1 REMARK time 25.90 ENERGY 4.44281E+00
2 ATOM 1 CA GLY 1 3.845 3.423 2.183 0.009
3 ATOM 2 CA ALA 2 1.200 0.715 1.940 0.014
4 ATOM 3 CB ALA 2 0.474 0.769 1.671 0.009
5 ATOM 4 CA ALA 3 1.995 0.040 -1.727 0.018
6 ATOM 5 CB ALA 3 1.863 0.781 -1.942 0.077
7 ATOM 6 CA ALA 4 5.418 -1.310 -0.739 0.016
8 ATOM 7 CB ALA 4 5.768 -0.694 -0.429 0.042
9 ATOM 8 CA CYS 5 5.147 -5.041 -0.348 0.044
10 ATOM 9 CB CYS 5 5.186 -5.742 -1.375 0.026
11 ATOM 10 CA ALA 6 7.932 -6.927 1.485 0.044
12 ATOM 11 CB ALA 6 7.965 -6.669 2.164 0.006
13 ATOM 12 CA ALA 7 9.380 -10.230 0.263 0.024
14 ATOM 13 CB ALA 7 8.976 -10.468 -0.342 0.024
15 ATOM 14 CA ALA 8 12.929 -11.260 1.194 0.019
16 ATOM 15 CB ALA 8 12.719 -11.073 1.892 0.117
17 ATOM 16 CA ALA 9 15.537 -12.938 -0.975 0.035
18 ATOM 17 CB ALA 9 16.044 -12.421 -1.068 0.201
19 ATOM 18 CA ALA 10 16.957 -16.376 -1.800 0.003
20 ATOM 19 CB ALA 10 16.861 -16.352 -2.561 0.585
21 ATOM 20 CA ALA 11 19.464 -18.822 -0.264 0.067
22 ATOM 21 CB ALA 11 18.785 -19.139 -0.394 0.047
23 ATOM 22 CA ALA 12 22.007 -21.483 -1.391 0.045
24 ATOM 23 CB ALA 12 22.544 -21.659 -1.806 0.049
25 ATOM 24 CA ALA 13 24.259 -24.089 0.205 0.037
26 ATOM 25 CB ALA 13 23.703 -24.527 -0.027 0.041
27 ATOM 26 CA CYS 14 27.861 -25.335 -0.094 0.007
28 ATOM 27 CB CYS 14 28.511 -25.131 -1.109 0.039
29 ATOM 28 CA ALA 15 30.453 -27.856 1.203 0.006
30 ATOM 29 CB ALA 15 29.957 -28.389 1.335 0.026
31 ATOM 30 CA ALA 16 34.055 -28.335 0.034 0.001
32 ATOM 31 CB ALA 16 34.598 -27.781 0.078 0.056
33 ATOM 32 CA ALA 17 35.535 -31.350 1.755 0.049
34 ATOM 33 CB ALA 17 35.379 -31.341 2.486 0.032
35 ATOM 34 CA GLY 18 34.666 -34.614 0.062 0.000
55 REMARK time 49.86 ENERGY -9.22938E-01
56 ATOM 1 CA GLY 1 1.546 3.790 3.086 0.021
57 ATOM 2 CA ALA 2 2.235 0.041 3.052 0.061
58 ATOM 3 CB ALA 2 1.827 -0.493 3.254 0.002
59 ATOM 4 CA ALA 3 1.932 -0.054 -0.661 0.002
60 ATOM 5 CB ALA 3 1.599 0.412 -1.096 0.025
61 ATOM 6 CA ALA 4 5.617 -0.897 -0.973 0.012
62 ATOM 7 CB ALA 4 5.988 -0.289 -0.893 0.109
63 ATOM 8 CA CYS 5 7.031 -4.420 -1.257 0.021
64 ATOM 9 CB CYS 5 6.627 -4.848 -2.393 0.118
65 ATOM 10 CA ALA 6 8.814 -7.355 0.365 0.013
66 ATOM 11 CB ALA 6 8.751 -7.375 1.090 0.118
67 ATOM 12 CA ALA 7 10.039 -10.615 -1.203 0.024
68 ATOM 13 CB ALA 7 10.663 -10.774 -1.510 0.138
69 ATOM 14 CA ALA 8 10.429 -14.179 0.012 0.002
70 ATOM 15 CB ALA 8 9.819 -14.557 -0.097 0.010
71 ATOM 16 CA ALA 9 13.893 -15.573 -0.382 0.014
72 ATOM 17 CB ALA 9 13.843 -16.191 -0.804 0.077
73 ATOM 18 CA ALA 10 17.600 -15.033 0.354 0.038
74 ATOM 19 CB ALA 10 17.782 -14.752 1.060 0.036
75 ATOM 20 CA ALA 11 20.623 -17.073 -0.615 0.027
76 ATOM 21 CB ALA 11 21.169 -16.984 -1.155 0.027
77 ATOM 22 CA ALA 12 22.811 -19.877 0.796 0.010
78 ATOM 23 CB ALA 12 22.339 -20.258 1.210 0.319
79 ATOM 24 CA ALA 13 25.656 -21.691 -0.966 0.016
80 ATOM 25 CB ALA 13 26.015 -21.053 -1.121 0.034
81 ATOM 26 CA CYS 14 27.016 -25.273 -0.483 0.013
82 ATOM 27 CB CYS 14 26.335 -26.112 -1.014 0.114
83 ATOM 28 CA ALA 15 30.350 -27.092 -0.462 0.041
84 ATOM 29 CB ALA 15 30.576 -26.667 0.086 0.049
85 ATOM 30 CA ALA 16 32.038 -30.471 -0.686 0.033
86 ATOM 31 CB ALA 16 31.840 -30.250 -1.374 0.032
87 ATOM 32 CA ALA 17 34.103 -32.288 1.968 0.022
88 ATOM 33 CB ALA 17 34.363 -32.963 1.936 0.094
89 ATOM 34 CA GLY 18 37.377 -30.767 3.350 0.000
109 REMARK time 73.55 ENERGY 1.96543E-01
110 ATOM 1 CA GLY 1 4.366 0.409 4.696 0.064
111 ATOM 2 CA ALA 2 3.220 -2.803 3.061 0.019
112 ATOM 3 CB ALA 2 2.906 -3.108 3.678 0.008
113 ATOM 4 CA ALA 3 3.262 -1.375 -0.501 0.054
114 ATOM 5 CB ALA 3 3.042 -0.736 -0.722 0.034
115 ATOM 6 CA ALA 4 6.860 -2.449 -1.207 0.020
116 ATOM 7 CB ALA 4 7.001 -2.385 -0.539 0.002
117 ATOM 8 CA CYS 5 8.551 -5.414 -2.859 0.001
118 ATOM 9 CB CYS 5 9.132 -5.217 -3.936 0.041
119 ATOM 10 CA ALA 6 9.557 -8.008 -0.221 0.018
120 ATOM 11 CB ALA 6 9.662 -8.287 0.472 0.167
121 ATOM 12 CA ALA 7 12.130 -10.670 -1.003 0.058
122 ATOM 13 CB ALA 7 12.949 -10.645 -0.943 0.003
123 ATOM 14 CA ALA 8 11.493 -12.957 1.928 0.054
124 ATOM 15 CB ALA 8 10.987 -12.658 2.387 0.009
125 ATOM 16 CA ALA 9 11.918 -16.106 -0.227 0.142
126 ATOM 17 CB ALA 9 11.416 -16.279 -0.720 0.055
127 ATOM 18 CA ALA 10 15.481 -16.224 -1.542 0.043
128 ATOM 19 CB ALA 10 15.736 -15.695 -1.964 0.098
129 ATOM 20 CA ALA 11 18.228 -18.412 0.018 0.017
130 ATOM 21 CB ALA 11 17.935 -19.019 -0.252 0.039
131 ATOM 22 CA ALA 12 22.038 -18.092 -0.129 0.005
132 ATOM 23 CB ALA 12 22.439 -17.852 0.388 0.019
133 ATOM 24 CA ALA 13 24.928 -20.200 -1.278 0.007
134 ATOM 25 CB ALA 13 25.338 -20.014 -1.847 0.061
135 ATOM 26 CA CYS 14 27.361 -22.679 0.329 0.025
136 ATOM 27 CB CYS 14 26.366 -23.412 0.267 0.060
137 ATOM 28 CA ALA 15 30.518 -24.766 0.449 0.024
138 ATOM 29 CB ALA 15 30.953 -24.462 0.927 0.240
139 ATOM 30 CA ALA 16 30.957 -28.546 0.118 0.002
140 ATOM 31 CB ALA 16 31.033 -28.815 -0.565 0.051
141 ATOM 32 CA ALA 17 33.050 -31.246 2.019 0.030
142 ATOM 33 CB ALA 17 32.951 -31.074 2.718 0.098
143 ATOM 34 CA GLY 18 32.867 -34.484 0.139 0.000
163 REMARK time 93.96 ENERGY 2.18264E+01
164 ATOM 1 CA GLY 1 4.633 -3.190 4.982 0.011
165 ATOM 2 CA ALA 2 4.733 -4.978 1.581 0.007
166 ATOM 3 CB ALA 2 4.945 -5.121 0.847 0.029
167 ATOM 4 CA ALA 3 4.495 -1.782 -0.465 0.038
168 ATOM 5 CB ALA 3 4.332 -1.003 -0.364 0.010
169 ATOM 6 CA ALA 4 8.081 -2.136 -1.801 0.005
170 ATOM 7 CB ALA 4 8.614 -1.696 -1.524 0.049
171 ATOM 8 CA CYS 5 8.903 -5.894 -1.801 0.025
172 ATOM 9 CB CYS 5 7.896 -6.493 -2.185 0.016
173 ATOM 10 CA ALA 6 12.027 -7.430 -0.193 0.007
174 ATOM 11 CB ALA 6 12.576 -7.287 0.244 0.039
175 ATOM 12 CA ALA 7 11.705 -11.253 -0.176 0.022
176 ATOM 13 CB ALA 7 11.070 -11.698 -0.455 0.055
177 ATOM 14 CA ALA 8 14.926 -13.001 0.896 0.036
178 ATOM 15 CB ALA 8 14.884 -12.709 1.600 0.079
179 ATOM 16 CA ALA 9 13.182 -16.316 1.012 0.010
180 ATOM 17 CB ALA 9 12.443 -16.370 0.943 0.206
181 ATOM 18 CA ALA 10 14.226 -17.134 -2.557 0.050
182 ATOM 19 CB ALA 10 14.349 -17.062 -3.258 0.089
183 ATOM 20 CA ALA 11 17.586 -18.869 -1.612 0.061
184 ATOM 21 CB ALA 11 17.896 -19.452 -1.905 0.159
185 ATOM 22 CA ALA 12 21.029 -18.571 -0.120 0.051
