.199 -2.027
316 HD11 LEU 43 1HD1 LEU 43 4.255 3.279 0.778
317 HD12 LEU 43 2HD1 LEU 43 2.732 2.873 -0.015
318 HD13 LEU 43 3HD1 LEU 43 3.873 3.967 -0.802
319 HD21 LEU 43 3HD2 LEU 43 4.885 0.884 0.983
320 HD22 LEU 43 1HD2 LEU 43 4.942 -0.146 -0.448
321 HD23 LEU 43 2HD2 LEU 43 3.387 0.371 0.205
322 H ARG 44 H ARG 44 3.917 2.284 -4.917
323 HA ARG 44 HA ARG 44 1.846 1.041 -6.267
324 HE ARG 44 HE ARG 44 3.856 4.632 -9.137
325 HB2 ARG 44 2HB ARG 44 2.436 3.399 -6.551
326 HB3 ARG 44 1HB ARG 44 3.928 2.950 -7.356
327 HG2 ARG 44 2HG ARG 44 2.824 2.270 -9.295
328 HG3 ARG 44 1HG ARG 44 1.272 2.113 -8.469
329 HD2 ARG 44 2HD ARG 44 1.388 4.105 -9.936
330 HD3 ARG 44 1HD ARG 44 1.086 4.509 -8.248
331 HH11 ARG 44 1HH1 ARG 44 0.931 6.335 -8.485
332 HH12 ARG 44 2HH1 ARG 44 1.721 7.871 -8.385
333 HH21 ARG 44 1HH2 ARG 44 4.853 6.636 -9.002
334 HH22 ARG 44 2HH2 ARG 44 3.892 8.040 -8.680
335 H GLY 45 H GLY 45 5.324 0.652 -6.721
336 HA2 GLY 45 2HA GLY 45 5.254 -0.870 -9.098
337 HA3 GLY 45 1HA GLY 45 6.549 -0.883 -7.912
338 H ILE 46 H ILE 46 4.961 -1.831 -5.705
339 HA ILE 46 HA ILE 46 4.865 -4.664 -6.371
340 HB ILE 46 HB ILE 46 4.318 -3.318 -3.713
341 HG12 ILE 46 2HG1 ILE 46 6.893 -4.529 -4.774
342 HG13 ILE 46 1HG1 ILE 46 6.590 -2.810 -4.544
343 HG21 ILE 46 1HG2 ILE 46 4.807 -5.537 -2.761
344 HG22 ILE 46 2HG2 ILE 46 4.970 -6.192 -4.390
345 HG23 ILE 46 3HG2 ILE 46 3.411 -5.574 -3.838
346 HD11 ILE 46 3HD1 ILE 46 7.938 -3.670 -2.744
347 HD12 ILE 46 1HD1 ILE 46 6.734 -4.909 -2.388
348 HD13 ILE 46 2HD1 ILE 46 6.351 -3.206 -2.125
349 H PHE 47 H PHE 47 2.591 -2.122 -5.481
350 HA PHE 47 HA PHE 47 0.398 -3.911 -4.972
351 HD1 PHE 47 HD1 PHE 47 2.388 -1.604 -3.116
352 HD2 PHE 47 HD2 PHE 47 -1.796 -2.390 -2.902
353 HE1 PHE 47 HE1 PHE 47 2.564 -1.868 -0.679
354 HE2 PHE 47 HE2 PHE 47 -1.623 -2.655 -0.463
355 HZ PHE 47 HZ PHE 47 0.557 -2.388 0.651
356 HB2 PHE 47 2HB PHE 47 0.743 -0.933 -4.956
357 HB3 PHE 47 1HB PHE 47 -0.870 -1.623 -4.915
358 H GLU 48 H GLU 48 1.199 -1.662 -7.655
359 HA GLU 48 HA GLU 48 -1.375 -1.801 -8.815
360 HB2 GLU 48 2HB GLU 48 0.233 0.044 -9.230
361 HB3 GLU 48 1HB GLU 48 1.174 -1.044 -10.243
362 HG2 GLU 48 2HG GLU 48 -0.520 -1.175 -11.872
363 HG3 GLU 48 1HG GLU 48 -1.735 -0.519 -10.781
364 HA PRO 49 HA PRO 49 0.722 -5.402 -11.645
365 HB2 PRO 49 2HB PRO 49 1.654 -6.667 -9.082
366 HB3 PRO 49 1HB PRO 49 2.262 -6.891 -10.729
367 HG2 PRO 49 2HG PRO 49 3.571 -5.324 -9.039
368 HG3 PRO 49 1HG PRO 49 3.370 -4.837 -10.732
369 HD2 PRO 49 2HD PRO 49 1.995 -3.813 -8.291
370 HD3 PRO 49 1HD PRO 49 2.441 -2.955 -9.779
371 H PHE 50 H PHE 50 -0.879 -5.266 -8.502
372 HA PHE 50 HA PHE 50 -2.435 -7.658 -8.910
373 HD1 PHE 50 HD1 PHE 50 -3.034 -9.020 -6.434
374 HD2 PHE 50 HD2 PHE 50 -0.443 -5.661 -6.023
375 HE1 PHE 50 HE1 PHE 50 -1.526 -10.354 -5.024
376 HE2 PHE 50 HE2 PHE 50 1.065 -6.996 -4.610
377 HZ PHE 50 HZ PHE 50 0.522 -9.343 -4.105
378 HB2 PHE 50 2HB PHE 50 -2.652 -5.394 -6.925
379 HB3 PHE 50 1HB PHE 50 -3.789 -6.738 -6.962
380 H GLY 51 H GLY 51 -2.778 -4.308 -9.815
381 HA2 GLY 51 2HA GLY 51 -4.798 -4.931 -11.695
382 HA3 GLY 51 1HA GLY 51 -5.543 -4.191 -10.290
383 H ARG 52 H ARG 52 -5.372 -1.995 -9.988
384 HA ARG 52 HA ARG 52 -3.592 -0.368 -11.565
385 HE ARG 52 HE ARG 52 -6.843 3.951 -12.239
386 HB2 ARG 52 2HB ARG 52 -5.112 -0.712 -13.321
387 HB3 ARG 52 1HB ARG 52 -6.508 -0.617 -12.265
388 HG2 ARG 52 2HG ARG 52 -4.865 1.842 -12.508
389 HG3 ARG 52 1HG ARG 52 -5.782 1.349 -13.934
390 HD2 ARG 52 2HD ARG 52 -7.816 1.210 -12.500
391 HD3 ARG 52 1HD ARG 52 -6.873 1.870 -11.169
392 HH11 ARG 52 1HH1 ARG 52 -8.444 1.605 -14.200
393 HH12 ARG 52 2HH1 ARG 52 -9.331 2.798 -15.081
394 HH21 ARG 52 1HH2 ARG 52 -7.987 5.459 -13.363
395 HH22 ARG 52 2HH2 ARG 52 -9.053 4.961 -14.638
396 H ILE 53 H ILE 53 -3.179 1.519 -10.579
397 HA ILE 53 HA ILE 53 -4.780 2.170 -8.176
398 HB ILE 53 HB ILE 53 -1.844 2.703 -8.709
399 HG12 ILE 53 2HG1 ILE 53 -3.157 0.720 -6.822
400 HG13 ILE 53 1HG1 ILE 53 -2.422 0.304 -8.366
401 HG21 ILE 53 1HG2 ILE 53 -2.820 4.417 -7.268
402 HG22 ILE 53 2HG2 ILE 53 -1.740 3.375 -6.346
403 HG23 ILE 53 3HG2 ILE 53 -3.487 3.171 -6.212
404 HD11 ILE 53 3HD1 ILE 53 -0.257 1.103 -7.514
405 HD12 ILE 53 1HD1 ILE 53 -0.925 -0.234 -6.577
406 HD13 ILE 53 2HD1 ILE 53 -1.013 1.414 -5.950
407 H GLU 54 H GLU 54 -5.423 4.260 -7.795
408 HA GLU 54 HA GLU 54 -5.315 6.091 -10.065
409 HB2 GLU 54 2HB GLU 54 -6.929 6.084 -7.509
410 HB3 GLU 54 1HB GLU 54 -6.981 7.404 -8.672
411 HG2 GLU 54 2HG GLU 54 -7.620 4.550 -9.395
412 HG3 GLU 54 1HG GLU 54 -8.833 5.705 -8.849
413 H SER 55 H SER 55 -4.897 6.471 -6.518
414 HA SER 55 HA SER 55 -2.649 8.284 -6.992
415 HG SER 55 HG SER 55 -2.771 10.656 -5.985
416 HB2 SER 55 2HB SER 55 -4.585 9.794 -6.970
417 HB3 SER 55 1HB SER 55 -5.102 9.133 -5.420
418 H ILE 56 H ILE 56 -1.240 8.505 -5.258
419 HA ILE 56 HA ILE 56 -1.800 6.859 -2.873
420 HB ILE 56 HB ILE 56 0.871 7.183 -4.271
421 HG12 ILE 56 2HG1 ILE 56 -0.962 4.787 -3.981
422 HG13 ILE 56 1HG1 ILE 56 -0.628 5.662 -5.469
423 HG21 ILE 56 1HG2 ILE 56 1.733 5.601 -2.598
424 HG22 ILE 56 2HG2 ILE 56 0.166 5.603 -1.788
425 HG23 ILE 56 3HG2 ILE 56 1.134 7.077 -1.840
426 HD11 ILE 56 3HD1 ILE 56 1.343 4.031 -3.881
427 HD12 ILE 56 1HD1 ILE 56 1.708 4.934 -5.353
428 HD13 ILE 56 2HD1 ILE 56 0.582 3.577 -5.407
429 H GLN 57 H GLN 57 -1.716 7.946 -1.015
430 HA GLN 57 HA GLN 57 -0.375 10.579 -0.959
431 HB2 GLN 57 2HB GLN 57 -2.799 10.646 -0.557
432 HB3 GLN 57 1HB GLN 57 -2.623 9.511 0.771
433 HG2 GLN 57 2HG GLN 57 -2.904 11.747 1.628
434 HG3 GLN 57 1HG GLN 57 -1.283 11.166 1.998
435 HE21 GLN 57 1HE2 GLN 57 -3.165 13.369 0.077
436 HE22 GLN 57 2HE2 GLN 57 -1.848 14.369 -0.422
437 H LEU 58 H LEU 58 1.523 10.601 0.078
438 HA LEU 58 HA LEU 58 2.075 8.593 2.155
439 HG LEU 58 HG LEU 58 3.286 8.795 -0.818
440 HB2 LEU 58 2HB LEU 58 3.943 10.528 0.772
441 HB3 LEU 58 1HB LEU 58 4.425 9.311 1.937
442 HD11 LEU 58 1HD1 LEU 58 5.594 9.559 -0.860
443 HD12 LEU 58 2HD1 LEU 58 5.498 7.851 -1.287
444 HD13 LEU 58 3HD1 LEU 58 6.043 8.329 0.322
445 HD21 LEU 58 3HD2 LEU 58 2.510 7.098 0.754
446 HD22 LEU 58 1HD2 LEU 58 4.166 6.829 1.300
447 HD23 LEU 58 2HD2 LEU 58 3.706 6.424 -0.354
448 H MET 59 H MET 59 2.485 9.128 4.278
449 HA MET 59 HA MET 59 1.672 11.834 5.029
450 HB2 MET 59 2HB MET 59 1.873 9.258 6.573
451 HB3 MET 59 1HB MET 59 1.578 10.806 7.357
452 HG2 MET 59 2HG MET 59 -0.136 9.581 5.206
453 HG3 MET 59 1HG MET 59 -0.493 9.589 6.935
454 HE1 MET 59 3HE MET 59 -2.982 12.181 5.144
455 HE2 MET 59 1HE MET 59 -2.895 10.631 5.980
456 HE3 MET 59 2HE MET 59 -2.250 10.790 4.346
457 H MET 60 H MET 60 3.017 13.311 5.568
458 HA MET 60 HA MET 60 5.689 12.589 6.606
459 HB2 MET 60 2HB MET 60 4.942 14.883 4.774
460 HB3 MET 60 1HB MET 60 6.534 14.645 5.482
461 HG2 MET 60 2HG MET 60 6.735 12.509 4.287
462 HG3 MET 60 1HG MET 60 5.153 12.783 3.555
463 HE1 MET 60 3HE MET 60 7.612 13.324 0.544
464 HE2 MET 60 1HE MET 60 6.234 12.409 1.154
465 HE3 MET 60 2HE MET 60 7.831 12.176 1.865
466 H ASP 61 H ASP 61 6.720 14.703 7.585
467 HA ASP 61 HA ASP 61 5.033 15.448 9.810
468 HB2 ASP 61 2HB ASP 61 7.309 14.814 10.267
469 HB3 ASP 61 1HB ASP 61 7.929 15.994 9.120
470 H SER 62 H SER 62 4.236 17.482 10.267
471 HA SER 62 HA SER 62 3.957 19.233 7.947
472 HG SER 62 HG SER 62 2.551 20.236 11.320
473 HB2 SER 62 2HB SER 62 2.149 20.300 9.224
474 HB3 SER 62 1HB SER 62 1.942 18.550 9.184
475 H GLU 63 H GLU 63 6.119 19.140 10.450
476 HA GLU 63 HA GLU 63 6.216 22.064 10.818
477 HB2 GLU 63 2HB GLU 63 6.187 20.388 12.786
478 HB3 GLU 63 1HB GLU 63 7.849 20.031 12.348
479 HG2 GLU 63 2HG GLU 63 6.788 22.735 13.161
480 HG3 GLU 63 1HG GLU 63 7.680 21.632 14.198
481 H THR 64 H THR 64 8.768 19.589 10.823
482 HA THR 64 HA THR 64 10.522 21.409 9.348
483 HB THR 64 HB THR 64 11.578 20.576 11.278
484 HG1 THR 64 HG1 THR 64 13.345 20.107 10.244
485 HG21 THR 64 3HG2 THR 64 10.725 17.811 10.414
486 HG22 THR 64 1HG2 THR 64 10.117 18.719 11.800
487 HG23 THR 64 2HG2 THR 64 11.793 18.160 11.775
488 H GLY 65 H GLY 65 8.638 18.597 8.770
489 HA2 GLY 65 2HA GLY 65 8.055 17.982 6.557
490 HA3 GLY 65 1HA GLY 65 9.562 18.668 5.983
491 H ARG 66 H ARG 66 9.593 16.460 8.692
492 HA ARG 66 HA ARG 66 11.183 14.544 7.243
493 HE ARG 66 HE ARG 66 10.371 14.314 11.956
494 HB2 ARG 66 2HB ARG 66 9.956 14.337 10.003
495 HB3 ARG 66 1HB ARG 66 11.214 13.296 9.351
496 HG2 ARG 66 2HG ARG 66 12.747 15.196 9.237
497 HG3 ARG 66 1HG ARG 66 11.483 16.258 9.861
498 HD2 ARG 66 2HD ARG 66 12.758 13.925 11.300
499 HD3 ARG 66 1HD ARG 66 12.991 15.636 11.654
500 HH11 ARG 66 1HH1 ARG 66 12.889 16.320 13.182
501 HH12 ARG 66 2HH1 ARG 66 12.010 16.734 14.606
502 HH21 ARG 66 1HH2 ARG 66 9.255 14.845 13.804
503 HH22 ARG 66 2HH2 ARG 66 9.983 15.897 14.965
504 H SER 67 H SER 67 10.298 12.054 8.176
505 HA SER 67 HA SER 67 7.744 11.746 6.715
506 HG SER 67 HG SER 67 10.797 9.975 7.710
507 HB2 SER 67 2HB SER 67 8.376 9.417 6.336
508 HB3 SER 67 1HB SER 67 9.688 10.474 5.817
509 H LYS 68 H LYS 68 6.082 10.391 7.554
510 HA LYS 68 HA LYS 68 6.103 10.115 10.475
511 HB2 LYS 68 2HB LYS 68 3.886 9.947 8.428
512 HB3 LYS 68 1HB LYS 68 3.646 9.581 10.131
513 HG2 LYS 68 2HG LYS 68 4.676 12.228 9.120
514 HG3 LYS 68 1HG LYS 68 2.976 11.894 9.438
515 HD2 LYS 68 2HD LYS 68 5.201 11.692 11.481
516 HD3 LYS 68 1HD LYS 68 4.096 13.058 11.318
517 HE2 LYS 68 2HE LYS 68 3.275 10.214 11.943
518 HE3 LYS 68 1HE LYS 68 3.436 11.508 13.129
519 HZ1 LYS 68 3HZ LYS 68 1.534 11.487 10.840
520 HZ2 LYS 68 1HZ LYS 68 1.687 12.724 11.982
521 HZ3 LYS 68 2HZ LYS 68 1.135 11.199 12.455
522 H GLY 69 H GLY 69 5.755 8.123 7.557
523 HA2 GLY 69 2HA GLY 69 6.851 5.958 7.585
524 HA3 GLY 69 1HA GLY 69 6.335 5.766 9.249
525 H TYR 70 H TYR 70 3.873 7.041 7.231
526 HA TYR 70 HA TYR 70 2.920 4.437 6.356
527 HD1 TYR 70 HD1 TYR 70 2.912 6.253 9.988
528 HD2 TYR 70 HD2 TYR 70 -0.526 6.861 7.544
529 HE1 TYR 70 HE1 TYR 70 2.346 8.256 11.290
530 HE2 TYR 70 HE2 TYR 70 -1.095 8.870 8.845
531 HH TYR 70 HH TYR 70 -0.670 9.824 11.040
532 HB2 TYR 70 2HB TYR 70 0.674 4.787 7.435
533 HB3 TYR 70 1HB TYR 70 1.981 4.432 8.554
534 H GLY 71 H GLY 71 1.102 4.538 4.878
535 HA2 GLY 71 2HA GLY 71 0.372 7.175 3.839
536 HA3 GLY 71 1HA GLY 71 1.274 6.131 2.753
537 H PHE 72 H PHE 72 -1.303 7.097 2.189
538 HA PHE 72 HA PHE 72 -2.984 4.673 2.384
539 HD1 PHE 72 HD2 PHE 72 -2.792 8.169 4.201
540 HD2 PHE 72 HD1 PHE 72 -5.736 5.107 3.812
541 HE1 PHE 72 HE2 PHE 72 -3.213 8.261 6.623
542 HE2 PHE 72 HE1 PHE 72 -6.157 5.202 6.233
543 HZ PHE 72 HZ PHE 72 -4.898 6.777 7.643
544 HB2 PHE 72 2HB PHE 72 -3.769 7.573 2.009
545 HB3 PHE 72 1HB PHE 72 -4.897 6.230 1.872
546 H ILE 73 H ILE 73 -3.179 3.530 0.555
547 HA ILE 73 HA ILE 73 -2.655 4.832 -2.040
548 HB ILE 73 HB ILE 73 -2.712 1.881 -1.351
549 HG12 ILE 73 2HG1 ILE 73 -0.359 3.712 -1.930
550 HG13 ILE 73 1HG1 ILE 73 -0.810 3.107 -0.341
551 HG21 ILE 73 1HG2 ILE 73 -1.939 3.289 -3.912
552 HG22 ILE 73 2HG2 ILE 73 -3.356 2.266 -3.665
553 HG23 ILE 73 3HG2 ILE 73 -1.739 1.566 -3.599
554 HD11 ILE 73 3HD1 ILE 73 1.058 1.874 -1.301
555 HD12 ILE 73 1HD1 ILE 73 0.054 1.410 -2.674
556 HD13 ILE 73 2HD1 ILE 73 -0.344 0.837 -1.053
557 H THR 74 H THR 74 -4.209 4.967 -3.597
558 HA THR 74 HA THR 74 -6.885 3.907 -2.905
559 HB THR 74 HB THR 74 -6.209 6.283 -4.659
560 HG1 THR 74 HG1 THR 74 -5.960 7.101 -2.697
561 HG21 THR 74 3HG2 THR 74 -8.295 5.210 -5.358
562 HG22 THR 74 1HG2 THR 74 -8.630 6.753 -4.573
563 HG23 THR 74 2HG2 THR 74 -8.886 5.244 -3.698
564 H PHE 75 H PHE 75 -7.528 2.217 -4.062
565 HA PHE 75 HA PHE 75 -6.607 1.845 -6.831
566 HD1 PHE 75 HD1 PHE 75 -5.859 0.640 -3.531
567 HD2 PHE 75 HD2 PHE 75 -5.843 -1.559 -7.186
568 HE1 PHE 75 HE1 PHE 75 -3.653 -0.289 -2.968
569 HE2 PHE 75 HE2 PHE 75 -3.636 -2.484 -6.621
570 HZ PHE 75 HZ PHE 75 -2.546 -1.856 -4.507
571 HB2 PHE 75 2HB PHE 75 -8.009 -0.000 -4.885
572 HB3 PHE 75 1HB PHE 75 -7.757 -0.413 -6.575
573 H SER 76 H SER 76 -8.080 1.499 -8.554
574 HA SER 76 HA SER 76 -10.592 2.929 -8.298
575 HG SER 76 HG SER 76 -11.178 3.667 -10.919
576 HB2 SER 76 2HB SER 76 -9.174 3.237 -10.295
577 HB3 SER 76 1HB SER 76 -9.382 1.536 -10.706
578 H ASP 77 H ASP 77 -9.795 -0.135 -7.506
579 HA ASP 77 HA ASP 77 -12.539 -1.071 -7.896
580 HB2 ASP 77 2HB ASP 77 -11.161 -1.986 -9.773
581 HB3 ASP 77 1HB ASP 77 -10.145 -2.798 -8.585
582 H SER 78 H SER 78 -13.339 -2.202 -6.214
583 HA SER 78 HA SER 78 -12.023 -2.107 -3.710
584 HG SER 78 HG SER 78 -14.962 -3.702 -2.339
585 HB2 SER 78 2HB SER 78 -14.446 -1.976 -3.857
586 HB3 SER 78 1HB SER 78 -14.525 -3.604 -4.532
587 H GLU 79 H GLU 79 -12.734 -4.877 -5.858
588 HA GLU 79 HA GLU 79 -11.668 -6.796 -4.018
589 HB2 GLU 79 2HB GLU 79 -12.337 -7.045 -6.960
590 HB3 GLU 79 1HB GLU 79 -11.882 -8.396 -5.923
591 HG2 GLU 79 2HG GLU 79 -13.825 -7.974 -4.506
592 HG3 GLU 79 1HG GLU 79 -14.281 -6.612 -5.526
593 H CYS 80 H CYS 80 -10.372 -5.117 -6.836
594 HA CYS 80 HA CYS 80 -7.880 -6.389 -7.019
595 HG CYS 80 HG CYS 80 -5.856 -5.166 -8.688
596 HB2 CYS 80 2HB CYS 80 -8.619 -4.809 -8.714
597 HB3 CYS 80 1HB CYS 80 -8.611 -3.496 -7.540
598 H ALA 81 H ALA 81 -8.886 -3.613 -5.039
599 HA ALA 81 HA ALA 81 -6.398 -3.190 -3.765
600 HB1 ALA 81 3HB ALA 81 -7.636 -1.841 -2.178
601 HB2 ALA 81 1HB ALA 81 -9.156 -2.550 -2.722
602 HB3 ALA 81 2HB ALA 81 -8.215 -1.534 -3.815
603 H LYS 82 H LYS 82 -9.277 -5.027 -2.722
604 HA LYS 82 HA LYS 82 -8.275 -5.873 -0.242
605 HB2 LYS 82 2HB LYS 82 -10.653 -6.021 -0.885
606 HB3 LYS 82 1HB LYS 82 -10.261 -7.287 -2.041
607 HG2 LYS 82 2HG LYS 82 -9.682 -8.816 -0.304
608 HG3 LYS 82 1HG LYS 82 -9.735 -7.544 0.917
609 HD2 LYS 82 2HD LYS 82 -11.734 -8.881 1.091
610 HD3 LYS 82 1HD LYS 82 -12.165 -7.281 0.489
611 HE2 LYS 82 2HE LYS 82 -13.396 -8.909 -0.764
612 HE3 LYS 82 1HE LYS 82 -12.166 -8.224 -1.823
613 HZ1 LYS 82 3HZ LYS 82 -12.372 -10.654 -1.997
614 HZ2 LYS 82 1HZ LYS 82 -11.888 -10.807 -0.383
615 HZ3 LYS 82 2HZ LYS 82 -10.822 -10.169 -1.527
616 H LYS 83 H LYS 83 -7.875 -7.234 -3.471
617 HA LYS 83 HA LYS 83 -6.612 -9.649 -2.697
618 HB2 LYS 83 2HB LYS 83 -7.543 -9.240 -4.961
619 HB3 LYS 83 1HB LYS 83 -6.252 -8.087 -5.271
620 HG2 LYS 83 2HG LYS 83 -4.592 -9.878 -5.037
621 HG3 LYS 83 1HG LYS 83 -5.888 -11.034 -4.720
622 HD2 LYS 83 2HD LYS 83 -6.831 -10.527 -6.958
623 HD3 LYS 83 1HD LYS 83 -5.453 -9.467 -7.269
624 HE2 LYS 83 2HE LYS 83 -5.102 -11.656 -8.283
625 HE3 LYS 83 1HE LYS 83 -3.929 -11.372 -6.996
626 HZ1 LYS 83 3HZ LYS 83 -6.410 -12.984 -6.716
627 HZ2 LYS 83 1HZ LYS 83 -5.238 -12.744 -5.524
628 HZ3 LYS 83 2HZ LYS 83 -4.855 -13.612 -6.920
629 H ALA 84 H ALA 84 -5.245 -6.515 -3.748
630 HA ALA 84 HA ALA 84 -2.536 -7.109 -3.377
631 HB1 ALA 84 3HB ALA 84 -3.918 -4.445 -3.003
632 HB2 ALA 84 1HB ALA 84 -3.323 -5.095 -4.532
633 HB3 ALA 84 2HB ALA 84 -2.187 -4.685 -3.245
634 H LEU 85 H LEU 85 -4.892 -5.767 -1.087
635 HA LEU 85 HA LEU 85 -3.244 -5.420 1.133
636 HG LEU 85 HG LEU 85 -4.556 -5.009 3.304
637 HB2 LEU 85 2HB LEU 85 -5.562 -4.596 0.940
638 HB3 LEU 85 1HB LEU 85 -6.159 -6.235 1.059
639 HD11 LEU 85 1HD1 LEU 85 -6.697 -4.374 4.361
640 HD12 LEU 85 2HD1 LEU 85 -7.534 -4.771 2.859
641 HD13 LEU 85 3HD1 LEU 85 -6.363 -3.454 2.896
642 HD21 LEU 85 3HD2 LEU 85 -4.907 -7.418 3.437
643 HD22 LEU 85 1HD2 LEU 85 -6.643 -7.202 3.210
644 HD23 LEU 85 2HD2 LEU 85 -5.862 -6.602 4.672
645 H GLU 86 H GLU 86 -5.303 -8.249 0.390
646 HA GLU 86 HA GLU 86 -4.559 -9.737 2.656
647 HB2 GLU 86 2HB GLU 86 -6.611 -10.075 1.300
648 HB3 GLU 86 1HB GLU 86 -5.626 -10.754 0.015
649 HG2 GLU 86 2HG GLU 86 -4.968 -12.594 1.455
650 HG3 GLU 86 1HG GLU 86 -5.882 -11.895 2.791
651 H GLN 87 H GLN 87 -2.947 -9.381 -0.428
652 HA GLN 87 HA GLN 87 -1.300 -11.752 -0.009
653 HB2 GLN 87 2HB GLN 87 -1.366 -9.688 -2.217
654 HB3 GLN 87 1HB GLN 87 -0.239 -11.036 -2.177
655 HG2 GLN 87 2HG GLN 87 -3.225 -11.399 -2.122
656 HG3 GLN 87 1HG GLN 87 -2.291 -11.329 -3.613
657 HE21 GLN 87 1HE2 GLN 87 -2.861 -13.421 -4.170
658 HE22 GLN 87 2HE2 GLN 87 -2.205 -14.802 -3.372
659 H LEU 88 H LEU 88 -1.048 -8.271 0.344
660 HA LEU 88 HA LEU 88 1.846 -8.491 0.817
661 HG LEU 88 HG LEU 88 0.375 -7.416 -1.690
662 HB2 LEU 88 2HB LEU 88 0.145 -6.039 0.366
663 HB3 LEU 88 1HB LEU 88 1.890 -6.055 0.540
664 HD11 LEU 88 1HD1 LEU 88 0.202 -5.015 -1.896
665 HD12 LEU 88 2HD1 LEU 88 1.291 -5.659 -3.124
666 HD13 LEU 88 3HD1 LEU 88 1.948 -4.847 -1.701
667 HD21 LEU 88 3HD2 LEU 88 3.332 -7.016 -1.257
668 HD22 LEU 88 1HD2 LEU 88 2.588 -7.682 -2.711
669 HD23 LEU 88 2HD2 LEU 88 2.458 -8.547 -1.180
670 H ASN 89 H ASN 89 -1.005 -8.342 2.582
671 HA ASN 89 HA ASN 89 -0.219 -6.777 4.808
672 HB2 ASN 89 2HB ASN 89 -2.556 -7.433 4.381
673 HB3 ASN 89 1HB ASN 89 -2.144 -9.117 4.677
674 HD21 ASN 89 1HD2 ASN 89 -2.720 -6.022 6.111
675 HD22 ASN 89 2HD2 ASN 89 -2.795 -6.572 7.745
676 H GLY 90 H GLY 90 1.850 -7.249 5.478
677 HA2 GLY 90 2HA GLY 90 2.999 -8.502 7.251
678 HA3 GLY 90 1HA GLY 90 2.329 -9.970 6.559
679 H PHE 91 H PHE 91 3.207 -8.003 4.037
680 HA PHE 91 HA PHE 91 5.362 -9.613 3.180
681 HD1 PHE 91 HD2 PHE 91 5.584 -9.810 0.327
682 HD2 PHE 91 HD1 PHE 91 6.478 -5.821 1.532
683 HE1 PHE 91 HE2 PHE 91 7.412 -9.722 -1.317
684 HE2 PHE 91 HE1 PHE 91 8.305 -5.731 -0.113
685 HZ PHE 91 HZ PHE 91 8.776 -7.684 -1.539
686 HB2 PHE 91 2HB PHE 91 3.952 -8.410 1.600
687 HB3 PHE 91 1HB PHE 91 4.467 -6.865 2.266
688 H GLU 92 H GLU 92 7.558 -9.424 3.385
689 HA GLU 92 HA GLU 92 8.635 -7.722 5.401
690 HB2 GLU 92 2HB GLU 92 10.081 -9.394 3.328
691 HB3 GLU 92 1HB GLU 92 10.823 -8.665 4.746
692 HG2 GLU 92 2HG GLU 92 8.670 -10.779 4.778
693 HG3 GLU 92 1HG GLU 92 10.389 -11.058 5.043
694 H LEU 93 H LEU 93 8.010 -5.608 4.597
695 HA LEU 93 HA LEU 93 9.179 -4.648 2.120
696 HG LEU 93 HG LEU 93 8.933 -1.651 2.875
697 HB2 LEU 93 2HB LEU 93 6.941 -3.920 2.735
698 HB3 LEU 93 1HB LEU 93 7.544 -3.240 4.236
699 HD11 LEU 93 1HD1 LEU 93 7.268 -2.700 0.586
700 HD12 LEU 93 2HD1 LEU 93 9.006 -2.919 0.793
701 HD13 LEU 93 3HD1 LEU 93 8.346 -1.304 0.530
702 HD21 LEU 93 3HD2 LEU 93 5.944 -1.515 2.452
703 HD22 LEU 93 1HD2 LEU 93 7.070 -0.163 2.338
704 HD23 LEU 93 2HD2 LEU 93 6.814 -0.967 3.887
705 H ALA 94 H ALA 94 11.204 -3.918 2.000
706 HA ALA 94 HA ALA 94 13.191 -2.913 2.490
707 HB1 ALA 94 3HB ALA 94 13.084 -0.817 3.728
708 HB2 ALA 94 1HB ALA 94 11.489 -1.246 4.353
709 HB3 ALA 94 2HB ALA 94 11.712 -0.953 2.628
710 H GLY 95 H GLY 95 12.312 -5.223 4.143
711 HA2 GLY 95 2HA GLY 95 13.654 -6.475 5.630
712 HA3 GLY 95 1HA GLY 95 14.396 -4.987 6.191
713 H ARG 96 H ARG 96 11.017 -4.764 6.059
714 HA ARG 96 HA ARG 96 10.578 -5.768 8.772
715 HE ARG 96 HE ARG 96 12.410 -1.636 11.914
716 HB2 ARG 96 2HB ARG 96 10.232 -2.880 7.939
717 HB3 ARG 96 1HB ARG 96 9.411 -3.558 9.339
718 HG2 ARG 96 2HG ARG 96 11.465 -3.974 10.457
719 HG3 ARG 96 1HG ARG 96 12.402 -3.619 9.005
720 HD2 ARG 96 2HD ARG 96 11.808 -1.294 9.117
721 HD3 ARG 96 1HD ARG 96 10.667 -1.598 10.427
722 HH11 ARG 96 1HH1 ARG 96 13.728 -1.846 8.739
723 HH12 ARG 96 2HH1 ARG 96 15.336 -1.507 9.268
724 HH21 ARG 96 1HH2 ARG 96 14.468 -1.207 12.570
725 HH22 ARG 96 2HH2 ARG 96 15.747 -1.134 11.411
726 HA PRO 97 HA PRO 97 6.762 -7.185 6.964
727 HB2 PRO 97 2HB PRO 97 5.159 -7.011 9.247
728 HB3 PRO 97 1HB PRO 97 6.185 -8.382 8.815
729 HG2 PRO 97 2HG PRO 97 6.734 -6.117 10.692
730 HG3 PRO 97 1HG PRO 97 7.144 -7.836 10.858
731 HD2 PRO 97 2HD PRO 97 8.998 -6.032 10.164
732 HD3 PRO 97 1HD PRO 97 8.990 -7.656 9.438
733 H MET 98 H MET 98 5.100 -6.245 5.905
734 HA MET 98 HA MET 98 4.635 -3.388 6.393
735 HB2 MET 98 2HB MET 98 5.384 -4.016 4.149
736 HB3 MET 98 1HB MET 98 4.022 -5.114 3.976
737 HG2 MET 98 2HG MET 98 2.472 -3.316 3.907
738 HG3 MET 98 1HG MET 98 3.703 -2.153 4.398
739 HE1 MET 98 3HE MET 98 2.571 -4.634 1.573
740 HE2 MET 98 1HE MET 98 4.274 -5.053 1.763
741 HE3 MET 98 2HE MET 98 3.719 -4.263 0.287
742 H LYS 99 H LYS 99 2.881 -2.777 7.427
743 HA LYS 99 HA LYS 99 0.645 -4.608 7.792
744 HB2 LYS 99 2HB LYS 99 1.211 -1.878 8.983
745 HB3 LYS 99 1HB LYS 99 -0.159 -2.897 9.414
746 HG2 LYS 99 2HG LYS 99 1.366 -4.610 10.258
747 HG3 LYS 99 1HG LYS 99 2.751 -3.616 9.797
748 HD2 LYS 99 2HD LYS 99 2.012 -1.871 11.369
749 HD3 LYS 99 1HD LYS 99 0.628 -2.869 11.824
750 HE2 LYS 99 2HE LYS 99 3.531 -3.642 12.186
751 HE3 LYS 99 1HE LYS 99 2.479 -3.012 13.455
752 HZ1 LYS 99 3HZ LYS 99 1.087 -4.930 13.272
753 HZ2 LYS 99 1HZ LYS 99 2.684 -5.454 13.462
754 HZ3 LYS 99 2HZ LYS 99 1.951 -5.509 11.942
755 H VAL 100 H VAL 100 -0.518 -4.639 5.909
756 HA VAL 100 HA VAL 100 -1.542 -2.088 4.845
757 HB VAL 100 HB VAL 100 -1.754 -4.812 3.544
758 HG11 VAL 100 1HG1 VAL 100 -2.059 -2.017 2.433
759 HG12 VAL 100 2HG1 VAL 100 -3.355 -3.181 2.715
760 HG13 VAL 100 3HG1 VAL 100 -2.128 -3.506 1.490
761 HG21 VAL 100 3HG2 VAL 100 0.602 -4.303 3.835
762 HG22 VAL 100 1HG2 VAL 100 0.369 -2.705 3.123
763 HG23 VAL 100 2HG2 VAL 100 0.156 -4.150 2.137
764 H GLY 101 H GLY 101 -3.415 -1.555 5.886
765 HA2 GLY 101 2HA GLY 101 -5.549 -3.611 5.950
766 HA3 GLY 101 1HA GLY 101 -5.230 -2.603 7.356
767 H HIS 102 H HIS 102 -7.696 -2.832 5.747
768 HA HIS 102 HA HIS 102 -7.996 -0.448 4.209
769 HD1 HIS 102 HD1 HIS 102 -11.572 -0.611 6.508
770 HD2 HIS 102 HD2 HIS 102 -9.834 -4.344 5.962
771 HE1 HIS 102 HE1 HIS 102 -12.548 -2.075 8.295
772 HE2 HIS 102 HE2 HIS 102 -11.641 -4.366 7.810
773 HB2 HIS 102 2HB HIS 102 -10.375 -0.929 4.213
774 HB3 HIS 102 1HB HIS 102 -9.488 -2.429 3.973
775 H VAL 103 H VAL 103 -9.815 1.184 4.883
776 HA VAL 103 HA VAL 103 -8.883 2.621 7.138
777 HB VAL 103 HB VAL 103 -11.552 2.971 5.731
778 HG11 VAL 103 1HG1 VAL 103 -11.404 5.297 6.508
779 HG12 VAL 103 2HG1 VAL 103 -9.916 4.910 7.373
780 HG13 VAL 103 3HG1 VAL 103 -11.437 4.158 7.854
781 HG21 VAL 103 3HG2 VAL 103 -9.732 3.031 4.111
782 HG22 VAL 103 1HG2 VAL 103 -8.871 4.216 5.094
783 HG23 VAL 103 2HG2 VAL 103 -10.406 4.643 4.336
784 H THR 104 H THR 104 -9.664 2.789 9.234
785 HA THR 104 HA THR 104 -10.845 0.424 10.276
786 HB THR 104 HB THR 104 -10.779 1.614 12.489
787 HG1 THR 104 HG1 THR 104 -10.990 3.754 11.975
788 HG21 THR 104 3HG2 THR 104 -8.328 1.701 12.606