186 ATOM 23 CB ALA 12 21.172 -18.184 0.395 0.064
187 ATOM 24 CA ALA 13 23.795 -20.972 -1.044 0.023
188 ATOM 25 CB ALA 13 23.673 -20.227 -1.213 0.113
189 ATOM 26 CA CYS 14 26.422 -20.856 1.793 0.025
190 ATOM 27 CB CYS 14 25.677 -21.257 2.680 0.007
191 ATOM 28 CA ALA 15 29.320 -23.225 1.314 0.028
192 ATOM 29 CB ALA 15 30.041 -23.252 1.282 0.087
193 ATOM 30 CA ALA 16 29.135 -26.859 0.300 0.040
194 ATOM 31 CB ALA 16 28.560 -27.181 -0.080 0.067
195 ATOM 32 CA ALA 17 31.655 -29.721 0.263 0.009
196 ATOM 33 CB ALA 17 32.049 -29.944 0.825 0.077
197 ATOM 34 CA GLY 18 31.998 -33.372 -0.692 0.000
217 REMARK time 123.96 ENERGY 2.30766E+00
218 ATOM 1 CA GLY 1 4.483 1.083 2.657 0.019
219 ATOM 2 CA ALA 2 3.751 -2.533 3.264 0.023
220 ATOM 3 CB ALA 2 3.125 -2.652 3.594 0.097
221 ATOM 4 CA ALA 3 4.643 -3.417 -0.353 0.025
222 ATOM 5 CB ALA 3 4.645 -2.979 -0.920 0.116
223 ATOM 6 CA ALA 4 8.384 -3.679 0.023 0.013
224 ATOM 7 CB ALA 4 8.716 -3.674 0.743 0.006
225 ATOM 8 CA CYS 5 10.214 -6.573 -1.652 0.008
226 ATOM 9 CB CYS 5 10.956 -6.335 -2.535 0.027
227 ATOM 10 CA ALA 6 12.086 -9.189 0.492 0.024
228 ATOM 11 CB ALA 6 11.575 -9.542 0.957 0.002
229 ATOM 12 CA ALA 7 15.094 -10.757 -1.260 0.016
230 ATOM 13 CB ALA 7 15.707 -10.264 -1.197 0.098
231 ATOM 14 CA ALA 8 14.897 -13.915 0.947 0.051
232 ATOM 15 CB ALA 8 15.411 -13.568 1.376 0.131
233 ATOM 16 CA ALA 9 11.746 -15.268 -0.746 0.013
234 ATOM 17 CB ALA 9 11.274 -15.207 -1.313 0.025
235 ATOM 18 CA ALA 10 13.691 -17.677 -2.854 0.024
236 ATOM 19 CB ALA 10 13.788 -17.196 -3.398 0.111
237 ATOM 20 CA ALA 11 15.784 -20.613 -1.783 0.002
238 ATOM 21 CB ALA 11 15.836 -21.369 -1.782 0.104
239 ATOM 22 CA ALA 12 19.061 -19.513 -0.145 0.016
240 ATOM 23 CB ALA 12 19.391 -19.583 0.532 0.056
241 ATOM 24 CA ALA 13 22.577 -20.749 -0.568 0.003
242 ATOM 25 CB ALA 13 22.686 -20.711 -1.312 0.164
243 ATOM 26 CA CYS 14 25.522 -21.007 1.778 0.062
244 ATOM 27 CB CYS 14 25.150 -22.081 2.067 0.026
245 ATOM 28 CA ALA 15 28.695 -22.554 0.297 0.128
246 ATOM 29 CB ALA 15 29.232 -22.159 0.408 0.013
247 ATOM 30 CA ALA 16 29.747 -26.153 -0.052 0.019
248 ATOM 31 CB ALA 16 29.569 -26.459 -0.689 0.092
249 ATOM 32 CA ALA 17 32.649 -27.993 1.654 0.027
250 ATOM 33 CB ALA 17 33.087 -28.439 2.081 0.042
251 ATOM 34 CA GLY 18 33.204 -31.337 -0.141 0.000
271 REMARK time 150.50 ENERGY 4.32872E+00
272 ATOM 1 CA GLY 1 3.335 2.224 3.021 0.022
273 ATOM 2 CA ALA 2 4.820 -1.246 3.718 0.046
274 ATOM 3 CB ALA 2 5.156 -1.988 3.697 0.089
275 ATOM 4 CA ALA 3 4.769 -2.119 0.037 0.034
276 ATOM 5 CB ALA 3 4.819 -1.831 -0.659 0.038
277 ATOM 6 CA ALA 4 8.589 -2.214 -0.090 0.003
278 ATOM 7 CB ALA 4 8.467 -1.849 0.611 0.017
279 ATOM 8 CA CYS 5 10.478 -5.251 -1.257 0.054
280 ATOM 9 CB CYS 5 11.215 -5.297 -2.189 0.027
281 ATOM 10 CA ALA 6 10.397 -8.945 -0.074 0.031
282 ATOM 11 CB ALA 6 9.766 -9.197 -0.412 0.118
283 ATOM 12 CA ALA 7 13.482 -11.241 -0.324 0.027
284 ATOM 13 CB ALA 7 13.847 -11.081 0.253 0.024
285 ATOM 14 CA ALA 8 11.525 -14.139 1.117 0.051
286 ATOM 15 CB ALA 8 10.955 -14.010 1.666 0.048
287 ATOM 16 CA ALA 9 10.846 -15.604 -2.306 0.020
288 ATOM 17 CB ALA 9 10.500 -15.079 -2.693 0.013
289 ATOM 18 CA ALA 10 14.511 -16.685 -2.606 0.007
290 ATOM 19 CB ALA 10 15.263 -16.804 -2.709 0.323
291 ATOM 20 CA ALA 11 15.693 -19.970 -1.083 0.009
292 ATOM 21 CB ALA 11 15.485 -20.534 -1.409 0.061
293 ATOM 22 CA ALA 12 19.230 -21.103 -0.068 0.010
294 ATOM 23 CB ALA 12 18.767 -21.096 0.534 0.014
295 ATOM 24 CA ALA 13 22.566 -22.101 -1.712 0.070
296 ATOM 25 CB ALA 13 22.836 -21.461 -1.960 0.091
297 ATOM 26 CA CYS 14 25.287 -24.394 -0.210 0.015
298 ATOM 27 CB CYS 14 25.095 -25.310 0.554 0.050
299 ATOM 28 CA ALA 15 29.147 -24.558 -0.611 0.017
300 ATOM 29 CB ALA 15 29.395 -23.921 -0.422 0.053
301 ATOM 30 CA ALA 16 31.442 -27.343 0.568 0.042
302 ATOM 31 CB ALA 16 31.610 -27.788 0.024 0.111
303 ATOM 32 CA ALA 17 34.473 -27.168 2.742 0.022
304 ATOM 33 CB ALA 17 34.400 -27.811 3.174 0.102
305 ATOM 34 CA GLY 18 37.762 -25.301 2.404 0.000
325 REMARK time 173.00 ENERGY 1.72406E+01
326 ATOM 1 CA GLY 1 5.685 -0.716 4.946 0.011
327 ATOM 2 CA ALA 2 4.294 -1.902 1.627 0.023
328 ATOM 3 CB ALA 2 3.584 -1.933 1.446 0.028
329 ATOM 4 CA ALA 3 5.974 0.893 -0.341 0.050
330 ATOM 5 CB ALA 3 6.494 1.389 -0.316 0.079
331 ATOM 6 CA ALA 4 9.048 -1.275 -0.920 0.017
332 ATOM 7 CB ALA 4 9.550 -1.263 -0.330 0.073
333 ATOM 8 CA CYS 5 8.659 -4.969 -0.326 0.011
334 ATOM 9 CB CYS 5 7.948 -5.489 -1.249 0.018
335 ATOM 10 CA ALA 6 10.624 -7.869 1.022 0.105
336 ATOM 11 CB ALA 6 10.106 -8.396 1.431 0.081
337 ATOM 12 CA ALA 7 11.206 -11.451 -0.218 0.009
338 ATOM 13 CB ALA 7 11.173 -11.475 -0.919 0.047
339 ATOM 14 CA ALA 8 12.551 -14.385 1.756 0.007
340 ATOM 15 CB ALA 8 12.232 -14.804 2.296 0.156
341 ATOM 16 CA ALA 9 12.459 -16.318 -1.441 0.013
342 ATOM 17 CB ALA 9 12.000 -16.047 -1.838 0.044
343 ATOM 18 CA ALA 10 16.165 -16.198 -1.863 0.023
344 ATOM 19 CB ALA 10 16.289 -15.819 -1.272 0.031
345 ATOM 20 CA ALA 11 17.510 -19.616 -2.990 0.013
346 ATOM 21 CB ALA 11 17.989 -19.734 -3.641 0.102
347 ATOM 22 CA ALA 12 18.850 -22.818 -1.465 0.004
348 ATOM 23 CB ALA 12 18.258 -23.134 -1.316 0.015
349 ATOM 24 CA ALA 13 22.595 -23.077 -0.821 0.010
350 ATOM 25 CB ALA 13 22.983 -22.613 -0.509 0.168
351 ATOM 26 CA CYS 14 24.772 -26.027 0.095 0.014
352 ATOM 27 CB CYS 14 24.392 -26.632 -0.841 0.010
353 ATOM 28 CA ALA 15 28.508 -26.410 -0.631 0.014
354 ATOM 29 CB ALA 15 28.484 -26.142 -1.280 0.057
355 ATOM 30 CA ALA 16 31.369 -26.398 1.904 0.008
356 ATOM 31 CB ALA 16 31.673 -27.038 2.161 0.024
357 ATOM 32 CA ALA 17 34.374 -24.044 1.691 0.027
358 ATOM 33 CB ALA 17 34.186 -23.261 1.745 0.053
359 ATOM 34 CA GLY 18 37.000 -25.828 3.765 0.000
379 REMARK time 196.37 ENERGY 1.02675E+01
380 ATOM 1 CA GLY 1 4.595 4.350 4.521 0.008
381 ATOM 2 CA ALA 2 4.211 0.729 3.480 0.006
382 ATOM 3 CB ALA 2 3.722 0.137 3.686 0.133
383 ATOM 4 CA ALA 3 5.370 0.201 -0.112 0.048
384 ATOM 5 CB ALA 3 5.536 0.979 -0.138 0.051
385 ATOM 6 CA ALA 4 8.366 -2.060 0.639 0.030
386 ATOM 7 CB ALA 4 8.653 -2.118 1.301 0.032
387 ATOM 8 CA CYS 5 8.551 -5.557 -0.591 0.030