789 HG22 THR 104 1HG2 THR 104 -8.239 1.696 10.845
790 HG23 THR 104 2HG2 THR 104 -8.875 0.289 11.701
791 H GLU 105 H GLU 105 -12.486 2.899 8.802
792 HA GLU 105 HA GLU 105 -14.707 3.151 10.594
793 HB2 GLU 105 2HB GLU 105 -14.222 4.882 8.906
794 HB3 GLU 105 1HB GLU 105 -14.584 3.735 7.623
795 HG2 GLU 105 2HG GLU 105 -16.891 3.585 8.345
796 HG3 GLU 105 1HG GLU 105 -16.556 4.625 9.725
797 H ARG 106 H ARG 106 -15.951 1.482 11.101
798 HA ARG 106 HA ARG 106 -16.962 -0.288 8.973
799 HE ARG 106 HE ARG 106 -14.601 -3.766 10.030
800 HB2 ARG 106 2HB ARG 106 -15.145 -1.496 10.079
801 HB3 ARG 106 1HB ARG 106 -15.861 -1.179 11.653
802 HG2 ARG 106 2HG ARG 106 -17.880 -2.489 10.870
803 HG3 ARG 106 1HG ARG 106 -16.918 -2.972 9.473
804 HD2 ARG 106 2HD ARG 106 -16.205 -3.475 12.366
805 HD3 ARG 106 1HD ARG 106 -16.880 -4.663 11.252
806 HH11 ARG 106 1HH1 ARG 106 -15.320 -5.184 13.078
807 HH12 ARG 106 2HH1 ARG 106 -13.794 -5.983 13.188
808 HH21 ARG 106 1HH2 ARG 106 -12.645 -4.778 10.181
809 HH22 ARG 106 2HH2 ARG 106 -12.288 -5.764 11.558
810 H THR 107 H THR 107 -19.136 -0.497 9.040
811 HA THR 107 HA THR 107 -20.500 -0.181 11.650
812 HB THR 107 HB THR 107 -21.642 0.541 8.929
813 HG1 THR 107 HG1 THR 107 -21.227 2.590 9.453
814 HG21 THR 107 3HG2 THR 107 -22.845 0.828 11.691
815 HG22 THR 107 1HG2 THR 107 -23.362 -0.319 10.454
816 HG23 THR 107 2HG2 THR 107 -23.561 1.412 10.189
817 H ASP 108 H ASP 108 -20.443 -2.384 12.112
818 HA ASP 108 HA ASP 108 -21.881 -4.179 10.259
819 HB2 ASP 108 2HB ASP 108 -19.509 -4.760 10.811
820 HB3 ASP 108 1HB ASP 108 -19.978 -4.927 12.499
Start of MODEL 17
1 HA MET 1 HA MET 1 -17.463 -14.714 16.574
2 H1 MET 1 1H MET 1 -19.732 -15.350 17.049
3 H2 MET 1 2H MET 1 -19.673 -13.753 16.501
4 H3 MET 1 3H MET 1 -19.896 -14.073 18.144
5 HB2 MET 1 2HB MET 1 -17.899 -12.270 17.051
6 HB3 MET 1 1HB MET 1 -17.813 -12.652 18.764
7 HG2 MET 1 2HG MET 1 -15.502 -13.411 18.475
8 HG3 MET 1 1HG MET 1 -15.591 -13.015 16.760
9 HE1 MET 1 3HE MET 1 -13.248 -11.903 18.524
10 HE2 MET 1 1HE MET 1 -13.217 -10.208 18.038
11 HE3 MET 1 2HE MET 1 -13.476 -11.466 16.829
12 H GLY 2 H GLY 2 -19.396 -15.467 19.289
13 HA2 GLY 2 2HA GLY 2 -17.305 -16.146 21.136
14 HA3 GLY 2 1HA GLY 2 -19.011 -16.518 21.303
15 H HIS 3 H HIS 3 -16.111 -17.520 19.505
16 HA HIS 3 HA HIS 3 -16.632 -20.290 20.191
17 HD1 HIS 3 HD1 HIS 3 -19.246 -18.892 17.468
18 HD2 HIS 3 HD2 HIS 3 -18.130 -22.675 18.764
19 HE1 HIS 3 HE1 HIS 3 -21.386 -20.176 17.713
20 HE2 HIS 3 HE2 HIS 3 -20.697 -22.399 18.656
21 HB2 HIS 3 2HB HIS 3 -16.728 -19.292 17.352
22 HB3 HIS 3 1HB HIS 3 -16.152 -20.922 17.693
23 H HIS 4 H HIS 4 -14.745 -21.637 18.873
24 HA HIS 4 HA HIS 4 -12.361 -20.632 20.109
25 HD1 HIS 4 HD1 HIS 4 -13.763 -24.991 19.904
26 HD2 HIS 4 HD2 HIS 4 -12.252 -21.870 22.190
27 HE1 HIS 4 HE1 HIS 4 -14.277 -25.589 22.283
28 HE2 HIS 4 HE2 HIS 4 -13.239 -23.753 23.653
29 HB2 HIS 4 2HB HIS 4 -12.878 -23.125 18.487
30 HB3 HIS 4 1HB HIS 4 -11.323 -22.746 19.222
31 H HIS 5 H HIS 5 -12.401 -18.642 18.701
32 HA HIS 5 HA HIS 5 -11.214 -17.315 17.311
33 HD1 HIS 5 HD1 HIS 5 -8.458 -20.267 19.343
34 HD2 HIS 5 HD2 HIS 5 -9.385 -16.228 19.033
35 HE1 HIS 5 HE1 HIS 5 -7.832 -19.263 21.553
36 HE2 HIS 5 HE2 HIS 5 -8.276 -16.803 21.295
37 HB2 HIS 5 2HB HIS 5 -9.375 -19.706 17.116
38 HB3 HIS 5 1HB HIS 5 -8.968 -18.065 16.626
39 H HIS 6 H HIS 6 -10.490 -20.365 15.582
40 HA HIS 6 HA HIS 6 -10.939 -19.078 13.071
41 HD1 HIS 6 HD1 HIS 6 -8.801 -18.729 12.796
42 HD2 HIS 6 HD2 HIS 6 -7.789 -22.613 13.867
43 HE1 HIS 6 HE1 HIS 6 -6.331 -18.683 13.231
44 HE2 HIS 6 HE2 HIS 6 -5.714 -21.072 13.704
45 HB2 HIS 6 2HB HIS 6 -10.472 -22.005 13.679
46 HB3 HIS 6 1HB HIS 6 -10.453 -21.285 12.072
47 H HIS 7 H HIS 7 -13.049 -18.375 13.075
48 HA HIS 7 HA HIS 7 -15.280 -20.111 13.475
49 HD1 HIS 7 HD1 HIS 7 -13.691 -16.162 13.749
50 HD2 HIS 7 HD2 HIS 7 -15.683 -16.846 10.161
51 HE1 HIS 7 HE1 HIS 7 -12.849 -14.409 12.163
52 HE2 HIS 7 HE2 HIS 7 -14.009 -14.881 9.983
53 HB2 HIS 7 2HB HIS 7 -16.587 -18.153 12.499
54 HB3 HIS 7 1HB HIS 7 -15.654 -17.821 13.952
55 H HIS 8 H HIS 8 -15.318 -21.842 12.110
56 HA HIS 8 HA HIS 8 -15.149 -21.457 9.236
57 HD1 HIS 8 HD1 HIS 8 -14.023 -23.958 12.522
58 HD2 HIS 8 HD2 HIS 8 -17.596 -25.115 10.743
59 HE1 HIS 8 HE1 HIS 8 -15.183 -25.395 14.217
60 HE2 HIS 8 HE2 HIS 8 -17.201 -26.289 13.014
61 HB2 HIS 8 2HB HIS 8 -15.590 -23.941 9.150
62 HB3 HIS 8 1HB HIS 8 -14.135 -23.468 10.010
63 H SER 9 H SER 9 -16.827 -20.770 8.105
64 HA SER 9 HA SER 9 -19.496 -20.789 9.218
65 HG SER 9 HG SER 9 -20.481 -18.704 6.471
66 HB2 SER 9 2HB SER 9 -18.628 -18.839 7.952
67 HB3 SER 9 1HB SER 9 -18.560 -19.830 6.495
68 H HIS 10 H HIS 10 -21.246 -21.161 7.240
69 HA HIS 10 HA HIS 10 -20.749 -23.741 5.965
70 HD1 HIS 10 HD1 HIS 10 -22.159 -23.071 10.153
71 HD2 HIS 10 HD2 HIS 10 -24.997 -22.904 7.124
72 HE1 HIS 10 HE1 HIS 10 -24.109 -21.827 11.128
73 HE2 HIS 10 HE2 HIS 10 -25.882 -21.935 9.349
74 HB2 HIS 10 2HB HIS 10 -22.766 -24.777 6.986
75 HB3 HIS 10 1HB HIS 10 -21.504 -24.440 8.164
76 H MET 11 H MET 11 -22.710 -24.459 4.667
77 HA MET 11 HA MET 11 -23.540 -22.424 2.920
78 HB2 MET 11 2HB MET 11 -24.758 -25.162 3.364
79 HB3 MET 11 1HB MET 11 -25.097 -24.117 1.989
80 HG2 MET 11 2HG MET 11 -22.431 -25.334 2.697
81 HG3 MET 11 1HG MET 11 -23.497 -25.825 1.379
82 HE1 MET 11 3HE MET 11 -20.345 -25.032 1.165
83 HE2 MET 11 1HE MET 11 -20.346 -24.120 -0.347
84 HE3 MET 11 2HE MET 11 -21.280 -25.609 -0.214
85 H ALA 12 H ALA 12 -25.204 -21.015 2.951
86 HA ALA 12 HA ALA 12 -27.175 -21.260 5.147
87 HB1 ALA 12 3HB ALA 12 -27.098 -18.838 5.397
88 HB2 ALA 12 1HB ALA 12 -25.917 -18.726 4.092
89 HB3 ALA 12 2HB ALA 12 -25.491 -19.534 5.600
90 H ALA 13 H ALA 13 -27.356 -22.019 2.247
91 HA ALA 13 HA ALA 13 -28.834 -21.963 0.528
92 HB1 ALA 13 3HB ALA 13 -30.597 -20.423 2.439
93 HB2 ALA 13 1HB ALA 13 -30.512 -22.179 2.308
94 HB3 ALA 13 2HB ALA 13 -31.117 -21.222 0.956
95 H ALA 14 H ALA 14 -26.889 -20.294 0.099
96 HA ALA 14 HA ALA 14 -26.209 -18.575 -1.206
97 HB1 ALA 14 3HB ALA 14 -27.764 -17.453 -2.676
98 HB2 ALA 14 1HB ALA 14 -29.130 -18.048 -1.732
99 HB3 ALA 14 2HB ALA 14 -28.121 -19.180 -2.632
100 H MET 15 H MET 15 -25.253 -16.918 -0.260
101 HA MET 15 HA MET 15 -26.488 -15.425 1.864
102 HB2 MET 15 2HB MET 15 -23.834 -14.950 0.483
103 HB3 MET 15 1HB MET 15 -24.347 -14.253 2.013
104 HG2 MET 15 2HG MET 15 -22.825 -16.064 2.427
105 HG3 MET 15 1HG MET 15 -24.432 -16.513 2.992
106 HE1 MET 15 3HE MET 15 -22.959 -19.943 1.788
107 HE2 MET 15 1HE MET 15 -23.664 -19.054 3.137
108 HE3 MET 15 2HE MET 15 -22.057 -18.633 2.547
109 H ALA 16 H ALA 16 -27.076 -13.254 1.895
110 HA ALA 16 HA ALA 16 -27.795 -12.128 -0.696
111 HB1 ALA 16 3HB ALA 16 -29.135 -10.538 0.594
112 HB2 ALA 16 1HB ALA 16 -28.475 -11.194 2.093
113 HB3 ALA 16 2HB ALA 16 -29.489 -12.201 1.060
114 H ASN 17 H ASN 17 -26.138 -11.084 -1.660
115 HA ASN 17 HA ASN 17 -24.356 -9.339 -0.174
116 HB2 ASN 17 2HB ASN 17 -24.562 -9.879 -3.150
117 HB3 ASN 17 1HB ASN 17 -23.311 -8.905 -2.385
118 HD21 ASN 17 1HD2 ASN 17 -21.635 -10.193 -3.001
119 HD22 ASN 17 2HD2 ASN 17 -21.380 -11.784 -2.378
120 H ASN 18 H ASN 18 -24.045 -7.077 -0.747
121 HA ASN 18 HA ASN 18 -24.785 -4.938 -0.915
122 HB2 ASN 18 2HB ASN 18 -24.896 -5.765 -3.342
123 HB3 ASN 18 1HB ASN 18 -26.637 -5.895 -3.106
124 HD21 ASN 18 1HD2 ASN 18 -27.828 -3.986 -2.734
125 HD22 ASN 18 2HD2 ASN 18 -27.205 -2.444 -3.198
126 H LEU 19 H LEU 19 -25.862 -5.832 1.215
127 HA LEU 19 HA LEU 19 -28.766 -5.833 1.186
128 HG LEU 19 HG LEU 19 -29.778 -6.635 3.332
129 HB2 LEU 19 2HB LEU 19 -27.363 -7.327 2.642
130 HB3 LEU 19 1HB LEU 19 -26.855 -5.912 3.539
131 HD11 LEU 19 1HD1 LEU 19 -28.619 -8.635 4.135
132 HD12 LEU 19 2HD1 LEU 19 -29.576 -7.893 5.413
133 HD13 LEU 19 3HD1 LEU 19 -27.825 -7.682 5.387
134 HD21 LEU 19 3HD2 LEU 19 -28.160 -5.133 5.403
135 HD22 LEU 19 1HD2 LEU 19 -29.894 -5.455 5.487
136 HD23 LEU 19 2HD2 LEU 19 -29.250 -4.421 4.212
137 H GLN 20 H GLN 20 -26.136 -3.693 2.072
138 HA GLN 20 HA GLN 20 -28.041 -1.606 2.870
139 HB2 GLN 20 2HB GLN 20 -25.845 -0.394 3.520
140 HB3 GLN 20 1HB GLN 20 -26.413 -1.718 4.520
141 HG2 GLN 20 2HG GLN 20 -24.007 -1.806 4.196
142 HG3 GLN 20 1HG GLN 20 -24.797 -3.219 3.507
143 HE21 GLN 20 1HE2 GLN 20 -23.155 -0.233 2.791
144 HE22 GLN 20 2HE2 GLN 20 -22.775 -0.609 1.151
145 H LYS 21 H LYS 21 -26.394 0.645 2.257
146 HA LYS 21 HA LYS 21 -27.064 1.064 -0.479
147 HB2 LYS 21 2HB LYS 21 -25.317 2.682 1.385
148 HB3 LYS 21 1HB LYS 21 -25.832 3.214 -0.209
149 HG2 LYS 21 2HG LYS 21 -28.161 3.162 0.510
150 HG3 LYS 21 1HG LYS 21 -27.664 2.582 2.103
151 HD2 LYS 21 2HD LYS 21 -28.107 5.007 2.098
152 HD3 LYS 21 1HD LYS 21 -26.432 4.639 2.504
153 HE2 LYS 21 2HE LYS 21 -25.809 5.101 0.148
154 HE3 LYS 21 1HE LYS 21 -27.476 5.576 -0.168
155 HZ1 LYS 21 3HZ LYS 21 -26.047 7.482 0.266
156 HZ2 LYS 21 1HZ LYS 21 -25.669 6.868 1.795
157 HZ3 LYS 21 2HZ LYS 21 -27.252 7.342 1.443
158 H GLY 22 H GLY 22 -26.021 -0.164 -1.985
159 HA2 GLY 22 2HA GLY 22 -23.377 -1.065 -1.929
160 HA3 GLY 22 1HA GLY 22 -24.338 -0.862 -3.386
161 H SER 23 H SER 23 -21.928 0.544 -1.310
162 HA SER 23 HA SER 23 -21.219 2.453 -3.432
163 HG SER 23 HG SER 23 -22.277 2.341 -0.099
164 HB2 SER 23 2HB SER 23 -20.832 4.224 -1.661
165 HB3 SER 23 1HB SER 23 -22.527 3.819 -1.946
166 H ALA 24 H ALA 24 -19.242 1.805 -4.000
167 HA ALA 24 HA ALA 24 -17.105 1.861 -2.038
168 HB1 ALA 24 3HB ALA 24 -17.616 -0.661 -3.626
169 HB2 ALA 24 1HB ALA 24 -17.872 -0.466 -1.893
170 HB3 ALA 24 2HB ALA 24 -16.242 -0.367 -2.557
171 H GLY 25 H GLY 25 -17.334 0.383 -5.281
172 HA2 GLY 25 2HA GLY 25 -16.219 0.800 -7.240
173 HA3 GLY 25 1HA GLY 25 -16.262 2.492 -6.777
174 HA PRO 26 HA PRO 26 -11.793 1.977 -6.628
175 HB2 PRO 26 2HB PRO 26 -11.199 4.543 -5.945
176 HB3 PRO 26 1HB PRO 26 -11.636 4.063 -7.587
177 HG2 PRO 26 2HG PRO 26 -13.322 5.355 -5.479
178 HG3 PRO 26 1HG PRO 26 -13.261 5.678 -7.222
179 HD2 PRO 26 2HD PRO 26 -15.206 4.167 -6.038
180 HD3 PRO 26 1HD PRO 26 -14.683 3.939 -7.717
181 H MET 27 H MET 27 -10.602 1.196 -4.953
182 HA MET 27 HA MET 27 -11.664 1.646 -2.241
183 HB2 MET 27 2HB MET 27 -11.691 -0.668 -3.089
184 HB3 MET 27 1HB MET 27 -9.946 -0.609 -3.300
185 HG2 MET 27 2HG MET 27 -10.570 -1.812 -1.277
186 HG3 MET 27 1HG MET 27 -9.647 -0.357 -0.899
187 HE1 MET 27 3HE MET 27 -11.397 -2.026 1.221
188 HE2 MET 27 1HE MET 27 -12.165 -0.717 2.119
189 HE3 MET 27 2HE MET 27 -10.467 -0.592 1.661
190 H ARG 28 H ARG 28 -10.460 2.591 -0.691
191 HA ARG 28 HA ARG 28 -7.654 3.248 -1.306
192 HE ARG 28 HE ARG 28 -9.774 7.078 -0.049
193 HB2 ARG 28 2HB ARG 28 -9.285 5.088 -0.780
194 HB3 ARG 28 1HB ARG 28 -9.423 4.433 0.848
195 HG2 ARG 28 2HG ARG 28 -7.019 4.830 1.195
196 HG3 ARG 28 1HG ARG 28 -6.908 5.507 -0.432
197 HD2 ARG 28 2HD ARG 28 -8.460 6.602 1.914
198 HD3 ARG 28 1HD ARG 28 -7.071 7.333 1.107
199 HH11 ARG 28 1HH1 ARG 28 -6.680 8.599 0.029
200 HH12 ARG 28 2HH1 ARG 28 -7.135 9.831 -1.094
201 HH21 ARG 28 1HH2 ARG 28 -10.356 8.656 -1.455
202 HH22 ARG 28 2HH2 ARG 28 -9.209 9.872 -1.920
203 H LEU 29 H LEU 29 -6.121 2.039 -0.367
204 HA LEU 29 HA LEU 29 -6.769 0.561 2.092
205 HG LEU 29 HG LEU 29 -6.632 -0.696 -0.834
206 HB2 LEU 29 2HB LEU 29 -4.544 0.139 0.092
207 HB3 LEU 29 1HB LEU 29 -4.770 -0.811 1.549
208 HD11 LEU 29 1HD1 LEU 29 -4.603 -2.027 -1.174
209 HD12 LEU 29 2HD1 LEU 29 -6.041 -3.044 -1.100
210 HD13 LEU 29 3HD1 LEU 29 -4.957 -2.946 0.289
211 HD21 LEU 29 3HD2 LEU 29 -7.939 -0.876 1.214
212 HD22 LEU 29 1HD2 LEU 29 -6.928 -2.212 1.767
213 HD23 LEU 29 2HD2 LEU 29 -7.949 -2.408 0.343
214 H TYR 30 H TYR 30 -5.357 0.517 3.846
215 HA TYR 30 HA TYR 30 -3.564 2.837 4.085
216 HD1 TYR 30 HD2 TYR 30 -3.390 4.499 6.463
217 HD2 TYR 30 HD1 TYR 30 -3.636 0.453 7.774
218 HE1 TYR 30 HE2 TYR 30 -1.850 5.005 8.311
219 HE2 TYR 30 HE1 TYR 30 -2.097 0.950 9.619
220 HH TYR 30 HH TYR 30 -1.287 4.093 10.549
221 HB2 TYR 30 2HB TYR 30 -5.257 2.952 5.740
222 HB3 TYR 30 1HB TYR 30 -5.132 1.237 6.109
223 H VAL 31 H VAL 31 -1.438 2.561 4.354
224 HA VAL 31 HA VAL 31 -0.394 -0.092 5.155
225 HB VAL 31 HB VAL 31 0.811 1.806 3.115
226 HG11 VAL 31 1HG1 VAL 31 1.840 -0.852 4.125
227 HG12 VAL 31 2HG1 VAL 31 2.572 0.730 4.396
228 HG13 VAL 31 3HG1 VAL 31 2.514 0.056 2.768
229 HG21 VAL 31 3HG2 VAL 31 0.402 0.008 1.494
230 HG22 VAL 31 1HG2 VAL 31 -1.100 0.573 2.226
231 HG23 VAL 31 2HG2 VAL 31 -0.382 -0.950 2.751
232 H GLY 32 H GLY 32 0.331 0.193 7.216
233 HA2 GLY 32 2HA GLY 32 1.926 2.634 7.786
234 HA3 GLY 32 1HA GLY 32 0.760 1.990 8.926
235 H SER 33 H SER 33 3.892 1.506 7.439
236 HA SER 33 HA SER 33 5.065 0.476 9.791
237 HG SER 33 HG SER 33 5.316 -2.224 7.057
238 HB2 SER 33 2HB SER 33 5.529 -1.841 9.109
239 HB3 SER 33 1HB SER 33 3.793 -1.562 9.229
240 H LEU 34 H LEU 34 5.489 2.335 7.496
241 HA LEU 34 HA LEU 34 7.757 1.289 6.010
242 HG LEU 34 HG LEU 34 4.814 2.560 5.361
243 HB2 LEU 34 2HB LEU 34 6.606 4.087 6.041
244 HB3 LEU 34 1HB LEU 34 7.672 3.405 4.827
245 HD11 LEU 34 1HD1 LEU 34 4.342 3.496 3.159
246 HD12 LEU 34 2HD1 LEU 34 6.017 4.033 3.017
247 HD13 LEU 34 3HD1 LEU 34 4.970 4.725 4.258
248 HD21 LEU 34 3HD2 LEU 34 6.752 1.567 3.267
249 HD22 LEU 34 1HD2 LEU 34 5.049 1.123 3.399
250 HD23 LEU 34 2HD2 LEU 34 6.182 0.660 4.667
251 H HIS 35 H HIS 35 9.817 2.701 5.867
252 HA HIS 35 HA HIS 35 10.366 4.130 8.358
253 HD1 HIS 35 HD1 HIS 35 14.130 2.701 6.901
254 HD2 HIS 35 HD2 HIS 35 11.230 -0.269 7.020
255 HE1 HIS 35 HE1 HIS 35 15.015 0.842 5.473
256 HE2 HIS 35 HE2 HIS 35 13.381 -1.037 5.804
257 HB2 HIS 35 2HB HIS 35 12.398 2.909 8.863
258 HB3 HIS 35 1HB HIS 35 11.024 1.819 8.821
259 H PHE 36 H PHE 36 10.273 5.919 6.879
260 HA PHE 36 HA PHE 36 11.255 7.686 5.842
261 HD1 PHE 36 HD1 PHE 36 12.083 9.873 6.665
262 HD2 PHE 36 HD2 PHE 36 15.660 7.554 6.504
263 HE1 PHE 36 HE1 PHE 36 13.353 11.873 6.018
264 HE2 PHE 36 HE2 PHE 36 16.929 9.558 5.855
265 HZ PHE 36 HZ PHE 36 15.777 11.722 5.613
266 HB2 PHE 36 2HB PHE 36 12.492 7.571 7.960
267 HB3 PHE 36 1HB PHE 36 13.703 6.542 7.205
268 H ASN 37 H ASN 37 11.745 4.817 4.430
269 HA ASN 37 HA ASN 37 13.294 6.007 2.244
270 HB2 ASN 37 2HB ASN 37 14.837 4.682 3.779
271 HB3 ASN 37 1HB ASN 37 13.959 3.239 3.289
272 HD21 ASN 37 1HD2 ASN 37 14.133 2.536 1.128
273 HD22 ASN 37 2HD2 ASN 37 15.441 3.039 0.120
274 H ILE 38 H ILE 38 10.682 5.821 2.052
275 HA ILE 38 HA ILE 38 10.210 3.555 0.220
276 HB ILE 38 HB ILE 38 8.109 4.631 2.123
277 HG12 ILE 38 2HG1 ILE 38 9.867 3.381 3.345
278 HG13 ILE 38 1HG1 ILE 38 8.317 2.554 3.378
279 HG21 ILE 38 1HG2 ILE 38 8.078 2.262 0.242
280 HG22 ILE 38 2HG2 ILE 38 7.188 3.771 0.039
281 HG23 ILE 38 3HG2 ILE 38 6.794 2.687 1.373
282 HD11 ILE 38 3HD1 ILE 38 10.639 1.857 1.595
283 HD12 ILE 38 1HD1 ILE 38 9.091 1.011 1.666
284 HD13 ILE 38 2HD1 ILE 38 10.164 1.011 3.067
285 H THR 39 H THR 39 9.576 4.252 -1.751
286 HA THR 39 HA THR 39 8.560 7.023 -2.014
287 HB THR 39 HB THR 39 9.346 7.010 -4.307
288 HG1 THR 39 HG1 THR 39 10.605 5.025 -4.939
289 HG21 THR 39 3HG2 THR 39 11.765 6.741 -3.979
290 HG22 THR 39 1HG2 THR 39 11.470 5.860 -2.481
291 HG23 THR 39 2HG2 THR 39 11.027 7.563 -2.605
292 H GLU 40 H GLU 40 6.865 7.465 -3.573
293 HA GLU 40 HA GLU 40 4.687 5.737 -3.718
294 HB2 GLU 40 2HB GLU 40 5.529 7.960 -5.599
295 HB3 GLU 40 1HB GLU 40 3.984 7.131 -5.725
296 HG2 GLU 40 2HG GLU 40 3.396 7.895 -3.467
297 HG3 GLU 40 1HG GLU 40 4.942 8.738 -3.360
298 H ASP 41 H ASP 41 7.521 5.943 -5.743
299 HA ASP 41 HA ASP 41 6.683 4.395 -7.930
300 HB2 ASP 41 2HB ASP 41 9.491 4.541 -6.813
301 HB3 ASP 41 1HB ASP 41 9.015 4.241 -8.484
302 H MET 42 H MET 42 8.221 3.470 -4.864
303 HA MET 42 HA MET 42 8.586 0.717 -5.441
304 HB2 MET 42 2HB MET 42 8.182 2.094 -2.769
305 HB3 MET 42 1HB MET 42 8.791 0.458 -2.984
306 HG2 MET 42 2HG MET 42 10.785 1.266 -4.029
307 HG3 MET 42 1HG MET 42 10.151 2.913 -4.080
308 HE1 MET 42 3HE MET 42 12.457 3.768 -2.933
309 HE2 MET 42 1HE MET 42 13.029 2.099 -2.896
310 HE3 MET 42 2HE MET 42 13.090 3.083 -1.435
311 H LEU 43 H LEU 43 6.101 2.358 -3.506
312 HA LEU 43 HA LEU 43 4.436 0.182 -2.993
313 HG LEU 43 HG LEU 43 5.428 2.760 -1.637
314 HB2 LEU 43 2HB LEU 43 3.637 3.071 -3.392
315 HB3 LEU 43 1HB LEU 43 2.696 1.853 -2.552
316 HD11 LEU 43 1HD1 LEU 43 4.259 4.084 0.062
317 HD12 LEU 43 2HD1 LEU 43 2.715 3.690 -0.696
318 HD13 LEU 43 3HD1 LEU 43 3.908 4.651 -1.570
319 HD21 LEU 43 3HD2 LEU 43 4.742 1.712 0.491
320 HD22 LEU 43 1HD2 LEU 43 4.819 0.555 -0.838
321 HD23 LEU 43 2HD2 LEU 43 3.256 1.155 -0.281
322 H ARG 44 H ARG 44 4.106 2.624 -5.577
323 HA ARG 44 HA ARG 44 1.833 1.642 -6.818
324 HE ARG 44 HE ARG 44 3.802 5.693 -8.870
325 HB2 ARG 44 2HB ARG 44 3.234 3.802 -7.243
326 HB3 ARG 44 1HB ARG 44 4.093 2.819 -8.421
327 HG2 ARG 44 2HG ARG 44 1.922 2.364 -9.545
328 HG3 ARG 44 1HG ARG 44 1.147 3.472 -8.411
329 HD2 ARG 44 2HD ARG 44 3.262 4.116 -10.462
330 HD3 ARG 44 1HD ARG 44 1.588 4.670 -10.441
331 HH11 ARG 44 1HH1 ARG 44 0.382 5.656 -9.333
332 HH12 ARG 44 2HH1 ARG 44 0.148 7.145 -8.483
333 HH21 ARG 44 1HH2 ARG 44 3.476 7.612 -7.815
334 HH22 ARG 44 2HH2 ARG 44 1.873 8.231 -7.634
335 H GLY 45 H GLY 45 5.241 0.826 -7.533
336 HA2 GLY 45 2HA GLY 45 4.744 -0.945 -9.666
337 HA3 GLY 45 1HA GLY 45 6.186 -0.936 -8.666
338 H ILE 46 H ILE 46 4.661 -1.504 -6.190
339 HA ILE 46 HA ILE 46 4.537 -4.388 -6.471
340 HB ILE 46 HB ILE 46 4.091 -2.625 -4.051
341 HG12 ILE 46 2HG1 ILE 46 6.473 -4.321 -4.865
342 HG13 ILE 46 1HG1 ILE 46 6.394 -2.565 -4.959
343 HG21 ILE 46 1HG2 ILE 46 4.291 -4.667 -2.711
344 HG22 ILE 46 2HG2 ILE 46 4.383 -5.632 -4.185
345 HG23 ILE 46 3HG2 ILE 46 2.906 -4.750 -3.798
346 HD11 ILE 46 3HD1 ILE 46 7.653 -3.270 -3.021
347 HD12 ILE 46 1HD1 ILE 46 6.282 -4.217 -2.443
348 HD13 ILE 46 2HD1 ILE 46 6.169 -2.457 -2.523
349 H PHE 47 H PHE 47 2.228 -1.771 -5.863
350 HA PHE 47 HA PHE 47 0.069 -3.626 -5.305
351 HD1 PHE 47 HD2 PHE 47 1.992 -0.754 -3.543
352 HD2 PHE 47 HD1 PHE 47 -1.765 -2.689 -3.055
353 HE1 PHE 47 HE2 PHE 47 2.437 -1.004 -1.138
354 HE2 PHE 47 HE1 PHE 47 -1.326 -2.938 -0.648
355 HZ PHE 47 HZ PHE 47 0.776 -2.093 0.316
356 HB2 PHE 47 2HB PHE 47 0.269 -0.623 -5.282
357 HB3 PHE 47 1HB PHE 47 -1.267 -1.455 -5.079
358 H GLU 48 H GLU 48 1.039 -1.616 -8.070
359 HA GLU 48 HA GLU 48 -1.390 -1.516 -9.429
360 HB2 GLU 48 2HB GLU 48 1.441 -1.476 -10.425
361 HB3 GLU 48 1HB GLU 48 0.109 -1.524 -11.571
362 HG2 GLU 48 2HG GLU 48 -0.810 0.522 -10.428
363 HG3 GLU 48 1HG GLU 48 0.703 0.607 -9.532
364 HA PRO 49 HA PRO 49 -0.015 -6.002 -11.391
365 HB2 PRO 49 2HB PRO 49 0.539 -6.812 -8.544
366 HB3 PRO 49 1HB PRO 49 1.123 -7.540 -10.046
367 HG2 PRO 49 2HG PRO 49 2.687 -5.898 -8.652
368 HG3 PRO 49 1HG PRO 49 2.672 -5.848 -10.425
369 HD2 PRO 49 2HD PRO 49 1.556 -3.913 -8.472
370 HD3 PRO 49 1HD PRO 49 2.105 -3.647 -10.138
371 H PHE 50 H PHE 50 -1.415 -5.309 -8.184
372 HA PHE 50 HA PHE 50 -3.631 -7.118 -8.508
373 HD1 PHE 50 HD2 PHE 50 -4.119 -8.359 -5.894
374 HD2 PHE 50 HD1 PHE 50 -0.976 -5.478 -5.791
375 HE1 PHE 50 HE2 PHE 50 -2.775 -9.879 -4.501
376 HE2 PHE 50 HE1 PHE 50 0.367 -6.998 -4.398
377 HZ PHE 50 HZ PHE 50 -0.533 -9.196 -3.740
378 HB2 PHE 50 2HB PHE 50 -3.174 -4.858 -6.539
379 HB3 PHE 50 1HB PHE 50 -4.516 -5.991 -6.464
380 H GLY 51 H GLY 51 -3.359 -3.555 -8.414
381 HA2 GLY 51 2HA GLY 51 -5.482 -3.231 -10.343
382 HA3 GLY 51 1HA GLY 51 -5.913 -2.746 -8.707
383 H ARG 52 H ARG 52 -5.300 -1.358 -11.386
384 HA ARG 52 HA ARG 52 -2.995 0.198 -11.218
385 HE ARG 52 HE ARG 52 -4.965 3.838 -11.982
386 HB2 ARG 52 2HB ARG 52 -4.900 -0.088 -13.075
387 HB3 ARG 52 1HB ARG 52 -5.459 1.426 -12.387
388 HG2 ARG 52 2HG ARG 52 -2.661 0.992 -13.427
389 HG3 ARG 52 1HG ARG 52 -3.985 1.634 -14.397
390 HD2 ARG 52 2HD ARG 52 -2.871 2.876 -11.878
391 HD3 ARG 52 1HD ARG 52 -2.546 3.416 -13.524
392 HH11 ARG 52 1HH1 ARG 52 -3.504 3.925 -15.107
393 HH12 ARG 52 2HH1 ARG 52 -4.653 5.060 -15.721
394 HH21 ARG 52 1HH2 ARG 52 -6.396 5.307 -12.778
395 HH22 ARG 52 2HH2 ARG 52 -6.256 5.851 -14.417
396 H ILE 53 H ILE 53 -2.379 1.735 -9.814
397 HA ILE 53 HA ILE 53 -4.210 2.802 -7.861
398 HB ILE 53 HB ILE 53 -1.264 3.294 -8.327
399 HG12 ILE 53 2HG1 ILE 53 -1.146 2.204 -6.017
400 HG13 ILE 53 1HG1 ILE 53 -2.832 1.759 -6.245
401 HG21 ILE 53 1HG2 ILE 53 -2.202 5.353 -7.456
402 HG22 ILE 53 2HG2 ILE 53 -1.253 4.551 -6.206
403 HG23 ILE 53 3HG2 ILE 53 -3.013 4.468 -6.162
404 HD11 ILE 53 3HD1 ILE 53 -0.489 0.889 -7.917
405 HD12 ILE 53 1HD1 ILE 53 -2.176 0.507 -8.270
406 HD13 ILE 53 2HD1 ILE 53 -1.427 -0.094 -6.793
407 H GLU 54 H GLU 54 -5.140 4.758 -7.790
408 HA GLU 54 HA GLU 54 -4.858 6.562 -10.052
409 HB2 GLU 54 2HB GLU 54 -6.644 6.821 -7.617
410 HB3 GLU 54 1HB GLU 54 -6.781 7.725 -9.123
411 HG2 GLU 54 2HG GLU 54 -7.234 4.770 -8.734
412 HG3 GLU 54 1HG GLU 54 -8.458 5.990 -9.061
413 H SER 55 H SER 55 -4.526 6.796 -6.496
414 HA SER 55 HA SER 55 -2.394 8.756 -6.816
415 HG SER 55 HG SER 55 -5.285 10.295 -7.275
416 HB2 SER 55 2HB SER 55 -4.974 9.420 -5.370
417 HB3 SER 55 1HB SER 55 -3.483 10.341 -5.176
418 H ILE 56 H ILE 56 -0.916 8.739 -5.185
419 HA ILE 56 HA ILE 56 -1.462 7.021 -2.829
420 HB ILE 56 HB ILE 56 1.241 7.598 -4.085
421 HG12 ILE 56 2HG1 ILE 56 -0.440 5.075 -4.220
422 HG13 ILE 56 1HG1 ILE 56 -0.168 6.192 -5.553
423 HG21 ILE 56 1HG2 ILE 56 1.385 7.162 -1.699
424 HG22 ILE 56 2HG2 ILE 56 2.039 5.795 -2.601
425 HG23 ILE 56 3HG2 ILE 56 0.430 5.690 -1.884
426 HD11 ILE 56 3HD1 ILE 56 1.924 4.517 -4.180
427 HD12 ILE 56 1HD1 ILE 56 2.224 5.660 -5.488
428 HD13 ILE 56 2HD1 ILE 56 1.230 4.234 -5.775
429 H GLN 57 H GLN 57 -0.966 7.808 -0.799
430 HA GLN 57 HA GLN 57 0.294 10.467 -0.588
431 HB2 GLN 57 2HB GLN 57 -2.130 10.826 -0.549
432 HB3 GLN 57 1HB GLN 57 -2.302 9.651 0.747
433 HG2 GLN 57 2HG GLN 57 -2.442 11.913 1.615
434 HG3 GLN 57 1HG GLN 57 -1.009 11.099 2.240
435 HE21 GLN 57 1HE2 GLN 57 1.018 11.860 1.657
436 HE22 GLN 57 2HE2 GLN 57 1.248 13.350 0.823
437 H LEU 58 H LEU 58 2.097 10.062 0.574
438 HA LEU 58 HA LEU 58 1.929 8.309 2.932
439 HG LEU 58 HG LEU 58 3.210 6.749 1.466
440 HB2 LEU 58 2HB LEU 58 4.358 9.528 1.598
441 HB3 LEU 58 1HB LEU 58 4.395 8.475 3.000
442 HD11 LEU 58 1HD1 LEU 58 4.372 8.595 -0.616
443 HD12 LEU 58 2HD1 LEU 58 2.662 8.244 -0.361
444 HD13 LEU 58 3HD1 LEU 58 3.751 6.971 -0.913
445 HD21 LEU 58 3HD2 LEU 58 5.368 5.946 0.636
446 HD22 LEU 58 1HD2 LEU 58 5.471 6.483 2.311
447 HD23 LEU 58 2HD2 LEU 58 6.098 7.507 1.017
448 H MET 59 H MET 59 2.659 9.045 5.002
449 HA MET 59 HA MET 59 2.120 11.893 5.379
450 HB2 MET 59 2HB MET 59 2.103 9.541 7.248
451 HB3 MET 59 1HB MET 59 2.043 11.198 7.844
452 HG2 MET 59 2HG MET 59 0.076 9.899 5.973
453 HG3 MET 59 1HG MET 59 -0.182 10.301 7.673
454 HE1 MET 59 3HE MET 59 -2.087 11.215 5.229
455 HE2 MET 59 1HE MET 59 -2.440 12.875 5.707
456 HE3 MET 59 2HE MET 59 -2.430 11.592 6.919
457 H MET 60 H MET 60 3.585 13.318 5.725
458 HA MET 60 HA MET 60 6.040 12.757 7.179
459 HB2 MET 60 2HB MET 60 7.485 13.649 5.348
460 HB3 MET 60 1HB MET 60 6.720 12.118 4.946
461 HG2 MET 60 2HG MET 60 5.049 13.286 3.609
462 HG3 MET 60 1HG MET 60 5.780 14.834 4.033
463 HE1 MET 60 3HE MET 60 5.956 15.481 1.468
464 HE2 MET 60 1HE MET 60 5.214 13.946 1.031
465 HE3 MET 60 2HE MET 60 6.711 14.453 0.248
466 H ASP 61 H ASP 61 6.964 14.604 8.081
467 HA ASP 61 HA ASP 61 5.596 17.166 7.528
468 HB2 ASP 61 2HB ASP 61 5.121 16.364 9.780
469 HB3 ASP 61 1HB ASP 61 6.839 16.185 10.105
470 H SER 62 H SER 62 6.824 18.634 6.554
471 HA SER 62 HA SER 62 9.596 18.139 6.069
472 HG SER 62 HG SER 62 10.261 20.837 5.243
473 HB2 SER 62 2HB SER 62 8.154 19.146 4.351
474 HB3 SER 62 1HB SER 62 7.924 20.569 5.366
475 H GLU 63 H GLU 63 8.012 19.866 8.576
476 HA GLU 63 HA GLU 63 10.077 21.795 9.066
477 HB2 GLU 63 2HB GLU 63 7.984 20.743 10.992
478 HB3 GLU 63 1HB GLU 63 8.940 22.204 11.194
479 HG2 GLU 63 2HG GLU 63 6.884 21.716 9.044
480 HG3 GLU 63 1HG GLU 63 6.670 22.711 10.481
481 H THR 64 H THR 64 9.046 19.116 11.178
482 HA THR 64 HA THR 64 11.717 18.027 11.365
483 HB THR 64 HB THR 64 12.023 19.850 12.901
484 HG1 THR 64 HG1 THR 64 11.578 17.428 14.352
485 HG21 THR 64 3HG2 THR 64 10.616 20.156 14.891
486 HG22 THR 64 1HG2 THR 64 9.566 18.849 14.342
487 HG23 THR 64 2HG2 THR 64 9.681 20.337 13.403
488 H GLY 65 H GLY 65 8.682 17.387 11.015
489 HA2 GLY 65 2HA GLY 65 8.400 15.251 12.996
490 HA3 GLY 65 1HA GLY 65 7.231 15.687 11.758
491 H ARG 66 H ARG 66 9.189 15.708 9.634
492 HA ARG 66 HA ARG 66 10.109 14.379 8.051
493 HE ARG 66 HE ARG 66 13.547 11.712 10.078
494 HB2 ARG 66 2HB ARG 66 10.832 12.637 10.418
495 HB3 ARG 66 1HB ARG 66 11.562 12.548 8.820
496 HG2 ARG 66 2HG ARG 66 12.544 14.718 9.056
497 HG3 ARG 66 1HG ARG 66 11.646 15.030 10.543
498 HD2 ARG 66 2HD ARG 66 13.999 14.467 10.974
499 HD3 ARG 66 1HD ARG 66 12.893 13.301 11.696
500 HH11 ARG 66 1HH1 ARG 66 15.265 14.677 9.729
501 HH12 ARG 66 2HH1 ARG 66 16.578 13.943 8.878
502 HH21 ARG 66 1HH2 ARG 66 15.238 10.768 9.017
503 HH22 ARG 66 2HH2 ARG 66 16.574 11.737 8.499
504 H SER 67 H SER 67 10.282 11.653 7.633
505 HA SER 67 HA SER 67 7.614 11.045 6.859
506 HG SER 67 HG SER 67 9.621 9.918 4.469
507 HB2 SER 67 2HB SER 67 10.049 9.235 6.880
508 HB3 SER 67 1HB SER 67 8.542 8.925 6.015
509 H LYS 68 H LYS 68 6.101 10.579 8.357
510 HA LYS 68 HA LYS 68 6.603 9.456 10.890
511 HB2 LYS 68 2HB LYS 68 4.076 9.801 9.292
512 HB3 LYS 68 1HB LYS 68 4.061 9.032 10.872
513 HG2 LYS 68 2HG LYS 68 5.038 11.077 11.852
514 HG3 LYS 68 1HG LYS 68 4.978 11.845 10.265
515 HD2 LYS 68 2HD LYS 68 2.569 11.698 10.222
516 HD3 LYS 68 1HD LYS 68 2.558 10.749 11.708
517 HE2 LYS 68 2HE LYS 68 1.931 13.093 12.103
518 HE3 LYS 68 1HE LYS 68 3.404 12.654 12.963
519 HZ1 LYS 68 3HZ LYS 68 3.539 14.835 11.896
520 HZ2 LYS 68 1HZ LYS 68 3.313 14.120 10.379
521 HZ3 LYS 68 2HZ LYS 68 4.699 13.769 11.291
522 H GLY 69 H GLY 69 5.571 7.903 7.865
523 HA2 GLY 69 2HA GLY 69 6.578 5.698 7.474
524 HA3 GLY 69 1HA GLY 69 6.246 5.317 9.150
525 H TYR 70 H TYR 70 3.558 6.921 7.862
526 HA TYR 70 HA TYR 70 2.416 4.401 6.848
527 HD1 TYR 70 HD1 TYR 70 2.449 6.972 10.109
528 HD2 TYR 70 HD2 TYR 70 -1.135 6.650 7.828
529 HE1 TYR 70 HE1 TYR 70 1.660 9.103 11.055
530 HE2 TYR 70 HE2 TYR 70 -1.928 8.779 8.762
531 HH TYR 70 HH TYR 70 -1.590 10.221 10.610
532 HB2 TYR 70 2HB TYR 70 0.315 4.790 7.984
533 HB3 TYR 70 1HB TYR 70 1.624 4.759 9.155
534 H GLY 71 H GLY 71 0.818 4.550 5.260
535 HA2 GLY 71 2HA GLY 71 0.213 7.183 4.125
536 HA3 GLY 71 1HA GLY 71 1.142 6.078 3.130
537 H PHE 72 H PHE 72 -1.386 7.132 2.417
538 HA PHE 72 HA PHE 72 -3.076 4.706 2.426
539 HD1 PHE 72 HD1 PHE 72 -3.021 8.126 4.342
540 HD2 PHE 72 HD2 PHE 72 -5.943 5.104 3.648
541 HE1 PHE 72 HE1 PHE 72 -3.616 8.157 6.728
542 HE2 PHE 72 HE2 PHE 72 -6.540 5.134 6.036
543 HZ PHE 72 HZ PHE 72 -5.376 6.663 7.579
544 HB2 PHE 72 2HB PHE 72 -3.847 7.614 2.073
545 HB3 PHE 72 1HB PHE 72 -4.952 6.269 1.813
546 H ILE 73 H ILE 73 -3.710 3.822 0.501
547 HA ILE 73 HA ILE 73 -2.778 5.128 -1.985
548 HB ILE 73 HB ILE 73 -2.744 2.161 -1.365
549 HG12 ILE 73 2HG1 ILE 73 -0.462 4.102 -1.832
550 HG13 ILE 73 1HG1 ILE 73 -0.955 3.490 -0.258
551 HG21 ILE 73 1HG2 ILE 73 -1.925 3.649 -3.865
552 HG22 ILE 73 2HG2 ILE 73 -3.296 2.550 -3.700
553 HG23 ILE 73 3HG2 ILE 73 -1.650 1.932 -3.564
554 HD11 ILE 73 3HD1 ILE 73 0.128 1.850 -2.541
555 HD12 ILE 73 1HD1 ILE 73 -0.375 1.221 -0.971
556 HD13 ILE 73 2HD1 ILE 73 1.000 2.321 -1.082
557 H THR 74 H THR 74 -4.314 5.481 -3.453
558 HA THR 74 HA THR 74 -6.965 4.235 -3.101
559 HB THR 74 HB THR 74 -6.164 6.652 -4.757
560 HG1 THR 74 HG1 THR 74 -6.414 7.697 -2.937
561 HG21 THR 74 3HG2 THR 74 -8.125 5.536 -5.705
562 HG22 THR 74 1HG2 THR 74 -8.590 7.059 -4.947
563 HG23 THR 74 2HG2 THR 74 -8.905 5.531 -4.121
564 H PHE 75 H PHE 75 -7.476 2.571 -4.336
565 HA PHE 75 HA PHE 75 -6.113 2.135 -6.905
566 HD1 PHE 75 HD1 PHE 75 -6.477 0.998 -3.272
567 HD2 PHE 75 HD2 PHE 75 -4.848 -0.979 -6.674
568 HE1 PHE 75 HE1 PHE 75 -4.528 0.319 -1.940
569 HE2 PHE 75 HE2 PHE 75 -2.897 -1.658 -5.345
570 HZ PHE 75 HZ PHE 75 -2.738 -1.009 -2.977
571 HB2 PHE 75 2HB PHE 75 -7.877 0.278 -5.279
572 HB3 PHE 75 1HB PHE 75 -7.030 -0.156 -6.759
573 H SER 76 H SER 76 -7.256 1.781 -8.829
574 HA SER 76 HA SER 76 -9.876 2.941 -9.057
575 HG SER 76 HG SER 76 -9.754 3.043 -12.331
576 HB2 SER 76 2HB SER 76 -8.234 3.104 -10.885
577 HB3 SER 76 1HB SER 76 -8.271 1.358 -11.083
578 H ASP 77 H ASP 77 -8.707 -0.189 -8.343
579 HA ASP 77 HA ASP 77 -11.312 -1.434 -8.963
580 HB2 ASP 77 2HB ASP 77 -9.176 -2.365 -10.009
581 HB3 ASP 77 1HB ASP 77 -8.718 -2.887 -8.392
582 H SER 78 H SER 78 -12.255 -2.871 -7.379
583 HA SER 78 HA SER 78 -11.602 -2.088 -4.616
584 HG SER 78 HG SER 78 -14.311 -3.405 -6.749
585 HB2 SER 78 2HB SER 78 -13.855 -2.795 -4.016
586 HB3 SER 78 1HB SER 78 -13.929 -1.688 -5.386
587 H GLU 79 H GLU 79 -12.697 -5.051 -6.314
588 HA GLU 79 HA GLU 79 -12.164 -6.747 -4.111
589 HB2 GLU 79 2HB GLU 79 -12.626 -7.361 -7.035
590 HB3 GLU 79 1HB GLU 79 -12.463 -8.605 -5.800
591 HG2 GLU 79 2HG GLU 79 -14.388 -7.641 -4.602
592 HG3 GLU 79 1HG GLU 79 -14.571 -6.451 -5.890
593 H CYS 80 H CYS 80 -10.230 -6.036 -7.020
594 HA CYS 80 HA CYS 80 -8.105 -7.805 -6.473
595 HG CYS 80 HG CYS 80 -9.734 -6.331 -9.460
596 HB2 CYS 80 2HB CYS 80 -8.014 -5.110 -7.853
597 HB3 CYS 80 1HB CYS 80 -6.730 -6.314 -7.897
598 H ALA 81 H ALA 81 -8.902 -4.654 -5.205
599 HA ALA 81 HA ALA 81 -6.453 -4.220 -3.796
600 HB1 ALA 81 3HB ALA 81 -7.665 -2.433 -2.641
601 HB2 ALA 81 1HB ALA 81 -9.181 -3.011 -3.335
602 HB3 ALA 81 2HB ALA 81 -7.919 -2.361 -4.384
603 H LYS 82 H LYS 82 -9.561 -5.729 -2.985
604 HA LYS 82 HA LYS 82 -9.165 -6.261 -0.280
605 HB2 LYS 82 2HB LYS 82 -10.798 -7.395 -2.421
606 HB3 LYS 82 1HB LYS 82 -10.276 -8.631 -1.291
607 HG2 LYS 82 2HG LYS 82 -12.306 -7.965 -0.435
608 HG3 LYS 82 1HG LYS 82 -11.159 -7.041 0.533
609 HD2 LYS 82 2HD LYS 82 -11.577 -5.056 -0.798
610 HD3 LYS 82 1HD LYS 82 -12.605 -5.972 -1.902
611 HE2 LYS 82 2HE LYS 82 -14.117 -6.462 0.029
612 HE3 LYS 82 1HE LYS 82 -13.142 -5.365 1.004
613 HZ1 LYS 82 3HZ LYS 82 -15.087 -4.246 0.142
614 HZ2 LYS 82 1HZ LYS 82 -14.658 -4.644 -1.445
615 HZ3 LYS 82 2HZ LYS 82 -13.693 -3.586 -0.552
616 H LYS 83 H LYS 83 -8.152 -8.233 -3.084
617 HA LYS 83 HA LYS 83 -6.702 -10.133 -1.585
618 HB2 LYS 83 2HB LYS 83 -7.425 -10.483 -3.933
619 HB3 LYS 83 1HB LYS 83 -6.212 -9.321 -4.461
620 HG2 LYS 83 2HG LYS 83 -4.430 -10.743 -3.681
621 HG3 LYS 83 1HG LYS 83 -5.582 -11.854 -2.943
622 HD2 LYS 83 2HD LYS 83 -4.771 -12.801 -5.010
623 HD3 LYS 83 1HD LYS 83 -6.470 -12.374 -5.196
624 HE2 LYS 83 2HE LYS 83 -4.517 -10.295 -5.987
625 HE3 LYS 83 1HE LYS 83 -4.554 -11.743 -6.990
626 HZ1 LYS 83 3HZ LYS 83 -6.969 -10.150 -6.324
627 HZ2 LYS 83 1HZ LYS 83 -6.844 -11.405 -7.452
628 HZ3 LYS 83 2HZ LYS 83 -6.056 -9.937 -7.734
629 H ALA 84 H ALA 84 -5.687 -7.097 -3.134
630 HA ALA 84 HA ALA 84 -2.944 -7.211 -2.663
631 HB1 ALA 84 3HB ALA 84 -4.703 -4.758 -2.494
632 HB2 ALA 84 1HB ALA 84 -4.041 -5.442 -3.979
633 HB3 ALA 84 2HB ALA 84 -2.958 -4.775 -2.757
634 H LEU 85 H LEU 85 -5.548 -6.190 -0.505
635 HA LEU 85 HA LEU 85 -3.958 -5.392 1.682
636 HG LEU 85 HG LEU 85 -5.413 -4.731 3.707
637 HB2 LEU 85 2HB LEU 85 -6.366 -4.849 1.330
638 HB3 LEU 85 1HB LEU 85 -6.774 -6.516 1.674
639 HD11 LEU 85 1HD1 LEU 85 -8.375 -5.193 3.319
640 HD12 LEU 85 2HD1 LEU 85 -7.511 -3.679 3.052
641 HD13 LEU 85 3HD1 LEU 85 -7.632 -4.350 4.679
642 HD21 LEU 85 3HD2 LEU 85 -6.377 -6.332 5.320
643 HD22 LEU 85 1HD2 LEU 85 -5.266 -7.113 4.196
644 HD23 LEU 85 2HD2 LEU 85 -7.006 -7.290 3.978
645 H GLU 86 H GLU 86 -5.823 -8.401 1.248
646 HA GLU 86 HA GLU 86 -4.808 -9.621 3.592
647 HB2 GLU 86 2HB GLU 86 -6.004 -11.614 2.846
648 HB3 GLU 86 1HB GLU 86 -6.996 -10.175 2.623
649 HG2 GLU 86 2HG GLU 86 -6.494 -10.168 0.247
650 HG3 GLU 86 1HG GLU 86 -5.436 -11.563 0.447
651 H GLN 87 H GLN 87 -3.448 -9.372 0.434
652 HA GLN 87 HA GLN 87 -1.834 -11.779 0.652
653 HB2 GLN 87 2HB GLN 87 -2.716 -10.941 -1.533
654 HB3 GLN 87 1HB GLN 87 -1.684 -9.528 -1.374
655 HG2 GLN 87 2HG GLN 87 -0.540 -10.965 -2.822
656 HG3 GLN 87 1HG GLN 87 0.276 -11.142 -1.270
657 HE21 GLN 87 1HE2 GLN 87 -1.761 -12.660 -3.619
658 HE22 GLN 87 2HE2 GLN 87 -1.663 -14.257 -2.978
659 H LEU 88 H LEU 88 -1.408 -8.281 1.015
660 HA LEU 88 HA LEU 88 1.494 -8.626 1.149
661 HG LEU 88 HG LEU 88 -0.322 -7.462 -1.128
662 HB2 LEU 88 2HB LEU 88 -0.143 -6.103 0.928
663 HB3 LEU 88 1HB LEU 88 1.608 -6.206 0.838
664 HD11 LEU 88 1HD1 LEU 88 1.473 -5.057 -1.437
665 HD12 LEU 88 2HD1 LEU 88 -0.285 -5.035 -1.304
666 HD13 LEU 88 3HD1 LEU 88 0.481 -5.785 -2.702
667 HD21 LEU 88 3HD2 LEU 88 2.702 -7.332 -1.145
668 HD22 LEU 88 1HD2 LEU 88 1.693 -7.925 -2.467
669 HD23 LEU 88 2HD2 LEU 88 1.715 -8.778 -0.926
670 H ASN 89 H ASN 89 -1.088 -8.149 3.368
671 HA ASN 89 HA ASN 89 0.285 -6.591 5.298
672 HB2 ASN 89 2HB ASN 89 -1.391 -7.639 6.935
673 HB3 ASN 89 1HB ASN 89 -2.033 -6.672 5.614
674 HD21 ASN 89 1HD2 ASN 89 -4.023 -7.692 5.800
675 HD22 ASN 89 2HD2 ASN 89 -4.283 -9.302 5.238
676 H GLY 90 H GLY 90 2.377 -7.432 5.346
677 HA2 GLY 90 2HA GLY 90 3.473 -8.794 7.285
678 HA3 GLY 90 1HA GLY 90 2.771 -10.157 6.425
679 H PHE 91 H PHE 91 3.360 -8.417 3.911
680 HA PHE 91 HA PHE 91 5.760 -9.671 3.102
681 HD1 PHE 91 HD2 PHE 91 5.873 -10.221 0.320
682 HD2 PHE 91 HD1 PHE 91 5.920 -5.996 0.877
683 HE1 PHE 91 HE2 PHE 91 7.530 -10.001 -1.484
684 HE2 PHE 91 HE1 PHE 91 7.574 -5.774 -0.929
685 HZ PHE 91 HZ PHE 91 8.376 -7.775 -2.110
686 HB2 PHE 91 2HB PHE 91 4.030 -8.986 1.515
687 HB3 PHE 91 1HB PHE 91 4.268 -7.297 1.941
688 H GLU 92 H GLU 92 7.882 -8.988 3.125
689 HA GLU 92 HA GLU 92 8.508 -6.747 4.851
690 HB2 GLU 92 2HB GLU 92 10.309 -8.718 3.431
691 HB3 GLU 92 1HB GLU 92 10.866 -7.483 4.554
692 HG2 GLU 92 2HG GLU 92 9.557 -8.516 6.345
693 HG3 GLU 92 1HG GLU 92 8.990 -9.750 5.218
694 H LEU 93 H LEU 93 8.288 -4.790 3.931
695 HA LEU 93 HA LEU 93 9.571 -4.272 1.332
696 HG LEU 93 HG LEU 93 9.182 -1.158 1.546
697 HB2 LEU 93 2HB LEU 93 7.255 -3.495 1.574
698 HB3 LEU 93 1HB LEU 93 7.710 -2.548 2.979
699 HD11 LEU 93 1HD1 LEU 93 7.986 -2.743 -0.730
700 HD12 LEU 93 2HD1 LEU 93 9.668 -2.790 -0.201
701 HD13 LEU 93 3HD1 LEU 93 9.003 -1.310 -0.888
702 HD21 LEU 93 3HD2 LEU 93 6.309 -1.330 0.625
703 HD22 LEU 93 1HD2 LEU 93 7.388 0.048 0.395
704 HD23 LEU 93 2HD2 LEU 93 6.903 -0.428 2.023
705 H ALA 94 H ALA 94 11.465 -3.212 1.220
706 HA ALA 94 HA ALA 94 13.388 -2.154 1.828
707 HB1 ALA 94 3HB ALA 94 11.696 -0.732 3.897
708 HB2 ALA 94 1HB ALA 94 11.841 -0.246 2.204
709 HB3 ALA 94 2HB ALA 94 13.255 -0.209 3.257
710 H GLY 95 H GLY 95 12.451 -4.643 3.225
711 HA2 GLY 95 2HA GLY 95 13.602 -6.076 4.668
712 HA3 GLY 95 1HA GLY 95 14.537 -4.712 5.256
713 H ARG 96 H ARG 96 11.191 -4.122 5.264
714 HA ARG 96 HA ARG 96 10.890 -4.985 8.063
715 HE ARG 96 HE ARG 96 8.005 -0.288 9.994
716 HB2 ARG 96 2HB ARG 96 11.557 -2.657 8.150
717 HB3 ARG 96 1HB ARG 96 10.349 -2.220 6.952
718 HG2 ARG 96 2HG ARG 96 8.569 -2.580 8.501
719 HG3 ARG 96 1HG ARG 96 9.662 -3.321 9.675
720 HD2 ARG 96 2HD ARG 96 10.760 -1.241 10.088
721 HD3 ARG 96 1HD ARG 96 9.954 -0.470 8.724
722 HH11 ARG 96 1HH1 ARG 96 10.466 -1.914 11.784
723 HH12 ARG 96 2HH1 ARG 96 9.703 -1.604 13.299
724 HH21 ARG 96 1HH2 ARG 96 7.071 0.123 11.946
725 HH22 ARG 96 2HH2 ARG 96 7.804 -0.477 13.395
726 HA PRO 97 HA PRO 97 7.112 -6.789 6.569
727 HB2 PRO 97 2HB PRO 97 5.646 -6.566 8.943
728 HB3 PRO 97 1HB PRO 97 6.724 -7.897 8.514
729 HG2 PRO 97 2HG PRO 97 7.258 -5.497 10.218
730 HG3 PRO 97 1HG PRO 97 7.792 -7.175 10.442
731 HD2 PRO 97 2HD PRO 97 9.474 -5.315 9.520
732 HD3 PRO 97 1HD PRO 97 9.505 -6.969 8.871
733 H MET 98 H MET 98 5.218 -6.132 5.666
734 HA MET 98 HA MET 98 4.546 -3.286 5.901
735 HB2 MET 98 2HB MET 98 5.069 -4.257 3.666
736 HB3 MET 98 1HB MET 98 3.673 -5.312 3.826
737 HG2 MET 98 2HG MET 98 2.260 -3.239 4.019
738 HG3 MET 98 1HG MET 98 3.696 -2.314 3.585
739 HE1 MET 98 3HE MET 98 4.951 -2.564 1.198
740 HE2 MET 98 1HE MET 98 4.443 -3.725 -0.029
741 HE3 MET 98 2HE MET 98 5.106 -4.295 1.502
742 H LYS 99 H LYS 99 2.933 -2.799 7.278
743 HA LYS 99 HA LYS 99 0.810 -4.730 7.833
744 HB2 LYS 99 2HB LYS 99 1.385 -1.996 8.993
745 HB3 LYS 99 1HB LYS 99 0.044 -3.019 9.488
746 HG2 LYS 99 2HG LYS 99 1.591 -4.723 10.269
747 HG3 LYS 99 1HG LYS 99 2.958 -3.752 9.718
748 HD2 LYS 99 2HD LYS 99 2.318 -1.973 11.285
749 HD3 LYS 99 1HD LYS 99 0.962 -2.955 11.839
750 HE2 LYS 99 2HE LYS 99 2.444 -4.612 12.742
751 HE3 LYS 99 1HE LYS 99 3.846 -3.831 12.008
752 HZ1 LYS 99 3HZ LYS 99 3.511 -1.930 13.442
753 HZ2 LYS 99 1HZ LYS 99 3.659 -3.338 14.368
754 HZ3 LYS 99 2HZ LYS 99 2.138 -2.643 14.127
755 H VAL 100 H VAL 100 -0.541 -4.821 6.102
756 HA VAL 100 HA VAL 100 -1.660 -2.313 5.040
757 HB VAL 100 HB VAL 100 -1.877 -5.098 3.864
758 HG11 VAL 100 1HG1 VAL 100 -2.477 -2.373 2.681
759 HG12 VAL 100 2HG1 VAL 100 -3.669 -3.584 3.159
760 HG13 VAL 100 3HG1 VAL 100 -2.570 -3.912 1.820
761 HG21 VAL 100 3HG2 VAL 100 0.451 -4.407 3.886
762 HG22 VAL 100 1HG2 VAL 100 0.026 -2.860 3.156
763 HG23 VAL 100 2HG2 VAL 100 -0.178 -4.354 2.240
764 H GLY 101 H GLY 101 -3.671 -1.735 5.550
765 HA2 GLY 101 2HA GLY 101 -5.738 -3.773 5.952
766 HA3 GLY 101 1HA GLY 101 -5.445 -2.665 7.285
767 H HIS 102 H HIS 102 -7.924 -2.903 5.888
768 HA HIS 102 HA HIS 102 -8.212 -0.719 4.054
769 HD1 HIS 102 HD1 HIS 102 -12.110 -1.031 6.357
770 HD2 HIS 102 HD2 HIS 102 -9.464 -4.235 6.367
771 HE1 HIS 102 HE1 HIS 102 -12.789 -2.460 8.303
772 HE2 HIS 102 HE2 HIS 102 -11.067 -4.290 8.389
773 HB2 HIS 102 2HB HIS 102 -10.642 -1.070 4.326
774 HB3 HIS 102 1HB HIS 102 -9.792 -2.573 3.994
775 H VAL 103 H VAL 103 -9.382 1.280 4.429
776 HA VAL 103 HA VAL 103 -8.523 2.713 6.673
777 HB VAL 103 HB VAL 103 -10.891 3.380 4.903
778 HG11 VAL 103 1HG1 VAL 103 -10.456 5.707 5.560
779 HG12 VAL 103 2HG1 VAL 103 -9.184 5.162 6.653
780 HG13 VAL 103 3HG1 VAL 103 -10.860 4.705 6.954
781 HG21 VAL 103 3HG2 VAL 103 -8.865 3.005 3.585
782 HG22 VAL 103 1HG2 VAL 103 -7.977 4.136 4.606
783 HG23 VAL 103 2HG2 VAL 103 -9.300 4.716 3.591
784 H THR 104 H THR 104 -9.033 1.851 8.641
785 HA THR 104 HA THR 104 -11.711 0.941 9.273
786 HB THR 104 HB THR 104 -10.782 0.349 11.479
787 HG1 THR 104 HG1 THR 104 -8.945 1.170 12.145
788 HG21 THR 104 3HG2 THR 104 -10.525 -1.241 9.623
789 HG22 THR 104 1HG2 THR 104 -9.166 -1.332 10.742
790 HG23 THR 104 2HG2 THR 104 -8.984 -0.495 9.201
791 H GLU 105 H GLU 105 -12.177 1.528 11.802
792 HA GLU 105 HA GLU 105 -12.667 4.428 11.806
793 HB2 GLU 105 2HB GLU 105 -13.975 2.278 13.488
794 HB3 GLU 105 1HB GLU 105 -14.514 3.942 13.288
795 HG2 GLU 105 2HG GLU 105 -15.211 3.563 11.072
796 HG3 GLU 105 1HG GLU 105 -14.338 2.036 10.967
797 H ARG 106 H ARG 106 -12.754 5.417 14.055
798 HA ARG 106 HA ARG 106 -11.811 6.023 16.021
799 HE ARG 106 HE ARG 106 -12.873 4.500 19.706
800 HB2 ARG 106 2HB ARG 106 -12.534 3.871 16.869
801 HB3 ARG 106 1HB ARG 106 -11.111 3.085 16.202
802 HG2 ARG 106 2HG ARG 106 -10.837 3.361 18.582
803 HG3 ARG 106 1HG ARG 106 -9.690 4.405 17.740
804 HD2 ARG 106 2HD ARG 106 -10.683 5.600 19.603
805 HD3 ARG 106 1HD ARG 106 -11.210 6.319 18.081
806 HH11 ARG 106 1HH1 ARG 106 -12.539 7.253 17.657
807 HH12 ARG 106 2HH1 ARG 106 -14.227 7.609 17.687
808 HH21 ARG 106 1HH2 ARG 106 -15.025 4.984 19.756
809 HH22 ARG 106 2HH2 ARG 106 -15.628 6.328 18.846
810 H THR 107 H THR 107 -10.183 7.422 15.547
811 HA THR 107 HA THR 107 -7.491 6.404 15.016
812 HB THR 107 HB THR 107 -8.455 9.252 15.442
813 HG1 THR 107 HG1 THR 107 -8.869 7.831 13.386
814 HG21 THR 107 3HG2 THR 107 -5.746 8.220 14.574
815 HG22 THR 107 1HG2 THR 107 -6.113 9.022 16.102
816 HG23 THR 107 2HG2 THR 107 -6.239 9.914 14.585
817 H ASP 108 H ASP 108 -6.355 5.630 16.684
818 HA ASP 108 HA ASP 108 -7.206 5.677 19.325
819 HB2 ASP 108 2HB ASP 108 -5.614 4.044 18.217
820 HB3 ASP 108 1HB ASP 108 -4.335 5.228 18.474
Start of MODEL 18
1 HA MET 1 HA MET 1 -4.845 -31.600 -7.610
2 H1 MET 1 1H MET 1 -2.829 -32.809 -6.988
3 H2 MET 1 2H MET 1 -3.952 -33.790 -7.787
4 H3 MET 1 3H MET 1 -3.760 -33.916 -6.110
5 HB2 MET 1 2HB MET 1 -6.140 -33.548 -5.686
6 HB3 MET 1 1HB MET 1 -6.921 -32.102 -6.312
7 HG2 MET 1 2HG MET 1 -7.651 -34.075 -7.517
8 HG3 MET 1 1HG MET 1 -6.764 -32.984 -8.581
9 HE1 MET 1 3HE MET 1 -7.413 -36.054 -9.292
10 HE2 MET 1 1HE MET 1 -5.872 -36.524 -10.009
11 HE3 MET 1 2HE MET 1 -6.561 -34.940 -10.362
12 H GLY 2 H GLY 2 -4.187 -32.899 -4.336
13 HA2 GLY 2 2HA GLY 2 -3.447 -31.801 -2.440
14 HA3 GLY 2 1HA GLY 2 -3.285 -30.335 -3.393
15 H HIS 3 H HIS 3 -5.517 -29.388 -4.070
16 HA HIS 3 HA HIS 3 -7.242 -29.388 -1.679
17 HD1 HIS 3 HD1 HIS 3 -4.669 -26.871 -4.060
18 HD2 HIS 3 HD2 HIS 3 -8.670 -26.706 -5.168
19 HE1 HIS 3 HE1 HIS 3 -4.685 -25.901 -6.368
20 HE2 HIS 3 HE2 HIS 3 -7.095 -25.950 -7.077
21 HB2 HIS 3 2HB HIS 3 -8.028 -27.154 -2.459
22 HB3 HIS 3 1HB HIS 3 -6.309 -27.205 -2.097
23 H HIS 4 H HIS 4 -9.001 -30.587 -1.873
24 HA HIS 4 HA HIS 4 -10.219 -30.981 -4.522
25 HD1 HIS 4 HD1 HIS 4 -12.546 -34.311 -2.349
26 HD2 HIS 4 HD2 HIS 4 -11.041 -32.789 -5.910
27 HE1 HIS 4 HE1 HIS 4 -13.848 -35.443 -4.167
28 HE2 HIS 4 HE2 HIS 4 -13.021 -34.405 -6.295
29 HB2 HIS 4 2HB HIS 4 -9.560 -32.943 -3.032
30 HB3 HIS 4 1HB HIS 4 -10.884 -32.472 -1.974
31 H HIS 5 H HIS 5 -10.671 -29.232 -1.653
32 HA HIS 5 HA HIS 5 -13.344 -28.366 -2.528
33 HD1 HIS 5 HD1 HIS 5 -15.728 -29.900 -1.599
34 HD2 HIS 5 HD2 HIS 5 -12.491 -31.754 0.227
35 HE1 HIS 5 HE1 HIS 5 -16.263 -32.345 -1.611
36 HE2 HIS 5 HE2 HIS 5 -14.407 -33.409 -0.300
37 HB2 HIS 5 2HB HIS 5 -12.620 -29.003 0.349
38 HB3 HIS 5 1HB HIS 5 -14.137 -28.297 -0.196
39 H HIS 6 H HIS 6 -13.887 -26.173 -1.799
40 HA HIS 6 HA HIS 6 -11.950 -24.592 -0.404
41 HD1 HIS 6 HD1 HIS 6 -8.996 -23.843 -1.525
42 HD2 HIS 6 HD2 HIS 6 -11.995 -21.139 -2.522
43 HE1 HIS 6 HE1 HIS 6 -8.016 -21.569 -1.120
44 HE2 HIS 6 HE2 HIS 6 -9.794 -19.953 -1.844
45 HB2 HIS 6 2HB HIS 6 -10.958 -24.917 -2.749
46 HB3 HIS 6 1HB HIS 6 -12.247 -23.867 -3.321
47 H HIS 7 H HIS 7 -14.888 -24.706 -2.360
48 HA HIS 7 HA HIS 7 -15.613 -21.984 -1.995
49 HD1 HIS 7 HD1 HIS 7 -16.919 -25.936 -3.928
50 HD2 HIS 7 HD2 HIS 7 -19.303 -24.115 -1.060
51 HE1 HIS 7 HE1 HIS 7 -18.525 -27.707 -3.167
52 HE2 HIS 7 HE2 HIS 7 -20.055 -26.538 -1.549
53 HB2 HIS 7 2HB HIS 7 -17.740 -22.525 -2.947
54 HB3 HIS 7 1HB HIS 7 -16.525 -23.466 -3.799
55 H HIS 8 H HIS 8 -15.838 -24.669 0.135
56 HA HIS 8 HA HIS 8 -16.637 -24.946 2.239
57 HD1 HIS 8 HD1 HIS 8 -15.107 -20.600 2.186
58 HD2 HIS 8 HD2 HIS 8 -14.389 -24.448 3.587
59 HE1 HIS 8 HE1 HIS 8 -12.642 -20.705 2.628
60 HE2 HIS 8 HE2 HIS 8 -12.263 -22.976 3.632
61 HB2 HIS 8 2HB HIS 8 -17.159 -21.962 2.187
62 HB3 HIS 8 1HB HIS 8 -17.167 -22.985 3.623
63 H SER 9 H SER 9 -18.829 -22.377 1.074
64 HA SER 9 HA SER 9 -21.075 -24.283 1.161
65 HG SER 9 HG SER 9 -21.090 -24.190 3.466
66 HB2 SER 9 2HB SER 9 -21.062 -21.543 2.469
67 HB3 SER 9 1HB SER 9 -22.484 -22.569 2.290
68 H HIS 10 H HIS 10 -23.162 -22.793 0.421
69 HA HIS 10 HA HIS 10 -22.682 -22.109 -2.293
70 HD1 HIS 10 HD1 HIS 10 -24.953 -19.399 -2.717
71 HD2 HIS 10 HD2 HIS 10 -26.036 -23.284 -3.699
72 HE1 HIS 10 HE1 HIS 10 -26.067 -19.236 -4.958
73 HE2 HIS 10 HE2 HIS 10 -26.863 -21.571 -5.449
74 HB2 HIS 10 2HB HIS 10 -24.873 -22.932 -1.287
75 HB3 HIS 10 1HB HIS 10 -25.104 -21.302 -0.665
76 H MET 11 H MET 11 -22.715 -20.243 0.672
77 HA MET 11 HA MET 11 -22.652 -17.667 -0.544
78 HB2 MET 11 2HB MET 11 -23.181 -18.159 1.882
79 HB3 MET 11 1HB MET 11 -21.466 -18.442 2.132
80 HG2 MET 11 2HG MET 11 -22.582 -15.849 1.086
81 HG3 MET 11 1HG MET 11 -22.323 -16.172 2.796
82 HE1 MET 11 3HE MET 11 -19.964 -16.509 3.911
83 HE2 MET 11 1HE MET 11 -18.444 -16.538 3.018
84 HE3 MET 11 2HE MET 11 -19.615 -17.839 2.806
85 H ALA 12 H ALA 12 -21.211 -17.784 -2.231
86 HA ALA 12 HA ALA 12 -18.522 -17.108 -1.833
87 HB1 ALA 12 3HB ALA 12 -17.377 -19.127 -2.659
88 HB2 ALA 12 1HB ALA 12 -18.915 -19.993 -2.670
89 HB3 ALA 12 2HB ALA 12 -18.222 -19.445 -1.144
90 H ALA 13 H ALA 13 -20.724 -18.859 -3.977
91 HA ALA 13 HA ALA 13 -19.959 -17.053 -6.191
92 HB1 ALA 13 3HB ALA 13 -21.175 -19.819 -6.375
93 HB2 ALA 13 1HB ALA 13 -19.481 -19.419 -6.673