388 ATOM 9 CB CYS 5 8.713 -5.318 -1.835 0.045
389 ATOM 10 CA ALA 6 11.328 -8.025 0.172 0.028
390 ATOM 11 CB ALA 6 11.968 -8.174 0.543 0.167
391 ATOM 12 CA ALA 7 11.008 -11.677 -0.771 0.014
392 ATOM 13 CB ALA 7 11.495 -11.553 -1.294 0.151
393 ATOM 14 CA ALA 8 12.358 -14.832 0.931 0.071
394 ATOM 15 CB ALA 8 12.365 -14.905 1.670 0.016
395 ATOM 16 CA ALA 9 12.160 -17.874 -1.284 0.014
396 ATOM 17 CB ALA 9 12.169 -18.522 -1.720 0.084
397 ATOM 18 CA ALA 10 15.771 -17.659 -2.539 0.024
398 ATOM 19 CB ALA 10 16.228 -17.068 -2.333 0.084
399 ATOM 20 CA ALA 11 17.737 -20.908 -2.786 0.037
400 ATOM 21 CB ALA 11 17.633 -21.391 -3.331 0.078
401 ATOM 22 CA ALA 12 21.296 -20.924 -1.387 0.006
402 ATOM 23 CB ALA 12 21.285 -20.743 -0.711 0.092
403 ATOM 24 CA ALA 13 24.449 -22.950 -2.042 0.004
404 ATOM 25 CB ALA 13 25.151 -22.911 -2.101 0.083
405 ATOM 26 CA CYS 14 24.839 -26.580 -0.887 0.007
406 ATOM 27 CB CYS 14 23.748 -27.075 -1.046 0.051
407 ATOM 28 CA ALA 15 28.126 -28.224 0.198 0.018
408 ATOM 29 CB ALA 15 28.557 -28.579 -0.269 0.038
409 ATOM 30 CA ALA 16 30.352 -26.136 2.285 0.007
410 ATOM 31 CB ALA 16 30.522 -26.320 3.011 0.037
411 ATOM 32 CA ALA 17 33.016 -23.505 1.547 0.052
412 ATOM 33 CB ALA 17 32.504 -22.933 1.463 0.068
413 ATOM 34 CA GLY 18 35.716 -22.438 4.105 0.000
433 REMARK time 217.84 ENERGY 2.99297E+01
434 ATOM 1 CA GLY 1 4.572 4.939 0.850 0.008
435 ATOM 2 CA ALA 2 6.091 2.585 3.475 0.025
436 ATOM 3 CB ALA 2 5.993 2.701 4.227 0.046
437 ATOM 4 CA ALA 3 4.942 -0.949 2.648 0.013
438 ATOM 5 CB ALA 3 4.404 -0.912 2.059 0.056
439 ATOM 6 CA ALA 4 7.755 -3.504 2.338 0.041
440 ATOM 7 CB ALA 4 7.859 -3.960 2.876 0.001
441 ATOM 8 CA CYS 5 9.246 -5.151 -0.699 0.012
442 ATOM 9 CB CYS 5 10.298 -4.435 -0.794 0.025
443 ATOM 10 CA ALA 6 10.204 -8.825 -0.539 0.008
444 ATOM 11 CB ALA 6 10.188 -9.030 0.129 0.039
445 ATOM 12 CA ALA 7 11.075 -11.819 -2.658 0.007
446 ATOM 13 CB ALA 7 11.780 -11.837 -2.952 0.027
447 ATOM 14 CA ALA 8 12.091 -15.002 -0.844 0.008
448 ATOM 15 CB ALA 8 11.925 -14.626 -0.249 0.027
449 ATOM 16 CA ALA 9 11.506 -18.441 -2.349 0.009
450 ATOM 17 CB ALA 9 11.232 -18.842 -2.882 0.060
451 ATOM 18 CA ALA 10 15.188 -18.965 -3.340 0.013
452 ATOM 19 CB ALA 10 15.395 -18.794 -4.024 0.075
453 ATOM 20 CA ALA 11 17.888 -19.739 -0.748 0.010
454 ATOM 21 CB ALA 11 17.844 -20.420 -0.482 0.042
455 ATOM 22 CA ALA 12 21.474 -20.533 -1.620 0.013
456 ATOM 23 CB ALA 12 21.939 -19.926 -1.327 0.002
457 ATOM 24 CA ALA 13 23.681 -23.640 -2.150 0.004
458 ATOM 25 CB ALA 13 23.878 -23.330 -2.872 0.027
459 ATOM 26 CA CYS 14 25.739 -25.288 0.635 0.020
460 ATOM 27 CB CYS 14 24.910 -26.247 0.872 0.015
461 ATOM 28 CA ALA 15 27.932 -28.091 -0.376 0.004
462 ATOM 29 CB ALA 15 28.303 -27.830 -1.066 0.060
463 ATOM 30 CA ALA 16 31.219 -26.507 0.828 0.055
464 ATOM 31 CB ALA 16 31.277 -27.260 1.133 0.248
465 ATOM 32 CA ALA 17 32.062 -23.259 2.728 0.098
466 ATOM 33 CB ALA 17 31.625 -23.376 3.127 0.279
467 ATOM 34 CA GLY 18 35.466 -21.845 3.922 0.000
487 REMARK time 241.24 ENERGY 1.12832E+01
488 ATOM 1 CA GLY 1 5.469 3.714 -0.900 0.001
489 ATOM 2 CA ALA 2 6.761 3.914 2.691 0.026
490 ATOM 3 CB ALA 2 6.384 4.239 3.220 0.007
491 ATOM 4 CA ALA 3 6.266 0.215 3.386 0.004
492 ATOM 5 CB ALA 3 5.611 -0.099 3.357 0.059
493 ATOM 6 CA ALA 4 8.353 -2.778 2.306 0.011
494 ATOM 7 CB ALA 4 9.032 -2.818 2.628 0.053
495 ATOM 8 CA CYS 5 7.826 -6.484 1.440 0.013
496 ATOM 9 CB CYS 5 7.230 -6.331 0.408 0.054
497 ATOM 10 CA ALA 6 10.355 -9.296 0.927 0.026
498 ATOM 11 CB ALA 6 10.564 -9.253 1.623 0.118
499 ATOM 12 CA ALA 7 10.663 -12.058 -1.613 0.016
500 ATOM 13 CB ALA 7 10.800 -11.675 -2.293 0.028
501 ATOM 14 CA ALA 8 12.148 -15.590 -2.095 0.028
502 ATOM 15 CB ALA 8 12.682 -15.338 -1.599 0.076
503 ATOM 16 CA ALA 9 12.078 -17.611 -5.395 0.026
504 ATOM 17 CB ALA 9 11.960 -17.590 -6.151 0.055
505 ATOM 18 CA ALA 10 15.306 -19.285 -4.400 0.004
506 ATOM 19 CB ALA 10 15.630 -18.974 -5.053 0.041
507 ATOM 20 CA ALA 11 16.638 -21.079 -1.279 0.016
508 ATOM 21 CB ALA 11 16.518 -21.704 -0.894 0.016
509 ATOM 22 CA ALA 12 20.344 -21.000 -0.474 0.050
510 ATOM 23 CB ALA 12 20.783 -20.669 0.035 0.076
511 ATOM 24 CA ALA 13 22.601 -23.881 -1.612 0.038
512 ATOM 25 CB ALA 13 22.426 -24.144 -2.232 0.117
513 ATOM 26 CA CYS 14 26.249 -23.930 -0.529 0.076
514 ATOM 27 CB CYS 14 26.111 -23.816 0.686 0.032
515 ATOM 28 CA ALA 15 28.235 -26.989 0.206 0.018
516 ATOM 29 CB ALA 15 28.396 -27.233 -0.517 0.026
517 ATOM 30 CA ALA 16 31.994 -26.955 1.035 0.012
518 ATOM 31 CB ALA 16 32.617 -26.810 0.526 0.143
519 ATOM 32 CA ALA 17 32.444 -23.925 3.274 0.045
520 ATOM 33 CB ALA 17 32.200 -24.436 3.725 0.094
521 ATOM 34 CA GLY 18 35.920 -22.729 4.373 0.000
541 REMARK time 265.73 ENERGY 4.09982E+00
542 ATOM 1 CA GLY 1 3.593 3.588 0.750 0.004
543 ATOM 2 CA ALA 2 7.251 4.205 1.397 0.024
544 ATOM 3 CB ALA 2 7.566 4.683 1.935 0.013
545 ATOM 4 CA ALA 3 7.639 0.836 3.161 0.002
546 ATOM 5 CB ALA 3 7.456 0.774 3.778 0.028
547 ATOM 6 CA ALA 4 7.975 -2.661 1.498 0.003
548 ATOM 7 CB ALA 4 8.357 -2.518 0.880 0.036
549 ATOM 8 CA CYS 5 8.009 -6.250 2.587 0.010
550 ATOM 9 CB CYS 5 6.950 -6.490 3.117 0.001
551 ATOM 10 CA ALA 6 9.897 -8.900 0.500 0.016
552 ATOM 11 CB ALA 6 10.619 -8.852 0.661 0.111
553 ATOM 12 CA ALA 7 9.225 -12.184 -1.341 0.030
554 ATOM 13 CB ALA 7 8.753 -12.523 -1.770 0.074
555 ATOM 14 CA ALA 8 11.877 -14.590 -2.690 0.015
556 ATOM 15 CB ALA 8 12.252 -14.690 -2.055 0.034
557 ATOM 16 CA ALA 9 11.230 -17.625 -4.924 0.009
558 ATOM 17 CB ALA 9 11.264 -17.519 -5.628 0.037
559 ATOM 18 CA ALA 10 14.513 -19.557 -5.511 0.034
560 ATOM 19 CB ALA 10 15.030 -19.279 -5.969 0.209
561 ATOM 20 CA ALA 11 16.338 -21.536 -2.951 0.087
562 ATOM 21 CB ALA 11 16.068 -22.137 -3.188 0.032
563 ATOM 22 CA ALA 12 20.106 -22.134 -2.515 0.110
564 ATOM 23 CB ALA 12 20.593 -21.614 -2.439 0.308
565 ATOM 24 CA ALA 13 22.309 -25.047 -1.266 0.014
566 ATOM 25 CB ALA 13 22.245 -25.051 -1.956 0.175
567 ATOM 26 CA CYS 14 25.792 -23.901 0.012 0.040
568 ATOM 27 CB CYS 14 25.339 -22.745 0.306 0.005
569 ATOM 28 CA ALA 15 28.863 -26.034 0.864 0.030