94 HB3 ALA 13 2HB ALA 13 -20.737 -18.783 -7.734
95 H ALA 14 H ALA 14 -21.608 -15.976 -7.290
96 HA ALA 14 HA ALA 14 -23.622 -14.989 -7.662
97 HB1 ALA 14 3HB ALA 14 -24.851 -17.255 -6.088
98 HB2 ALA 14 1HB ALA 14 -24.541 -17.270 -7.824
99 HB3 ALA 14 2HB ALA 14 -25.700 -16.128 -7.147
100 H MET 15 H MET 15 -23.624 -16.249 -4.300
101 HA MET 15 HA MET 15 -24.848 -13.838 -3.283
102 HB2 MET 15 2HB MET 15 -23.619 -16.183 -1.813
103 HB3 MET 15 1HB MET 15 -24.558 -14.896 -1.069
104 HG2 MET 15 2HG MET 15 -25.549 -16.897 -3.088
105 HG3 MET 15 1HG MET 15 -25.921 -16.862 -1.364
106 HE1 MET 15 3HE MET 15 -29.336 -15.894 -3.031
107 HE2 MET 15 1HE MET 15 -28.536 -16.971 -1.889
108 HE3 MET 15 2HE MET 15 -28.142 -17.061 -3.605
109 H ALA 16 H ALA 16 -23.677 -12.004 -3.144
110 HA ALA 16 HA ALA 16 -21.210 -11.967 -1.635
111 HB1 ALA 16 3HB ALA 16 -19.833 -10.949 -3.373
112 HB2 ALA 16 1HB ALA 16 -21.157 -11.103 -4.527
113 HB3 ALA 16 2HB ALA 16 -20.388 -12.548 -3.872
114 H ASN 17 H ASN 17 -20.335 -9.708 -1.431
115 HA ASN 17 HA ASN 17 -22.546 -7.830 -1.080
116 HB2 ASN 17 2HB ASN 17 -20.835 -6.498 0.202
117 HB3 ASN 17 1HB ASN 17 -21.153 -8.102 0.851
118 HD21 ASN 17 1HD2 ASN 17 -18.798 -6.290 1.043
119 HD22 ASN 17 2HD2 ASN 17 -17.459 -7.258 0.543
120 H ASN 18 H ASN 18 -23.004 -6.792 -2.989
121 HA ASN 18 HA ASN 18 -20.780 -5.320 -4.261
122 HB2 ASN 18 2HB ASN 18 -23.035 -6.768 -5.666
123 HB3 ASN 18 1HB ASN 18 -21.928 -5.658 -6.466
124 HD21 ASN 18 1HD2 ASN 18 -19.625 -6.536 -4.872
125 HD22 ASN 18 2HD2 ASN 18 -19.194 -8.089 -5.485
126 H LEU 19 H LEU 19 -24.371 -5.432 -4.218
127 HA LEU 19 HA LEU 19 -24.403 -2.528 -4.578
128 HG LEU 19 HG LEU 19 -27.466 -2.188 -4.040
129 HB2 LEU 19 2HB LEU 19 -25.899 -3.932 -5.960
130 HB3 LEU 19 1HB LEU 19 -26.704 -4.485 -4.502
131 HD11 LEU 19 1HD1 LEU 19 -25.656 -0.942 -5.086
132 HD12 LEU 19 2HD1 LEU 19 -27.217 -0.435 -5.730
133 HD13 LEU 19 3HD1 LEU 19 -26.172 -1.493 -6.680
134 HD21 LEU 19 3HD2 LEU 19 -28.154 -3.165 -6.810
135 HD22 LEU 19 1HD2 LEU 19 -29.091 -2.015 -5.855
136 HD23 LEU 19 2HD2 LEU 19 -28.911 -3.677 -5.302
137 H GLN 20 H GLN 20 -23.825 -1.671 -2.648
138 HA GLN 20 HA GLN 20 -25.198 -2.524 -0.202
139 HB2 GLN 20 2HB GLN 20 -22.766 -2.366 -0.098
140 HB3 GLN 20 1HB GLN 20 -22.825 -0.685 -0.612
141 HG2 GLN 20 2HG GLN 20 -24.034 -0.114 1.455
142 HG3 GLN 20 1HG GLN 20 -23.924 -1.796 1.970
143 HE21 GLN 20 1HE2 GLN 20 -21.920 -2.613 2.616
144 HE22 GLN 20 2HE2 GLN 20 -20.600 -1.577 3.021
145 H LYS 21 H LYS 21 -24.282 0.607 -1.676
146 HA LYS 21 HA LYS 21 -26.891 1.714 -0.944
147 HB2 LYS 21 2HB LYS 21 -25.026 2.082 0.874
148 HB3 LYS 21 1HB LYS 21 -24.418 3.288 -0.244
149 HG2 LYS 21 2HG LYS 21 -27.153 3.262 1.037
150 HG3 LYS 21 1HG LYS 21 -25.799 4.302 1.478
151 HD2 LYS 21 2HD LYS 21 -25.877 5.257 -0.833
152 HD3 LYS 21 1HD LYS 21 -27.340 4.314 -1.124
153 HE2 LYS 21 2HE LYS 21 -28.014 6.521 -0.526
154 HE3 LYS 21 1HE LYS 21 -28.371 5.474 0.846
155 HZ1 LYS 21 3HZ LYS 21 -27.357 7.572 1.519
156 HZ2 LYS 21 1HZ LYS 21 -25.981 7.216 0.605
157 HZ3 LYS 21 2HZ LYS 21 -26.382 6.260 1.944
158 H GLY 22 H GLY 22 -27.396 1.920 -3.128
159 HA2 GLY 22 2HA GLY 22 -27.567 3.038 -5.124
160 HA3 GLY 22 1HA GLY 22 -26.571 4.300 -4.424
161 H SER 23 H SER 23 -24.247 4.103 -4.598
162 HA SER 23 HA SER 23 -23.206 2.115 -6.472
163 HG SER 23 HG SER 23 -24.644 3.059 -7.967
164 HB2 SER 23 2HB SER 23 -23.080 5.094 -7.035
165 HB3 SER 23 1HB SER 23 -22.142 3.877 -7.900
166 H ALA 24 H ALA 24 -20.884 2.030 -6.558
167 HA ALA 24 HA ALA 24 -19.407 3.574 -4.536
168 HB1 ALA 24 3HB ALA 24 -18.340 1.570 -3.642
169 HB2 ALA 24 1HB ALA 24 -19.306 0.557 -4.717
170 HB3 ALA 24 2HB ALA 24 -20.090 1.482 -3.436
171 H GLY 25 H GLY 25 -16.979 3.260 -4.807
172 HA2 GLY 25 2HA GLY 25 -16.126 2.273 -7.411
173 HA3 GLY 25 1HA GLY 25 -16.038 4.013 -7.213
174 HA PRO 26 HA PRO 26 -11.787 3.239 -6.263
175 HB2 PRO 26 2HB PRO 26 -11.964 5.856 -4.846
176 HB3 PRO 26 1HB PRO 26 -10.840 5.327 -6.101
177 HG2 PRO 26 2HG PRO 26 -12.830 7.007 -6.674
178 HG3 PRO 26 1HG PRO 26 -12.357 5.733 -7.813
179 HD2 PRO 26 2HD PRO 26 -14.713 5.853 -5.971
180 HD3 PRO 26 1HD PRO 26 -14.599 5.199 -7.619
181 H MET 27 H MET 27 -11.109 1.889 -4.742
182 HA MET 27 HA MET 27 -11.932 2.227 -1.938
183 HB2 MET 27 2HB MET 27 -12.302 0.019 -2.986
184 HB3 MET 27 1HB MET 27 -10.582 -0.107 -3.324
185 HG2 MET 27 2HG MET 27 -10.095 -0.152 -0.944
186 HG3 MET 27 1HG MET 27 -11.807 0.049 -0.574
187 HE1 MET 27 3HE MET 27 -11.660 -2.105 1.017
188 HE2 MET 27 1HE MET 27 -9.954 -2.303 0.605
189 HE3 MET 27 2HE MET 27 -11.060 -3.670 0.475
190 H ARG 28 H ARG 28 -10.455 2.709 -0.341
191 HA ARG 28 HA ARG 28 -7.719 3.318 -1.276
192 HE ARG 28 HE ARG 28 -9.359 7.246 -0.358
193 HB2 ARG 28 2HB ARG 28 -9.180 5.250 -0.635
194 HB3 ARG 28 1HB ARG 28 -9.215 4.620 1.007
195 HG2 ARG 28 2HG ARG 28 -6.846 4.963 1.250
196 HG3 ARG 28 1HG ARG 28 -6.697 5.415 -0.451
197 HD2 ARG 28 2HD ARG 28 -8.154 6.927 1.721
198 HD3 ARG 28 1HD ARG 28 -6.686 7.423 0.879
199 HH11 ARG 28 1HH1 ARG 28 -6.205 8.638 -0.216
200 HH12 ARG 28 2HH1 ARG 28 -6.520 9.737 -1.507
201 HH21 ARG 28 1HH2 ARG 28 -9.745 8.654 -1.998
202 HH22 ARG 28 2HH2 ARG 28 -8.502 9.746 -2.512
203 H LEU 29 H LEU 29 -6.029 2.360 -0.318
204 HA LEU 29 HA LEU 29 -6.513 0.698 2.059
205 HG LEU 29 HG LEU 29 -6.342 -0.433 -0.882
206 HB2 LEU 29 2HB LEU 29 -4.303 0.570 -0.000
207 HB3 LEU 29 1HB LEU 29 -4.387 -0.449 1.425
208 HD11 LEU 29 1HD1 LEU 29 -4.193 -1.497 -1.384
209 HD12 LEU 29 2HD1 LEU 29 -5.507 -2.671 -1.327
210 HD13 LEU 29 3HD1 LEU 29 -4.380 -2.543 0.025
211 HD21 LEU 29 3HD2 LEU 29 -7.512 -0.859 1.223
212 HD22 LEU 29 1HD2 LEU 29 -6.354 -2.132 1.621
213 HD23 LEU 29 2HD2 LEU 29 -7.432 -2.317 0.236
214 H TYR 30 H TYR 30 -5.329 0.859 3.856
215 HA TYR 30 HA TYR 30 -3.508 3.134 4.192
216 HD1 TYR 30 HD1 TYR 30 -3.168 4.543 6.655
217 HD2 TYR 30 HD2 TYR 30 -3.967 0.532 7.832
218 HE1 TYR 30 HE1 TYR 30 -1.751 4.848 8.643
219 HE2 TYR 30 HE2 TYR 30 -2.551 0.821 9.819
220 HH TYR 30 HH TYR 30 -1.512 3.862 10.899
221 HB2 TYR 30 2HB TYR 30 -5.208 3.178 5.825
222 HB3 TYR 30 1HB TYR 30 -5.156 1.439 6.057
223 H VAL 31 H VAL 31 -1.387 2.698 3.956
224 HA VAL 31 HA VAL 31 -0.406 -0.022 4.602
225 HB VAL 31 HB VAL 31 0.670 1.881 2.506
226 HG11 VAL 31 1HG1 VAL 31 1.476 -0.955 3.166
227 HG12 VAL 31 2HG1 VAL 31 2.439 0.498 3.444
228 HG13 VAL 31 3HG1 VAL 31 2.068 -0.014 1.796
229 HG21 VAL 31 3HG2 VAL 31 -1.490 0.966 1.849
230 HG22 VAL 31 1HG2 VAL 31 -0.918 -0.670 2.190
231 HG23 VAL 31 2HG2 VAL 31 -0.200 0.261 0.876
232 H GLY 32 H GLY 32 0.825 -0.047 6.374
233 HA2 GLY 32 2HA GLY 32 2.518 2.301 6.991
234 HA3 GLY 32 1HA GLY 32 1.815 1.248 8.203
235 H SER 33 H SER 33 4.492 1.832 6.176
236 HA SER 33 HA SER 33 6.202 0.138 7.664
237 HG SER 33 HG SER 33 7.655 -1.541 5.217
238 HB2 SER 33 2HB SER 33 5.092 -1.630 6.286
239 HB3 SER 33 1HB SER 33 5.686 -0.827 4.833
240 H LEU 34 H LEU 34 5.920 2.865 6.410
241 HA LEU 34 HA LEU 34 8.124 2.946 4.482
242 HG LEU 34 HG LEU 34 4.863 3.526 4.521
243 HB2 LEU 34 2HB LEU 34 6.399 5.253 5.374
244 HB3 LEU 34 1HB LEU 34 7.358 5.124 3.909
245 HD11 LEU 34 1HD1 LEU 34 3.848 4.840 2.719
246 HD12 LEU 34 2HD1 LEU 34 5.322 5.802 2.598
247 HD13 LEU 34 3HD1 LEU 34 4.352 5.855 4.071
248 HD21 LEU 34 3HD2 LEU 34 6.427 2.255 3.157
249 HD22 LEU 34 1HD2 LEU 34 6.575 3.610 2.037
250 HD23 LEU 34 2HD2 LEU 34 5.036 2.762 2.198
251 H HIS 35 H HIS 35 9.976 2.724 5.751
252 HA HIS 35 HA HIS 35 10.236 4.221 8.214
253 HD1 HIS 35 HD1 HIS 35 14.398 3.264 7.003
254 HD2 HIS 35 HD2 HIS 35 11.411 0.864 5.405
255 HE1 HIS 35 HE1 HIS 35 15.450 2.101 5.055
256 HE2 HIS 35 HE2 HIS 35 13.704 0.494 4.251
257 HB2 HIS 35 2HB HIS 35 12.387 3.104 8.495
258 HB3 HIS 35 1HB HIS 35 11.138 1.945 8.070
259 H PHE 36 H PHE 36 9.893 6.253 6.781
260 HA PHE 36 HA PHE 36 10.668 8.205 5.872
261 HD1 PHE 36 HD2 PHE 36 10.523 10.264 7.517
262 HD2 PHE 36 HD1 PHE 36 14.624 9.373 6.766
263 HE1 PHE 36 HE2 PHE 36 10.987 12.660 7.243
264 HE2 PHE 36 HE1 PHE 36 15.091 11.776 6.491
265 HZ PHE 36 HZ PHE 36 13.272 13.418 6.731
266 HB2 PHE 36 2HB PHE 36 11.672 8.065 8.240
267 HB3 PHE 36 1HB PHE 36 13.190 7.660 7.450
268 H ASN 37 H ASN 37 11.000 6.155 4.104
269 HA ASN 37 HA ASN 37 13.454 6.759 2.652
270 HB2 ASN 37 2HB ASN 37 14.340 5.023 3.970
271 HB3 ASN 37 1HB ASN 37 12.844 4.104 3.936
272 HD21 ASN 37 1HD2 ASN 37 14.493 5.484 1.128
273 HD22 ASN 37 2HD2 ASN 37 14.860 3.961 0.405
274 H ILE 38 H ILE 38 10.610 4.657 2.782
275 HA ILE 38 HA ILE 38 10.676 4.092 -0.036
276 HB ILE 38 HB ILE 38 8.585 3.418 2.046
277 HG12 ILE 38 2HG1 ILE 38 10.913 1.781 1.001
278 HG13 ILE 38 1HG1 ILE 38 10.851 2.564 2.575
279 HG21 ILE 38 1HG2 ILE 38 9.065 2.233 -0.693
280 HG22 ILE 38 2HG2 ILE 38 7.700 3.241 -0.220
281 HG23 ILE 38 3HG2 ILE 38 7.902 1.644 0.497
282 HD11 ILE 38 3HD1 ILE 38 8.965 1.156 3.196
283 HD12 ILE 38 1HD1 ILE 38 10.385 0.210 2.756
284 HD13 ILE 38 2HD1 ILE 38 9.045 0.364 1.622
285 H THR 39 H THR 39 9.473 4.972 -1.646
286 HA THR 39 HA THR 39 7.633 7.179 -0.948
287 HB THR 39 HB THR 39 8.196 8.266 -3.043
288 HG1 THR 39 HG1 THR 39 9.272 7.287 -4.608
289 HG21 THR 39 3HG2 THR 39 10.565 8.798 -2.650
290 HG22 THR 39 1HG2 THR 39 10.700 7.405 -1.576
291 HG23 THR 39 2HG2 THR 39 9.655 8.759 -1.140
292 H GLU 40 H GLU 40 6.215 7.719 -2.985
293 HA GLU 40 HA GLU 40 4.209 5.860 -3.248
294 HB2 GLU 40 2HB GLU 40 4.938 7.870 -5.395
295 HB3 GLU 40 1HB GLU 40 3.359 7.155 -5.115
296 HG2 GLU 40 2HG GLU 40 3.112 9.259 -4.222
297 HG3 GLU 40 1HG GLU 40 3.512 8.303 -2.797
298 H ASP 41 H ASP 41 6.944 6.376 -5.421
299 HA ASP 41 HA ASP 41 6.164 4.804 -7.570
300 HB2 ASP 41 2HB ASP 41 8.987 5.263 -6.577
301 HB3 ASP 41 1HB ASP 41 8.509 4.836 -8.221
302 H MET 42 H MET 42 8.003 3.829 -4.675
303 HA MET 42 HA MET 42 8.579 1.198 -5.594
304 HB2 MET 42 2HB MET 42 9.727 2.491 -3.694
305 HB3 MET 42 1HB MET 42 8.367 2.007 -2.690
306 HG2 MET 42 2HG MET 42 10.192 0.498 -2.329
307 HG3 MET 42 1HG MET 42 8.901 -0.357 -3.174
308 HE1 MET 42 3HE MET 42 11.807 -1.561 -3.014
309 HE2 MET 42 1HE MET 42 12.077 -2.063 -4.683
310 HE3 MET 42 2HE MET 42 10.504 -2.323 -3.927
311 H LEU 43 H LEU 43 6.144 2.457 -3.325
312 HA LEU 43 HA LEU 43 4.739 0.123 -2.771
313 HG LEU 43 HG LEU 43 5.468 2.715 -1.358
314 HB2 LEU 43 2HB LEU 43 3.665 2.933 -3.098
315 HB3 LEU 43 1HB LEU 43 2.814 1.619 -2.305
316 HD11 LEU 43 1HD1 LEU 43 4.202 3.848 0.402
317 HD12 LEU 43 2HD1 LEU 43 2.691 3.341 -0.356
318 HD13 LEU 43 3HD1 LEU 43 3.777 4.448 -1.200
319 HD21 LEU 43 3HD2 LEU 43 4.950 1.494 0.702
320 HD22 LEU 43 1HD2 LEU 43 5.033 0.406 -0.681
321 HD23 LEU 43 2HD2 LEU 43 3.464 0.881 -0.026
322 H ARG 44 H ARG 44 4.003 2.518 -5.304
323 HA ARG 44 HA ARG 44 1.945 1.243 -6.621
324 HE ARG 44 HE ARG 44 0.780 4.255 -10.069
325 HB2 ARG 44 2HB ARG 44 2.481 3.448 -7.256
326 HB3 ARG 44 1HB ARG 44 4.156 3.040 -7.590
327 HG2 ARG 44 2HG ARG 44 3.516 1.846 -9.586
328 HG3 ARG 44 1HG ARG 44 1.805 2.091 -9.222
329 HD2 ARG 44 2HD ARG 44 3.674 4.421 -9.533
330 HD3 ARG 44 1HD ARG 44 2.953 3.644 -10.939
331 HH11 ARG 44 1HH1 ARG 44 3.468 5.886 -8.630
332 HH12 ARG 44 2HH1 ARG 44 2.504 7.234 -8.137
333 HH21 ARG 44 1HH2 ARG 44 -0.408 5.992 -9.459
334 HH22 ARG 44 2HH2 ARG 44 0.336 7.293 -8.590
335 H GLY 45 H GLY 45 5.442 0.748 -7.080
336 HA2 GLY 45 2HA GLY 45 5.272 -1.091 -9.215
337 HA3 GLY 45 1HA GLY 45 6.620 -0.947 -8.097
338 H ILE 46 H ILE 46 4.874 -1.553 -5.757
339 HA ILE 46 HA ILE 46 4.987 -4.453 -5.933
340 HB ILE 46 HB ILE 46 4.107 -2.738 -3.596
341 HG12 ILE 46 2HG1 ILE 46 6.403 -2.177 -4.230
342 HG13 ILE 46 1HG1 ILE 46 6.395 -3.073 -2.718
343 HG21 ILE 46 1HG2 ILE 46 4.641 -4.732 -2.243
344 HG22 ILE 46 2HG2 ILE 46 4.967 -5.634 -3.725
345 HG23 ILE 46 3HG2 ILE 46 3.341 -5.032 -3.397
346 HD11 ILE 46 3HD1 ILE 46 7.052 -5.102 -3.926
347 HD12 ILE 46 1HD1 ILE 46 8.212 -3.790 -4.137
348 HD13 ILE 46 2HD1 ILE 46 7.083 -4.181 -5.431
349 H PHE 47 H PHE 47 2.491 -1.961 -5.715
350 HA PHE 47 HA PHE 47 0.390 -3.907 -5.238
351 HD1 PHE 47 HD2 PHE 47 2.120 -1.276 -3.497
352 HD2 PHE 47 HD1 PHE 47 -1.952 -2.510 -3.262
353 HE1 PHE 47 HE2 PHE 47 2.294 -1.371 -1.048
354 HE2 PHE 47 HE1 PHE 47 -1.778 -2.608 -0.812
355 HZ PHE 47 HZ PHE 47 0.344 -2.038 0.301
356 HB2 PHE 47 2HB PHE 47 0.425 -0.902 -5.391
357 HB3 PHE 47 1HB PHE 47 -1.086 -1.802 -5.322
358 H GLU 48 H GLU 48 1.566 -2.083 -8.052
359 HA GLU 48 HA GLU 48 -0.719 -2.296 -9.654
360 HB2 GLU 48 2HB GLU 48 2.189 -2.130 -10.388
361 HB3 GLU 48 1HB GLU 48 0.955 -2.322 -11.628
362 HG2 GLU 48 2HG GLU 48 -0.169 -0.273 -10.602
363 HG3 GLU 48 1HG GLU 48 1.332 -0.034 -9.712
364 HA PRO 49 HA PRO 49 1.004 -6.843 -10.955
365 HB2 PRO 49 2HB PRO 49 1.514 -7.386 -8.042
366 HB3 PRO 49 1HB PRO 49 2.224 -8.158 -9.468
367 HG2 PRO 49 2HG PRO 49 3.600 -6.326 -8.136
368 HG3 PRO 49 1HG PRO 49 3.627 -6.343 -9.910
369 HD2 PRO 49 2HD PRO 49 2.204 -4.490 -8.051
370 HD3 PRO 49 1HD PRO 49 2.911 -4.166 -9.647
371 H PHE 50 H PHE 50 -0.840 -5.525 -8.279
372 HA PHE 50 HA PHE 50 -2.793 -7.708 -8.383
373 HD1 PHE 50 HD2 PHE 50 -0.345 -5.824 -5.858
374 HD2 PHE 50 HD1 PHE 50 -3.520 -8.653 -5.612
375 HE1 PHE 50 HE2 PHE 50 1.006 -7.204 -4.338
376 HE2 PHE 50 HE1 PHE 50 -2.172 -10.036 -4.093
377 HZ PHE 50 HZ PHE 50 0.089 -9.315 -3.449
378 HB2 PHE 50 2HB PHE 50 -2.592 -5.262 -6.605
379 HB3 PHE 50 1HB PHE 50 -3.897 -6.442 -6.513
380 H GLY 51 H GLY 51 -2.679 -4.179 -8.903
381 HA2 GLY 51 2HA GLY 51 -4.648 -4.388 -11.012
382 HA3 GLY 51 1HA GLY 51 -5.249 -3.576 -9.573
383 H ARG 52 H ARG 52 -5.375 -1.456 -10.181
384 HA ARG 52 HA ARG 52 -2.825 -0.211 -10.983
385 HE ARG 52 HE ARG 52 -5.708 3.149 -12.492
386 HB2 ARG 52 2HB ARG 52 -4.521 -0.345 -12.883
387 HB3 ARG 52 1HB ARG 52 -5.498 0.796 -11.964
388 HG2 ARG 52 2HG ARG 52 -3.519 2.347 -11.958
389 HG3 ARG 52 1HG ARG 52 -2.732 1.234 -13.078
390 HD2 ARG 52 2HD ARG 52 -3.682 2.896 -14.435
391 HD3 ARG 52 1HD ARG 52 -4.788 1.528 -14.556
392 HH11 ARG 52 1HH1 ARG 52 -5.226 3.375 -15.898
393 HH12 ARG 52 2HH1 ARG 52 -6.493 4.532 -16.106
394 HH21 ARG 52 1HH2 ARG 52 -7.300 4.646 -12.761
395 HH22 ARG 52 2HH2 ARG 52 -7.661 5.246 -14.347
396 H ILE 53 H ILE 53 -2.331 1.740 -10.087
397 HA ILE 53 HA ILE 53 -3.902 2.536 -7.748
398 HB ILE 53 HB ILE 53 -1.102 3.254 -8.649
399 HG12 ILE 53 2HG1 ILE 53 -0.508 2.185 -6.424
400 HG13 ILE 53 1HG1 ILE 53 -2.179 1.645 -6.314
401 HG21 ILE 53 1HG2 ILE 53 -2.101 5.222 -7.645
402 HG22 ILE 53 2HG2 ILE 53 -0.884 4.532 -6.575
403 HG23 ILE 53 3HG2 ILE 53 -2.595 4.276 -6.239
404 HD11 ILE 53 3HD1 ILE 53 -0.228 0.892 -8.481
405 HD12 ILE 53 1HD1 ILE 53 -1.892 0.323 -8.335
406 HD13 ILE 53 2HD1 ILE 53 -0.701 -0.112 -7.110
407 H GLU 54 H GLU 54 -4.935 4.475 -7.581
408 HA GLU 54 HA GLU 54 -4.936 6.260 -9.897
409 HB2 GLU 54 2HB GLU 54 -6.667 6.346 -7.413
410 HB3 GLU 54 1HB GLU 54 -6.891 7.303 -8.870
411 HG2 GLU 54 2HG GLU 54 -7.204 4.316 -8.586
412 HG3 GLU 54 1HG GLU 54 -8.474 5.504 -8.862
413 H SER 55 H SER 55 -4.366 6.404 -6.378
414 HA SER 55 HA SER 55 -2.424 8.533 -6.776
415 HG SER 55 HG SER 55 -2.724 10.765 -5.487
416 HB2 SER 55 2HB SER 55 -4.482 9.823 -6.499
417 HB3 SER 55 1HB SER 55 -4.858 8.953 -5.015
418 H ILE 56 H ILE 56 -0.876 8.670 -5.119
419 HA ILE 56 HA ILE 56 -1.247 6.913 -2.770
420 HB ILE 56 HB ILE 56 1.363 7.253 -4.275
421 HG12 ILE 56 2HG1 ILE 56 -0.480 4.854 -4.091
422 HG13 ILE 56 1HG1 ILE 56 -0.210 5.838 -5.523
423 HG21 ILE 56 1HG2 ILE 56 2.199 5.508 -2.742
424 HG22 ILE 56 2HG2 ILE 56 0.661 5.550 -1.878
425 HG23 ILE 56 3HG2 ILE 56 1.706 6.970 -1.890
426 HD11 ILE 56 3HD1 ILE 56 2.115 5.119 -5.589
427 HD12 ILE 56 1HD1 ILE 56 1.013 3.744 -5.629
428 HD13 ILE 56 2HD1 ILE 56 1.861 4.148 -4.138
429 H GLN 57 H GLN 57 -1.472 8.338 -1.125
430 HA GLN 57 HA GLN 57 0.369 10.652 -1.008
431 HB2 GLN 57 2HB GLN 57 -2.285 10.255 0.398
432 HB3 GLN 57 1HB GLN 57 -1.270 11.688 0.511
433 HG2 GLN 57 2HG GLN 57 -2.656 10.662 -1.963
434 HG3 GLN 57 1HG GLN 57 -3.116 12.069 -1.009
435 HE21 GLN 57 1HE2 GLN 57 -1.818 13.941 -1.125
436 HE22 GLN 57 2HE2 GLN 57 -0.713 14.190 -2.428
437 H LEU 58 H LEU 58 1.991 10.529 0.419
438 HA LEU 58 HA LEU 58 1.862 8.520 2.555
439 HG LEU 58 HG LEU 58 3.604 7.053 1.478
440 HB2 LEU 58 2HB LEU 58 4.169 10.024 1.322
441 HB3 LEU 58 1HB LEU 58 4.343 9.052 2.772
442 HD11 LEU 58 1HD1 LEU 58 3.765 8.919 -0.884
443 HD12 LEU 58 2HD1 LEU 58 2.306 8.153 -0.252
444 HD13 LEU 58 3HD1 LEU 58 3.582 7.165 -0.964
445 HD21 LEU 58 3HD2 LEU 58 5.991 8.515 0.351
446 HD22 LEU 58 1HD2 LEU 58 5.685 6.782 0.232
447 HD23 LEU 58 2HD2 LEU 58 5.970 7.519 1.808
448 H MET 59 H MET 59 2.125 8.986 4.701
449 HA MET 59 HA MET 59 1.842 11.815 5.431
450 HB2 MET 59 2HB MET 59 1.267 9.348 7.085
451 HB3 MET 59 1HB MET 59 0.971 11.009 7.578
452 HG2 MET 59 2HG MET 59 -0.552 11.180 5.546
453 HG3 MET 59 1HG MET 59 -0.422 9.424 5.447
454 HE1 MET 59 3HE MET 59 -0.535 11.732 8.648
455 HE2 MET 59 1HE MET 59 -2.257 11.697 9.023
456 HE3 MET 59 2HE MET 59 -1.693 12.481 7.548
457 H MET 60 H MET 60 3.912 12.580 5.549
458 HA MET 60 HA MET 60 5.438 11.548 7.849
459 HB2 MET 60 2HB MET 60 7.429 12.757 6.797
460 HB3 MET 60 1HB MET 60 6.899 11.267 6.030
461 HG2 MET 60 2HG MET 60 5.651 12.649 4.373
462 HG3 MET 60 1HG MET 60 6.403 14.079 5.087
463 HE1 MET 60 3HE MET 60 8.306 13.604 1.665
464 HE2 MET 60 1HE MET 60 7.336 14.707 2.641
465 HE3 MET 60 2HE MET 60 6.608 13.242 1.979
466 H ASP 61 H ASP 61 5.343 12.799 9.552
467 HA ASP 61 HA ASP 61 4.070 14.194 10.810
468 HB2 ASP 61 2HB ASP 61 5.285 16.206 11.262
469 HB3 ASP 61 1HB ASP 61 6.397 14.881 10.973
470 H SER 62 H SER 62 4.716 16.408 8.039
471 HA SER 62 HA SER 62 3.536 18.262 7.436
472 HG SER 62 HG SER 62 1.478 18.846 6.577
473 HB2 SER 62 2HB SER 62 2.448 16.450 6.110
474 HB3 SER 62 1HB SER 62 1.257 16.253 7.395
475 H GLU 63 H GLU 63 3.890 18.185 10.137
476 HA GLU 63 HA GLU 63 1.617 19.516 11.289
477 HB2 GLU 63 2HB GLU 63 1.065 17.004 11.337
478 HB3 GLU 63 1HB GLU 63 2.371 16.845 12.499
479 HG2 GLU 63 2HG GLU 63 0.640 17.054 13.947
480 HG3 GLU 63 1HG GLU 63 1.013 18.765 13.734
481 H THR 64 H THR 64 4.580 17.660 12.023
482 HA THR 64 HA THR 64 5.306 19.683 14.047
483 HB THR 64 HB THR 64 4.499 17.734 15.220
484 HG1 THR 64 HG1 THR 64 6.112 17.768 16.607
485 HG21 THR 64 3HG2 THR 64 6.591 16.165 13.706
486 HG22 THR 64 1HG2 THR 64 4.844 16.044 13.489
487 HG23 THR 64 2HG2 THR 64 5.581 15.544 15.012
488 H GLY 65 H GLY 65 6.496 17.463 11.553
489 HA2 GLY 65 2HA GLY 65 8.572 17.956 10.414
490 HA3 GLY 65 1HA GLY 65 9.192 18.642 11.905
491 H ARG 66 H ARG 66 7.493 15.642 12.123
492 HA ARG 66 HA ARG 66 10.037 14.151 12.276
493 HE ARG 66 HE ARG 66 7.007 13.143 16.200
494 HB2 ARG 66 2HB ARG 66 7.507 13.607 13.855
495 HB3 ARG 66 1HB ARG 66 9.027 12.730 13.987
496 HG2 ARG 66 2HG ARG 66 10.107 14.876 14.707
497 HG3 ARG 66 1HG ARG 66 8.495 15.597 14.761
498 HD2 ARG 66 2HD ARG 66 9.379 13.178 16.343
499 HD3 ARG 66 1HD ARG 66 9.292 14.821 16.975
500 HH11 ARG 66 1HH1 ARG 66 8.269 15.945 17.757
501 HH12 ARG 66 2HH1 ARG 66 6.777 16.299 18.555
502 HH21 ARG 66 1HH2 ARG 66 5.103 13.615 17.236
503 HH22 ARG 66 2HH2 ARG 66 5.007 15.019 18.241
504 H SER 67 H SER 67 9.270 11.572 12.268
505 HA SER 67 HA SER 67 7.893 11.309 9.668
506 HG SER 67 HG SER 67 10.805 9.826 11.538
507 HB2 SER 67 2HB SER 67 9.081 9.132 9.462
508 HB3 SER 67 1HB SER 67 10.179 10.502 9.613
509 H LYS 68 H LYS 68 5.987 10.287 9.519
510 HA LYS 68 HA LYS 68 4.926 8.817 11.808
511 HB2 LYS 68 2HB LYS 68 3.716 9.692 9.186
512 HB3 LYS 68 1HB LYS 68 2.873 8.608 10.280
513 HG2 LYS 68 2HG LYS 68 2.947 10.325 12.034
514 HG3 LYS 68 1HG LYS 68 3.775 11.417 10.920
515 HD2 LYS 68 2HD LYS 68 1.877 11.566 9.502
516 HD3 LYS 68 1HD LYS 68 1.091 10.195 10.288
517 HE2 LYS 68 2HE LYS 68 0.004 12.200 11.014
518 HE3 LYS 68 1HE LYS 68 0.930 11.560 12.368
519 HZ1 LYS 68 3HZ LYS 68 1.190 13.932 12.207
520 HZ2 LYS 68 1HZ LYS 68 1.727 13.812 10.607
521 HZ3 LYS 68 2HZ LYS 68 2.669 13.184 11.865
522 H GLY 69 H GLY 69 5.160 8.108 8.293
523 HA2 GLY 69 2HA GLY 69 6.499 6.277 7.507
524 HA3 GLY 69 1HA GLY 69 6.217 5.453 9.027
525 H TYR 70 H TYR 70 3.478 6.891 7.394
526 HA TYR 70 HA TYR 70 2.855 4.367 6.054
527 HD1 TYR 70 HD1 TYR 70 -0.511 6.693 7.170
528 HD2 TYR 70 HD2 TYR 70 2.193 5.213 10.109
529 HE1 TYR 70 HE1 TYR 70 -1.311 8.387 8.757
530 HE2 TYR 70 HE2 TYR 70 1.400 6.909 11.700
531 HH TYR 70 HH TYR 70 -1.409 8.816 11.094
532 HB2 TYR 70 2HB TYR 70 0.514 4.401 7.013
533 HB3 TYR 70 1HB TYR 70 1.794 3.952 8.132
534 H GLY 71 H GLY 71 1.222 4.489 4.440
535 HA2 GLY 71 2HA GLY 71 0.487 7.222 3.587
536 HA3 GLY 71 1HA GLY 71 1.289 6.134 2.470
537 H PHE 72 H PHE 72 -1.274 7.329 2.063
538 HA PHE 72 HA PHE 72 -3.071 4.989 2.163
539 HD1 PHE 72 HD1 PHE 72 -5.494 5.330 3.756
540 HD2 PHE 72 HD2 PHE 72 -2.822 8.642 3.993
541 HE1 PHE 72 HE1 PHE 72 -5.793 5.392 6.197
542 HE2 PHE 72 HE2 PHE 72 -3.120 8.707 6.437
543 HZ PHE 72 HZ PHE 72 -4.601 7.083 7.539
544 HB2 PHE 72 2HB PHE 72 -3.709 7.937 1.869
545 HB3 PHE 72 1HB PHE 72 -4.903 6.646 1.765
546 H ILE 73 H ILE 73 -3.519 3.967 0.320
547 HA ILE 73 HA ILE 73 -2.840 5.287 -2.240
548 HB ILE 73 HB ILE 73 -2.891 2.317 -1.641
549 HG12 ILE 73 2HG1 ILE 73 -0.518 4.169 -2.032
550 HG13 ILE 73 1HG1 ILE 73 -1.051 3.526 -0.484
551 HG21 ILE 73 1HG2 ILE 73 -1.973 3.834 -4.092
552 HG22 ILE 73 2HG2 ILE 73 -3.407 2.817 -3.971
553 HG23 ILE 73 3HG2 ILE 73 -1.803 2.096 -3.842
554 HD11 ILE 73 3HD1 ILE 73 -0.029 1.914 -2.813
555 HD12 ILE 73 1HD1 ILE 73 -0.564 1.260 -1.265
556 HD13 ILE 73 2HD1 ILE 73 0.857 2.301 -1.340
557 H THR 74 H THR 74 -4.356 5.409 -3.818
558 HA THR 74 HA THR 74 -7.058 4.402 -3.225
559 HB THR 74 HB THR 74 -6.226 6.412 -5.343
560 HG1 THR 74 HG1 THR 74 -7.196 7.919 -3.789
561 HG21 THR 74 3HG2 THR 74 -8.361 5.317 -5.834
562 HG22 THR 74 1HG2 THR 74 -8.617 7.000 -5.373
563 HG23 THR 74 2HG2 THR 74 -8.947 5.710 -4.216
564 H PHE 75 H PHE 75 -8.031 2.864 -4.449
565 HA PHE 75 HA PHE 75 -6.793 2.080 -7.019
566 HD1 PHE 75 HD2 PHE 75 -6.275 0.787 -3.266
567 HD2 PHE 75 HD1 PHE 75 -5.297 -0.581 -7.179
568 HE1 PHE 75 HE2 PHE 75 -3.994 0.274 -2.514
569 HE2 PHE 75 HE1 PHE 75 -3.018 -1.101 -6.428
570 HZ PHE 75 HZ PHE 75 -2.362 -0.673 -4.095
571 HB2 PHE 75 2HB PHE 75 -8.005 0.287 -4.898
572 HB3 PHE 75 1HB PHE 75 -7.594 -0.258 -6.518
573 H SER 76 H SER 76 -8.183 1.643 -8.731
574 HA SER 76 HA SER 76 -10.933 2.521 -8.485
575 HG SER 76 HG SER 76 -8.778 3.337 -11.120
576 HB2 SER 76 2HB SER 76 -9.427 1.371 -10.859
577 HB3 SER 76 1HB SER 76 -11.064 2.021 -10.924
578 H ASP 77 H ASP 77 -9.439 -0.377 -7.843
579 HA ASP 77 HA ASP 77 -11.904 -1.913 -8.383
580 HB2 ASP 77 2HB ASP 77 -9.849 -2.488 -9.817
581 HB3 ASP 77 1HB ASP 77 -9.136 -3.129 -8.340
582 H SER 78 H SER 78 -12.885 -2.446 -6.537
583 HA SER 78 HA SER 78 -11.617 -2.189 -3.986
584 HG SER 78 HG SER 78 -14.272 -0.942 -3.444
585 HB2 SER 78 2HB SER 78 -14.327 -3.353 -4.692
586 HB3 SER 78 1HB SER 78 -13.788 -2.946 -3.063
587 H GLU 79 H GLU 79 -12.005 -4.852 -6.158
588 HA GLU 79 HA GLU 79 -11.586 -6.847 -4.064
589 HB2 GLU 79 2HB GLU 79 -12.278 -6.978 -6.975
590 HB3 GLU 79 1HB GLU 79 -11.571 -8.391 -6.203
591 HG2 GLU 79 2HG GLU 79 -14.034 -8.453 -6.263
592 HG3 GLU 79 1HG GLU 79 -13.382 -8.519 -4.628
593 H CYS 80 H CYS 80 -9.804 -5.464 -6.811
594 HA CYS 80 HA CYS 80 -7.476 -7.059 -6.505
595 HG CYS 80 HG CYS 80 -8.549 -7.174 -8.900
596 HB2 CYS 80 2HB CYS 80 -7.765 -4.251 -7.604
597 HB3 CYS 80 1HB CYS 80 -6.312 -5.239 -7.746
598 H ALA 81 H ALA 81 -8.444 -3.948 -5.094
599 HA ALA 81 HA ALA 81 -6.112 -3.558 -3.517
600 HB1 ALA 81 3HB ALA 81 -7.462 -1.927 -2.286
601 HB2 ALA 81 1HB ALA 81 -8.924 -2.542 -3.058
602 HB3 ALA 81 2HB ALA 81 -7.682 -1.747 -4.026
603 H LYS 82 H LYS 82 -9.226 -5.134 -2.881
604 HA LYS 82 HA LYS 82 -8.828 -5.758 -0.170
605 HB2 LYS 82 2HB LYS 82 -10.994 -5.883 -1.410
606 HB3 LYS 82 1HB LYS 82 -10.415 -7.337 -2.208
607 HG2 LYS 82 2HG LYS 82 -10.346 -8.529 -0.120
608 HG3 LYS 82 1HG LYS 82 -10.734 -7.061 0.780
609 HD2 LYS 82 2HD LYS 82 -12.552 -8.352 -1.266
610 HD3 LYS 82 1HD LYS 82 -12.673 -8.603 0.473
611 HE2 LYS 82 2HE LYS 82 -14.283 -6.961 -0.003
612 HE3 LYS 82 1HE LYS 82 -12.920 -6.066 0.661
613 HZ1 LYS 82 3HZ LYS 82 -13.821 -4.951 -1.264
614 HZ2 LYS 82 1HZ LYS 82 -13.604 -6.325 -2.226
615 HZ3 LYS 82 2HZ LYS 82 -12.262 -5.496 -1.618
616 H LYS 83 H LYS 83 -8.070 -7.640 -3.115
617 HA LYS 83 HA LYS 83 -6.898 -9.854 -1.839
618 HB2 LYS 83 2HB LYS 83 -7.408 -9.910 -4.229
619 HB3 LYS 83 1HB LYS 83 -6.232 -8.635 -4.534
620 HG2 LYS 83 2HG LYS 83 -4.440 -10.148 -3.726
621 HG3 LYS 83 1HG LYS 83 -5.641 -11.425 -3.546
622 HD2 LYS 83 2HD LYS 83 -6.106 -11.345 -5.939
623 HD3 LYS 83 1HD LYS 83 -4.954 -10.025 -6.133
624 HE2 LYS 83 2HE LYS 83 -3.137 -11.499 -5.415
625 HE3 LYS 83 1HE LYS 83 -4.286 -12.818 -5.193
626 HZ1 LYS 83 3HZ LYS 83 -3.154 -13.034 -7.297
627 HZ2 LYS 83 1HZ LYS 83 -3.638 -11.481 -7.768
628 HZ3 LYS 83 2HZ LYS 83 -4.791 -12.699 -7.568
629 H ALA 84 H ALA 84 -5.366 -6.881 -3.116
630 HA ALA 84 HA ALA 84 -2.740 -7.335 -2.395
631 HB1 ALA 84 3HB ALA 84 -4.195 -4.692 -2.226
632 HB2 ALA 84 1HB ALA 84 -3.496 -5.385 -3.690
633 HB3 ALA 84 2HB ALA 84 -2.451 -4.916 -2.349
634 H LEU 85 H LEU 85 -5.362 -6.076 -0.369
635 HA LEU 85 HA LEU 85 -3.896 -5.685 1.990
636 HG LEU 85 HG LEU 85 -5.449 -5.484 4.095
637 HB2 LEU 85 2HB LEU 85 -6.136 -4.798 1.650
638 HB3 LEU 85 1HB LEU 85 -6.802 -6.415 1.565
639 HD11 LEU 85 1HD1 LEU 85 -8.317 -4.944 3.312
640 HD12 LEU 85 2HD1 LEU 85 -7.053 -3.732 3.536
641 HD13 LEU 85 3HD1 LEU 85 -7.616 -4.684 4.909
642 HD21 LEU 85 3HD2 LEU 85 -6.055 -7.855 3.913
643 HD22 LEU 85 1HD2 LEU 85 -7.723 -7.410 3.551
644 HD23 LEU 85 2HD2 LEU 85 -7.035 -7.049 5.134
645 H GLU 86 H GLU 86 -5.676 -8.555 0.850
646 HA GLU 86 HA GLU 86 -5.193 -10.124 3.165
647 HB2 GLU 86 2HB GLU 86 -7.027 -10.506 1.522
648 HB3 GLU 86 1HB GLU 86 -5.832 -11.061 0.358
649 HG2 GLU 86 2HG GLU 86 -5.219 -12.886 1.917
650 HG3 GLU 86 1HG GLU 86 -6.505 -12.352 2.999
651 H GLN 87 H GLN 87 -3.365 -9.638 0.204
652 HA GLN 87 HA GLN 87 -1.677 -11.973 0.673
653 HB2 GLN 87 2HB GLN 87 -1.490 -9.940 -1.561
654 HB3 GLN 87 1HB GLN 87 -0.786 -11.551 -1.531
655 HG2 GLN 87 2HG GLN 87 -3.758 -11.140 -1.369
656 HG3 GLN 87 1HG GLN 87 -2.921 -11.154 -2.915
657 HE21 GLN 87 1HE2 GLN 87 -1.041 -13.161 -2.291
658 HE22 GLN 87 2HE2 GLN 87 -1.886 -14.657 -2.154
659 H LEU 88 H LEU 88 -1.471 -8.458 0.907
660 HA LEU 88 HA LEU 88 1.447 -8.591 1.196
661 HG LEU 88 HG LEU 88 -0.358 -7.491 -1.173
662 HB2 LEU 88 2HB LEU 88 -0.324 -6.168 0.899
663 HB3 LEU 88 1HB LEU 88 1.429 -6.176 0.879
664 HD11 LEU 88 1HD1 LEU 88 -0.419 -5.077 -1.339
665 HD12 LEU 88 2HD1 LEU 88 0.488 -5.760 -2.689
666 HD13 LEU 88 3HD1 LEU 88 1.344 -5.007 -1.342
667 HD21 LEU 88 3HD2 LEU 88 1.724 -7.868 -2.425
668 HD22 LEU 88 1HD2 LEU 88 1.715 -8.729 -0.888
669 HD23 LEU 88 2HD2 LEU 88 2.651 -7.244 -1.060
670 H ASN 89 H ASN 89 -1.280 -8.340 3.245
671 HA ASN 89 HA ASN 89 -0.156 -6.714 5.282
672 HB2 ASN 89 2HB ASN 89 -2.586 -7.402 5.107
673 HB3 ASN 89 1HB ASN 89 -2.113 -8.974 5.742
674 HD21 ASN 89 1HD2 ASN 89 -3.905 -7.058 6.902
675 HD22 ASN 89 2HD2 ASN 89 -3.252 -6.624 8.438
676 H GLY 90 H GLY 90 1.892 -7.211 5.828
677 HA2 GLY 90 2HA GLY 90 3.327 -8.434 7.332
678 HA3 GLY 90 1HA GLY 90 2.450 -9.901 6.918
679 H PHE 91 H PHE 91 3.274 -7.707 4.374
680 HA PHE 91 HA PHE 91 4.944 -9.686 3.099
681 HD1 PHE 91 HD2 PHE 91 4.699 -10.095 0.439
682 HD2 PHE 91 HD1 PHE 91 5.916 -6.037 0.937
683 HE1 PHE 91 HE2 PHE 91 6.151 -10.285 -1.539
684 HE2 PHE 91 HE1 PHE 91 7.368 -6.227 -1.039
685 HZ PHE 91 HZ PHE 91 7.486 -8.351 -2.278
686 HB2 PHE 91 2HB PHE 91 3.354 -8.374 1.783
687 HB3 PHE 91 1HB PHE 91 4.167 -6.885 2.248
688 H GLU 92 H GLU 92 7.139 -9.580 2.679
689 HA GLU 92 HA GLU 92 8.749 -8.011 4.459
690 HB2 GLU 92 2HB GLU 92 9.763 -9.606 2.102
691 HB3 GLU 92 1HB GLU 92 10.628 -9.187 3.571
692 HG2 GLU 92 2HG GLU 92 8.308 -11.102 3.375
693 HG3 GLU 92 1HG GLU 92 10.006 -11.541 3.528
694 H LEU 93 H LEU 93 8.227 -5.834 3.835
695 HA LEU 93 HA LEU 93 9.272 -4.958 1.222
696 HG LEU 93 HG LEU 93 8.867 -1.935 1.761
697 HB2 LEU 93 2HB LEU 93 6.970 -4.293 1.796
698 HB3 LEU 93 1HB LEU 93 7.564 -3.476 3.229
699 HD11 LEU 93 1HD1 LEU 93 7.350 -3.290 -0.473
700 HD12 LEU 93 2HD1 LEU 93 9.091 -3.371 -0.194
701 HD13 LEU 93 3HD1 LEU 93 8.340 -1.837 -0.626
702 HD21 LEU 93 3HD2 LEU 93 6.926 -0.633 0.984
703 HD22 LEU 93 1HD2 LEU 93 6.708 -1.240 2.626
704 HD23 LEU 93 2HD2 LEU 93 5.887 -2.028 1.277
705 H ALA 94 H ALA 94 11.186 -3.951 1.093
706 HA ALA 94 HA ALA 94 13.145 -2.934 1.647
707 HB1 ALA 94 3HB ALA 94 11.485 -1.618 3.801
708 HB2 ALA 94 1HB ALA 94 11.684 -1.040 2.147
709 HB3 ALA 94 2HB ALA 94 13.067 -1.079 3.239
710 H GLY 95 H GLY 95 12.188 -5.441 3.152
711 HA2 GLY 95 2HA GLY 95 13.471 -6.889 4.488
712 HA3 GLY 95 1HA GLY 95 14.391 -5.515 5.079
713 H ARG 96 H ARG 96 11.054 -4.956 5.179
714 HA ARG 96 HA ARG 96 10.810 -5.925 7.950
715 HE ARG 96 HE ARG 96 9.359 -1.962 9.274
716 HB2 ARG 96 2HB ARG 96 10.408 -3.135 6.919
717 HB3 ARG 96 1HB ARG 96 9.468 -3.696 8.295
718 HG2 ARG 96 2HG ARG 96 11.527 -4.177 9.516
719 HG3 ARG 96 1HG ARG 96 12.479 -3.620 8.135
720 HD2 ARG 96 2HD ARG 96 12.239 -1.912 9.925
721 HD3 ARG 96 1HD ARG 96 11.608 -1.386 8.364
722 HH11 ARG 96 1HH1 ARG 96 11.950 -1.248 11.424
723 HH12 ARG 96 2HH1 ARG 96 10.900 -0.734 12.696
724 HH21 ARG 96 1HH2 ARG 96 8.022 -1.293 10.894
725 HH22 ARG 96 2HH2 ARG 96 8.690 -0.748 12.395
726 HA PRO 97 HA PRO 97 6.704 -7.289 6.811
727 HB2 PRO 97 2HB PRO 97 5.783 -6.473 9.499
728 HB3 PRO 97 1HB PRO 97 5.835 -8.081 8.774
729 HG2 PRO 97 2HG PRO 97 7.532 -7.361 10.733
730 HG3 PRO 97 1HG PRO 97 8.024 -8.452 9.422
731 HD2 PRO 97 2HD PRO 97 8.588 -5.525 9.777
732 HD3 PRO 97 1HD PRO 97 9.665 -6.822 9.215
733 H MET 98 H MET 98 5.117 -6.247 5.698
734 HA MET 98 HA MET 98 4.710 -3.385 6.195
735 HB2 MET 98 2HB MET 98 5.297 -4.079 3.911
736 HB3 MET 98 1HB MET 98 3.868 -5.104 3.848
737 HG2 MET 98 2HG MET 98 2.414 -3.217 3.901
738 HG3 MET 98 1HG MET 98 3.753 -2.125 4.253
739 HE1 MET 98 3HE MET 98 3.272 -4.283 0.196
740 HE2 MET 98 1HE MET 98 2.156 -4.506 1.543
741 HE3 MET 98 2HE MET 98 3.813 -5.098 1.665
742 H LYS 99 H LYS 99 2.947 -2.614 7.138
743 HA LYS 99 HA LYS 99 0.740 -4.398 7.803
744 HB2 LYS 99 2HB LYS 99 1.426 -1.565 8.620
745 HB3 LYS 99 1HB LYS 99 -0.025 -2.402 9.160
746 HG2 LYS 99 2HG LYS 99 2.798 -3.344 9.666
747 HG3 LYS 99 1HG LYS 99 1.798 -2.456 10.820
748 HD2 LYS 99 2HD LYS 99 0.133 -4.273 10.751
749 HD3 LYS 99 1HD LYS 99 1.163 -5.163 9.630
750 HE2 LYS 99 2HE LYS 99 2.880 -5.391 11.309
751 HE3 LYS 99 1HE LYS 99 1.994 -4.335 12.413
752 HZ1 LYS 99 3HZ LYS 99 1.037 -6.970 11.433
753 HZ2 LYS 99 1HZ LYS 99 0.237 -5.965 12.533
754 HZ3 LYS 99 2HZ LYS 99 1.706 -6.681 12.957
755 H VAL 100 H VAL 100 -0.787 -4.637 6.248
756 HA VAL 100 HA VAL 100 -1.746 -2.205 4.860
757 HB VAL 100 HB VAL 100 -1.968 -5.052 3.857
758 HG11 VAL 100 1HG1 VAL 100 -2.493 -2.408 2.479
759 HG12 VAL 100 2HG1 VAL 100 -3.714 -3.569 3.007
760 HG13 VAL 100 3HG1 VAL 100 -2.584 -4.000 1.724
761 HG21 VAL 100 3HG2 VAL 100 -0.199 -4.470 2.259
762 HG22 VAL 100 1HG2 VAL 100 0.377 -4.366 3.922
763 HG23 VAL 100 2HG2 VAL 100 -0.013 -2.895 3.032
764 H GLY 101 H GLY 101 -3.696 -1.533 5.441
765 HA2 GLY 101 2HA GLY 101 -5.866 -3.488 5.818
766 HA3 GLY 101 1HA GLY 101 -5.571 -2.324 7.104
767 H HIS 102 H HIS 102 -7.971 -2.654 5.318
768 HA HIS 102 HA HIS 102 -7.856 -0.451 3.457
769 HD1 HIS 102 HD1 HIS 102 -12.065 -0.427 4.405
770 HD2 HIS 102 HD2 HIS 102 -10.154 -3.993 5.356
771 HE1 HIS 102 HE1 HIS 102 -13.583 -1.591 6.031
772 HE2 HIS 102 HE2 HIS 102 -12.491 -3.816 6.449
773 HB2 HIS 102 2HB HIS 102 -10.110 -0.968 2.868
774 HB3 HIS 102 1HB HIS 102 -9.278 -2.498 3.102
775 H VAL 103 H VAL 103 -8.822 1.589 3.624
776 HA VAL 103 HA VAL 103 -8.762 2.753 6.177
777 HB VAL 103 HB VAL 103 -9.683 4.785 5.162
778 HG11 VAL 103 1HG1 VAL 103 -7.670 3.415 3.372
779 HG12 VAL 103 2HG1 VAL 103 -7.306 4.272 4.871
780 HG13 VAL 103 3HG1 VAL 103 -7.947 5.154 3.485
781 HG21 VAL 103 3HG2 VAL 103 -11.381 3.777 3.708
782 HG22 VAL 103 1HG2 VAL 103 -10.112 3.107 2.679
783 HG23 VAL 103 2HG2 VAL 103 -10.324 4.854 2.798
784 H THR 104 H THR 104 -10.179 2.762 7.778
785 HA THR 104 HA THR 104 -13.010 2.962 7.363
786 HB THR 104 HB THR 104 -12.871 0.579 7.013
787 HG1 THR 104 HG1 THR 104 -13.752 0.631 9.676
788 HG21 THR 104 3HG2 THR 104 -11.442 0.413 9.674
789 HG22 THR 104 1HG2 THR 104 -10.724 0.121 8.088
790 HG23 THR 104 2HG2 THR 104 -11.971 -0.961 8.705
791 H GLU 105 H GLU 105 -11.832 4.834 8.536
792 HA GLU 105 HA GLU 105 -11.321 4.462 11.349
793 HB2 GLU 105 2HB GLU 105 -11.621 7.032 9.765
794 HB3 GLU 105 1HB GLU 105 -10.914 6.873 11.370
795 HG2 GLU 105 2HG GLU 105 -9.096 5.533 10.469
796 HG3 GLU 105 1HG GLU 105 -9.823 5.588 8.866
797 H ARG 106 H ARG 106 -13.401 3.482 11.817
798 HA ARG 106 HA ARG 106 -15.443 5.459 12.513
799 HE ARG 106 HE ARG 106 -18.222 1.122 11.088
800 HB2 ARG 106 2HB ARG 106 -17.234 3.922 11.658
801 HB3 ARG 106 1HB ARG 106 -16.255 4.672 10.404
802 HG2 ARG 106 2HG ARG 106 -14.998 2.623 10.104
803 HG3 ARG 106 1HG ARG 106 -15.861 1.867 11.444
804 HD2 ARG 106 2HD ARG 106 -17.223 2.899 8.952
805 HD3 ARG 106 1HD ARG 106 -16.673 1.235 9.141
806 HH11 ARG 106 1HH1 ARG 106 -18.777 3.461 8.616
807 HH12 ARG 106 2HH1 ARG 106 -20.480 3.512 8.900
808 HH21 ARG 106 1HH2 ARG 106 -20.396 1.188 11.436
809 HH22 ARG 106 2HH2 ARG 106 -21.391 2.240 10.488
810 H THR 107 H THR 107 -17.264 4.303 13.794
811 HA THR 107 HA THR 107 -15.961 2.669 15.870
812 HB THR 107 HB THR 107 -18.580 4.198 15.997
813 HG1 THR 107 HG1 THR 107 -15.966 4.848 16.966
814 HG21 THR 107 3HG2 THR 107 -18.483 2.327 17.590
815 HG22 THR 107 1HG2 THR 107 -18.406 3.881 18.422
816 HG23 THR 107 2HG2 THR 107 -16.940 2.928 18.198
817 H ASP 108 H ASP 108 -16.857 0.730 16.615
818 HA ASP 108 HA ASP 108 -18.255 -0.905 14.809
819 HB2 ASP 108 2HB ASP 108 -16.826 -1.827 16.553
820 HB3 ASP 108 1HB ASP 108 -17.886 -1.193 17.806
Start of MODEL 19
1 HA MET 1 HA MET 1 9.393 31.024 -19.770
2 H1 MET 1 1H MET 1 11.096 30.198 -18.292
3 H2 MET 1 2H MET 1 11.031 29.265 -19.699
4 H3 MET 1 3H MET 1 10.376 28.666 -18.261
5 HB2 MET 1 2HB MET 1 8.196 28.262 -19.413
6 HB3 MET 1 1HB MET 1 7.404 29.611 -20.218
7 HG2 MET 1 2HG MET 1 9.090 29.617 -21.950
8 HG3 MET 1 1HG MET 1 9.987 28.346 -21.118
9 HE1 MET 1 3HE MET 1 8.597 26.505 -24.294
10 HE2 MET 1 1HE MET 1 10.038 26.922 -23.366
11 HE3 MET 1 2HE MET 1 9.131 28.183 -24.200
12 H GLY 2 H GLY 2 8.468 32.479 -18.449
13 HA2 GLY 2 2HA GLY 2 8.131 32.167 -15.700
14 HA3 GLY 2 1HA GLY 2 7.377 33.422 -16.665
15 H HIS 3 H HIS 3 5.780 31.588 -18.278
16 HA HIS 3 HA HIS 3 3.470 31.440 -16.654
17 HD1 HIS 3 HD1 HIS 3 1.341 31.418 -20.379
18 HD2 HIS 3 HD2 HIS 3 4.471 33.494 -18.599
19 HE1 HIS 3 HE1 HIS 3 1.112 33.792 -21.170
20 HE2 HIS 3 HE2 HIS 3 3.113 34.986 -20.219
21 HB2 HIS 3 2HB HIS 3 4.107 30.198 -19.334
22 HB3 HIS 3 1HB HIS 3 2.525 30.082 -18.574
23 H HIS 4 H HIS 4 5.974 29.091 -17.317
24 HA HIS 4 HA HIS 4 4.504 27.074 -15.734
25 HD1 HIS 4 HD1 HIS 4 3.736 24.264 -17.609
26 HD2 HIS 4 HD2 HIS 4 4.300 27.874 -19.583
27 HE1 HIS 4 HE1 HIS 4 1.874 24.409 -19.284
28 HE2 HIS 4 HE2 HIS 4 2.307 26.541 -20.552
29 HB2 HIS 4 2HB HIS 4 6.447 26.666 -18.017
30 HB3 HIS 4 1HB HIS 4 5.887 25.365 -16.971
31 H HIS 5 H HIS 5 5.323 27.151 -13.726
32 HA HIS 5 HA HIS 5 8.155 27.727 -13.308
33 HD1 HIS 5 HD1 HIS 5 4.311 29.184 -11.897
34 HD2 HIS 5 HD2 HIS 5 8.267 30.445 -12.033
35 HE1 HIS 5 HE1 HIS 5 4.212 31.656 -12.287
36 HE2 HIS 5 HE2 HIS 5 6.608 32.373 -12.502
37 HB2 HIS 5 2HB HIS 5 5.902 27.347 -11.317
38 HB3 HIS 5 1HB HIS 5 7.547 27.830 -10.907
39 H HIS 6 H HIS 6 5.861 25.135 -12.420
40 HA HIS 6 HA HIS 6 8.003 23.195 -12.730
41 HD1 HIS 6 HD1 HIS 6 9.870 21.984 -10.902
42 HD2 HIS 6 HD2 HIS 6 8.391 25.426 -9.109
43 HE1 HIS 6 HE1 HIS 6 11.855 23.098 -9.860
44 HE2 HIS 6 HE2 HIS 6 10.940 25.155 -8.740
45 HB2 HIS 6 2HB HIS 6 6.565 23.638 -10.124
46 HB3 HIS 6 1HB HIS 6 7.224 22.060 -10.535
47 H HIS 7 H HIS 7 5.285 22.053 -10.930
48 HA HIS 7 HA HIS 7 3.802 20.412 -11.405
49 HD1 HIS 7 HD1 HIS 7 3.180 23.881 -11.738
50 HD2 HIS 7 HD2 HIS 7 0.259 20.979 -12.307
51 HE1 HIS 7 HE1 HIS 7 1.163 24.704 -10.490
52 HE2 HIS 7 HE2 HIS 7 -0.562 22.897 -10.777
53 HB2 HIS 7 2HB HIS 7 3.517 22.147 -13.846
54 HB3 HIS 7 1HB HIS 7 2.583 20.666 -13.681
55 H HIS 8 H HIS 8 4.499 18.405 -11.592
56 HA HIS 8 HA HIS 8 6.566 17.601 -13.360
57 HD1 HIS 8 HD1 HIS 8 8.345 15.583 -11.562
58 HD2 HIS 8 HD2 HIS 8 5.391 17.583 -9.423
59 HE1 HIS 8 HE1 HIS 8 9.444 16.334 -9.433
60 HE2 HIS 8 HE2 HIS 8 7.653 17.566 -8.169
61 HB2 HIS 8 2HB HIS 8 4.658 15.973 -11.666
62 HB3 HIS 8 1HB HIS 8 6.017 15.286 -12.552
63 H SER 9 H SER 9 6.236 17.658 -15.491
64 HA SER 9 HA SER 9 3.788 17.259 -16.828
65 HG SER 9 HG SER 9 6.934 15.989 -18.211
66 HB2 SER 9 2HB SER 9 5.157 17.174 -18.888
67 HB3 SER 9 1HB SER 9 5.654 18.498 -17.836
68 H HIS 10 H HIS 10 2.671 15.388 -16.842
69 HA HIS 10 HA HIS 10 4.152 12.866 -17.277
70 HD1 HIS 10 HD1 HIS 10 4.758 11.707 -15.062
71 HD2 HIS 10 HD2 HIS 10 1.776 14.145 -13.497
72 HE1 HIS 10 HE1 HIS 10 5.458 12.192 -12.705
73 HE2 HIS 10 HE2 HIS 10 3.667 13.693 -11.785
74 HB2 HIS 10 2HB HIS 10 1.419 13.282 -16.040
75 HB3 HIS 10 1HB HIS 10 2.192 11.720 -16.293
76 H MET 11 H MET 11 2.823 15.016 -19.138
77 HA MET 11 HA MET 11 2.183 14.992 -21.311
78 HB2 MET 11 2HB MET 11 3.537 12.896 -21.456
79 HB3 MET 11 1HB MET 11 2.074 11.978 -21.132
80 HG2 MET 11 2HG MET 11 2.458 13.814 -23.493
81 HG3 MET 11 1HG MET 11 2.698 12.069 -23.526
82 HE1 MET 11 3HE MET 11 0.788 13.655 -25.534
83 HE2 MET 11 1HE MET 11 -0.622 12.597 -25.576
84 HE3 MET 11 2HE MET 11 1.001 11.905 -25.600
85 H ALA 12 H ALA 12 0.308 12.563 -19.476
86 HA ALA 12 HA ALA 12 -1.992 12.759 -21.144
87 HB1 ALA 12 3HB ALA 12 -1.716 11.568 -18.387
88 HB2 ALA 12 1HB ALA 12 -1.411 10.736 -19.912
89 HB3 ALA 12 2HB ALA 12 -3.041 11.281 -19.515
90 H ALA 13 H ALA 13 -1.148 15.348 -19.756
91 HA ALA 13 HA ALA 13 -3.489 15.936 -18.111
92 HB1 ALA 13 3HB ALA 13 -1.286 16.779 -17.422
93 HB2 ALA 13 1HB ALA 13 -2.435 18.089 -17.695
94 HB3 ALA 13 2HB ALA 13 -1.196 17.737 -18.900
95 H ALA 14 H ALA 14 -2.613 16.149 -21.402
96 HA ALA 14 HA ALA 14 -3.916 18.523 -22.196
97 HB1 ALA 14 3HB ALA 14 -2.283 17.355 -23.600
98 HB2 ALA 14 1HB ALA 14 -3.797 17.626 -24.463
99 HB3 ALA 14 2HB ALA 14 -3.420 16.026 -23.822
100 H MET 15 H MET 15 -6.004 18.963 -21.875
101 HA MET 15 HA MET 15 -8.270 18.831 -21.820
102 HB2 MET 15 2HB MET 15 -7.691 16.851 -24.025
103 HB3 MET 15 1HB MET 15 -9.326 17.324 -23.584
104 HG2 MET 15 2HG MET 15 -8.568 18.579 -25.497
105 HG3 MET 15 1HG MET 15 -8.805 19.649 -24.118
106 HE1 MET 15 3HE MET 15 -7.441 21.530 -25.462
107 HE2 MET 15 1HE MET 15 -7.215 20.396 -26.794
108 HE3 MET 15 2HE MET 15 -5.830 21.264 -26.130
109 H ALA 16 H ALA 16 -6.666 16.888 -20.121
110 HA ALA 16 HA ALA 16 -8.282 14.531 -19.856
111 HB1 ALA 16 3HB ALA 16 -6.247 15.672 -17.937
112 HB2 ALA 16 1HB ALA 16 -5.903 14.553 -19.256
113 HB3 ALA 16 2HB ALA 16 -6.913 14.038 -17.906
114 H ASN 17 H ASN 17 -10.414 15.087 -19.445
115 HA ASN 17 HA ASN 17 -11.050 16.725 -17.098
116 HB2 ASN 17 2HB ASN 17 -12.308 17.003 -19.260
117 HB3 ASN 17 1HB ASN 17 -12.939 15.371 -19.056
118 HD21 ASN 17 1HD2 ASN 17 -15.066 15.998 -18.896
119 HD22 ASN 17 2HD2 ASN 17 -15.693 16.878 -17.548
120 H ASN 18 H ASN 18 -12.375 13.657 -18.333
121 HA ASN 18 HA ASN 18 -13.111 11.767 -17.329
122 HB2 ASN 18 2HB ASN 18 -10.662 11.445 -17.305
123 HB3 ASN 18 1HB ASN 18 -10.603 12.119 -15.679
124 HD21 ASN 18 1HD2 ASN 18 -13.122 9.979 -16.902
125 HD22 ASN 18 2HD2 ASN 18 -12.744 8.657 -15.863
126 H LEU 19 H LEU 19 -15.021 12.302 -16.314
127 HA LEU 19 HA LEU 19 -15.078 13.326 -13.623
128 HG LEU 19 HG LEU 19 -16.545 14.132 -16.348
129 HB2 LEU 19 2HB LEU 19 -17.287 12.062 -15.258
130 HB3 LEU 19 1HB LEU 19 -17.504 12.920 -13.745
131 HD11 LEU 19 1HD1 LEU 19 -18.675 15.349 -16.283
132 HD12 LEU 19 2HD1 LEU 19 -19.149 14.433 -14.852
133 HD13 LEU 19 3HD1 LEU 19 -18.914 13.605 -16.393
134 HD21 LEU 19 3HD2 LEU 19 -17.054 15.432 -13.667
135 HD22 LEU 19 1HD2 LEU 19 -16.696 16.283 -15.171
136 HD23 LEU 19 2HD2 LEU 19 -15.485 15.226 -14.447
137 H GLN 20 H GLN 20 -13.625 11.708 -12.718
138 HA GLN 20 HA GLN 20 -14.536 8.965 -12.543
139 HB2 GLN 20 2HB GLN 20 -12.466 8.611 -11.210
140 HB3 GLN 20 1HB GLN 20 -12.163 9.344 -12.780
141 HG2 GLN 20 2HG GLN 20 -11.905 11.526 -11.747
142 HG3 GLN 20 1HG GLN 20 -12.295 10.848 -10.166
143 HE21 GLN 20 1HE2 GLN 20 -10.749 9.626 -9.094
144 HE22 GLN 20 2HE2 GLN 20 -9.096 9.568 -9.585
145 H LYS 21 H LYS 21 -14.511 7.853 -10.411
146 HA LYS 21 HA LYS 21 -15.283 7.396 -8.364
147 HB2 LYS 21 2HB LYS 21 -14.761 8.746 -6.541
148 HB3 LYS 21 1HB LYS 21 -13.554 9.173 -7.742
149 HG2 LYS 21 2HG LYS 21 -14.723 11.228 -8.249
150 HG3 LYS 21 1HG LYS 21 -16.051 10.780 -7.180
151 HD2 LYS 21 2HD LYS 21 -13.220 11.086 -6.184
152 HD3 LYS 21 1HD LYS 21 -14.322 12.455 -6.300
153 HE2 LYS 21 2HE LYS 21 -14.406 11.654 -4.056
154 HE3 LYS 21 1HE LYS 21 -15.918 11.200 -4.835
155 HZ1 LYS 21 3HZ LYS 21 -15.127 8.962 -5.072
156 HZ2 LYS 21 1HZ LYS 21 -14.951 9.426 -3.459
157 HZ3 LYS 21 2HZ LYS 21 -13.601 9.376 -4.473
158 H GLY 22 H GLY 22 -16.867 10.159 -9.874
159 HA2 GLY 22 2HA GLY 22 -18.986 10.533 -8.106
160 HA3 GLY 22 1HA GLY 22 -19.039 10.881 -9.822
161 H SER 23 H SER 23 -18.571 7.994 -10.477
162 HA SER 23 HA SER 23 -21.220 6.914 -9.731
163 HG SER 23 HG SER 23 -22.296 8.157 -11.707
164 HB2 SER 23 2HB SER 23 -19.945 6.765 -12.480
165 HB3 SER 23 1HB SER 23 -21.505 6.084 -12.021
166 H ALA 24 H ALA 24 -18.236 6.359 -8.996
167 HA ALA 24 HA ALA 24 -18.260 3.459 -9.577
168 HB1 ALA 24 3HB ALA 24 -16.656 4.554 -11.058
169 HB2 ALA 24 1HB ALA 24 -15.833 3.517 -9.893
170 HB3 ALA 24 2HB ALA 24 -15.840 5.267 -9.668
171 H GLY 25 H GLY 25 -16.911 2.157 -8.107
172 HA2 GLY 25 2HA GLY 25 -16.767 3.337 -5.389
173 HA3 GLY 25 1HA GLY 25 -17.293 1.691 -5.696
174 HA PRO 26 HA PRO 26 -12.510 1.710 -6.005
175 HB2 PRO 26 2HB PRO 26 -11.148 3.887 -5.287
176 HB3 PRO 26 1HB PRO 26 -11.934 3.799 -6.870
177 HG2 PRO 26 2HG PRO 26 -12.812 5.226 -4.391
178 HG3 PRO 26 1HG PRO 26 -12.914 5.752 -6.081
179 HD2 PRO 26 2HD PRO 26 -14.992 4.599 -4.603
180 HD3 PRO 26 1HD PRO 26 -14.938 4.736 -6.371
181 H MET 27 H MET 27 -10.701 1.491 -4.372
182 HA MET 27 HA MET 27 -11.706 1.656 -1.595
183 HB2 MET 27 2HB MET 27 -11.712 -0.677 -2.439
184 HB3 MET 27 1HB MET 27 -9.986 -0.555 -2.742
185 HG2 MET 27 2HG MET 27 -9.576 -0.250 -0.355
186 HG3 MET 27 1HG MET 27 -11.309 -0.327 -0.041
187 HE1 MET 27 3HE MET 27 -10.969 -2.245 1.755
188 HE2 MET 27 1HE MET 27 -9.225 -2.161 1.499
189 HE3 MET 27 2HE MET 27 -10.050 -3.717 1.451
190 H ARG 28 H ARG 28 -10.247 2.173 0.024
191 HA ARG 28 HA ARG 28 -7.620 3.191 -0.873
192 HE ARG 28 HE ARG 28 -6.269 7.577 0.675
193 HB2 ARG 28 2HB ARG 28 -9.388 4.874 -0.135
194 HB3 ARG 28 1HB ARG 28 -9.222 4.211 1.483
195 HG2 ARG 28 2HG ARG 28 -6.857 4.851 1.500
196 HG3 ARG 28 1HG ARG 28 -7.030 5.513 -0.128
197 HD2 ARG 28 2HD ARG 28 -8.844 7.019 0.822
198 HD3 ARG 28 1HD ARG 28 -8.315 6.492 2.421
199 HH11 ARG 28 1HH1 ARG 28 -8.446 8.159 3.298
200 HH12 ARG 28 2HH1 ARG 28 -7.609 9.587 3.798
201 HH21 ARG 28 1HH2 ARG 28 -5.234 9.416 1.343
202 HH22 ARG 28 2HH2 ARG 28 -5.816 10.274 2.727
203 H LEU 29 H LEU 29 -5.935 2.074 -0.061
204 HA LEU 29 HA LEU 29 -6.331 0.383 2.305
205 HG LEU 29 HG LEU 29 -6.067 -0.468 -0.831
206 HB2 LEU 29 2HB LEU 29 -4.091 0.381 0.276
207 HB3 LEU 29 1HB LEU 29 -4.278 -0.766 1.590
208 HD11 LEU 29 1HD1 LEU 29 -3.960 -1.657 -1.223
209 HD12 LEU 29 2HD1 LEU 29 -5.347 -2.739 -1.335
210 HD13 LEU 29 3HD1 LEU 29 -4.330 -2.755 0.107
211 HD21 LEU 29 3HD2 LEU 29 -7.353 -2.350 0.080
212 HD22 LEU 29 1HD2 LEU 29 -7.443 -0.931 1.125
213 HD23 LEU 29 2HD2 LEU 29 -6.398 -2.282 1.561
214 H TYR 30 H TYR 30 -5.213 0.598 4.159
215 HA TYR 30 HA TYR 30 -3.457 2.911 4.493
216 HD1 TYR 30 HD2 TYR 30 -3.499 4.460 6.989
217 HD2 TYR 30 HD1 TYR 30 -3.074 0.333 7.970
218 HE1 TYR 30 HE2 TYR 30 -1.976 5.053 8.828
219 HE2 TYR 30 HE1 TYR 30 -1.555 0.922 9.805