570 ATOM 29 CB ALA 15 29.373 -25.876 0.293 0.050
571 ATOM 30 CA ALA 16 31.852 -25.894 3.306 0.043
572 ATOM 31 CB ALA 16 31.842 -26.452 3.795 0.098
573 ATOM 32 CA ALA 17 35.551 -24.914 3.050 0.019
574 ATOM 33 CB ALA 17 35.994 -24.273 3.116 0.104
575 ATOM 34 CA GLY 18 37.920 -25.707 5.995 0.000
595 REMARK time 289.03 ENERGY 1.51157E+01
596 ATOM 1 CA GLY 1 4.210 2.880 5.139 0.018
597 ATOM 2 CA ALA 2 6.335 4.170 2.328 0.020
598 ATOM 3 CB ALA 2 6.933 4.676 2.450 0.015
599 ATOM 4 CA ALA 3 7.995 0.725 1.851 0.005
600 ATOM 5 CB ALA 3 8.348 0.577 2.485 0.050
601 ATOM 6 CA ALA 4 7.374 -2.527 0.163 0.001
602 ATOM 7 CB ALA 4 7.625 -2.510 -0.581 0.047
603 ATOM 8 CA CYS 5 8.227 -6.214 0.915 0.010
604 ATOM 9 CB CYS 5 7.770 -6.610 2.009 0.010
605 ATOM 10 CA ALA 6 9.627 -8.905 -1.358 0.021
606 ATOM 11 CB ALA 6 10.217 -8.687 -1.773 0.055
607 ATOM 12 CA ALA 7 10.472 -12.423 -0.503 0.029
608 ATOM 13 CB ALA 7 9.942 -12.832 -0.230 0.020
609 ATOM 14 CA ALA 8 12.408 -15.078 -2.602 0.052
610 ATOM 15 CB ALA 8 13.101 -14.742 -2.646 0.017
611 ATOM 16 CA ALA 9 11.535 -18.685 -1.882 0.026
612 ATOM 17 CB ALA 9 10.760 -18.736 -1.922 0.032
613 ATOM 18 CA ALA 10 13.598 -19.748 -4.909 0.065
614 ATOM 19 CB ALA 10 13.722 -19.050 -4.848 0.108
615 ATOM 20 CA ALA 11 16.699 -21.747 -4.007 0.046
616 ATOM 21 CB ALA 11 16.774 -21.998 -4.784 0.151
617 ATOM 22 CA ALA 12 20.383 -21.111 -3.111 0.038
618 ATOM 23 CB ALA 12 20.425 -20.791 -2.377 0.106
619 ATOM 24 CA ALA 13 22.606 -23.818 -1.780 0.004
620 ATOM 25 CB ALA 13 22.584 -24.304 -2.254 0.050
621 ATOM 26 CA CYS 14 25.660 -23.196 0.336 0.027
622 ATOM 27 CB CYS 14 25.992 -22.326 1.113 0.013
623 ATOM 28 CA ALA 15 29.071 -24.838 0.232 0.011
624 ATOM 29 CB ALA 15 29.198 -24.459 -0.356 0.344
625 ATOM 30 CA ALA 16 31.447 -26.217 3.031 0.013
626 ATOM 31 CB ALA 16 31.376 -26.889 2.787 0.047
627 ATOM 32 CA ALA 17 34.458 -25.222 5.223 0.005
628 ATOM 33 CB ALA 17 34.590 -25.401 5.894 0.165
629 ATOM 34 CA GLY 18 36.930 -27.275 3.310 0.000
649 REMARK time 319.03 ENERGY 2.60926E+00
650 ATOM 1 CA GLY 1 9.175 1.132 5.828 0.011
651 ATOM 2 CA ALA 2 5.657 1.291 4.401 0.022
652 ATOM 3 CB ALA 2 5.240 1.971 4.213 0.012
653 ATOM 4 CA ALA 3 6.869 0.166 0.899 0.027
654 ATOM 5 CB ALA 3 7.421 0.625 0.688 0.072
655 ATOM 6 CA ALA 4 7.160 -3.430 -0.604 0.009
656 ATOM 7 CB ALA 4 6.753 -3.584 -1.242 0.015
657 ATOM 8 CA CYS 5 10.177 -5.642 -0.807 0.060
658 ATOM 9 CB CYS 5 10.261 -6.095 0.336 0.015
659 ATOM 10 CA ALA 6 10.536 -8.827 -2.722 0.039
660 ATOM 11 CB ALA 6 10.904 -8.997 -3.386 0.022
661 ATOM 12 CA ALA 7 9.540 -12.221 -1.210 0.006
662 ATOM 13 CB ALA 7 8.773 -12.307 -0.999 0.026
663 ATOM 14 CA ALA 8 11.852 -15.152 -1.712 0.056
664 ATOM 15 CB ALA 8 12.547 -15.257 -1.567 0.023
665 ATOM 16 CA ALA 9 10.420 -18.629 -2.434 0.016
666 ATOM 17 CB ALA 9 10.228 -19.118 -2.961 0.058
667 ATOM 18 CA ALA 10 13.758 -19.739 -3.896 0.040
668 ATOM 19 CB ALA 10 14.042 -19.478 -4.518 0.035
669 ATOM 20 CA ALA 11 16.541 -20.334 -1.315 0.063
670 ATOM 21 CB ALA 11 16.924 -20.822 -0.922 0.117
671 ATOM 22 CA ALA 12 20.057 -19.357 -0.754 0.014
672 ATOM 23 CB ALA 12 20.363 -19.005 -0.168 0.072
673 ATOM 24 CA ALA 13 23.066 -21.291 -1.804 0.002
674 ATOM 25 CB ALA 13 23.173 -20.683 -2.109 0.114
675 ATOM 26 CA CYS 14 25.636 -23.618 -0.118 0.017
676 ATOM 27 CB CYS 14 25.672 -24.907 -0.109 0.003
677 ATOM 28 CA ALA 15 29.286 -22.736 0.794 0.025
678 ATOM 29 CB ALA 15 29.750 -22.664 1.347 0.027
679 ATOM 30 CA ALA 16 31.760 -25.533 1.307 0.030
680 ATOM 31 CB ALA 16 32.438 -25.394 0.915 0.076
681 ATOM 32 CA ALA 17 32.458 -27.010 4.692 0.054
682 ATOM 33 CB ALA 17 31.999 -27.255 5.238 0.103
683 ATOM 34 CA GLY 18 36.112 -27.959 4.356 0.000
703 REMARK time 342.91 ENERGY 3.33459E+00
704 ATOM 1 CA GLY 1 10.068 2.779 4.507 0.010
705 ATOM 2 CA ALA 2 7.063 0.677 5.438 0.048
706 ATOM 3 CB ALA 2 6.786 1.219 5.793 0.021
707 ATOM 4 CA ALA 3 6.380 -0.548 1.888 0.029
708 ATOM 5 CB ALA 3 6.304 0.049 1.282 0.139
709 ATOM 6 CA ALA 4 6.749 -3.952 0.160 0.016
710 ATOM 7 CB ALA 4 6.237 -4.378 -0.290 0.027
711 ATOM 8 CA CYS 5 9.525 -5.594 -1.835 0.009
712 ATOM 9 CB CYS 5 9.767 -6.241 -0.799 0.006
713 ATOM 10 CA ALA 6 9.544 -8.366 -4.452 0.003
714 ATOM 11 CB ALA 6 9.753 -8.060 -5.136 0.183
715 ATOM 12 CA ALA 7 10.020 -11.700 -2.609 0.012
716 ATOM 13 CB ALA 7 9.559 -11.623 -2.045 0.189
717 ATOM 14 CA ALA 8 11.229 -15.108 -3.653 0.021
718 ATOM 15 CB ALA 8 11.797 -14.782 -3.877 0.118
719 ATOM 16 CA ALA 9 10.561 -18.427 -1.833 0.031
720 ATOM 17 CB ALA 9 10.021 -18.842 -1.944 0.100
721 ATOM 18 CA ALA 10 13.891 -19.900 -3.037 0.006
722 ATOM 19 CB ALA 10 14.245 -19.647 -3.674 0.202
723 ATOM 20 CA ALA 11 16.695 -20.628 -0.615 0.003
724 ATOM 21 CB ALA 11 17.016 -21.325 -0.387 0.081
725 ATOM 22 CA ALA 12 20.079 -19.446 0.547 0.002
726 ATOM 23 CB ALA 12 20.245 -19.535 1.344 0.061
727 ATOM 24 CA ALA 13 23.457 -20.465 -0.904 0.005
728 ATOM 25 CB ALA 13 23.563 -19.758 -0.954 0.148
729 ATOM 26 CA CYS 14 25.668 -23.187 0.558 0.005
730 ATOM 27 CB CYS 14 26.034 -24.173 -0.063 0.088
731 ATOM 28 CA ALA 15 29.444 -22.731 1.146 0.012
732 ATOM 29 CB ALA 15 29.457 -22.118 1.488 0.106
733 ATOM 30 CA ALA 16 31.384 -25.979 1.047 0.018
734 ATOM 31 CB ALA 16 31.944 -26.029 0.466 0.131
735 ATOM 32 CA ALA 17 33.031 -27.574 4.065 0.004
736 ATOM 33 CB ALA 17 32.347 -28.051 4.061 0.035
737 ATOM 34 CA GLY 18 36.515 -28.816 4.785 0.000
757 REMARK time 371.54 ENERGY 5.11938E+00
758 ATOM 1 CA GLY 1 6.785 4.475 6.056 0.029
759 ATOM 2 CA ALA 2 9.321 2.220 4.312 0.027
760 ATOM 3 CB ALA 2 9.661 1.960 4.975 0.123
761 ATOM 4 CA ALA 3 8.349 -0.083 1.422 0.008
762 ATOM 5 CB ALA 3 8.937 -0.040 1.022 0.025
763 ATOM 6 CA ALA 4 6.643 -3.513 1.504 0.016
764 ATOM 7 CB ALA 4 6.055 -3.690 1.781 0.087
765 ATOM 8 CA CYS 5 6.623 -5.699 -1.634 0.027
766 ATOM 9 CB CYS 5 7.696 -6.119 -1.742 0.044
767 ATOM 10 CA ALA 6 5.972 -9.113 -3.318 0.031
768 ATOM 11 CB ALA 6 5.551 -9.259 -3.885 0.010
769 ATOM 12 CA ALA 7 9.090 -11.230 -3.931 0.004
770 ATOM 13 CB ALA 7 9.502 -11.426 -3.359 0.051
771 ATOM 14 CA ALA 8 9.504 -14.820 -5.154 0.028
772 ATOM 15 CB ALA 8 9.951 -15.007 -5.754 0.037
773 ATOM 16 CA ALA 9 11.465 -17.342 -3.176 0.011
774 ATOM 17 CB ALA 9 11.144 -18.063 -3.358 0.172
775 ATOM 18 CA ALA 10 15.243 -18.110 -2.982 0.013
776 ATOM 19 CB ALA 10 15.693 -17.544 -2.739 0.034
777 ATOM 20 CA ALA 11 17.289 -21.121 -1.916 0.022
778 ATOM 21 CB ALA 11 17.570 -21.251 -2.609 0.145
779 ATOM 22 CA ALA 12 20.057 -21.363 0.666 0.002
780 ATOM 23 CB ALA 12 19.488 -21.588 1.122 0.046
781 ATOM 24 CA ALA 13 23.785 -21.777 0.018 0.008
782 ATOM 25 CB ALA 13 24.184 -21.732 -0.638 0.072
783 ATOM 26 CA CYS 14 26.169 -23.066 2.798 0.034
784 ATOM 27 CB CYS 14 25.886 -24.098 3.251 0.046
785 ATOM 28 CA ALA 15 29.932 -23.433 2.031 0.023
786 ATOM 29 CB ALA 15 29.865 -22.745 2.413 0.032
787 ATOM 30 CA ALA 16 32.374 -26.065 0.921 0.007
788 ATOM 31 CB ALA 16 32.736 -26.540 0.539 0.090
789 ATOM 32 CA ALA 17 34.687 -27.715 3.518 0.011
790 ATOM 33 CB ALA 17 34.099 -27.726 3.839 0.026
791 ATOM 34 CA GLY 18 37.251 -30.286 2.495 0.000
811 REMARK time 397.98 ENERGY 1.22854E+01
812 ATOM 1 CA GLY 1 7.979 5.948 5.687 0.001
813 ATOM 2 CA ALA 2 8.473 2.519 4.140 0.021
814 ATOM 3 CB ALA 2 8.529 2.258 4.937 0.093
815 ATOM 4 CA ALA 3 6.326 0.272 1.850 0.029
816 ATOM 5 CB ALA 3 6.963 0.176 1.703 0.065
817 ATOM 6 CA ALA 4 7.491 -3.078 0.586 0.011
818 ATOM 7 CB ALA 4 6.762 -3.117 1.051 0.414
819 ATOM 8 CA CYS 5 6.348 -5.268 -2.282 0.014
820 ATOM 9 CB CYS 5 6.916 -4.970 -3.273 0.002
821 ATOM 10 CA ALA 6 6.341 -9.037 -2.218 0.024
822 ATOM 11 CB ALA 6 5.737 -9.301 -2.468 0.336
823 ATOM 12 CA ALA 7 9.175 -11.313 -3.042 0.011
824 ATOM 13 CB ALA 7 9.910 -11.064 -2.739 0.016
825 ATOM 14 CA ALA 8 9.431 -14.914 -4.198 0.017
826 ATOM 15 CB ALA 8 9.661 -14.515 -4.771 0.010
827 ATOM 16 CA ALA 9 11.844 -17.345 -2.625 0.016
828 ATOM 17 CB ALA 9 11.599 -17.891 -2.247 0.045
829 ATOM 18 CA ALA 10 15.450 -18.325 -3.300 0.008
830 ATOM 19 CB ALA 10 15.644 -17.638 -3.339 0.021
831 ATOM 20 CA ALA 11 17.592 -21.451 -2.870 0.004
832 ATOM 21 CB ALA 11 17.751 -21.487 -3.639 0.020
833 ATOM 22 CA ALA 12 20.212 -22.031 -0.127 0.030
834 ATOM 23 CB ALA 12 19.831 -22.335 0.450 0.003
835 ATOM 24 CA ALA 13 23.948 -21.846 0.185 0.003
836 ATOM 25 CB ALA 13 24.189 -21.156 0.295 0.003
837 ATOM 26 CA CYS 14 25.902 -24.248 2.474 0.000
838 ATOM 27 CB CYS 14 25.808 -25.338 1.908 0.011
839 ATOM 28 CA ALA 15 29.586 -24.209 3.155 0.005
840 ATOM 29 CB ALA 15 29.834 -24.004 3.823 0.025
841 ATOM 30 CA ALA 16 32.523 -26.005 1.626 0.002
842 ATOM 31 CB ALA 16 32.419 -25.539 1.035 0.008
843 ATOM 32 CA ALA 17 35.190 -28.170 3.323 0.005
844 ATOM 33 CB ALA 17 35.097 -28.798 3.746 0.021
845 ATOM 34 CA GLY 18 38.701 -29.107 2.160 0.000
865 REMARK time 421.31 ENERGY 7.60323E+00
866 ATOM 1 CA GLY 1 5.804 5.303 5.992 0.048
867 ATOM 2 CA ALA 2 7.612 3.798 2.994 0.014
868 ATOM 3 CB ALA 2 8.252 3.534 3.112 0.159
869 ATOM 4 CA ALA 3 6.304 0.655 1.527 0.005
870 ATOM 5 CB ALA 3 5.985 1.266 1.253 0.049
871 ATOM 6 CA ALA 4 7.461 -2.907 1.079 0.038
872 ATOM 7 CB ALA 4 7.423 -3.105 1.904 0.026
873 ATOM 8 CA CYS 5 6.294 -5.082 -1.790 0.024
874 ATOM 9 CB CYS 5 7.141 -5.002 -2.582 0.047
875 ATOM 10 CA ALA 6 6.510 -8.792 -2.234 0.008
876 ATOM 11 CB ALA 6 6.258 -9.457 -2.439 0.007
877 ATOM 12 CA ALA 7 9.585 -11.064 -2.632 0.009
878 ATOM 13 CB ALA 7 9.778 -11.408 -1.942 0.055
879 ATOM 14 CA ALA 8 10.288 -14.306 -4.326 0.028
880 ATOM 15 CB ALA 8 10.662 -14.520 -4.824 0.080
881 ATOM 16 CA ALA 9 11.822 -16.980 -2.205 0.004
882 ATOM 17 CB ALA 9 11.624 -17.456 -2.800 0.081
883 ATOM 18 CA ALA 10 15.428 -18.121 -2.719 0.055
884 ATOM 19 CB ALA 10 16.153 -18.078 -2.527 0.024
885 ATOM 20 CA ALA 11 17.574 -21.233 -2.615 0.051
886 ATOM 21 CB ALA 11 18.244 -21.364 -2.833 0.084
887 ATOM 22 CA ALA 12 19.654 -22.806 0.104 0.008
888 ATOM 23 CB ALA 12 19.294 -23.336 0.363 0.010
889 ATOM 24 CA ALA 13 23.424 -22.921 0.050 0.003
890 ATOM 25 CB ALA 13 23.809 -22.281 -0.034 0.016
891 ATOM 26 CA CYS 14 25.998 -25.249 1.550 0.003
892 ATOM 27 CB CYS 14 26.272 -26.131 0.621 0.005
893 ATOM 28 CA ALA 15 29.544 -24.485 2.744 0.002
894 ATOM 29 CB ALA 15 29.741 -24.554 3.458 0.010
895 ATOM 30 CA ALA 16 32.974 -25.486 1.611 0.011
896 ATOM 31 CB ALA 16 33.097 -24.959 1.176 0.021
897 ATOM 32 CA ALA 17 35.109 -28.060 3.442 0.005
898 ATOM 33 CB ALA 17 35.166 -28.740 3.492 0.009
899 ATOM 34 CA GLY 18 38.808 -28.763 3.346 0.000
919 REMARK time 447.37 ENERGY 6.95261E+00
920 ATOM 1 CA GLY 1 4.679 5.650 5.402 0.008
921 ATOM 2 CA ALA 2 6.536 4.367 2.383 0.019
922 ATOM 3 CB ALA 2 7.095 4.192 1.964 0.095
923 ATOM 4 CA ALA 3 5.309 0.957 1.489 0.024
924 ATOM 5 CB ALA 3 5.028 1.216 0.893 0.053
925 ATOM 6 CA ALA 4 6.483 -2.540 1.349 0.028
926 ATOM 7 CB ALA 4 6.281 -2.601 2.141 0.036
927 ATOM 8 CA CYS 5 7.337 -4.984 -1.368 0.028
928 ATOM 9 CB CYS 5 8.294 -4.328 -1.813 0.002
929 ATOM 10 CA ALA 6 7.506 -8.586 -2.061 0.031
930 ATOM 11 CB ALA 6 6.966 -9.059 -2.375 0.089
931 ATOM 12 CA ALA 7 10.584 -10.820 -1.694 0.106
932 ATOM 13 CB ALA 7 10.317 -11.111 -1.099 0.029
933 ATOM 14 CA ALA 8 10.356 -14.054 -3.743 0.066
934 ATOM 15 CB ALA 8 10.638 -13.602 -4.360 0.315
935 ATOM 16 CA ALA 9 12.177 -17.290 -2.726 0.039
936 ATOM 17 CB ALA 9 12.052 -17.899 -2.273 0.049
937 ATOM 18 CA ALA 10 15.787 -18.646 -2.970 0.059
938 ATOM 19 CB ALA 10 15.960 -17.960 -2.732 0.019
939 ATOM 20 CA ALA 11 17.103 -22.240 -2.604 0.071
940 ATOM 21 CB ALA 11 17.369 -21.930 -3.171 0.012
941 ATOM 22 CA ALA 12 19.646 -23.395 -0.032 0.050
942 ATOM 23 CB ALA 12 19.361 -23.942 0.399 0.047
943 ATOM 24 CA ALA 13 23.453 -23.037 -0.321 0.030
944 ATOM 25 CB ALA 13 23.645 -22.321 -0.371 0.008
945 ATOM 26 CA CYS 14 26.035 -25.305 1.156 0.006
946 ATOM 27 CB CYS 14 26.239 -26.275 0.349 0.009
947 ATOM 28 CA ALA 15 29.498 -24.856 2.494 0.004
948 ATOM 29 CB ALA 15 29.522 -24.531 3.118 0.022
949 ATOM 30 CA ALA 16 33.087 -25.913 1.782 0.014
950 ATOM 31 CB ALA 16 33.704 -25.494 1.535 0.034
951 ATOM 32 CA ALA 17 35.398 -28.482 3.404 0.000
952 ATOM 33 CB ALA 17 35.186 -29.144 3.124 0.000
953 ATOM 34 CA GLY 18 39.069 -28.045 3.606 0.000
973 REMARK time 468.33 ENERGY -1.69259E+00