220 HH TYR 30 HH TYR 30 -1.166 4.106 10.939
221 HB2 TYR 30 2HB TYR 30 -5.136 2.713 6.188
222 HB3 TYR 30 1HB TYR 30 -4.774 1.013 6.445
223 H VAL 31 H VAL 31 -1.398 2.520 3.894
224 HA VAL 31 HA VAL 31 -0.148 -0.050 4.588
225 HB VAL 31 HB VAL 31 0.926 2.149 2.800
226 HG11 VAL 31 1HG1 VAL 31 1.871 -0.691 3.265
227 HG12 VAL 31 2HG1 VAL 31 2.702 0.785 3.764
228 HG13 VAL 31 3HG1 VAL 31 2.519 0.412 2.051
229 HG21 VAL 31 3HG2 VAL 31 0.334 0.634 0.931
230 HG22 VAL 31 1HG2 VAL 31 -1.085 1.181 1.827
231 HG23 VAL 31 2HG2 VAL 31 -0.456 -0.447 2.081
232 H GLY 32 H GLY 32 0.425 0.142 6.727
233 HA2 GLY 32 2HA GLY 32 2.002 2.482 7.569
234 HA3 GLY 32 1HA GLY 32 1.264 1.297 8.631
235 H SER 33 H SER 33 3.978 1.951 6.513
236 HA SER 33 HA SER 33 5.812 0.539 8.139
237 HG SER 33 HG SER 33 6.450 -2.452 7.156
238 HB2 SER 33 2HB SER 33 4.630 -1.416 7.056
239 HB3 SER 33 1HB SER 33 5.248 -0.853 5.504
240 H LEU 34 H LEU 34 5.396 3.053 6.500
241 HA LEU 34 HA LEU 34 7.415 3.020 4.455
242 HG LEU 34 HG LEU 34 4.350 4.252 4.875
243 HB2 LEU 34 2HB LEU 34 6.223 5.431 5.836
244 HB3 LEU 34 1HB LEU 34 7.078 5.415 4.307
245 HD11 LEU 34 1HD1 LEU 34 3.585 5.890 3.242
246 HD12 LEU 34 2HD1 LEU 34 5.234 6.488 3.056
247 HD13 LEU 34 3HD1 LEU 34 4.398 6.672 4.598
248 HD21 LEU 34 3HD2 LEU 34 5.956 4.118 2.319
249 HD22 LEU 34 1HD2 LEU 34 4.271 3.625 2.506
250 HD23 LEU 34 2HD2 LEU 34 5.545 2.758 3.364
251 H HIS 35 H HIS 35 9.375 2.371 5.297
252 HA HIS 35 HA HIS 35 10.330 3.380 7.818
253 HD1 HIS 35 HD1 HIS 35 10.481 1.045 9.323
254 HD2 HIS 35 HD2 HIS 35 10.060 -0.484 5.487
255 HE1 HIS 35 HE1 HIS 35 8.993 -0.954 9.563
256 HE2 HIS 35 HE2 HIS 35 8.525 -1.667 7.199
257 HB2 HIS 35 2HB HIS 35 11.754 1.630 5.800
258 HB3 HIS 35 1HB HIS 35 12.255 1.912 7.467
259 H PHE 36 H PHE 36 10.113 5.632 6.769
260 HA PHE 36 HA PHE 36 11.131 7.614 6.417
261 HD1 PHE 36 HD2 PHE 36 11.455 8.875 8.705
262 HD2 PHE 36 HD1 PHE 36 12.917 4.913 9.261
263 HE1 PHE 36 HE2 PHE 36 10.452 8.824 10.949
264 HE2 PHE 36 HE1 PHE 36 11.914 4.857 11.507
265 HZ PHE 36 HZ PHE 36 10.682 6.814 12.358
266 HB2 PHE 36 2HB PHE 36 13.571 6.114 7.381
267 HB3 PHE 36 1HB PHE 36 13.392 7.864 7.340
268 H ASN 37 H ASN 37 11.650 5.294 4.206
269 HA ASN 37 HA ASN 37 12.921 7.188 2.405
270 HB2 ASN 37 2HB ASN 37 14.788 5.896 3.539
271 HB3 ASN 37 1HB ASN 37 14.185 4.455 2.730
272 HD21 ASN 37 1HD2 ASN 37 14.557 4.197 0.551
273 HD22 ASN 37 2HD2 ASN 37 15.596 5.237 -0.356
274 H ILE 38 H ILE 38 10.471 5.194 2.854
275 HA ILE 38 HA ILE 38 10.463 3.716 0.379
276 HB ILE 38 HB ILE 38 8.169 4.239 2.290
277 HG12 ILE 38 2HG1 ILE 38 10.024 3.032 3.373
278 HG13 ILE 38 1HG1 ILE 38 8.636 1.975 3.151
279 HG21 ILE 38 1HG2 ILE 38 8.454 2.218 0.055
280 HG22 ILE 38 2HG2 ILE 38 7.388 3.623 0.062
281 HG23 ILE 38 3HG2 ILE 38 7.110 2.301 1.196
282 HD11 ILE 38 3HD1 ILE 38 9.722 0.953 1.216
283 HD12 ILE 38 1HD1 ILE 38 10.722 0.830 2.663
284 HD13 ILE 38 2HD1 ILE 38 11.105 2.027 1.426
285 H THR 39 H THR 39 9.648 4.327 -1.552
286 HA THR 39 HA THR 39 8.525 7.051 -1.759
287 HB THR 39 HB THR 39 9.272 7.065 -4.074
288 HG1 THR 39 HG1 THR 39 10.608 5.161 -4.733
289 HG21 THR 39 3HG2 THR 39 11.711 6.920 -3.748
290 HG22 THR 39 1HG2 THR 39 11.454 6.057 -2.232
291 HG23 THR 39 2HG2 THR 39 10.926 7.733 -2.394
292 H GLU 40 H GLU 40 6.869 7.452 -3.370
293 HA GLU 40 HA GLU 40 4.653 5.777 -3.374
294 HB2 GLU 40 2HB GLU 40 5.345 7.731 -5.590
295 HB3 GLU 40 1HB GLU 40 3.747 7.142 -5.167
296 HG2 GLU 40 2HG GLU 40 3.592 9.120 -4.103
297 HG3 GLU 40 1HG GLU 40 4.444 8.266 -2.820
298 H ASP 41 H ASP 41 7.319 6.009 -5.652
299 HA ASP 41 HA ASP 41 6.365 4.323 -7.667
300 HB2 ASP 41 2HB ASP 41 8.258 5.775 -8.019
301 HB3 ASP 41 1HB ASP 41 9.188 4.944 -6.776
302 H MET 42 H MET 42 8.197 3.541 -4.712
303 HA MET 42 HA MET 42 8.675 0.815 -5.305
304 HB2 MET 42 2HB MET 42 8.388 2.192 -2.619
305 HB3 MET 42 1HB MET 42 8.985 0.554 -2.839
306 HG2 MET 42 2HG MET 42 10.883 1.389 -4.102
307 HG3 MET 42 1HG MET 42 10.274 3.037 -3.950
308 HE1 MET 42 3HE MET 42 13.421 3.033 -1.593
309 HE2 MET 42 1HE MET 42 12.622 3.848 -2.938
310 HE3 MET 42 2HE MET 42 13.229 2.205 -3.138
311 H LEU 43 H LEU 43 6.217 2.299 -3.215
312 HA LEU 43 HA LEU 43 4.687 0.056 -2.632
313 HG LEU 43 HG LEU 43 5.551 2.637 -1.291
314 HB2 LEU 43 2HB LEU 43 3.747 2.903 -3.044
315 HB3 LEU 43 1HB LEU 43 2.848 1.647 -2.209
316 HD11 LEU 43 1HD1 LEU 43 4.352 3.941 0.389
317 HD12 LEU 43 2HD1 LEU 43 2.815 3.493 -0.349
318 HD13 LEU 43 3HD1 LEU 43 3.972 4.482 -1.245
319 HD21 LEU 43 3HD2 LEU 43 4.936 1.562 0.819
320 HD22 LEU 43 1HD2 LEU 43 4.945 0.401 -0.507
321 HD23 LEU 43 2HD2 LEU 43 3.414 1.021 0.111
322 H ARG 44 H ARG 44 4.330 2.333 -5.352
323 HA ARG 44 HA ARG 44 2.100 1.130 -6.548
324 HE ARG 44 HE ARG 44 2.591 3.059 -11.822
325 HB2 ARG 44 2HB ARG 44 2.896 3.357 -7.161
326 HB3 ARG 44 1HB ARG 44 4.357 2.665 -7.853
327 HG2 ARG 44 2HG ARG 44 3.095 1.576 -9.579
328 HG3 ARG 44 1HG ARG 44 1.574 2.065 -8.832
329 HD2 ARG 44 2HD ARG 44 2.074 4.402 -9.271
330 HD3 ARG 44 1HD ARG 44 3.653 3.962 -9.930
331 HH11 ARG 44 1HH1 ARG 44 0.340 4.497 -9.650
332 HH12 ARG 44 2HH1 ARG 44 -0.926 4.552 -10.823
333 HH21 ARG 44 1HH2 ARG 44 0.965 3.133 -13.318
334 HH22 ARG 44 2HH2 ARG 44 -0.568 3.812 -12.882
335 H GLY 45 H GLY 45 5.573 0.562 -7.138
336 HA2 GLY 45 2HA GLY 45 5.347 -1.277 -9.226
337 HA3 GLY 45 1HA GLY 45 6.676 -1.221 -8.080
338 H ILE 46 H ILE 46 4.922 -1.770 -5.778
339 HA ILE 46 HA ILE 46 4.780 -4.661 -6.032
340 HB ILE 46 HB ILE 46 4.150 -2.914 -3.644
341 HG12 ILE 46 2HG1 ILE 46 6.479 -2.628 -4.363
342 HG13 ILE 46 1HG1 ILE 46 6.409 -3.521 -2.848
343 HG21 ILE 46 1HG2 ILE 46 4.465 -4.974 -2.332
344 HG22 ILE 46 2HG2 ILE 46 4.655 -5.889 -3.830
345 HG23 ILE 46 3HG2 ILE 46 3.118 -5.105 -3.462
346 HD11 ILE 46 3HD1 ILE 46 8.068 -4.454 -4.342
347 HD12 ILE 46 1HD1 ILE 46 6.843 -4.701 -5.584
348 HD13 ILE 46 2HD1 ILE 46 6.763 -5.609 -4.073
349 H PHE 47 H PHE 47 2.482 -2.059 -5.171
350 HA PHE 47 HA PHE 47 0.296 -3.908 -4.869
351 HD1 PHE 47 HD1 PHE 47 2.440 -1.633 -3.113
352 HD2 PHE 47 HD2 PHE 47 -1.674 -2.468 -2.372
353 HE1 PHE 47 HE1 PHE 47 2.928 -1.903 -0.720
354 HE2 PHE 47 HE2 PHE 47 -1.184 -2.742 0.024
355 HZ PHE 47 HZ PHE 47 1.116 -2.459 0.853
356 HB2 PHE 47 2HB PHE 47 0.484 -0.904 -4.687
357 HB3 PHE 47 1HB PHE 47 -1.030 -1.771 -4.487
358 H GLU 48 H GLU 48 1.264 -1.612 -7.392
359 HA GLU 48 HA GLU 48 -1.224 -1.244 -8.616
360 HB2 GLU 48 2HB GLU 48 1.029 -0.020 -9.013
361 HB3 GLU 48 1HB GLU 48 1.321 -1.252 -10.228
362 HG2 GLU 48 2HG GLU 48 -1.224 0.321 -10.295
363 HG3 GLU 48 1HG GLU 48 0.270 1.055 -10.868
364 HA PRO 49 HA PRO 49 0.143 -5.007 -11.667
365 HB2 PRO 49 2HB PRO 49 1.183 -6.583 -9.334
366 HB3 PRO 49 1HB PRO 49 1.628 -6.685 -11.043
367 HG2 PRO 49 2HG PRO 49 3.211 -5.410 -9.347
368 HG3 PRO 49 1HG PRO 49 2.905 -4.728 -10.957
369 HD2 PRO 49 2HD PRO 49 1.829 -3.881 -8.303
370 HD3 PRO 49 1HD PRO 49 2.239 -2.899 -9.724
371 H PHE 50 H PHE 50 -1.202 -4.997 -8.424
372 HA PHE 50 HA PHE 50 -2.819 -7.326 -8.736
373 HD1 PHE 50 HD1 PHE 50 -3.614 -8.535 -6.100
374 HD2 PHE 50 HD2 PHE 50 -0.611 -5.516 -6.084
375 HE1 PHE 50 HE1 PHE 50 -2.187 -9.968 -4.702
376 HE2 PHE 50 HE2 PHE 50 0.823 -6.946 -4.686
377 HZ PHE 50 HZ PHE 50 0.031 -9.175 -3.989
378 HB2 PHE 50 2HB PHE 50 -2.880 -5.019 -6.800
379 HB3 PHE 50 1HB PHE 50 -4.126 -6.263 -6.781
380 H GLY 51 H GLY 51 -3.619 -3.817 -9.007
381 HA2 GLY 51 2HA GLY 51 -5.509 -4.322 -11.084
382 HA3 GLY 51 1HA GLY 51 -6.339 -4.159 -9.552
383 H ARG 52 H ARG 52 -3.525 -2.347 -10.768
384 HA ARG 52 HA ARG 52 -3.285 -0.216 -11.531
385 HE ARG 52 HE ARG 52 -6.225 3.790 -13.147
386 HB2 ARG 52 2HB ARG 52 -5.155 -0.543 -12.984
387 HB3 ARG 52 1HB ARG 52 -6.297 -0.324 -11.668
388 HG2 ARG 52 2HG ARG 52 -5.694 2.028 -11.506
389 HG3 ARG 52 1HG ARG 52 -4.492 1.821 -12.783
390 HD2 ARG 52 2HD ARG 52 -6.183 1.324 -14.390
391 HD3 ARG 52 1HD ARG 52 -7.428 1.236 -13.146
392 HH11 ARG 52 1HH1 ARG 52 -8.405 1.865 -14.989
393 HH12 ARG 52 2HH1 ARG 52 -9.272 3.237 -15.590
394 HH21 ARG 52 1HH2 ARG 52 -7.352 5.534 -13.908
395 HH22 ARG 52 2HH2 ARG 52 -8.680 5.290 -14.992
396 H ILE 53 H ILE 53 -2.843 1.703 -10.598
397 HA ILE 53 HA ILE 53 -4.214 2.417 -8.078
398 HB ILE 53 HB ILE 53 -1.235 2.555 -8.607
399 HG12 ILE 53 2HG1 ILE 53 -2.845 0.954 -6.596
400 HG13 ILE 53 1HG1 ILE 53 -2.029 0.311 -8.015
401 HG21 ILE 53 1HG2 ILE 53 -1.967 4.526 -7.378
402 HG22 ILE 53 2HG2 ILE 53 -1.044 3.453 -6.327
403 HG23 ILE 53 3HG2 ILE 53 -2.803 3.509 -6.204
404 HD11 ILE 53 3HD1 ILE 53 0.125 1.015 -7.056
405 HD12 ILE 53 1HD1 ILE 53 -0.738 -0.155 -6.060
406 HD13 ILE 53 2HD1 ILE 53 -0.728 1.547 -5.606
407 H GLU 54 H GLU 54 -4.793 4.513 -7.869
408 HA GLU 54 HA GLU 54 -4.099 6.329 -10.090
409 HB2 GLU 54 2HB GLU 54 -6.504 6.355 -8.254
410 HB3 GLU 54 1HB GLU 54 -6.224 7.470 -9.588
411 HG2 GLU 54 2HG GLU 54 -6.526 4.483 -9.866
412 HG3 GLU 54 1HG GLU 54 -7.810 5.655 -10.135
413 H SER 55 H SER 55 -4.653 6.344 -6.553
414 HA SER 55 HA SER 55 -3.012 8.800 -6.407
415 HG SER 55 HG SER 55 -4.993 9.872 -6.969
416 HB2 SER 55 2HB SER 55 -5.482 8.191 -4.757
417 HB3 SER 55 1HB SER 55 -4.459 9.616 -4.587
418 H ILE 56 H ILE 56 -1.241 8.559 -5.219
419 HA ILE 56 HA ILE 56 -1.247 6.597 -3.002
420 HB ILE 56 HB ILE 56 1.167 7.558 -4.564
421 HG12 ILE 56 2HG1 ILE 56 -0.310 4.914 -4.721
422 HG13 ILE 56 1HG1 ILE 56 -0.338 6.170 -5.951
423 HG21 ILE 56 1HG2 ILE 56 2.330 5.709 -3.406
424 HG22 ILE 56 2HG2 ILE 56 0.866 5.391 -2.476
425 HG23 ILE 56 3HG2 ILE 56 1.717 6.923 -2.283
426 HD11 ILE 56 3HD1 ILE 56 2.085 5.863 -6.275
427 HD12 ILE 56 1HD1 ILE 56 1.150 4.404 -6.615
428 HD13 ILE 56 2HD1 ILE 56 2.048 4.544 -5.103
429 H GLN 57 H GLN 57 -1.558 7.719 -1.154
430 HA GLN 57 HA GLN 57 -0.339 10.376 -0.844
431 HB2 GLN 57 2HB GLN 57 -2.457 8.964 0.802
432 HB3 GLN 57 1HB GLN 57 -1.836 10.575 1.137
433 HG2 GLN 57 2HG GLN 57 -3.250 9.781 -1.403
434 HG3 GLN 57 1HG GLN 57 -4.022 10.559 -0.024
435 HE21 GLN 57 1HE2 GLN 57 -1.742 12.298 0.532
436 HE22 GLN 57 2HE2 GLN 57 -1.740 13.491 -0.713
437 H LEU 58 H LEU 58 1.625 10.412 0.102
438 HA LEU 58 HA LEU 58 2.243 8.487 2.241
439 HG LEU 58 HG LEU 58 3.551 8.858 -0.763
440 HB2 LEU 58 2HB LEU 58 4.049 10.524 0.917
441 HB3 LEU 58 1HB LEU 58 4.545 9.291 2.060
442 HD11 LEU 58 1HD1 LEU 58 6.233 8.332 0.525
443 HD12 LEU 58 2HD1 LEU 58 5.857 9.624 -0.618
444 HD13 LEU 58 3HD1 LEU 58 5.789 7.942 -1.138
445 HD21 LEU 58 3HD2 LEU 58 3.964 6.469 -0.387
446 HD22 LEU 58 1HD2 LEU 58 2.680 7.084 0.655
447 HD23 LEU 58 2HD2 LEU 58 4.290 6.795 1.316
448 H MET 59 H MET 59 2.335 9.109 4.369
449 HA MET 59 HA MET 59 1.398 11.827 4.914
450 HB2 MET 59 2HB MET 59 1.638 9.499 6.826
451 HB3 MET 59 1HB MET 59 0.783 11.007 7.110
452 HG2 MET 59 2HG MET 59 0.065 8.888 5.095
453 HG3 MET 59 1HG MET 59 -0.782 9.246 6.597
454 HE1 MET 59 3HE MET 59 -2.278 12.794 5.846
455 HE2 MET 59 1HE MET 59 -0.783 12.381 6.686
456 HE3 MET 59 2HE MET 59 -2.251 11.450 6.985
457 H MET 60 H MET 60 2.851 13.333 5.298
458 HA MET 60 HA MET 60 5.143 12.714 7.052
459 HB2 MET 60 2HB MET 60 6.546 14.242 5.744
460 HB3 MET 60 1HB MET 60 5.956 12.920 4.747
461 HG2 MET 60 2HG MET 60 4.265 14.387 3.780
462 HG3 MET 60 1HG MET 60 4.820 15.713 4.802
463 HE1 MET 60 3HE MET 60 5.677 13.356 1.783
464 HE2 MET 60 1HE MET 60 6.964 12.973 2.929
465 HE3 MET 60 2HE MET 60 7.341 13.816 1.426
466 H ASP 61 H ASP 61 5.895 14.478 8.350
467 HA ASP 61 HA ASP 61 3.809 16.149 9.333
468 HB2 ASP 61 2HB ASP 61 5.666 15.192 10.726
469 HB3 ASP 61 1HB ASP 61 6.773 16.323 9.948
470 H SER 62 H SER 62 3.085 17.758 8.034
471 HA SER 62 HA SER 62 4.783 19.238 6.256
472 HG SER 62 HG SER 62 2.214 21.548 5.966
473 HB2 SER 62 2HB SER 62 2.408 18.849 5.716
474 HB3 SER 62 1HB SER 62 1.928 19.814 7.112
475 H GLU 63 H GLU 63 6.306 19.809 7.993
476 HA GLU 63 HA GLU 63 6.207 22.509 8.738
477 HB2 GLU 63 2HB GLU 63 4.489 21.643 10.362
478 HB3 GLU 63 1HB GLU 63 5.736 20.617 11.064
479 HG2 GLU 63 2HG GLU 63 7.010 22.591 11.718
480 HG3 GLU 63 1HG GLU 63 5.783 23.634 10.995
481 H THR 64 H THR 64 7.288 19.474 10.253
482 HA THR 64 HA THR 64 10.042 20.469 10.408
483 HB THR 64 HB THR 64 10.488 18.496 11.773
484 HG1 THR 64 HG1 THR 64 7.800 17.714 11.778
485 HG21 THR 64 3HG2 THR 64 7.902 19.829 12.588
486 HG22 THR 64 1HG2 THR 64 9.523 20.460 12.888
487 HG23 THR 64 2HG2 THR 64 9.002 18.961 13.660
488 H GLY 65 H GLY 65 8.106 18.364 8.473
489 HA2 GLY 65 2HA GLY 65 8.654 17.383 6.441
490 HA3 GLY 65 1HA GLY 65 10.320 17.876 6.681
491 H ARG 66 H ARG 66 8.799 16.079 9.219
492 HA ARG 66 HA ARG 66 10.617 13.848 8.744
493 HE ARG 66 HE ARG 66 10.948 17.003 13.394
494 HB2 ARG 66 2HB ARG 66 8.665 14.258 11.021
495 HB3 ARG 66 1HB ARG 66 9.979 13.089 10.961
496 HG2 ARG 66 2HG ARG 66 11.607 14.925 10.898
497 HG3 ARG 66 1HG ARG 66 10.287 16.087 10.983
498 HD2 ARG 66 2HD ARG 66 9.620 15.033 13.164
499 HD3 ARG 66 1HD ARG 66 11.102 14.080 13.084
500 HH11 ARG 66 1HH1 ARG 66 12.787 14.087 13.547
501 HH12 ARG 66 2HH1 ARG 66 14.111 14.849 14.359
502 HH21 ARG 66 1HH2 ARG 66 12.653 17.953 14.431
503 HH22 ARG 66 2HH2 ARG 66 14.037 17.001 14.852
504 H SER 67 H SER 67 10.012 11.726 8.409
505 HA SER 67 HA SER 67 7.465 11.326 7.094
506 HG SER 67 HG SER 67 10.611 10.610 6.225
507 HB2 SER 67 2HB SER 67 9.688 9.339 7.662
508 HB3 SER 67 1HB SER 67 8.318 9.071 6.585
509 H LYS 68 H LYS 68 5.643 10.554 8.006
510 HA LYS 68 HA LYS 68 5.515 9.908 10.776
511 HB2 LYS 68 2HB LYS 68 3.500 9.629 8.544
512 HB3 LYS 68 1HB LYS 68 3.132 9.254 10.221
513 HG2 LYS 68 2HG LYS 68 4.022 11.949 9.193
514 HG3 LYS 68 1HG LYS 68 2.360 11.488 9.571
515 HD2 LYS 68 2HD LYS 68 3.059 11.045 11.913
516 HD3 LYS 68 1HD LYS 68 4.678 11.621 11.509
517 HE2 LYS 68 2HE LYS 68 3.409 13.383 12.591
518 HE3 LYS 68 1HE LYS 68 3.729 13.812 10.910
519 HZ1 LYS 68 3HZ LYS 68 1.467 14.326 11.509
520 HZ2 LYS 68 1HZ LYS 68 1.178 12.728 11.977
521 HZ3 LYS 68 2HZ LYS 68 1.478 13.096 10.352
522 H GLY 69 H GLY 69 5.540 7.923 7.848
523 HA2 GLY 69 2HA GLY 69 6.576 5.731 7.951
524 HA3 GLY 69 1HA GLY 69 5.927 5.550 9.569
525 H TYR 70 H TYR 70 3.539 6.905 7.659
526 HA TYR 70 HA TYR 70 2.559 4.349 6.621
527 HD1 TYR 70 HD2 TYR 70 0.098 7.626 7.714
528 HD2 TYR 70 HD1 TYR 70 2.045 5.226 10.648
529 HE1 TYR 70 HE2 TYR 70 -0.079 9.467 9.338
530 HE2 TYR 70 HE1 TYR 70 1.869 7.062 12.269
531 HH TYR 70 HH TYR 70 1.507 9.324 12.454
532 HB2 TYR 70 2HB TYR 70 0.234 5.037 7.584
533 HB3 TYR 70 1HB TYR 70 1.403 4.240 8.626
534 H GLY 71 H GLY 71 0.900 4.508 5.032
535 HA2 GLY 71 2HA GLY 71 0.242 7.151 3.972
536 HA3 GLY 71 1HA GLY 71 1.186 6.095 2.932
537 H PHE 72 H PHE 72 -1.340 7.070 2.202
538 HA PHE 72 HA PHE 72 -3.059 4.667 2.368
539 HD1 PHE 72 HD1 PHE 72 -2.844 8.297 4.078
540 HD2 PHE 72 HD2 PHE 72 -5.660 5.099 3.979
541 HE1 PHE 72 HE1 PHE 72 -3.154 8.492 6.512
542 HE2 PHE 72 HE2 PHE 72 -5.969 5.290 6.409
543 HZ PHE 72 HZ PHE 72 -4.716 6.990 7.679
544 HB2 PHE 72 2HB PHE 72 -3.860 7.561 1.980
545 HB3 PHE 72 1HB PHE 72 -4.971 6.198 1.945
546 H ILE 73 H ILE 73 -3.296 3.560 0.508
547 HA ILE 73 HA ILE 73 -2.740 4.945 -2.048
548 HB ILE 73 HB ILE 73 -2.613 1.979 -1.448
549 HG12 ILE 73 2HG1 ILE 73 -0.384 3.991 -1.902
550 HG13 ILE 73 1HG1 ILE 73 -0.814 3.274 -0.352
551 HG21 ILE 73 1HG2 ILE 73 -1.823 3.503 -3.938
552 HG22 ILE 73 2HG2 ILE 73 -3.231 2.453 -3.773
553 HG23 ILE 73 3HG2 ILE 73 -1.608 1.771 -3.671
554 HD11 ILE 73 3HD1 ILE 73 0.256 1.817 -2.759
555 HD12 ILE 73 1HD1 ILE 73 -0.222 1.061 -1.241
556 HD13 ILE 73 2HD1 ILE 73 1.133 2.190 -1.275
557 H THR 74 H THR 74 -4.260 5.040 -3.607
558 HA THR 74 HA THR 74 -6.887 3.794 -3.057
559 HB THR 74 HB THR 74 -6.304 6.253 -4.737
560 HG1 THR 74 HG1 THR 74 -7.756 7.017 -2.783
561 HG21 THR 74 3HG2 THR 74 -8.293 5.024 -5.504
562 HG22 THR 74 1HG2 THR 74 -8.737 6.562 -4.762
563 HG23 THR 74 2HG2 THR 74 -8.947 5.058 -3.865
564 H PHE 75 H PHE 75 -7.568 2.240 -4.386
565 HA PHE 75 HA PHE 75 -6.293 1.921 -7.039
566 HD1 PHE 75 HD2 PHE 75 -6.130 0.872 -3.563
567 HD2 PHE 75 HD1 PHE 75 -5.020 -1.445 -6.960
568 HE1 PHE 75 HE2 PHE 75 -4.055 0.210 -2.427
569 HE2 PHE 75 HE1 PHE 75 -2.940 -2.112 -5.822
570 HZ PHE 75 HZ PHE 75 -2.461 -1.284 -3.553
571 HB2 PHE 75 2HB PHE 75 -7.821 -0.106 -5.374
572 HB3 PHE 75 1HB PHE 75 -7.085 -0.422 -6.939
573 H SER 76 H SER 76 -7.552 1.485 -8.869
574 HA SER 76 HA SER 76 -10.082 2.794 -9.006
575 HG SER 76 HG SER 76 -8.518 3.420 -11.786
576 HB2 SER 76 2HB SER 76 -8.808 0.954 -11.052
577 HB3 SER 76 1HB SER 76 -10.106 2.112 -11.351
578 H ASP 77 H ASP 77 -9.269 -0.329 -8.008
579 HA ASP 77 HA ASP 77 -12.057 -1.208 -8.302
580 HB2 ASP 77 2HB ASP 77 -10.601 -2.212 -10.101
581 HB3 ASP 77 1HB ASP 77 -9.697 -3.030 -8.830
582 H SER 78 H SER 78 -12.887 -1.812 -6.421
583 HA SER 78 HA SER 78 -11.404 -1.837 -4.014
584 HG SER 78 HG SER 78 -14.259 -0.686 -4.876
585 HB2 SER 78 2HB SER 78 -14.212 -2.835 -4.558
586 HB3 SER 78 1HB SER 78 -13.519 -2.605 -2.953
587 H GLU 79 H GLU 79 -12.684 -4.485 -6.005
588 HA GLU 79 HA GLU 79 -12.143 -6.571 -4.172
589 HB2 GLU 79 2HB GLU 79 -12.548 -6.523 -7.162
590 HB3 GLU 79 1HB GLU 79 -12.233 -8.019 -6.296
591 HG2 GLU 79 2HG GLU 79 -14.624 -7.655 -6.712
592 HG3 GLU 79 1HG GLU 79 -14.245 -7.760 -4.998
593 H CYS 80 H CYS 80 -10.270 -5.357 -6.946
594 HA CYS 80 HA CYS 80 -8.055 -7.083 -6.641
595 HG CYS 80 HG CYS 80 -9.994 -5.869 -9.280
596 HB2 CYS 80 2HB CYS 80 -8.202 -4.313 -7.857
597 HB3 CYS 80 1HB CYS 80 -6.837 -5.410 -8.030
598 H ALA 81 H ALA 81 -8.758 -3.887 -5.265
599 HA ALA 81 HA ALA 81 -6.289 -3.476 -3.947
600 HB1 ALA 81 3HB ALA 81 -9.040 -2.460 -3.210
601 HB2 ALA 81 1HB ALA 81 -7.895 -1.678 -4.300
602 HB3 ALA 81 2HB ALA 81 -7.511 -1.838 -2.587
603 H LYS 82 H LYS 82 -9.300 -5.005 -2.888
604 HA LYS 82 HA LYS 82 -8.606 -5.518 -0.220
605 HB2 LYS 82 2HB LYS 82 -10.890 -5.689 -1.228
606 HB3 LYS 82 1HB LYS 82 -10.398 -7.186 -2.004
607 HG2 LYS 82 2HG LYS 82 -10.108 -8.257 0.140
608 HG3 LYS 82 1HG LYS 82 -10.441 -6.742 0.982
609 HD2 LYS 82 2HD LYS 82 -12.378 -8.258 -0.783
610 HD3 LYS 82 1HD LYS 82 -12.407 -8.206 0.982
611 HE2 LYS 82 2HE LYS 82 -12.839 -5.810 0.933
612 HE3 LYS 82 1HE LYS 82 -12.710 -5.798 -0.825
613 HZ1 LYS 82 3HZ LYS 82 -14.787 -7.210 0.763
614 HZ2 LYS 82 1HZ LYS 82 -14.649 -7.253 -0.923
615 HZ3 LYS 82 2HZ LYS 82 -15.005 -5.797 -0.143
616 H LYS 83 H LYS 83 -8.123 -7.473 -3.157
617 HA LYS 83 HA LYS 83 -6.846 -9.668 -1.908
618 HB2 LYS 83 2HB LYS 83 -7.707 -9.850 -4.168
619 HB3 LYS 83 1HB LYS 83 -6.606 -8.596 -4.729
620 HG2 LYS 83 2HG LYS 83 -4.699 -10.041 -4.295
621 HG3 LYS 83 1HG LYS 83 -5.766 -11.291 -3.651
622 HD2 LYS 83 2HD LYS 83 -6.858 -11.462 -5.855
623 HD3 LYS 83 1HD LYS 83 -5.762 -10.233 -6.485
624 HE2 LYS 83 2HE LYS 83 -3.855 -11.686 -6.057
625 HE3 LYS 83 1HE LYS 83 -4.923 -12.903 -5.359
626 HZ1 LYS 83 3HZ LYS 83 -4.949 -11.970 -8.175
627 HZ2 LYS 83 1HZ LYS 83 -6.025 -13.097 -7.512
628 HZ3 LYS 83 2HZ LYS 83 -4.375 -13.463 -7.622
629 H ALA 84 H ALA 84 -5.513 -6.724 -3.422
630 HA ALA 84 HA ALA 84 -2.798 -7.201 -3.086
631 HB1 ALA 84 3HB ALA 84 -4.211 -4.548 -2.774
632 HB2 ALA 84 1HB ALA 84 -3.721 -5.273 -4.307
633 HB3 ALA 84 2HB ALA 84 -2.499 -4.783 -3.131
634 H LEU 85 H LEU 85 -5.033 -5.634 -0.814
635 HA LEU 85 HA LEU 85 -3.338 -5.218 1.338
636 HG LEU 85 HG LEU 85 -4.616 -4.861 3.573
637 HB2 LEU 85 2HB LEU 85 -5.613 -4.347 1.196
638 HB3 LEU 85 1HB LEU 85 -6.272 -5.964 1.313
639 HD11 LEU 85 1HD1 LEU 85 -7.535 -4.302 3.058
640 HD12 LEU 85 2HD1 LEU 85 -6.227 -3.123 3.158
641 HD13 LEU 85 3HD1 LEU 85 -6.710 -4.025 4.592
642 HD21 LEU 85 3HD2 LEU 85 -6.085 -6.313 4.918
643 HD22 LEU 85 1HD2 LEU 85 -5.221 -7.224 3.681
644 HD23 LEU 85 2HD2 LEU 85 -6.923 -6.818 3.452
645 H GLU 86 H GLU 86 -5.428 -8.050 0.771
646 HA GLU 86 HA GLU 86 -4.668 -9.479 3.062
647 HB2 GLU 86 2HB GLU 86 -6.716 -9.921 1.781
648 HB3 GLU 86 1HB GLU 86 -5.750 -10.511 0.433
649 HG2 GLU 86 2HG GLU 86 -4.968 -12.374 1.759
650 HG3 GLU 86 1HG GLU 86 -5.815 -11.756 3.179
651 H GLN 87 H GLN 87 -3.238 -9.410 -0.170
652 HA GLN 87 HA GLN 87 -1.623 -11.771 0.261
653 HB2 GLN 87 2HB GLN 87 -2.532 -11.126 -1.967
654 HB3 GLN 87 1HB GLN 87 -1.497 -9.705 -1.955
655 HG2 GLN 87 2HG GLN 87 -0.529 -11.427 -3.335
656 HG3 GLN 87 1HG GLN 87 0.480 -11.163 -1.915
657 HE21 GLN 87 1HE2 GLN 87 -1.772 -13.325 -3.456
658 HE22 GLN 87 2HE2 GLN 87 -1.380 -14.721 -2.520
659 H LEU 88 H LEU 88 -1.239 -8.312 0.551
660 HA LEU 88 HA LEU 88 1.652 -8.607 0.964
661 HG LEU 88 HG LEU 88 0.084 -7.525 -1.503
662 HB2 LEU 88 2HB LEU 88 0.027 -6.101 0.538
663 HB3 LEU 88 1HB LEU 88 1.778 -6.195 0.622
664 HD11 LEU 88 1HD1 LEU 88 -0.000 -5.105 -1.704
665 HD12 LEU 88 2HD1 LEU 88 0.939 -5.817 -3.015
666 HD13 LEU 88 3HD1 LEU 88 1.762 -5.026 -1.670
667 HD21 LEU 88 3HD2 LEU 88 2.166 -8.722 -1.083
668 HD22 LEU 88 1HD2 LEU 88 3.082 -7.223 -1.262
669 HD23 LEU 88 2HD2 LEU 88 2.225 -7.906 -2.645
670 H ASN 89 H ASN 89 -1.126 -8.437 2.813
671 HA ASN 89 HA ASN 89 -0.301 -6.829 4.988
672 HB2 ASN 89 2HB ASN 89 -2.631 -7.645 4.655
673 HB3 ASN 89 1HB ASN 89 -2.095 -9.271 5.062
674 HD21 ASN 89 1HD2 ASN 89 -2.950 -6.170 6.254
675 HD22 ASN 89 2HD2 ASN 89 -2.849 -6.549 7.937
676 H GLY 90 H GLY 90 1.752 -7.176 5.729
677 HA2 GLY 90 2HA GLY 90 3.037 -8.304 7.425
678 HA3 GLY 90 1HA GLY 90 2.318 -9.823 6.916
679 H PHE 91 H PHE 91 3.029 -8.217 4.132
680 HA PHE 91 HA PHE 91 5.237 -9.878 3.465
681 HD1 PHE 91 HD2 PHE 91 5.127 -10.688 0.705
682 HD2 PHE 91 HD1 PHE 91 6.177 -6.570 1.024
683 HE1 PHE 91 HE2 PHE 91 6.825 -10.989 -1.045
684 HE2 PHE 91 HE1 PHE 91 7.879 -6.869 -0.731
685 HZ PHE 91 HZ PHE 91 8.205 -9.079 -1.763
686 HB2 PHE 91 2HB PHE 91 3.630 -9.032 1.792
687 HB3 PHE 91 1HB PHE 91 4.193 -7.392 2.075
688 H GLU 92 H GLU 92 7.369 -9.578 3.855
689 HA GLU 92 HA GLU 92 8.253 -7.158 5.167
690 HB2 GLU 92 2HB GLU 92 9.851 -9.584 4.315
691 HB3 GLU 92 1HB GLU 92 10.420 -8.295 5.370
692 HG2 GLU 92 2HG GLU 92 8.580 -8.885 6.959
693 HG3 GLU 92 1HG GLU 92 8.214 -10.273 5.937
694 H LEU 93 H LEU 93 8.149 -5.502 3.719
695 HA LEU 93 HA LEU 93 9.068 -5.759 1.006
696 HG LEU 93 HG LEU 93 9.430 -2.650 0.551