974 ATOM 1 CA GLY 1 3.785 7.008 3.443 0.004
975 ATOM 2 CA ALA 2 6.280 4.203 2.624 0.032
976 ATOM 3 CB ALA 2 6.776 3.690 2.785 0.020
977 ATOM 4 CA ALA 3 5.027 0.866 1.133 0.003
978 ATOM 5 CB ALA 3 4.794 1.112 0.461 0.073
979 ATOM 6 CA ALA 4 6.185 -2.706 1.598 0.013
980 ATOM 7 CB ALA 4 5.777 -3.243 1.956 0.049
981 ATOM 8 CA CYS 5 7.783 -4.808 -1.175 0.034
982 ATOM 9 CB CYS 5 8.803 -4.136 -1.239 0.037
983 ATOM 10 CA ALA 6 7.441 -8.531 -2.065 0.023
984 ATOM 11 CB ALA 6 7.130 -8.588 -2.814 0.038
985 ATOM 12 CA ALA 7 9.921 -11.243 -1.388 0.063
986 ATOM 13 CB ALA 7 10.127 -11.231 -0.719 0.098
987 ATOM 14 CA ALA 8 10.864 -13.973 -3.700 0.028
988 ATOM 15 CB ALA 8 11.267 -13.339 -3.874 0.196
989 ATOM 16 CA ALA 9 12.239 -17.201 -2.296 0.028
990 ATOM 17 CB ALA 9 11.520 -17.388 -2.482 0.044
991 ATOM 18 CA ALA 10 15.879 -18.326 -1.827 0.070
992 ATOM 19 CB ALA 10 15.745 -17.900 -1.255 0.166
993 ATOM 20 CA ALA 11 17.469 -21.511 -3.291 0.065
994 ATOM 21 CB ALA 11 17.820 -21.742 -3.945 0.074
995 ATOM 22 CA ALA 12 19.709 -23.130 -0.658 0.016
996 ATOM 23 CB ALA 12 19.397 -23.541 -0.141 0.072
997 ATOM 24 CA ALA 13 23.565 -23.516 -0.648 0.030
998 ATOM 25 CB ALA 13 23.677 -22.900 -1.093 0.050
999 ATOM 26 CA CYS 14 25.905 -25.595 1.337 0.015
1000 ATOM 27 CB CYS 14 26.467 -26.595 0.825 0.002
1001 ATOM 28 CA ALA 15 29.574 -24.828 2.397 0.012
1002 ATOM 29 CB ALA 15 29.531 -24.408 2.977 0.012
1003 ATOM 30 CA ALA 16 33.019 -26.224 1.657 0.020
1004 ATOM 31 CB ALA 16 33.591 -25.728 1.430 0.019
1005 ATOM 32 CA ALA 17 35.512 -28.520 3.540 0.004
1006 ATOM 33 CB ALA 17 35.220 -29.162 3.678 0.053
1007 ATOM 34 CA GLY 18 39.238 -28.784 2.836 0.000
1027 REMARK time 493.13 ENERGY -1.32150E+00
1028 ATOM 1 CA GLY 1 4.188 6.367 4.474 0.011
1029 ATOM 2 CA ALA 2 6.031 4.153 2.020 0.041
1030 ATOM 3 CB ALA 2 6.638 4.190 2.373 0.017
1031 ATOM 4 CA ALA 3 4.298 1.274 0.222 0.030
1032 ATOM 5 CB ALA 3 3.970 1.259 -0.405 0.191
1033 ATOM 6 CA ALA 4 4.947 -2.524 0.522 0.012
1034 ATOM 7 CB ALA 4 4.274 -2.769 0.548 0.014
1035 ATOM 8 CA CYS 5 7.650 -4.818 -0.773 0.019
1036 ATOM 9 CB CYS 5 8.774 -4.205 -0.619 0.018
1037 ATOM 10 CA ALA 6 7.638 -8.561 -1.337 0.004
1038 ATOM 11 CB ALA 6 7.388 -9.043 -1.878 0.045
1039 ATOM 12 CA ALA 7 10.593 -10.862 -1.071 0.051
1040 ATOM 13 CB ALA 7 10.661 -10.966 -0.399 0.140
1041 ATOM 14 CA ALA 8 10.820 -13.644 -3.598 0.050
1042 ATOM 15 CB ALA 8 10.797 -13.031 -3.905 0.112
1043 ATOM 16 CA ALA 9 12.249 -17.071 -2.837 0.040
1044 ATOM 17 CB ALA 9 12.566 -16.775 -3.457 0.071
1045 ATOM 18 CA ALA 10 15.731 -18.284 -1.592 0.061
1046 ATOM 19 CB ALA 10 15.904 -17.733 -1.162 0.063
1047 ATOM 20 CA ALA 11 17.340 -21.693 -1.947 0.009
1048 ATOM 21 CB ALA 11 17.973 -21.649 -2.284 0.027
1049 ATOM 22 CA ALA 12 19.935 -23.081 0.437 0.044
1050 ATOM 23 CB ALA 12 19.751 -23.383 1.038 0.044
1051 ATOM 24 CA ALA 13 23.680 -23.108 -0.462 0.026
1052 ATOM 25 CB ALA 13 23.688 -22.341 -0.181 0.013
1053 ATOM 26 CA CYS 14 26.449 -25.480 0.482 0.014
1054 ATOM 27 CB CYS 14 26.499 -26.317 -0.476 0.027
1055 ATOM 28 CA ALA 15 30.021 -25.147 1.813 0.018
1056 ATOM 29 CB ALA 15 30.148 -25.054 2.481 0.016
1057 ATOM 30 CA ALA 16 33.487 -26.523 1.283 0.009
1058 ATOM 31 CB ALA 16 34.003 -26.116 0.909 0.018
1059 ATOM 32 CA ALA 17 35.188 -29.133 3.442 0.010
1060 ATOM 33 CB ALA 17 35.046 -29.874 3.298 0.015
1061 ATOM 34 CA GLY 18 38.869 -29.996 3.698 0.000
1081 REMARK time 520.02 ENERGY 2.68959E+00
1082 ATOM 1 CA GLY 1 2.564 6.933 2.695 0.028
1083 ATOM 2 CA ALA 2 5.171 4.162 2.734 0.002
1084 ATOM 3 CB ALA 2 4.983 4.019 3.480 0.056
1085 ATOM 4 CA ALA 3 5.207 1.839 -0.352 0.022
1086 ATOM 5 CB ALA 3 5.938 1.735 -0.560 0.032
1087 ATOM 6 CA ALA 4 4.786 -1.984 -0.531 0.039
1088 ATOM 7 CB ALA 4 4.090 -2.195 -0.447 0.044
1089 ATOM 8 CA CYS 5 7.261 -4.758 -1.345 0.016
1090 ATOM 9 CB CYS 5 8.277 -4.261 -0.990 0.013
1091 ATOM 10 CA ALA 6 6.383 -8.459 -1.677 0.012
1092 ATOM 11 CB ALA 6 6.362 -8.805 -2.296 0.036
1093 ATOM 12 CA ALA 7 8.350 -11.626 -0.935 0.068
1094 ATOM 13 CB ALA 7 7.705 -11.830 -0.999 0.050
1095 ATOM 14 CA ALA 8 11.574 -13.209 -2.083 0.016
1096 ATOM 15 CB ALA 8 12.180 -13.019 -1.823 0.042
1097 ATOM 16 CA ALA 9 12.979 -16.276 -0.594 0.018
1098 ATOM 17 CB ALA 9 12.697 -16.948 -0.481 0.180
1099 ATOM 18 CA ALA 10 16.239 -18.088 -0.672 0.036
1100 ATOM 19 CB ALA 10 16.220 -17.824 0.043 0.204
1101 ATOM 20 CA ALA 11 18.168 -21.180 -1.591 0.018
1102 ATOM 21 CB ALA 11 18.502 -20.959 -2.242 0.033
1103 ATOM 22 CA ALA 12 21.106 -22.894 0.091 0.003
1104 ATOM 23 CB ALA 12 20.576 -23.354 0.451 0.020
1105 ATOM 24 CA ALA 13 24.714 -22.596 -0.998 0.005
1106 ATOM 25 CB ALA 13 24.824 -21.837 -1.083 0.023
1107 ATOM 26 CA CYS 14 27.397 -25.293 -0.608 0.047
1108 ATOM 27 CB CYS 14 27.373 -26.133 -1.562 0.026
1109 ATOM 28 CA ALA 15 30.506 -25.218 1.643 0.065
1110 ATOM 29 CB ALA 15 30.319 -25.052 2.333 0.014
1111 ATOM 30 CA ALA 16 33.701 -27.200 1.424 0.013
1112 ATOM 31 CB ALA 16 34.209 -26.707 1.446 0.011
1113 ATOM 32 CA ALA 17 34.364 -30.633 3.007 0.027
1114 ATOM 33 CB ALA 17 34.176 -31.012 2.355 0.028
1115 ATOM 34 CA GLY 18 37.641 -31.704 4.272 0.000
1135 REMARK time 544.32 ENERGY 1.55088E-02
1136 ATOM 1 CA GLY 1 2.941 7.891 1.333 0.014
1137 ATOM 2 CA ALA 2 3.267 4.109 1.377 0.005
1138 ATOM 3 CB ALA 2 2.792 3.496 1.515 0.097
1139 ATOM 4 CA ALA 3 4.555 1.623 -1.152 0.005
1140 ATOM 5 CB ALA 3 5.244 1.694 -1.245 0.084
1141 ATOM 6 CA ALA 4 4.871 -2.187 -1.025 0.021
1142 ATOM 7 CB ALA 4 4.390 -2.678 -1.454 0.055
1143 ATOM 8 CA CYS 5 7.753 -4.516 -0.032 0.034
1144 ATOM 9 CB CYS 5 7.520 -5.123 1.004 0.037
1145 ATOM 10 CA ALA 6 7.461 -8.126 -1.180 0.096
1146 ATOM 11 CB ALA 6 7.654 -8.611 -1.843 0.004
1147 ATOM 12 CA ALA 7 9.035 -11.238 0.182 0.051
1148 ATOM 13 CB ALA 7 8.549 -11.779 0.269 0.072
1149 ATOM 14 CA ALA 8 11.907 -13.321 -1.429 0.050
1150 ATOM 15 CB ALA 8 12.571 -13.226 -1.143 0.108
1151 ATOM 16 CA ALA 9 13.158 -16.958 -1.269 0.059
1152 ATOM 17 CB ALA 9 12.879 -17.345 -1.793 0.059
1153 ATOM 18 CA ALA 10 16.377 -17.679 0.672 0.024
1154 ATOM 19 CB ALA 10 16.232 -17.649 1.373 0.047
1155 ATOM 20 CA ALA 11 18.702 -19.940 -1.177 0.005
1156 ATOM 21 CB ALA 11 19.205 -19.654 -1.562 0.134
1157 ATOM 22 CA ALA 12 21.876 -22.073 -0.633 0.020
1158 ATOM 23 CB ALA 12 21.911 -22.773 -0.786 0.076
1159 ATOM 24 CA ALA 13 25.621 -21.506 -0.061 0.028
1160 ATOM 25 CB ALA 13 25.632 -21.314 0.576 0.010
1161 ATOM 26 CA CYS 14 27.793 -24.422 -1.187 0.004
1162 ATOM 27 CB CYS 14 28.306 -24.700 -2.363 0.038
1163 ATOM 28 CA ALA 15 28.870 -26.953 1.394 0.050
1164 ATOM 29 CB ALA 15 28.538 -27.448 1.857 0.021
1165 ATOM 30 CA ALA 16 32.310 -28.559 1.048 0.012
1166 ATOM 31 CB ALA 16 32.878 -28.185 0.828 0.075
1167 ATOM 32 CA ALA 17 34.034 -31.507 2.695 0.006
1168 ATOM 33 CB ALA 17 33.861 -32.238 2.719 0.042
1169 ATOM 34 CA GLY 18 37.710 -30.706 3.473 0.000
1189 REMARK time 564.59 ENERGY 3.11099E+00
1190 ATOM 1 CA GLY 1 -0.009 6.106 -0.742 0.006
1191 ATOM 2 CA ALA 2 3.183 4.739 0.740 0.044
1192 ATOM 3 CB ALA 2 3.321 4.435 1.408 0.028
1193 ATOM 4 CA ALA 3 4.925 1.827 -1.135 0.021
1194 ATOM 5 CB ALA 3 5.586 1.834 -1.405 0.043
1195 ATOM 6 CA ALA 4 4.593 -1.970 -0.826 0.034
1196 ATOM 7 CB ALA 4 4.197 -2.190 -1.464 0.010
1197 ATOM 8 CA CYS 5 7.028 -4.820 -0.432 0.012
1198 ATOM 9 CB CYS 5 7.146 -4.878 0.821 0.020
1199 ATOM 10 CA ALA 6 7.325 -8.645 -0.637 0.020
1200 ATOM 11 CB ALA 6 7.547 -8.739 -1.285 0.008
1201 ATOM 12 CA ALA 7 9.093 -11.282 1.325 0.037
1202 ATOM 13 CB ALA 7 8.536 -11.507 1.656 0.143
1203 ATOM 14 CA ALA 8 12.391 -12.551 0.109 0.014
1204 ATOM 15 CB ALA 8 13.000 -12.481 0.464 0.032
1205 ATOM 16 CA ALA 9 13.227 -15.797 -1.618 0.002
1206 ATOM 17 CB ALA 9 13.346 -15.881 -2.349 0.012
1207 ATOM 18 CA ALA 10 15.464 -18.546 -0.275 0.029
1208 ATOM 19 CB ALA 10 15.341 -18.984 -0.896 0.038
1209 ATOM 20 CA ALA 11 19.248 -18.711 -0.412 0.039
1210 ATOM 21 CB ALA 11 19.615 -18.564 0.140 0.029
1211 ATOM 22 CA ALA 12 21.922 -21.361 -0.923 0.076
1212 ATOM 23 CB ALA 12 21.668 -21.812 -1.288 0.131
1213 ATOM 24 CA ALA 13 25.601 -21.872 -0.255 0.028
1214 ATOM 25 CB ALA 13 25.455 -21.184 0.234 0.062
1215 ATOM 26 CA CYS 14 27.811 -24.788 -0.961 0.021
1216 ATOM 27 CB CYS 14 27.954 -24.536 -2.155 0.006
1217 ATOM 28 CA ALA 15 30.167 -26.975 1.165 0.031
1218 ATOM 29 CB ALA 15 29.708 -27.278 1.679 0.174
1219 ATOM 30 CA ALA 16 33.556 -28.856 1.160 0.023
1220 ATOM 31 CB ALA 16 34.184 -28.509 1.128 0.099
1221 ATOM 32 CA ALA 17 34.078 -32.376 2.444 0.010
1222 ATOM 33 CB ALA 17 33.649 -32.883 2.266 0.005
1223 ATOM 34 CA GLY 18 37.194 -34.268 3.225 0.000
1243 REMARK time 590.63 ENERGY -2.37410E+00
1244 ATOM 1 CA GLY 1 1.217 7.445 -0.753 0.028
1245 ATOM 2 CA ALA 2 2.419 3.943 0.216 0.031
1246 ATOM 3 CB ALA 2 1.959 3.793 0.759 0.012
1247 ATOM 4 CA ALA 3 3.361 0.950 -1.949 0.009
1248 ATOM 5 CB ALA 3 4.001 1.303 -2.258 0.061
1249 ATOM 6 CA ALA 4 3.766 -2.775 -0.902 0.022
1250 ATOM 7 CB ALA 4 3.245 -3.095 -1.202 0.026
1251 ATOM 8 CA CYS 5 6.760 -4.560 0.493 0.042
1252 ATOM 9 CB CYS 5 6.551 -4.379 1.710 0.028
1253 ATOM 10 CA ALA 6 8.975 -7.319 -0.940 0.011
1254 ATOM 11 CB ALA 6 9.659 -7.301 -1.108 0.057
1255 ATOM 12 CA ALA 7 9.437 -10.979 0.230 0.059
1256 ATOM 13 CB ALA 7 9.134 -11.506 -0.205 0.031
1257 ATOM 14 CA ALA 8 12.882 -12.245 1.073 0.037
1258 ATOM 15 CB ALA 8 12.982 -12.423 1.795 0.053
1259 ATOM 16 CA ALA 9 14.428 -15.133 -0.817 0.004
1260 ATOM 17 CB ALA 9 14.597 -15.321 -1.440 0.018
1261 ATOM 18 CA ALA 10 17.201 -17.538 -0.263 0.003
1262 ATOM 19 CB ALA 10 17.175 -18.021 0.348 0.153
1263 ATOM 20 CA ALA 11 19.678 -19.453 -2.338 0.024
1264 ATOM 21 CB ALA 11 20.051 -18.793 -2.345 0.114
1265 ATOM 22 CA ALA 12 21.304 -22.539 -0.863 0.027
1266 ATOM 23 CB ALA 12 21.216 -23.173 -1.077 0.002
1267 ATOM 24 CA ALA 13 24.861 -22.300 0.468 0.063
1268 ATOM 25 CB ALA 13 25.336 -22.083 0.993 0.191
1269 ATOM 26 CA CYS 14 27.425 -25.176 0.811 0.048
1270 ATOM 27 CB CYS 14 27.337 -25.137 -0.419 0.058
1271 ATOM 28 CA ALA 15 30.648 -26.596 2.182 0.026
1272 ATOM 29 CB ALA 15 30.643 -26.791 3.011 0.015
1273 ATOM 30 CA ALA 16 33.677 -28.622 1.031 0.036
1274 ATOM 31 CB ALA 16 33.986 -27.950 1.003 0.018
1275 ATOM 32 CA ALA 17 33.226 -32.381 0.811 0.031
1276 ATOM 33 CB ALA 17 32.615 -32.472 0.379 0.019
1277 ATOM 34 CA GLY 18 36.315 -34.471 0.439 0.000
1297 REMARK time 615.10 ENERGY -1.01656E+00
1298 ATOM 1 CA GLY 1 -0.655 6.130 -1.795 0.002
1299 ATOM 2 CA ALA 2 1.004 3.320 0.068 0.031
1300 ATOM 3 CB ALA 2 0.556 2.860 0.451 0.035
1301 ATOM 4 CA ALA 3 3.685 1.356 -1.835 0.002
1302 ATOM 5 CB ALA 3 4.387 1.355 -1.647 0.017
1303 ATOM 6 CA ALA 4 3.446 -2.338 -1.071 0.052
1304 ATOM 7 CB ALA 4 3.011 -2.599 -1.622 0.066
1305 ATOM 8 CA CYS 5 5.967 -4.521 0.803 0.009
1306 ATOM 9 CB CYS 5 5.849 -4.532 2.029 0.029
1307 ATOM 10 CA ALA 6 8.082 -7.040 -0.945 0.052
1308 ATOM 11 CB ALA 6 8.600 -7.181 -1.450 0.260
1309 ATOM 12 CA ALA 7 10.794 -9.335 0.585 0.007
1310 ATOM 13 CB ALA 7 10.744 -9.788 1.223 0.068
1311 ATOM 14 CA ALA 8 13.969 -10.888 -0.696 0.010
1312 ATOM 15 CB ALA 8 14.345 -10.232 -0.455 0.154
1313 ATOM 16 CA ALA 9 15.405 -14.247 -1.535 0.076
1314 ATOM 17 CB ALA 9 15.107 -14.216 -2.273 0.040
1315 ATOM 18 CA ALA 10 18.498 -15.928 0.018 0.041
1316 ATOM 19 CB ALA 10 18.393 -16.214 0.640 0.015
1317 ATOM 20 CA ALA 11 20.157 -19.173 -1.141 0.024
1318 ATOM 21 CB ALA 11 20.730 -19.191 -1.734 0.036
1319 ATOM 22 CA ALA 12 21.369 -22.190 0.587 0.020
1320 ATOM 23 CB ALA 12 21.307 -22.922 0.603 0.119
1321 ATOM 24 CA ALA 13 24.779 -23.883 1.132 0.007
1322 ATOM 25 CB ALA 13 25.163 -23.807 1.689 0.020
1323 ATOM 26 CA CYS 14 26.529 -27.240 1.523 0.014
1324 ATOM 27 CB CYS 14 26.422 -27.837 0.416 0.029
1325 ATOM 28 CA ALA 15 30.061 -27.965 2.583 0.057
1326 ATOM 29 CB ALA 15 29.782 -28.213 3.272 0.082
1327 ATOM 30 CA ALA 16 32.720 -28.721 0.024 0.005
1328 ATOM 31 CB ALA 16 33.099 -28.311 -0.489 0.037
1329 ATOM 32 CA ALA 17 34.320 -32.167 0.052 0.037
1330 ATOM 33 CB ALA 17 33.946 -32.598 -0.456 0.092
1331 ATOM 34 CA GLY 18 37.952 -32.740 -0.829 0.000
1351 REMARK time 639.74 ENERGY -5.91943E-01
1352 ATOM 1 CA GLY 1 -3.439 4.580 -2.374 0.069
1353 ATOM 2 CA ALA 2 -0.783 2.433 -0.694 0.036
1354 ATOM 3 CB ALA 2 -0.669 1.851 -0.334 0.036