697 HB2 LEU 93 2HB LEU 93 7.146 -4.360 1.565
698 HB3 LEU 93 1HB LEU 93 8.155 -3.338 2.570
699 HD11 LEU 93 1HD1 LEU 93 8.504 -3.151 -1.672
700 HD12 LEU 93 2HD1 LEU 93 7.347 -4.256 -0.933
701 HD13 LEU 93 3HD1 LEU 93 9.074 -4.600 -0.846
702 HD21 LEU 93 3HD2 LEU 93 7.671 -1.225 -0.408
703 HD22 LEU 93 1HD2 LEU 93 7.609 -1.256 1.354
704 HD23 LEU 93 2HD2 LEU 93 6.445 -2.193 0.413
705 H ALA 94 H ALA 94 9.988 -3.308 3.410
706 HA ALA 94 HA ALA 94 12.630 -3.068 2.205
707 HB1 ALA 94 3HB ALA 94 11.387 -1.530 4.494
708 HB2 ALA 94 1HB ALA 94 11.365 -1.045 2.798
709 HB3 ALA 94 2HB ALA 94 12.895 -1.132 3.670
710 H GLY 95 H GLY 95 12.438 -5.570 3.291
711 HA2 GLY 95 2HA GLY 95 13.511 -7.024 4.717
712 HA3 GLY 95 1HA GLY 95 14.460 -5.665 5.301
713 H ARG 96 H ARG 96 11.163 -5.051 5.554
714 HA ARG 96 HA ARG 96 10.882 -6.184 8.238
715 HE ARG 96 HE ARG 96 10.564 -3.005 10.771
716 HB2 ARG 96 2HB ARG 96 10.610 -3.233 7.596
717 HB3 ARG 96 1HB ARG 96 10.032 -3.969 9.086
718 HG2 ARG 96 2HG ARG 96 12.321 -4.621 9.657
719 HG3 ARG 96 1HG ARG 96 12.906 -3.885 8.164
720 HD2 ARG 96 2HD ARG 96 13.267 -2.362 10.021
721 HD3 ARG 96 1HD ARG 96 12.045 -1.700 8.938
722 HH11 ARG 96 1HH1 ARG 96 13.134 -0.721 11.134
723 HH12 ARG 96 2HH1 ARG 96 12.473 -0.063 12.587
724 HH21 ARG 96 1HH2 ARG 96 9.726 -2.139 12.602
725 HH22 ARG 96 2HH2 ARG 96 10.535 -0.826 13.391
726 HA PRO 97 HA PRO 97 6.780 -7.216 6.918
727 HB2 PRO 97 2HB PRO 97 5.430 -6.622 9.308
728 HB3 PRO 97 1HB PRO 97 6.192 -8.161 8.896
729 HG2 PRO 97 2HG PRO 97 7.264 -5.886 10.523
730 HG3 PRO 97 1HG PRO 97 7.434 -7.634 10.784
731 HD2 PRO 97 2HD PRO 97 9.449 -6.210 9.789
732 HD3 PRO 97 1HD PRO 97 9.097 -7.833 9.154
733 H MET 98 H MET 98 5.233 -6.178 5.825
734 HA MET 98 HA MET 98 4.806 -3.309 6.314
735 HB2 MET 98 2HB MET 98 5.522 -3.844 4.069
736 HB3 MET 98 1HB MET 98 4.250 -5.043 3.898
737 HG2 MET 98 2HG MET 98 2.562 -3.342 3.872
738 HG3 MET 98 1HG MET 98 3.745 -2.096 4.270
739 HE1 MET 98 3HE MET 98 3.784 -4.397 0.262
740 HE2 MET 98 1HE MET 98 2.678 -4.768 1.584
741 HE3 MET 98 2HE MET 98 4.406 -5.075 1.767
742 H LYS 99 H LYS 99 3.010 -2.688 7.342
743 HA LYS 99 HA LYS 99 0.797 -4.553 7.678
744 HB2 LYS 99 2HB LYS 99 1.445 -1.878 8.913
745 HB3 LYS 99 1HB LYS 99 -0.123 -2.636 9.133
746 HG2 LYS 99 2HG LYS 99 1.162 -3.157 11.039
747 HG3 LYS 99 1HG LYS 99 1.062 -4.632 10.078
748 HD2 LYS 99 2HD LYS 99 3.322 -4.203 9.202
749 HD3 LYS 99 1HD LYS 99 3.412 -2.726 10.168
750 HE2 LYS 99 2HE LYS 99 3.175 -5.556 11.202
751 HE3 LYS 99 1HE LYS 99 4.590 -4.510 11.305
752 HZ1 LYS 99 3HZ LYS 99 3.245 -2.989 12.688
753 HZ2 LYS 99 1HZ LYS 99 3.456 -4.507 13.398
754 HZ3 LYS 99 2HZ LYS 99 1.983 -4.112 12.673
755 H VAL 100 H VAL 100 -0.517 -4.639 5.926
756 HA VAL 100 HA VAL 100 -1.565 -2.104 4.847
757 HB VAL 100 HB VAL 100 -1.995 -4.844 3.633
758 HG11 VAL 100 1HG1 VAL 100 -2.179 -2.053 2.481
759 HG12 VAL 100 2HG1 VAL 100 -3.540 -3.086 2.915
760 HG13 VAL 100 3HG1 VAL 100 -2.464 -3.554 1.599
761 HG21 VAL 100 3HG2 VAL 100 0.413 -4.458 3.747
762 HG22 VAL 100 1HG2 VAL 100 0.212 -2.872 3.002
763 HG23 VAL 100 2HG2 VAL 100 -0.153 -4.334 2.083
764 H GLY 101 H GLY 101 -3.320 -1.481 5.989
765 HA2 GLY 101 2HA GLY 101 -5.275 -3.547 6.817
766 HA3 GLY 101 1HA GLY 101 -4.955 -2.079 7.719
767 H HIS 102 H HIS 102 -7.519 -2.881 6.982
768 HA HIS 102 HA HIS 102 -8.465 -1.557 4.631
769 HD1 HIS 102 HD1 HIS 102 -11.315 -3.619 3.929
770 HD2 HIS 102 HD2 HIS 102 -8.282 -4.983 6.417
771 HE1 HIS 102 HE1 HIS 102 -10.876 -5.981 3.217
772 HE2 HIS 102 HE2 HIS 102 -9.165 -6.836 4.842
773 HB2 HIS 102 2HB HIS 102 -9.910 -2.589 7.082
774 HB3 HIS 102 1HB HIS 102 -10.728 -1.950 5.662
775 H VAL 103 H VAL 103 -6.962 0.084 6.725
776 HA VAL 103 HA VAL 103 -6.934 2.207 7.496
777 HB VAL 103 HB VAL 103 -9.570 2.539 6.037
778 HG11 VAL 103 1HG1 VAL 103 -9.148 4.953 6.194
779 HG12 VAL 103 2HG1 VAL 103 -7.716 4.641 7.174
780 HG13 VAL 103 3HG1 VAL 103 -9.315 4.222 7.791
781 HG21 VAL 103 3HG2 VAL 103 -7.723 1.961 4.540
782 HG22 VAL 103 1HG2 VAL 103 -6.759 3.279 5.205
783 HG23 VAL 103 2HG2 VAL 103 -8.228 3.632 4.296
784 H THR 104 H THR 104 -7.145 2.569 9.577
785 HA THR 104 HA THR 104 -8.955 1.522 11.370
786 HB THR 104 HB THR 104 -7.032 2.515 12.287
787 HG1 THR 104 HG1 THR 104 -8.205 3.155 13.915
788 HG21 THR 104 3HG2 THR 104 -6.519 4.083 10.483
789 HG22 THR 104 1HG2 THR 104 -6.452 4.888 12.051
790 HG23 THR 104 2HG2 THR 104 -7.847 5.126 11.001
791 H GLU 105 H GLU 105 -10.626 2.610 12.687
792 HA GLU 105 HA GLU 105 -12.839 3.334 11.204
793 HB2 GLU 105 2HB GLU 105 -12.229 4.052 14.077
794 HB3 GLU 105 1HB GLU 105 -13.820 4.154 13.334
795 HG2 GLU 105 2HG GLU 105 -13.768 1.723 12.942
796 HG3 GLU 105 1HG GLU 105 -12.200 1.645 13.747
797 H ARG 106 H ARG 106 -10.329 5.431 12.454
798 HA ARG 106 HA ARG 106 -11.313 7.656 10.886
799 HE ARG 106 HE ARG 106 -12.258 6.397 15.874
800 HB2 ARG 106 2HB ARG 106 -11.625 9.213 12.687
801 HB3 ARG 106 1HB ARG 106 -12.592 7.791 13.047
802 HG2 ARG 106 2HG ARG 106 -10.572 7.047 14.481
803 HG3 ARG 106 1HG ARG 106 -10.062 8.730 14.362
804 HD2 ARG 106 2HD ARG 106 -11.275 8.751 16.324
805 HD3 ARG 106 1HD ARG 106 -12.509 9.224 15.155
806 HH11 ARG 106 1HH1 ARG 106 -14.072 9.325 16.001
807 HH12 ARG 106 2HH1 ARG 106 -15.484 8.541 16.616
808 HH21 ARG 106 1HH2 ARG 106 -14.058 5.418 16.675
809 HH22 ARG 106 2HH2 ARG 106 -15.478 6.351 16.983
810 H THR 107 H THR 107 -9.051 6.719 13.454
811 HA THR 107 HA THR 107 -6.671 7.077 12.056
812 HB THR 107 HB THR 107 -7.209 9.494 12.019
813 HG1 THR 107 HG1 THR 107 -5.192 10.098 12.602
814 HG21 THR 107 3HG2 THR 107 -7.234 10.785 14.128
815 HG22 THR 107 1HG2 THR 107 -7.189 9.275 15.037
816 HG23 THR 107 2HG2 THR 107 -8.584 9.653 14.023
817 H ASP 108 H ASP 108 -8.064 5.479 14.105
818 HA ASP 108 HA ASP 108 -6.559 6.008 16.575
819 HB2 ASP 108 2HB ASP 108 -9.102 6.106 16.531
820 HB3 ASP 108 1HB ASP 108 -9.081 4.363 16.293
Start of MODEL 20
1 HA MET 1 HA MET 1 13.951 25.654 -0.347
2 H1 MET 1 1H MET 1 11.957 24.648 0.581
3 H2 MET 1 2H MET 1 10.988 25.663 -0.359
4 H3 MET 1 3H MET 1 11.991 26.319 0.834
5 HB2 MET 1 2HB MET 1 11.985 24.513 -2.348
6 HB3 MET 1 1HB MET 1 13.701 24.722 -2.668
7 HG2 MET 1 2HG MET 1 14.236 23.182 -0.850
8 HG3 MET 1 1HG MET 1 12.516 22.981 -0.510
9 HE1 MET 1 3HE MET 1 13.579 19.533 -2.082
10 HE2 MET 1 1HE MET 1 12.816 20.320 -0.701
11 HE3 MET 1 2HE MET 1 14.532 20.570 -1.020
12 H GLY 2 H GLY 2 14.487 27.748 -0.550
13 HA2 GLY 2 2HA GLY 2 14.689 29.859 -1.429
14 HA3 GLY 2 1HA GLY 2 14.205 29.130 -2.949
15 H HIS 3 H HIS 3 13.164 31.092 -3.488
16 HA HIS 3 HA HIS 3 10.388 31.138 -2.560
17 HD1 HIS 3 HD1 HIS 3 13.733 33.181 -0.880
18 HD2 HIS 3 HD2 HIS 3 9.768 32.690 0.271
19 HE1 HIS 3 HE1 HIS 3 13.781 32.951 1.619
20 HE2 HIS 3 HE2 HIS 3 11.394 32.508 2.274
21 HB2 HIS 3 2HB HIS 3 12.051 33.675 -2.751
22 HB3 HIS 3 1HB HIS 3 10.338 33.583 -2.357
23 H HIS 4 H HIS 4 11.809 33.695 -4.496
24 HA HIS 4 HA HIS 4 11.697 34.274 -6.693
25 HD1 HIS 4 HD1 HIS 4 11.349 31.324 -9.592
26 HD2 HIS 4 HD2 HIS 4 14.266 34.132 -8.672
27 HE1 HIS 4 HE1 HIS 4 12.213 32.139 -11.801
28 HE2 HIS 4 HE2 HIS 4 13.846 33.957 -11.216
29 HB2 HIS 4 2HB HIS 4 13.341 32.381 -6.644
30 HB3 HIS 4 1HB HIS 4 12.043 31.299 -7.129
31 H HIS 5 H HIS 5 9.048 33.332 -5.428
32 HA HIS 5 HA HIS 5 6.886 32.893 -6.010
33 HD1 HIS 5 HD1 HIS 5 5.065 35.536 -7.062
34 HD2 HIS 5 HD2 HIS 5 9.168 35.971 -7.530
35 HE1 HIS 5 HE1 HIS 5 5.566 37.903 -6.409
36 HE2 HIS 5 HE2 HIS 5 8.014 38.194 -6.897
37 HB2 HIS 5 2HB HIS 5 7.788 33.769 -8.771
38 HB3 HIS 5 1HB HIS 5 6.115 33.590 -8.257
39 H HIS 6 H HIS 6 6.358 30.768 -5.875
40 HA HIS 6 HA HIS 6 7.717 28.750 -7.327
41 HD1 HIS 6 HD1 HIS 6 6.251 29.536 -3.521
42 HD2 HIS 6 HD2 HIS 6 8.527 26.564 -5.323
43 HE1 HIS 6 HE1 HIS 6 8.069 28.999 -1.881
44 HE2 HIS 6 HE2 HIS 6 9.356 27.114 -2.935
45 HB2 HIS 6 2HB HIS 6 5.200 28.658 -5.660
46 HB3 HIS 6 1HB HIS 6 5.931 27.226 -6.386
47 H HIS 7 H HIS 7 4.847 30.595 -8.070
48 HA HIS 7 HA HIS 7 3.885 30.963 -10.103
49 HD1 HIS 7 HD1 HIS 7 5.687 28.386 -13.273
50 HD2 HIS 7 HD2 HIS 7 4.342 32.294 -12.847
51 HE1 HIS 7 HE1 HIS 7 4.845 29.057 -15.539
52 HE2 HIS 7 HE2 HIS 7 4.251 31.486 -15.302
53 HB2 HIS 7 2HB HIS 7 6.174 31.070 -10.900
54 HB3 HIS 7 1HB HIS 7 6.245 29.321 -11.050
55 H HIS 8 H HIS 8 3.707 28.031 -8.667
56 HA HIS 8 HA HIS 8 2.565 26.563 -10.914
57 HD1 HIS 8 HD1 HIS 8 3.060 23.394 -10.957
58 HD2 HIS 8 HD2 HIS 8 6.023 25.775 -9.282
59 HE1 HIS 8 HE1 HIS 8 5.208 22.585 -11.953
60 HE2 HIS 8 HE2 HIS 8 6.961 24.146 -11.061
61 HB2 HIS 8 2HB HIS 8 3.427 25.814 -8.154
62 HB3 HIS 8 1HB HIS 8 2.249 24.792 -8.972
63 H SER 9 H SER 9 0.517 26.795 -11.436
64 HA SER 9 HA SER 9 -1.527 26.926 -9.298
65 HG SER 9 HG SER 9 -1.925 29.322 -9.928
66 HB2 SER 9 2HB SER 9 -1.776 27.667 -12.236
67 HB3 SER 9 1HB SER 9 -3.087 27.731 -11.057
68 H HIS 10 H HIS 10 -2.628 25.060 -8.937
69 HA HIS 10 HA HIS 10 -1.872 22.705 -10.237
70 HD1 HIS 10 HD1 HIS 10 -3.935 24.504 -6.733
71 HD2 HIS 10 HD2 HIS 10 -6.298 22.415 -9.440
72 HE1 HIS 10 HE1 HIS 10 -6.288 25.215 -6.255
73 HE2 HIS 10 HE2 HIS 10 -7.708 23.782 -7.754
74 HB2 HIS 10 2HB HIS 10 -3.595 21.569 -8.920
75 HB3 HIS 10 1HB HIS 10 -2.665 22.694 -7.944
76 H MET 11 H MET 11 -4.341 24.935 -11.151
77 HA MET 11 HA MET 11 -5.719 25.041 -12.956
78 HB2 MET 11 2HB MET 11 -3.652 24.561 -14.187
79 HB3 MET 11 1HB MET 11 -3.926 22.835 -14.007
80 HG2 MET 11 2HG MET 11 -4.524 23.586 -16.235
81 HG3 MET 11 1HG MET 11 -5.947 23.004 -15.369
82 HE1 MET 11 3HE MET 11 -7.438 25.871 -17.583
83 HE2 MET 11 1HE MET 11 -7.527 24.164 -17.153
84 HE3 MET 11 2HE MET 11 -6.131 24.778 -18.041
85 H ALA 12 H ALA 12 -7.699 24.421 -12.197
86 HA ALA 12 HA ALA 12 -8.521 21.650 -12.738
87 HB1 ALA 12 3HB ALA 12 -9.017 23.043 -10.109
88 HB2 ALA 12 1HB ALA 12 -7.905 21.701 -10.382
89 HB3 ALA 12 2HB ALA 12 -9.642 21.459 -10.574
90 H ALA 13 H ALA 13 -9.350 25.018 -12.488
91 HA ALA 13 HA ALA 13 -12.101 24.985 -12.232
92 HB1 ALA 13 3HB ALA 13 -10.473 26.911 -13.884
93 HB2 ALA 13 1HB ALA 13 -10.737 27.011 -12.143
94 HB3 ALA 13 2HB ALA 13 -12.096 27.192 -13.253
95 H ALA 14 H ALA 14 -13.374 23.615 -13.358
96 HA ALA 14 HA ALA 14 -14.103 24.224 -16.026
97 HB1 ALA 14 3HB ALA 14 -12.022 23.051 -16.574
98 HB2 ALA 14 1HB ALA 14 -13.432 22.173 -17.168
99 HB3 ALA 14 2HB ALA 14 -12.597 21.623 -15.714
100 H MET 15 H MET 15 -14.827 23.041 -13.104
101 HA MET 15 HA MET 15 -16.540 21.936 -12.140
102 HB2 MET 15 2HB MET 15 -17.782 22.155 -14.887
103 HB3 MET 15 1HB MET 15 -18.639 21.597 -13.455
104 HG2 MET 15 2HG MET 15 -18.340 23.740 -12.385
105 HG3 MET 15 1HG MET 15 -17.358 24.312 -13.733
106 HE1 MET 15 3HE MET 15 -20.717 26.387 -13.968
107 HE2 MET 15 1HE MET 15 -18.967 26.491 -13.791
108 HE3 MET 15 2HE MET 15 -19.947 25.815 -12.491
109 H ALA 16 H ALA 16 -16.680 20.442 -15.365
110 HA ALA 16 HA ALA 16 -16.535 18.283 -16.068
111 HB1 ALA 16 3HB ALA 16 -14.179 18.769 -15.652
112 HB2 ALA 16 1HB ALA 16 -14.544 17.070 -15.349
113 HB3 ALA 16 2HB ALA 16 -14.343 18.185 -13.996
114 H ASN 17 H ASN 17 -18.604 17.591 -15.328
115 HA ASN 17 HA ASN 17 -18.688 16.110 -12.790
116 HB2 ASN 17 2HB ASN 17 -20.966 16.779 -14.673
117 HB3 ASN 17 1HB ASN 17 -21.110 16.119 -13.047
118 HD21 ASN 17 1HD2 ASN 17 -20.461 18.950 -14.940
119 HD22 ASN 17 2HD2 ASN 17 -20.564 20.079 -13.638
120 H ASN 18 H ASN 18 -17.989 15.482 -15.957
121 HA ASN 18 HA ASN 18 -19.181 12.777 -15.923
122 HB2 ASN 18 2HB ASN 18 -18.234 14.370 -18.322
123 HB3 ASN 18 1HB ASN 18 -19.059 12.813 -18.353
124 HD21 ASN 18 1HD2 ASN 18 -21.255 12.733 -17.933
125 HD22 ASN 18 2HD2 ASN 18 -22.252 14.145 -17.951
126 H LEU 19 H LEU 19 -17.800 11.145 -15.613
127 HA LEU 19 HA LEU 19 -15.136 11.243 -16.843
128 HG LEU 19 HG LEU 19 -13.810 9.095 -14.949
129 HB2 LEU 19 2HB LEU 19 -14.837 11.907 -14.488
130 HB3 LEU 19 1HB LEU 19 -15.643 10.439 -13.967
131 HD11 LEU 19 1HD1 LEU 19 -11.755 10.171 -15.692
132 HD12 LEU 19 2HD1 LEU 19 -12.492 11.760 -15.482
133 HD13 LEU 19 3HD1 LEU 19 -13.116 10.652 -16.704
134 HD21 LEU 19 3HD2 LEU 19 -13.734 9.721 -12.586
135 HD22 LEU 19 1HD2 LEU 19 -12.881 11.211 -13.000
136 HD23 LEU 19 2HD2 LEU 19 -12.114 9.647 -13.276
137 H GLN 20 H GLN 20 -17.158 9.150 -14.814
138 HA GLN 20 HA GLN 20 -17.565 7.258 -16.944
139 HB2 GLN 20 2HB GLN 20 -15.377 6.488 -16.113
140 HB3 GLN 20 1HB GLN 20 -16.022 6.384 -14.480
141 HG2 GLN 20 2HG GLN 20 -17.560 4.627 -15.184
142 HG3 GLN 20 1HG GLN 20 -16.961 4.749 -16.836
143 HE21 GLN 20 1HE2 GLN 20 -16.961 2.466 -15.010
144 HE22 GLN 20 2HE2 GLN 20 -15.312 1.969 -14.883
145 H LYS 21 H LYS 21 -19.738 7.480 -16.710
146 HA LYS 21 HA LYS 21 -21.209 7.937 -14.439
147 HB2 LYS 21 2HB LYS 21 -23.152 6.960 -15.701
148 HB3 LYS 21 1HB LYS 21 -22.229 8.166 -16.586
149 HG2 LYS 21 2HG LYS 21 -21.036 6.339 -17.755
150 HG3 LYS 21 1HG LYS 21 -22.076 5.177 -16.933
151 HD2 LYS 21 2HD LYS 21 -24.045 6.175 -17.994
152 HD3 LYS 21 1HD LYS 21 -23.016 7.371 -18.787
153 HE2 LYS 21 2HE LYS 21 -22.930 4.377 -19.211
154 HE3 LYS 21 1HE LYS 21 -23.576 5.573 -20.336
155 HZ1 LYS 21 3HZ LYS 21 -21.390 6.507 -20.598
156 HZ2 LYS 21 1HZ LYS 21 -21.310 4.847 -20.906
157 HZ3 LYS 21 2HZ LYS 21 -20.741 5.461 -19.439
158 H GLY 22 H GLY 22 -21.172 6.856 -12.591
159 HA2 GLY 22 2HA GLY 22 -22.228 4.902 -11.488
160 HA3 GLY 22 1HA GLY 22 -21.392 3.899 -12.662
161 H SER 23 H SER 23 -18.973 5.693 -12.386
162 HA SER 23 HA SER 23 -16.943 5.509 -11.397
163 HG SER 23 HG SER 23 -19.115 4.822 -8.753
164 HB2 SER 23 2HB SER 23 -16.852 5.944 -8.948
165 HB3 SER 23 1HB SER 23 -17.869 7.085 -9.820
166 H ALA 24 H ALA 24 -15.749 3.755 -11.511
167 HA ALA 24 HA ALA 24 -16.558 1.172 -11.402
168 HB1 ALA 24 3HB ALA 24 -14.429 1.901 -12.336
169 HB2 ALA 24 1HB ALA 24 -14.213 0.526 -11.253
170 HB3 ALA 24 2HB ALA 24 -13.793 2.152 -10.711
171 H GLY 25 H GLY 25 -14.830 2.732 -8.692
172 HA2 GLY 25 2HA GLY 25 -16.152 2.194 -6.513
173 HA3 GLY 25 1HA GLY 25 -15.712 0.543 -6.926
174 HA PRO 26 HA PRO 26 -11.547 2.840 -5.987
175 HB2 PRO 26 2HB PRO 26 -11.704 5.223 -4.679
176 HB3 PRO 26 1HB PRO 26 -11.711 5.090 -6.440
177 HG2 PRO 26 2HG PRO 26 -14.023 5.430 -4.559
178 HG3 PRO 26 1HG PRO 26 -13.712 6.244 -6.104
179 HD2 PRO 26 2HD PRO 26 -15.430 4.158 -5.881
180 HD3 PRO 26 1HD PRO 26 -14.476 4.451 -7.352
181 H MET 27 H MET 27 -10.662 1.705 -4.373
182 HA MET 27 HA MET 27 -11.686 2.102 -1.625
183 HB2 MET 27 2HB MET 27 -12.179 -0.169 -2.530
184 HB3 MET 27 1HB MET 27 -10.451 -0.435 -2.729
185 HG2 MET 27 2HG MET 27 -11.355 -1.482 -0.695
186 HG3 MET 27 1HG MET 27 -10.113 -0.280 -0.342
187 HE1 MET 27 3HE MET 27 -12.561 0.058 2.715
188 HE2 MET 27 1HE MET 27 -10.896 -0.242 2.212
189 HE3 MET 27 2HE MET 27 -12.155 -1.428 1.861
190 H ARG 28 H ARG 28 -10.178 2.439 -0.003
191 HA ARG 28 HA ARG 28 -7.448 3.002 -0.981
192 HE ARG 28 HE ARG 28 -7.718 6.833 -1.043
193 HB2 ARG 28 2HB ARG 28 -8.847 4.960 -0.331
194 HB3 ARG 28 1HB ARG 28 -8.923 4.327 1.306
195 HG2 ARG 28 2HG ARG 28 -6.597 4.685 1.647
196 HG3 ARG 28 1HG ARG 28 -6.330 5.019 -0.067
197 HD2 ARG 28 2HD ARG 28 -7.974 6.705 1.835
198 HD3 ARG 28 1HD ARG 28 -6.351 7.087 1.254
199 HH11 ARG 28 1HH1 ARG 28 -8.391 8.623 1.831
200 HH12 ARG 28 2HH1 ARG 28 -9.271 9.849 0.982
201 HH21 ARG 28 1HH2 ARG 28 -8.854 8.420 -2.113
202 HH22 ARG 28 2HH2 ARG 28 -9.541 9.725 -1.212
203 H LEU 29 H LEU 29 -5.701 2.176 0.058
204 HA LEU 29 HA LEU 29 -6.191 0.442 2.395
205 HG LEU 29 HG LEU 29 -6.050 -0.638 -0.600
206 HB2 LEU 29 2HB LEU 29 -4.006 0.313 0.313
207 HB3 LEU 29 1HB LEU 29 -4.106 -0.733 1.716
208 HD11 LEU 29 1HD1 LEU 29 -3.963 -1.765 -1.129
209 HD12 LEU 29 2HD1 LEU 29 -5.276 -2.934 -0.997
210 HD13 LEU 29 3HD1 LEU 29 -4.111 -2.765 0.317
211 HD21 LEU 29 3HD2 LEU 29 -7.267 -1.056 1.469
212 HD22 LEU 29 1HD2 LEU 29 -6.128 -2.333 1.904
213 HD23 LEU 29 2HD2 LEU 29 -7.175 -2.526 0.498
214 H TYR 30 H TYR 30 -5.110 0.742 4.233
215 HA TYR 30 HA TYR 30 -3.201 2.923 4.515
216 HD1 TYR 30 HD2 TYR 30 -2.696 4.250 7.023
217 HD2 TYR 30 HD1 TYR 30 -3.258 0.145 8.029
218 HE1 TYR 30 HE2 TYR 30 -1.072 4.477 8.857
219 HE2 TYR 30 HE1 TYR 30 -1.638 0.365 9.864
220 HH TYR 30 HH TYR 30 -0.593 3.311 11.059
221 HB2 TYR 30 2HB TYR 30 -4.764 2.880 6.285
222 HB3 TYR 30 1HB TYR 30 -4.679 1.131 6.441
223 H VAL 31 H VAL 31 -1.153 2.460 3.950
224 HA VAL 31 HA VAL 31 -0.011 -0.156 4.726
225 HB VAL 31 HB VAL 31 1.010 1.792 2.639
226 HG11 VAL 31 1HG1 VAL 31 2.798 0.454 3.632
227 HG12 VAL 31 2HG1 VAL 31 2.501 -0.042 1.967
228 HG13 VAL 31 3HG1 VAL 31 1.894 -1.024 3.300
229 HG21 VAL 31 3HG2 VAL 31 0.229 0.149 0.987
230 HG22 VAL 31 1HG2 VAL 31 -1.105 0.798 1.940
231 HG23 VAL 31 2HG2 VAL 31 -0.480 -0.816 2.281
232 H GLY 32 H GLY 32 0.850 0.147 6.743
233 HA2 GLY 32 2HA GLY 32 2.599 2.511 7.140
234 HA3 GLY 32 1HA GLY 32 1.713 1.718 8.428
235 H SER 33 H SER 33 4.475 1.537 6.300
236 HA SER 33 HA SER 33 6.073 0.252 8.297
237 HG SER 33 HG SER 33 6.641 -2.783 7.700
238 HB2 SER 33 2HB SER 33 4.872 -1.725 7.348
239 HB3 SER 33 1HB SER 33 5.552 -1.342 5.769
240 H LEU 34 H LEU 34 5.943 2.591 6.408
241 HA LEU 34 HA LEU 34 8.153 2.183 4.561
242 HG LEU 34 HG LEU 34 4.931 3.265 4.584
243 HB2 LEU 34 2HB LEU 34 6.735 4.783 5.147
244 HB3 LEU 34 1HB LEU 34 7.616 4.338 3.696
245 HD11 LEU 34 1HD1 LEU 34 4.091 4.336 2.566
246 HD12 LEU 34 2HD1 LEU 34 5.707 4.938 2.196
247 HD13 LEU 34 3HD1 LEU 34 4.859 5.511 3.633
248 HD21 LEU 34 3HD2 LEU 34 6.611 2.477 2.201
249 HD22 LEU 34 1HD2 LEU 34 4.927 2.019 2.452
250 HD23 LEU 34 2HD2 LEU 34 6.169 1.456 3.568
251 H HIS 35 H HIS 35 10.108 2.068 5.648
252 HA HIS 35 HA HIS 35 10.608 3.545 8.027
253 HD1 HIS 35 HD1 HIS 35 14.734 3.098 6.594
254 HD2 HIS 35 HD2 HIS 35 11.889 0.781 4.653
255 HE1 HIS 35 HE1 HIS 35 15.801 2.404 4.436
256 HE2 HIS 35 HE2 HIS 35 14.153 0.815 3.395
257 HB2 HIS 35 2HB HIS 35 12.778 2.538 8.068
258 HB3 HIS 35 1HB HIS 35 11.644 1.330 7.487
259 H PHE 36 H PHE 36 10.031 5.673 7.129
260 HA PHE 36 HA PHE 36 10.595 7.818 6.645
261 HD1 PHE 36 HD1 PHE 36 11.083 9.398 9.046
262 HD2 PHE 36 HD2 PHE 36 12.619 5.433 9.367
263 HE1 PHE 36 HE1 PHE 36 10.193 9.237 11.335
264 HE2 PHE 36 HE2 PHE 36 11.732 5.273 11.654
265 HZ PHE 36 HZ PHE 36 10.518 7.176 12.642
266 HB2 PHE 36 2HB PHE 36 13.314 6.865 7.568
267 HB3 PHE 36 1HB PHE 36 12.790 8.545 7.484
268 H ASN 37 H ASN 37 11.211 5.753 4.373
269 HA ASN 37 HA ASN 37 12.772 7.607 2.723
270 HB2 ASN 37 2HB ASN 37 14.252 5.807 3.842
271 HB3 ASN 37 1HB ASN 37 13.488 4.673 2.741
272 HD21 ASN 37 1HD2 ASN 37 13.384 6.748 0.569
273 HD22 ASN 37 2HD2 ASN 37 15.000 6.840 -0.012
274 H ILE 38 H ILE 38 10.878 4.610 2.806
275 HA ILE 38 HA ILE 38 10.681 4.018 0.133
276 HB ILE 38 HB ILE 38 8.418 3.701 2.117
277 HG12 ILE 38 2HG1 ILE 38 10.515 2.777 3.016
278 HG13 ILE 38 1HG1 ILE 38 9.384 1.492 2.615
279 HG21 ILE 38 1HG2 ILE 38 9.070 2.203 -0.427
280 HG22 ILE 38 2HG2 ILE 38 7.700 3.283 -0.159
281 HG23 ILE 38 3HG2 ILE 38 7.803 1.756 0.716
282 HD11 ILE 38 3HD1 ILE 38 11.653 0.917 1.978
283 HD12 ILE 38 1HD1 ILE 38 11.745 2.346 0.950
284 HD13 ILE 38 2HD1 ILE 38 10.618 1.047 0.557
285 H THR 39 H THR 39 9.638 4.790 -1.619
286 HA THR 39 HA THR 39 8.148 7.304 -1.327
287 HB THR 39 HB THR 39 8.535 7.657 -3.703
288 HG1 THR 39 HG1 THR 39 10.122 5.882 -4.577
289 HG21 THR 39 3HG2 THR 39 11.061 6.723 -2.330
290 HG22 THR 39 1HG2 THR 39 10.331 8.320 -2.173
291 HG23 THR 39 2HG2 THR 39 10.980 7.796 -3.726
292 H GLU 40 H GLU 40 6.401 7.681 -2.976
293 HA GLU 40 HA GLU 40 4.319 5.799 -2.777
294 HB2 GLU 40 2HB GLU 40 4.461 7.846 -4.992
295 HB3 GLU 40 1HB GLU 40 3.039 7.219 -4.178
296 HG2 GLU 40 2HG GLU 40 3.198 9.344 -3.314
297 HG3 GLU 40 1HG GLU 40 4.018 8.392 -2.079
298 H ASP 41 H ASP 41 6.728 6.410 -5.273
299 HA ASP 41 HA ASP 41 5.596 4.876 -7.348
300 HB2 ASP 41 2HB ASP 41 8.480 5.652 -6.847
301 HB3 ASP 41 1HB ASP 41 7.862 4.990 -8.361
302 H MET 42 H MET 42 7.875 3.974 -4.763
303 HA MET 42 HA MET 42 8.457 1.371 -5.720
304 HB2 MET 42 2HB MET 42 9.761 2.466 -3.937
305 HB3 MET 42 1HB MET 42 8.374 2.378 -2.861
306 HG2 MET 42 2HG MET 42 8.476 -0.058 -2.912
307 HG3 MET 42 1HG MET 42 9.849 0.016 -4.017
308 HE1 MET 42 3HE MET 42 11.224 -1.571 -2.385
309 HE2 MET 42 1HE MET 42 9.860 -1.633 -1.270
310 HE3 MET 42 2HE MET 42 11.472 -1.238 -0.671
311 H LEU 43 H LEU 43 6.081 2.495 -3.331
312 HA LEU 43 HA LEU 43 4.738 0.107 -2.857
313 HG LEU 43 HG LEU 43 5.527 2.549 -1.308
314 HB2 LEU 43 2HB LEU 43 3.635 2.921 -2.952
315 HB3 LEU 43 1HB LEU 43 2.823 1.547 -2.218
316 HD11 LEU 43 1HD1 LEU 43 4.332 3.585 0.577
317 HD12 LEU 43 2HD1 LEU 43 2.795 3.209 -0.206
318 HD13 LEU 43 3HD1 LEU 43 3.927 4.328 -0.971
319 HD21 LEU 43 3HD2 LEU 43 5.009 1.238 0.703
320 HD22 LEU 43 1HD2 LEU 43 5.064 0.233 -0.743
321 HD23 LEU 43 2HD2 LEU 43 3.509 0.687 -0.043
322 H ARG 44 H ARG 44 3.845 2.644 -5.223
323 HA ARG 44 HA ARG 44 1.771 1.355 -6.511
324 HE ARG 44 HE ARG 44 3.974 4.645 -9.516
325 HB2 ARG 44 2HB ARG 44 2.313 3.674 -6.961
326 HB3 ARG 44 1HB ARG 44 3.861 3.224 -7.658
327 HG2 ARG 44 2HG ARG 44 2.847 2.311 -9.584
328 HG3 ARG 44 1HG ARG 44 1.249 2.304 -8.836
329 HD2 ARG 44 2HD ARG 44 1.540 4.119 -10.497
330 HD3 ARG 44 1HD ARG 44 1.151 4.708 -8.882
331 HH11 ARG 44 1HH1 ARG 44 1.065 6.499 -9.528
332 HH12 ARG 44 2HH1 ARG 44 1.899 8.011 -9.576
333 HH21 ARG 44 1HH2 ARG 44 5.041 6.624 -9.574
334 HH22 ARG 44 2HH2 ARG 44 4.111 8.080 -9.584
335 H GLY 45 H GLY 45 5.264 1.010 -7.103
336 HA2 GLY 45 2HA GLY 45 5.157 -0.657 -9.353
337 HA3 GLY 45 1HA GLY 45 6.462 -0.630 -8.179
338 H ILE 46 H ILE 46 4.827 -1.469 -5.929
339 HA ILE 46 HA ILE 46 4.795 -4.329 -6.456
340 HB ILE 46 HB ILE 46 4.164 -2.828 -3.902
341 HG12 ILE 46 2HG1 ILE 46 6.721 -4.211 -4.775
342 HG13 ILE 46 1HG1 ILE 46 6.483 -2.470 -4.690
343 HG21 ILE 46 1HG2 ILE 46 4.521 -4.987 -2.780
344 HG22 ILE 46 2HG2 ILE 46 4.728 -5.766 -4.350
345 HG23 ILE 46 3HG2 ILE 46 3.173 -5.056 -3.915
346 HD11 ILE 46 3HD1 ILE 46 7.730 -3.264 -2.779
347 HD12 ILE 46 1HD1 ILE 46 6.429 -4.382 -2.367
348 HD13 ILE 46 2HD1 ILE 46 6.159 -2.642 -2.272
349 H PHE 47 H PHE 47 2.408 -1.841 -5.591
350 HA PHE 47 HA PHE 47 0.276 -3.755 -5.242
351 HD1 PHE 47 HD2 PHE 47 2.323 -1.438 -3.470
352 HD2 PHE 47 HD1 PHE 47 -1.783 -2.370 -2.837
353 HE1 PHE 47 HE2 PHE 47 2.767 -1.736 -1.073
354 HE2 PHE 47 HE1 PHE 47 -1.345 -2.671 -0.435
355 HZ PHE 47 HZ PHE 47 0.933 -2.353 0.450
356 HB2 PHE 47 2HB PHE 47 0.408 -0.745 -5.099
357 HB3 PHE 47 1HB PHE 47 -1.109 -1.622 -4.936
358 H GLU 48 H GLU 48 1.266 -1.583 -7.845
359 HA GLU 48 HA GLU 48 -1.114 -1.368 -9.272
360 HB2 GLU 48 2HB GLU 48 0.924 -0.082 -9.785
361 HB3 GLU 48 1HB GLU 48 1.687 -1.534 -10.411
362 HG2 GLU 48 2HG GLU 48 0.946 -0.192 -12.250
363 HG3 GLU 48 1HG GLU 48 -0.052 -1.638 -12.176
364 HA PRO 49 HA PRO 49 0.247 -5.548 -11.671
365 HB2 PRO 49 2HB PRO 49 1.359 -6.821 -9.198
366 HB3 PRO 49 1HB PRO 49 1.804 -7.075 -10.891
367 HG2 PRO 49 2HG PRO 49 3.351 -5.598 -9.328
368 HG3 PRO 49 1HG PRO 49 3.028 -5.089 -10.997
369 HD2 PRO 49 2HD PRO 49 1.881 -4.040 -8.439
370 HD3 PRO 49 1HD PRO 49 2.336 -3.164 -9.914
371 H PHE 50 H PHE 50 -1.099 -5.070 -8.471
372 HA PHE 50 HA PHE 50 -2.729 -7.466 -8.555
373 HD1 PHE 50 HD2 PHE 50 -3.161 -8.670 -5.915
374 HD2 PHE 50 HD1 PHE 50 -0.319 -5.501 -6.043
375 HE1 PHE 50 HE2 PHE 50 -1.587 -10.033 -4.612
376 HE2 PHE 50 HE1 PHE 50 1.261 -6.864 -4.740
377 HZ PHE 50 HZ PHE 50 0.626 -9.132 -4.017
378 HB2 PHE 50 2HB PHE 50 -2.617 -5.118 -6.660
379 HB3 PHE 50 1HB PHE 50 -3.824 -6.390 -6.508
380 H GLY 51 H GLY 51 -3.109 -4.094 -9.401
381 HA2 GLY 51 2HA GLY 51 -5.466 -4.629 -10.935
382 HA3 GLY 51 1HA GLY 51 -5.861 -3.771 -9.450
383 H ARG 52 H ARG 52 -5.542 -1.592 -9.357
384 HA ARG 52 HA ARG 52 -3.511 -0.268 -10.859
385 HE ARG 52 HE ARG 52 -6.028 4.059 -12.780
386 HB2 ARG 52 2HB ARG 52 -5.052 -0.407 -12.694
387 HB3 ARG 52 1HB ARG 52 -6.384 0.160 -11.692
388 HG2 ARG 52 2HG ARG 52 -5.280 2.348 -11.479
389 HG3 ARG 52 1HG ARG 52 -3.956 1.771 -12.496
390 HD2 ARG 52 2HD ARG 52 -5.264 1.761 -14.410
391 HD3 ARG 52 1HD ARG 52 -6.776 1.652 -13.510
392 HH11 ARG 52 1HH1 ARG 52 -5.758 2.661 -15.922
393 HH12 ARG 52 2HH1 ARG 52 -5.982 4.172 -16.726
394 HH21 ARG 52 1HH2 ARG 52 -6.324 5.977 -13.824
395 HH22 ARG 52 2HH2 ARG 52 -6.286 6.035 -15.552
396 H ILE 53 H ILE 53 -2.923 1.613 -9.933
397 HA ILE 53 HA ILE 53 -4.513 2.549 -7.643
398 HB ILE 53 HB ILE 53 -1.671 3.192 -8.471
399 HG12 ILE 53 2HG1 ILE 53 -1.225 2.141 -6.156
400 HG13 ILE 53 1HG1 ILE 53 -2.869 1.520 -6.252
401 HG21 ILE 53 1HG2 ILE 53 -2.707 5.167 -7.475
402 HG22 ILE 53 2HG2 ILE 53 -1.489 4.482 -6.403
403 HG23 ILE 53 3HG2 ILE 53 -3.200 4.215 -6.072
404 HD11 ILE 53 3HD1 ILE 53 -2.272 0.325 -8.304
405 HD12 ILE 53 1HD1 ILE 53 -1.272 -0.151 -6.931
406 HD13 ILE 53 2HD1 ILE 53 -0.621 0.933 -8.161
407 H GLU 54 H GLU 54 -5.695 4.372 -7.737
408 HA GLU 54 HA GLU 54 -5.624 6.134 -10.019
409 HB2 GLU 54 2HB GLU 54 -7.026 6.558 -7.364
410 HB3 GLU 54 1HB GLU 54 -7.352 7.407 -8.867
411 HG2 GLU 54 2HG GLU 54 -8.082 5.246 -9.861
412 HG3 GLU 54 1HG GLU 54 -7.885 4.502 -8.275
413 H SER 55 H SER 55 -4.955 6.565 -6.550
414 HA SER 55 HA SER 55 -2.757 8.388 -7.119
415 HG SER 55 HG SER 55 -5.996 9.960 -5.228
416 HB2 SER 55 2HB SER 55 -3.622 10.183 -5.687
417 HB3 SER 55 1HB SER 55 -4.741 9.874 -7.013
418 H ILE 56 H ILE 56 -1.296 8.632 -5.380
419 HA ILE 56 HA ILE 56 -1.833 6.902 -3.037
420 HB ILE 56 HB ILE 56 0.860 7.465 -4.310
421 HG12 ILE 56 2HG1 ILE 56 -0.776 4.914 -4.153
422 HG13 ILE 56 1HG1 ILE 56 -0.493 5.873 -5.602
423 HG21 ILE 56 1HG2 ILE 56 1.763 5.887 -2.651
424 HG22 ILE 56 2HG2 ILE 56 0.169 5.759 -1.908
425 HG23 ILE 56 3HG2 ILE 56 1.036 7.294 -1.874
426 HD11 ILE 56 3HD1 ILE 56 1.892 5.371 -5.460
427 HD12 ILE 56 1HD1 ILE 56 0.915 3.907 -5.567
428 HD13 ILE 56 2HD1 ILE 56 1.597 4.399 -4.017
429 H GLN 57 H GLN 57 -1.902 7.920 -1.142
430 HA GLN 57 HA GLN 57 -0.649 10.569 -0.852
431 HB2 GLN 57 2HB GLN 57 -3.001 10.478 -0.236
432 HB3 GLN 57 1HB GLN 57 -2.701 9.130 0.852
433 HG2 GLN 57 2HG GLN 57 -2.980 11.174 2.110
434 HG3 GLN 57 1HG GLN 57 -1.327 10.588 2.271
435 HE21 GLN 57 1HE2 GLN 57 -2.505 12.251 -0.583
436 HE22 GLN 57 2HE2 GLN 57 -1.578 13.687 -0.352
437 H LEU 58 H LEU 58 1.306 10.628 0.068
438 HA LEU 58 HA LEU 58 2.178 8.378 1.757
439 HG LEU 58 HG LEU 58 5.564 8.694 0.356
440 HB2 LEU 58 2HB LEU 58 3.445 9.696 -0.305
441 HB3 LEU 58 1HB LEU 58 4.119 10.516 1.089
442 HD11 LEU 58 1HD1 LEU 58 5.820 7.502 2.464
443 HD12 LEU 58 2HD1 LEU 58 4.229 8.057 2.986
444 HD13 LEU 58 3HD1 LEU 58 5.531 9.220 2.737
445 HD21 LEU 58 3HD2 LEU 58 3.215 6.881 0.921
446 HD22 LEU 58 1HD2 LEU 58 4.846 6.362 0.489
447 HD23 LEU 58 2HD2 LEU 58 3.872 7.268 -0.670
448 H MET 59 H MET 59 2.588 8.644 3.917
449 HA MET 59 HA MET 59 1.524 11.118 5.038
450 HB2 MET 59 2HB MET 59 0.714 8.782 5.679
451 HB3 MET 59 1HB MET 59 2.233 8.596 6.542
452 HG2 MET 59 2HG MET 59 0.447 9.237 8.043
453 HG3 MET 59 1HG MET 59 1.667 10.506 7.955
454 HE1 MET 59 3HE MET 59 -1.699 12.487 8.457
455 HE2 MET 59 1HE MET 59 -0.081 12.196 9.093
456 HE3 MET 59 2HE MET 59 -1.293 10.914 9.146
457 H MET 60 H MET 60 3.182 12.560 4.914
458 HA MET 60 HA MET 60 5.459 12.111 6.728
459 HB2 MET 60 2HB MET 60 6.927 13.341 5.149
460 HB3 MET 60 1HB MET 60 6.329 11.831 4.478
461 HG2 MET 60 2HG MET 60 4.663 13.052 3.180
462 HG3 MET 60 1HG MET 60 5.238 14.572 3.864
463 HE1 MET 60 3HE MET 60 6.115 11.514 1.562
464 HE2 MET 60 1HE MET 60 7.420 11.468 2.749
465 HE3 MET 60 2HE MET 60 7.767 11.894 1.073
466 H ASP 61 H ASP 61 6.532 14.253 7.297
467 HA ASP 61 HA ASP 61 4.404 16.169 7.953
468 HB2 ASP 61 2HB ASP 61 5.808 15.046 9.752
469 HB3 ASP 61 1HB ASP 61 7.169 16.004 9.174
470 H SER 62 H SER 62 4.265 17.760 6.453
471 HA SER 62 HA SER 62 6.562 18.586 4.901
472 HG SER 62 HG SER 62 3.437 20.719 5.011
473 HB2 SER 62 2HB SER 62 4.969 20.027 3.689
474 HB3 SER 62 1HB SER 62 4.372 18.373 3.820
475 H GLU 63 H GLU 63 5.783 19.424 7.945
476 HA GLU 63 HA GLU 63 6.371 22.288 7.655
477 HB2 GLU 63 2HB GLU 63 5.761 20.711 10.168
478 HB3 GLU 63 1HB GLU 63 5.846 22.461 10.031
479 HG2 GLU 63 2HG GLU 63 3.809 20.678 8.704
480 HG3 GLU 63 1HG GLU 63 3.541 21.672 10.134
481 H THR 64 H THR 64 7.553 19.508 9.532
482 HA THR 64 HA THR 64 10.055 20.862 10.161
483 HB THR 64 HB THR 64 10.574 18.885 11.524
484 HG1 THR 64 HG1 THR 64 8.025 17.812 10.899
485 HG21 THR 64 3HG2 THR 64 7.745 19.875 11.928
486 HG22 THR 64 1HG2 THR 64 9.213 20.630 12.552
487 HG23 THR 64 2HG2 THR 64 8.718 19.042 13.140
488 H GLY 65 H GLY 65 8.884 18.552 7.867
489 HA2 GLY 65 2HA GLY 65 10.010 17.818 5.949
490 HA3 GLY 65 1HA GLY 65 11.519 18.407 6.631
491 H ARG 66 H ARG 66 9.109 16.116 7.884
492 HA ARG 66 HA ARG 66 11.182 14.009 7.964
493 HE ARG 66 HE ARG 66 13.099 15.581 12.279
494 HB2 ARG 66 2HB ARG 66 9.183 14.718 10.133
495 HB3 ARG 66 1HB ARG 66 10.187 13.272 10.145
496 HG2 ARG 66 2HG ARG 66 12.193 14.616 10.272
497 HG3 ARG 66 1HG ARG 66 11.244 16.097 10.125
498 HD2 ARG 66 2HD ARG 66 10.186 15.696 12.250
499 HD3 ARG 66 1HD ARG 66 10.943 14.107 12.377
500 HH11 ARG 66 1HH1 ARG 66 10.181 16.334 13.947
501 HH12 ARG 66 2HH1 ARG 66 10.999 17.179 15.211
502 HH21 ARG 66 1HH2 ARG 66 14.132 16.654 13.923
503 HH22 ARG 66 2HH2 ARG 66 13.200 17.344 15.208
504 H SER 67 H SER 67 9.939 11.825 8.655
505 HA SER 67 HA SER 67 7.534 11.600 6.947
506 HG SER 67 HG SER 67 10.487 10.358 5.348
507 HB2 SER 67 2HB SER 67 9.790 9.581 7.183
508 HB3 SER 67 1HB SER 67 8.305 9.352 6.258
509 H LYS 68 H LYS 68 5.840 10.371 7.734
510 HA LYS 68 HA LYS 68 5.986 9.562 10.523
511 HB2 LYS 68 2HB LYS 68 3.710 9.618 8.535
512 HB3 LYS 68 1HB LYS 68 3.532 9.044 10.186
513 HG2 LYS 68 2HG LYS 68 4.418 11.822 9.409
514 HG3 LYS 68 1HG LYS 68 2.779 11.373 9.890
515 HD2 LYS 68 2HD LYS 68 3.634 10.637 12.080
516 HD3 LYS 68 1HD LYS 68 5.263 11.110 11.595
517 HE2 LYS 68 2HE LYS 68 4.521 13.434 11.372
518 HE3 LYS 68 1HE LYS 68 2.892 12.964 11.852
519 HZ1 LYS 68 3HZ LYS 68 5.319 12.679 13.540
520 HZ2 LYS 68 1HZ LYS 68 3.738 12.294 14.001
521 HZ3 LYS 68 2HZ LYS 68 4.163 13.902 13.694
522 H GLY 69 H GLY 69 5.803 8.014 7.366
523 HA2 GLY 69 2HA GLY 69 6.847 5.880 7.042
524 HA3 GLY 69 1HA GLY 69 6.445 5.460 8.699
525 H TYR 70 H TYR 70 3.857 6.929 7.039
526 HA TYR 70 HA TYR 70 2.703 4.286 6.377
527 HD1 TYR 70 HD2 TYR 70 1.654 3.531 9.099
528 HD2 TYR 70 HD1 TYR 70 1.902 7.777 8.967
529 HE1 TYR 70 HE2 TYR 70 2.234 3.566 11.486
530 HE2 TYR 70 HE1 TYR 70 2.483 7.821 11.356
531 HH TYR 70 HH TYR 70 3.349 5.008 13.085
532 HB2 TYR 70 2HB TYR 70 0.952 6.599 7.151
533 HB3 TYR 70 1HB TYR 70 0.619 4.880 7.244
534 H GLY 71 H GLY 71 1.097 4.306 4.639
535 HA2 GLY 71 2HA GLY 71 0.901 6.722 3.015
536 HA3 GLY 71 1HA GLY 71 1.615 5.309 2.252
537 H PHE 72 H PHE 72 -1.098 6.953 2.210
538 HA PHE 72 HA PHE 72 -2.940 4.671 2.321
539 HD1 PHE 72 HD1 PHE 72 -2.302 8.035 4.290
540 HD2 PHE 72 HD2 PHE 72 -5.487 5.226 3.902
541 HE1 PHE 72 HE1 PHE 72 -2.549 7.981 6.738
542 HE2 PHE 72 HE2 PHE 72 -5.737 5.173 6.348
543 HZ PHE 72 HZ PHE 72 -4.275 6.547 7.771
544 HB2 PHE 72 2HB PHE 72 -3.412 7.656 2.135
545 HB3 PHE 72 1HB PHE 72 -4.702 6.466 1.988
546 H ILE 73 H ILE 73 -2.999 3.528 0.486
547 HA ILE 73 HA ILE 73 -2.617 4.876 -2.104
548 HB ILE 73 HB ILE 73 -2.572 1.926 -1.431
549 HG12 ILE 73 2HG1 ILE 73 -0.287 3.824 -2.047
550 HG13 ILE 73 1HG1 ILE 73 -0.701 3.223 -0.445
551 HG21 ILE 73 1HG2 ILE 73 -1.841 3.340 -4.001
552 HG22 ILE 73 2HG2 ILE 73 -3.258 2.322 -3.745
553 HG23 ILE 73 3HG2 ILE 73 -1.645 1.616 -3.681
554 HD11 ILE 73 3HD1 ILE 73 1.173 2.004 -1.356
555 HD12 ILE 73 1HD1 ILE 73 0.233 1.571 -2.784
556 HD13 ILE 73 2HD1 ILE 73 -0.222 0.936 -1.203
557 H THR 74 H THR 74 -4.256 5.143 -3.508
558 HA THR 74 HA THR 74 -6.853 3.891 -2.880
559 HB THR 74 HB THR 74 -6.315 6.271 -4.676
560 HG1 THR 74 HG1 THR 74 -6.195 7.320 -2.852
561 HG21 THR 74 3HG2 THR 74 -8.377 5.088 -5.259
562 HG22 THR 74 1HG2 THR 74 -8.743 6.638 -4.506
563 HG23 THR 74 2HG2 THR 74 -8.901 5.148 -3.576
564 H PHE 75 H PHE 75 -7.554 2.275 -4.105
565 HA PHE 75 HA PHE 75 -6.429 1.839 -6.785
566 HD1 PHE 75 HD1 PHE 75 -6.098 0.648 -3.334
567 HD2 PHE 75 HD2 PHE 75 -5.521 -1.441 -7.005
568 HE1 PHE 75 HE1 PHE 75 -3.944 -0.206 -2.509
569 HE2 PHE 75 HE2 PHE 75 -3.367 -2.296 -6.182
570 HZ PHE 75 HZ PHE 75 -2.581 -1.680 -3.934
571 HB2 PHE 75 2HB PHE 75 -8.009 0.028 -4.943
572 HB3 PHE 75 1HB PHE 75 -7.562 -0.411 -6.588
573 H SER 76 H SER 76 -7.782 1.403 -8.597
574 HA SER 76 HA SER 76 -10.169 3.023 -8.653
575 HG SER 76 HG SER 76 -11.279 2.045 -10.991
576 HB2 SER 76 2HB SER 76 -8.626 2.950 -10.583
577 HB3 SER 76 1HB SER 76 -8.996 1.241 -10.811
578 H ASP 77 H ASP 77 -9.604 -0.094 -7.682
579 HA ASP 77 HA ASP 77 -12.439 -0.780 -7.912
580 HB2 ASP 77 2HB ASP 77 -11.427 -1.912 -9.798
581 HB3 ASP 77 1HB ASP 77 -10.165 -2.582 -8.771
582 H SER 78 H SER 78 -13.215 -2.153 -6.298
583 HA SER 78 HA SER 78 -11.873 -1.957 -3.787
584 HG SER 78 HG SER 78 -14.937 -4.413 -4.103
585 HB2 SER 78 2HB SER 78 -13.832 -3.137 -2.874
586 HB3 SER 78 1HB SER 78 -14.322 -1.828 -3.949
587 H GLU 79 H GLU 79 -12.524 -4.657 -6.004
588 HA GLU 79 HA GLU 79 -11.588 -6.681 -4.231
589 HB2 GLU 79 2HB GLU 79 -11.901 -6.766 -7.242
590 HB3 GLU 79 1HB GLU 79 -11.683 -8.162 -6.194
591 HG2 GLU 79 2HG GLU 79 -13.798 -7.595 -5.045
592 HG3 GLU 79 1HG GLU 79 -14.027 -6.266 -6.179
593 H CYS 80 H CYS 80 -10.057 -4.857 -6.858
594 HA CYS 80 HA CYS 80 -7.574 -6.118 -6.963
595 HG CYS 80 HG CYS 80 -9.694 -4.903 -9.011
596 HB2 CYS 80 2HB CYS 80 -8.141 -3.148 -7.193
597 HB3 CYS 80 1HB CYS 80 -6.677 -3.952 -7.743
598 H ALA 81 H ALA 81 -8.646 -3.513 -4.795
599 HA ALA 81 HA ALA 81 -6.219 -3.287 -3.331
600 HB1 ALA 81 3HB ALA 81 -7.511 -1.963 -1.752
601 HB2 ALA 81 1HB ALA 81 -9.017 -2.539 -2.463
602 HB3 ALA 81 2HB ALA 81 -7.933 -1.516 -3.406
603 H LYS 82 H LYS 82 -9.197 -5.126 -2.805
604 HA LYS 82 HA LYS 82 -8.670 -6.173 -0.266
605 HB2 LYS 82 2HB LYS 82 -10.843 -6.319 -1.481
606 HB3 LYS 82 1HB LYS 82 -10.138 -7.526 -2.548
607 HG2 LYS 82 2HG LYS 82 -9.765 -8.983 -0.561
608 HG3 LYS 82 1HG LYS 82 -10.622 -7.788 0.418
609 HD2 LYS 82 2HD LYS 82 -11.754 -9.314 -1.937
610 HD3 LYS 82 1HD LYS 82 -12.119 -9.608 -0.236
611 HE2 LYS 82 2HE LYS 82 -12.714 -7.039 -1.720
612 HE3 LYS 82 1HE LYS 82 -13.883 -8.318 -1.399
613 HZ1 LYS 82 3HZ LYS 82 -13.990 -6.454 0.188
614 HZ2 LYS 82 1HZ LYS 82 -12.425 -6.825 0.711
615 HZ3 LYS 82 2HZ LYS 82 -13.681 -7.935 0.937
616 H LYS 83 H LYS 83 -7.826 -7.450 -3.472
617 HA LYS 83 HA LYS 83 -6.563 -9.823 -2.604
618 HB2 LYS 83 2HB LYS 83 -7.314 -9.464 -4.917
619 HB3 LYS 83 1HB LYS 83 -6.097 -8.211 -5.125
620 HG2 LYS 83 2HG LYS 83 -4.336 -9.917 -4.723
621 HG3 LYS 83 1HG LYS 83 -5.596 -11.151 -4.655
622 HD2 LYS 83 2HD LYS 83 -6.239 -10.631 -6.956
623 HD3 LYS 83 1HD LYS 83 -5.015 -9.358 -7.019
624 HE2 LYS 83 2HE LYS 83 -3.270 -11.068 -6.613
625 HE3 LYS 83 1HE LYS 83 -4.516 -12.317 -6.660
626 HZ1 LYS 83 3HZ LYS 83 -3.918 -10.457 -8.888
627 HZ2 LYS 83 1HZ LYS 83 -4.980 -11.770 -8.925
628 HZ3 LYS 83 2HZ LYS 83 -3.316 -12.033 -8.772
629 H ALA 84 H ALA 84 -5.171 -6.658 -3.529
630 HA ALA 84 HA ALA 84 -2.478 -7.216 -3.101
631 HB1 ALA 84 3HB ALA 84 -3.897 -4.597 -2.574
632 HB2 ALA 84 1HB ALA 84 -3.290 -5.144 -4.138
633 HB3 ALA 84 2HB ALA 84 -2.162 -4.809 -2.824
634 H LEU 85 H LEU 85 -4.841 -5.934 -0.760
635 HA LEU 85 HA LEU 85 -3.213 -5.889 1.506
636 HG LEU 85 HG LEU 85 -4.557 -5.656 3.694
637 HB2 LEU 85 2HB LEU 85 -5.462 -4.901 1.367
638 HB3 LEU 85 1HB LEU 85 -6.172 -6.497 1.289
639 HD11 LEU 85 1HD1 LEU 85 -6.238 -3.923 3.362
640 HD12 LEU 85 2HD1 LEU 85 -6.633 -4.920 4.759
641 HD13 LEU 85 3HD1 LEU 85 -7.498 -5.150 3.239
642 HD21 LEU 85 3HD2 LEU 85 -6.043 -7.270 4.838
643 HD22 LEU 85 1HD2 LEU 85 -5.110 -8.022 3.547
644 HD23 LEU 85 2HD2 LEU 85 -6.810 -7.635 3.293
645 H GLU 86 H GLU 86 -5.270 -8.506 0.270
646 HA GLU 86 HA GLU 86 -4.998 -10.328 2.339
647 HB2 GLU 86 2HB GLU 86 -6.466 -10.300 0.160
648 HB3 GLU 86 1HB GLU 86 -5.160 -11.259 -0.514
649 HG2 GLU 86 2HG GLU 86 -6.647 -12.008 1.997
650 HG3 GLU 86 1HG GLU 86 -7.131 -12.532 0.389
651 H GLN 87 H GLN 87 -2.788 -9.725 -0.361
652 HA GLN 87 HA GLN 87 -1.095 -11.981 0.416
653 HB2 GLN 87 2HB GLN 87 -1.043 -10.076 -1.916
654 HB3 GLN 87 1HB GLN 87 0.284 -11.181 -1.595
655 HG2 GLN 87 2HG GLN 87 -1.389 -13.061 -1.706
656 HG3 GLN 87 1HG GLN 87 -2.565 -11.876 -2.279
657 HE21 GLN 87 1HE2 GLN 87 -2.771 -12.914 -4.269
658 HE22 GLN 87 2HE2 GLN 87 -1.529 -12.867 -5.469
659 H LEU 88 H LEU 88 -0.938 -8.433 0.347
660 HA LEU 88 HA LEU 88 1.897 -8.482 0.986
661 HG LEU 88 HG LEU 88 0.369 -7.531 -1.531
662 HB2 LEU 88 2HB LEU 88 0.050 -6.143 0.511
663 HB3 LEU 88 1HB LEU 88 1.792 -6.047 0.689
664 HD11 LEU 88 1HD1 LEU 88 1.785 -4.867 -1.587
665 HD12 LEU 88 2HD1 LEU 88 0.047 -5.129 -1.729
666 HD13 LEU 88 3HD1 LEU 88 1.131 -5.725 -2.984
667 HD21 LEU 88 3HD2 LEU 88 3.305 -6.924 -1.123
668 HD22 LEU 88 1HD2 LEU 88 2.596 -7.677 -2.554
669 HD23 LEU 88 2HD2 LEU 88 2.541 -8.508 -1.000
670 H ASN 89 H ASN 89 -1.040 -8.173 2.783
671 HA ASN 89 HA ASN 89 0.026 -6.593 4.912
672 HB2 ASN 89 2HB ASN 89 -2.424 -6.895 4.467
673 HB3 ASN 89 1HB ASN 89 -2.285 -8.542 5.076
674 HD21 ASN 89 1HD2 ASN 89 -3.775 -8.010 6.727
675 HD22 ASN 89 2HD2 ASN 89 -3.295 -7.082 8.095
676 H GLY 90 H GLY 90 1.701 -7.223 6.087
677 HA2 GLY 90 2HA GLY 90 2.626 -8.656 7.807
678 HA3 GLY 90 1HA GLY 90 1.899 -10.035 6.994
679 H PHE 91 H PHE 91 2.896 -8.514 4.430
680 HA PHE 91 HA PHE 91 5.181 -10.117 3.970
681 HD1 PHE 91 HD1 PHE 91 5.910 -10.732 1.338
682 HD2 PHE 91 HD2 PHE 91 5.708 -6.483 1.530
683 HE1 PHE 91 HE1 PHE 91 7.804 -10.571 -0.228
684 HE2 PHE 91 HE2 PHE 91 7.600 -6.316 -0.030
685 HZ PHE 91 HZ PHE 91 8.647 -8.363 -0.916
686 HB2 PHE 91 2HB PHE 91 3.832 -9.468 2.109
687 HB3 PHE 91 1HB PHE 91 3.998 -7.761 2.495
688 H GLU 92 H GLU 92 7.328 -9.747 4.201
689 HA GLU 92 HA GLU 92 8.222 -7.467 5.695
690 HB2 GLU 92 2HB GLU 92 10.510 -8.441 5.349
691 HB3 GLU 92 1HB GLU 92 9.355 -9.544 6.083
692 HG2 GLU 92 2HG GLU 92 9.079 -10.732 4.021
693 HG3 GLU 92 1HG GLU 92 10.043 -9.543 3.148
694 H LEU 93 H LEU 93 7.945 -5.570 4.571
695 HA LEU 93 HA LEU 93 8.494 -5.248 1.805
696 HG LEU 93 HG LEU 93 9.312 -2.181 2.078
697 HB2 LEU 93 2HB LEU 93 6.912 -3.812 2.938
698 HB3 LEU 93 1HB LEU 93 8.163 -3.220 4.016
699 HD11 LEU 93 1HD1 LEU 93 6.861 -3.040 0.538
700 HD12 LEU 93 2HD1 LEU 93 8.504 -3.637 0.308
701 HD13 LEU 93 3HD1 LEU 93 8.119 -1.956 -0.053
702 HD21 LEU 93 3HD2 LEU 93 7.787 -0.863 3.466
703 HD22 LEU 93 1HD2 LEU 93 6.435 -1.328 2.432
704 HD23 LEU 93 2HD2 LEU 93 7.740 -0.335 1.785
705 H ALA 94 H ALA 94 10.105 -3.370 4.345
706 HA ALA 94 HA ALA 94 12.626 -3.559 2.817
707 HB1 ALA 94 3HB ALA 94 11.728 -1.458 4.793
708 HB2 ALA 94 1HB ALA 94 11.706 -1.303 3.036
709 HB3 ALA 94 2HB ALA 94 13.243 -1.450 3.889
710 H GLY 95 H GLY 95 12.144 -5.744 4.331
711 HA2 GLY 95 2HA GLY 95 13.284 -7.051 5.899
712 HA3 GLY 95 1HA GLY 95 14.138 -5.615 6.449
713 H ARG 96 H ARG 96 10.927 -4.892 6.314
714 HA ARG 96 HA ARG 96 10.366 -5.713 9.088
715 HE ARG 96 HE ARG 96 13.116 -1.889 10.651
716 HB2 ARG 96 2HB ARG 96 9.926 -3.001 7.809
717 HB3 ARG 96 1HB ARG 96 9.185 -3.480 9.331
718 HG2 ARG 96 2HG ARG 96 11.321 -3.655 10.394
719 HG3 ARG 96 1HG ARG 96 12.161 -3.421 8.858
720 HD2 ARG 96 2HD ARG 96 11.248 -1.150 8.702
721 HD3 ARG 96 1HD ARG 96 10.404 -1.374 10.233
722 HH11 ARG 96 1HH1 ARG 96 11.060 0.776 9.909
723 HH12 ARG 96 2HH1 ARG 96 12.143 1.931 10.598
724 HH21 ARG 96 1HH2 ARG 96 14.482 -0.393 11.527
725 HH22 ARG 96 2HH2 ARG 96 14.059 1.284 11.480
726 HA PRO 97 HA PRO 97 6.526 -7.308 7.384
727 HB2 PRO 97 2HB PRO 97 4.985 -6.950 9.675
728 HB3 PRO 97 1HB PRO 97 6.007 -8.354 9.348
729 HG2 PRO 97 2HG PRO 97 6.594 -5.919 10.999
730 HG3 PRO 97 1HG PRO 97 6.986 -7.618 11.329
731 HD2 PRO 97 2HD PRO 97 8.844 -5.914 10.441
732 HD3 PRO 97 1HD PRO 97 8.813 -7.601 9.882
733 H MET 98 H MET 98 4.897 -6.358 6.264
734 HA MET 98 HA MET 98 4.577 -3.466 6.611
735 HB2 MET 98 2HB MET 98 5.306 -4.223 4.410
736 HB3 MET 98 1HB MET 98 3.901 -5.269 4.273
737 HG2 MET 98 2HG MET 98 2.439 -3.444 4.032
738 HG3 MET 98 1HG MET 98 3.656 -2.294 4.589
739 HE1 MET 98 3HE MET 98 3.949 -4.473 0.521
740 HE2 MET 98 1HE MET 98 2.668 -4.782 1.695
741 HE3 MET 98 2HE MET 98 4.333 -5.249 2.057
742 H LYS 99 H LYS 99 2.822 -2.665 7.523
743 HA LYS 99 HA LYS 99 0.512 -4.352 8.052
744 HB2 LYS 99 2HB LYS 99 1.287 -1.560 8.922
745 HB3 LYS 99 1HB LYS 99 -0.259 -2.286 9.337
746 HG2 LYS 99 2HG LYS 99 2.420 -3.462 10.072
747 HG3 LYS 99 1HG LYS 99 1.463 -2.422 11.129
748 HD2 LYS 99 2HD LYS 99 -0.403 -4.081 10.961
749 HD3 LYS 99 1HD LYS 99 0.678 -5.136 10.050
750 HE2 LYS 99 2HE LYS 99 2.195 -5.271 11.946
751 HE3 LYS 99 1HE LYS 99 1.193 -4.139 12.855
752 HZ1 LYS 99 3HZ LYS 99 0.754 -6.411 13.520
753 HZ2 LYS 99 1HZ LYS 99 0.359 -6.834 11.932
754 HZ3 LYS 99 2HZ LYS 99 -0.617 -5.748 12.783
755 H VAL 100 H VAL 100 -0.732 -4.574 6.250
756 HA VAL 100 HA VAL 100 -1.629 -2.125 4.860
757 HB VAL 100 HB VAL 100 -1.758 -4.961 3.807
758 HG11 VAL 100 1HG1 VAL 100 -2.145 -2.303 2.421
759 HG12 VAL 100 2HG1 VAL 100 -3.418 -3.449 2.842
760 HG13 VAL 100 3HG1 VAL 100 -2.197 -3.890 1.649
761 HG21 VAL 100 3HG2 VAL 100 0.143 -4.418 2.393
762 HG22 VAL 100 1HG2 VAL 100 0.578 -4.253 4.095
763 HG23 VAL 100 2HG2 VAL 100 0.257 -2.815 3.122
764 H GLY 101 H GLY 101 -3.466 -1.528 5.925
765 HA2 GLY 101 2HA GLY 101 -5.590 -3.583 6.190
766 HA3 GLY 101 1HA GLY 101 -5.380 -2.263 7.326
767 H HIS 102 H HIS 102 -7.596 -3.150 5.380
768 HA HIS 102 HA HIS 102 -7.852 -0.966 3.524
769 HD1 HIS 102 HD1 HIS 102 -11.392 -2.200 5.554
770 HD2 HIS 102 HD2 HIS 102 -9.107 -5.400 4.209
771 HE1 HIS 102 HE1 HIS 102 -12.143 -4.183 6.903
772 HE2 HIS 102 HE2 HIS 102 -10.853 -6.130 5.965
773 HB2 HIS 102 2HB HIS 102 -10.154 -1.921 3.137
774 HB3 HIS 102 1HB HIS 102 -8.831 -3.049 2.876
775 H VAL 103 H VAL 103 -7.441 0.365 5.730
776 HA VAL 103 HA VAL 103 -8.180 1.746 7.382
777 HB VAL 103 HB VAL 103 -10.427 2.324 5.433
778 HG11 VAL 103 1HG1 VAL 103 -10.327 4.590 6.384
779 HG12 VAL 103 2HG1 VAL 103 -9.072 4.065 7.508
780 HG13 VAL 103 3HG1 VAL 103 -10.699 3.387 7.620
781 HG21 VAL 103 3HG2 VAL 103 -7.614 3.441 5.470
782 HG22 VAL 103 1HG2 VAL 103 -8.921 3.981 4.415
783 HG23 VAL 103 2HG2 VAL 103 -8.277 2.346 4.257
784 H THR 104 H THR 104 -8.693 0.011 8.834
785 HA THR 104 HA THR 104 -11.221 -1.277 8.889
786 HB THR 104 HB THR 104 -10.534 -2.126 11.120
787 HG1 THR 104 HG1 THR 104 -8.556 -1.467 11.993
788 HG21 THR 104 3HG2 THR 104 -8.576 -3.389 10.377
789 HG22 THR 104 1HG2 THR 104 -8.328 -2.252 9.049
790 HG23 THR 104 2HG2 THR 104 -9.763 -3.276 9.080
791 H GLU 105 H GLU 105 -12.937 -1.074 10.315
792 HA GLU 105 HA GLU 105 -13.849 1.465 10.967
793 HB2 GLU 105 2HB GLU 105 -15.620 0.384 12.219
794 HB3 GLU 105 1HB GLU 105 -15.291 -0.543 10.765
795 HG2 GLU 105 2HG GLU 105 -14.363 -1.236 13.554
796 HG3 GLU 105 1HG GLU 105 -15.697 -1.992 12.687
797 H ARG 106 H ARG 106 -11.968 -0.784 12.924
798 HA ARG 106 HA ARG 106 -12.096 0.920 15.270
799 HE ARG 106 HE ARG 106 -12.185 0.092 17.517
800 HB2 ARG 106 2HB ARG 106 -10.446 -1.568 14.787
801 HB3 ARG 106 1HB ARG 106 -10.682 -0.765 16.334
802 HG2 ARG 106 2HG ARG 106 -12.754 -2.220 14.699
803 HG3 ARG 106 1HG ARG 106 -12.084 -2.701 16.256
804 HD2 ARG 106 2HD ARG 106 -13.877 -0.344 15.677
805 HD3 ARG 106 1HD ARG 106 -14.273 -1.783 16.615
806 HH11 ARG 106 1HH1 ARG 106 -15.103 -1.641 18.092
807 HH12 ARG 106 2HH1 ARG 106 -15.239 -1.077 19.718
808 HH21 ARG 106 1HH2 ARG 106 -12.371 0.797 19.606
809 HH22 ARG 106 2HH2 ARG 106 -13.700 0.260 20.572
810 H THR 107 H THR 107 -10.140 0.659 12.493
811 HA THR 107 HA THR 107 -8.369 1.848 11.732
812 HB THR 107 HB THR 107 -8.379 3.330 14.377
813 HG1 THR 107 HG1 THR 107 -10.351 3.635 13.327
814 HG21 THR 107 3HG2 THR 107 -6.276 3.594 13.142
815 HG22 THR 107 1HG2 THR 107 -7.208 5.090 13.117
816 HG23 THR 107 2HG2 THR 107 -7.173 4.050 11.693
817 H ASP 108 H ASP 108 -7.783 1.251 15.219
818 HA ASP 108 HA ASP 108 -6.276 -0.034 16.309
819 HB2 ASP 108 2HB ASP 108 -5.653 -1.182 13.576
820 HB3 ASP 108 1HB ASP 108 -5.126 -1.861 15.113
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