1355 ATOM 4 CA ALA 3 2.511 0.744 -1.205 0.007
1356 ATOM 5 CB ALA 3 2.938 1.302 -1.259 0.121
1357 ATOM 6 CA ALA 4 3.814 -2.604 -0.192 0.005
1358 ATOM 7 CB ALA 4 3.453 -3.289 -0.469 0.022
1359 ATOM 8 CA CYS 5 7.357 -3.845 0.544 0.002
1360 ATOM 9 CB CYS 5 7.619 -3.326 1.631 0.001
1361 ATOM 10 CA ALA 6 9.432 -6.349 -1.467 0.031
1362 ATOM 11 CB ALA 6 9.513 -6.277 -2.197 0.033
1363 ATOM 12 CA ALA 7 12.373 -8.254 -0.009 0.028
1364 ATOM 13 CB ALA 7 12.037 -8.586 0.617 0.397
1365 ATOM 14 CA ALA 8 15.027 -10.583 -1.336 0.031
1366 ATOM 15 CB ALA 8 15.658 -10.289 -1.106 0.031
1367 ATOM 16 CA ALA 9 15.229 -14.446 -1.101 0.035
1368 ATOM 17 CB ALA 9 15.179 -14.886 -1.692 0.041
1369 ATOM 18 CA ALA 10 18.267 -15.846 0.935 0.011
1370 ATOM 19 CB ALA 10 17.886 -16.017 1.566 0.028
1371 ATOM 20 CA ALA 11 20.635 -18.689 0.121 0.004
1372 ATOM 21 CB ALA 11 21.273 -18.615 -0.173 0.021
1373 ATOM 22 CA ALA 12 21.606 -21.728 2.183 0.008
1374 ATOM 23 CB ALA 12 21.396 -22.280 2.657 0.049
1375 ATOM 24 CA ALA 13 24.529 -24.064 1.505 0.008
1376 ATOM 25 CB ALA 13 24.726 -24.122 2.125 0.046
1377 ATOM 26 CA CYS 14 25.469 -27.473 0.196 0.019
1378 ATOM 27 CB CYS 14 25.958 -27.521 -0.909 0.032
1379 ATOM 28 CA ALA 15 28.627 -29.312 1.508 0.012
1380 ATOM 29 CB ALA 15 28.829 -29.992 1.790 0.110
1381 ATOM 30 CA ALA 16 31.933 -29.760 -0.354 0.022
1382 ATOM 31 CB ALA 16 32.274 -29.199 -0.687 0.086
1383 ATOM 32 CA ALA 17 34.784 -32.197 -0.550 0.010
1384 ATOM 33 CB ALA 17 35.222 -32.758 -0.498 0.059
1385 ATOM 34 CA GLY 18 38.106 -30.835 0.656 0.000
1405 REMARK time 665.01 ENERGY 7.41746E+00
1406 ATOM 1 CA GLY 1 -4.320 -0.229 -2.191 0.008
1407 ATOM 2 CA ALA 2 -1.239 1.287 -0.496 0.020
1408 ATOM 3 CB ALA 2 -1.556 1.624 0.128 0.009
1409 ATOM 4 CA ALA 3 2.433 0.524 -1.363 0.007
1410 ATOM 5 CB ALA 3 3.025 0.719 -1.801 0.048
1411 ATOM 6 CA ALA 4 4.638 -2.333 -0.123 0.028
1412 ATOM 7 CB ALA 4 4.043 -2.817 -0.125 0.035
1413 ATOM 8 CA CYS 5 8.192 -3.261 -1.059 0.012
1414 ATOM 9 CB CYS 5 9.153 -2.749 -0.440 0.001
1415 ATOM 10 CA ALA 6 9.747 -6.734 -0.429 0.016
1416 ATOM 11 CB ALA 6 9.710 -7.067 -0.962 0.006
1417 ATOM 12 CA ALA 7 12.993 -7.525 1.250 0.101
1418 ATOM 13 CB ALA 7 12.777 -7.620 1.965 0.105
1419 ATOM 14 CA ALA 8 15.330 -9.945 -0.689 0.048
1420 ATOM 15 CB ALA 8 16.015 -9.950 -0.880 0.180
1421 ATOM 16 CA ALA 9 15.291 -13.562 -0.344 0.024
1422 ATOM 17 CB ALA 9 14.974 -13.940 -0.872 0.203
1423 ATOM 18 CA ALA 10 18.229 -15.734 0.804 0.048
1424 ATOM 19 CB ALA 10 18.596 -15.880 1.523 0.025
1425 ATOM 20 CA ALA 11 19.951 -19.015 -0.085 0.007
1426 ATOM 21 CB ALA 11 20.619 -19.085 -0.168 0.020
1427 ATOM 22 CA ALA 12 20.452 -22.533 1.369 0.007
1428 ATOM 23 CB ALA 12 20.057 -23.098 1.111 0.089
1429 ATOM 24 CA ALA 13 24.132 -23.646 1.923 0.038
1430 ATOM 25 CB ALA 13 24.577 -23.742 2.463 0.042
1431 ATOM 26 CA CYS 14 26.090 -26.285 0.008 0.023
1432 ATOM 27 CB CYS 14 26.559 -25.735 -1.001 0.003
1433 ATOM 28 CA ALA 15 28.424 -28.952 1.114 0.016
1434 ATOM 29 CB ALA 15 28.150 -29.584 1.110 0.025
1435 ATOM 30 CA ALA 16 32.225 -29.197 0.208 0.030
1436 ATOM 31 CB ALA 16 32.803 -28.985 0.742 0.057
1437 ATOM 32 CA ALA 17 33.914 -32.411 -0.815 0.018
1438 ATOM 33 CB ALA 17 34.267 -32.292 -1.489 0.015
1439 ATOM 34 CA GLY 18 36.759 -34.298 0.730 0.000
1459 REMARK time 690.11 ENERGY 3.20546E+00
1460 ATOM 1 CA GLY 1 -4.235 2.563 -1.022 0.008
1461 ATOM 2 CA ALA 2 -0.619 1.404 -0.359 0.023
1462 ATOM 3 CB ALA 2 -0.229 1.505 0.188 0.017
1463 ATOM 4 CA ALA 3 1.070 -1.520 -1.845 0.040
1464 ATOM 5 CB ALA 3 1.097 -1.326 -2.502 0.040
1465 ATOM 6 CA ALA 4 4.221 -3.293 -0.522 0.031
1466 ATOM 7 CB ALA 4 4.046 -3.887 -0.126 0.031
1467 ATOM 8 CA CYS 5 7.909 -3.001 -1.080 0.014
1468 ATOM 9 CB CYS 5 8.209 -2.330 -0.051 0.002
1469 ATOM 10 CA ALA 6 10.274 -5.825 -2.108 0.040
1470 ATOM 11 CB ALA 6 10.593 -5.649 -2.750 0.056
1471 ATOM 12 CA ALA 7 12.263 -7.418 0.836 0.047
1472 ATOM 13 CB ALA 7 11.890 -8.095 1.001 0.056
1473 ATOM 14 CA ALA 8 15.398 -9.515 0.848 0.005
1474 ATOM 15 CB ALA 8 16.184 -9.475 0.721 0.035
1475 ATOM 16 CA ALA 9 16.064 -13.185 0.588 0.020
1476 ATOM 17 CB ALA 9 15.517 -13.316 0.057 0.069
1477 ATOM 18 CA ALA 10 18.713 -15.694 1.472 0.030
1478 ATOM 19 CB ALA 10 18.643 -16.055 2.065 0.080
1479 ATOM 20 CA ALA 11 20.562 -18.260 -0.398 0.017
1480 ATOM 21 CB ALA 11 21.234 -18.429 -0.543 0.079
1481 ATOM 22 CA ALA 12 20.996 -21.983 0.081 0.030
1482 ATOM 23 CB ALA 12 20.816 -22.693 -0.112 0.089
1483 ATOM 24 CA ALA 13 24.069 -23.756 1.430 0.013
1484 ATOM 25 CB ALA 13 23.846 -23.746 2.167 0.116
1485 ATOM 26 CA CYS 14 26.446 -26.488 0.402 0.013
1486 ATOM 27 CB CYS 14 27.135 -25.455 0.103 0.007
1487 ATOM 28 CA ALA 15 28.653 -29.276 1.776 0.035
1488 ATOM 29 CB ALA 15 28.221 -29.918 1.791 0.048
1489 ATOM 30 CA ALA 16 32.223 -30.244 0.776 0.007
1490 ATOM 31 CB ALA 16 32.688 -30.439 1.418 0.073
1491 ATOM 32 CA ALA 17 33.364 -32.961 -1.614 0.012
1492 ATOM 33 CB ALA 17 32.970 -32.488 -2.039 0.046
1493 ATOM 34 CA GLY 18 36.736 -34.394 -0.610 0.000
1513 REMARK time 713.68 ENERGY -2.46707E+00
1514 ATOM 1 CA GLY 1 -2.863 3.964 0.424 0.021
1515 ATOM 2 CA ALA 2 0.246 1.740 0.141 0.013
1516 ATOM 3 CB ALA 2 0.533 1.316 0.739 0.003
1517 ATOM 4 CA ALA 3 1.091 -0.884 -2.400 0.002
1518 ATOM 5 CB ALA 3 1.391 -0.419 -2.882 0.031
1519 ATOM 6 CA ALA 4 3.328 -3.804 -1.427 0.017
1520 ATOM 7 CB ALA 4 2.877 -4.438 -1.582 0.148
1521 ATOM 8 CA CYS 5 7.097 -4.314 -1.817 0.026
1522 ATOM 9 CB CYS 5 7.603 -3.557 -0.980 0.013
1523 ATOM 10 CA ALA 6 9.060 -7.419 -1.339 0.032
1524 ATOM 11 CB ALA 6 9.538 -7.890 -1.634 0.157
1525 ATOM 12 CA ALA 7 11.884 -8.524 1.023 0.002
1526 ATOM 13 CB ALA 7 11.746 -8.765 1.732 0.016
1527 ATOM 14 CA ALA 8 15.420 -9.333 0.000 0.024
1528 ATOM 15 CB ALA 8 15.865 -8.811 0.203 0.032
1529 ATOM 16 CA ALA 9 16.541 -13.001 0.014 0.011
1530 ATOM 17 CB ALA 9 16.679 -13.325 -0.595 0.068
1531 ATOM 18 CA ALA 10 18.612 -15.225 2.301 0.058
1532 ATOM 19 CB ALA 10 18.253 -15.571 2.686 0.242
1533 ATOM 20 CA ALA 11 21.827 -16.926 1.309 0.033
1534 ATOM 21 CB ALA 11 21.965 -16.826 2.025 0.023
1535 ATOM 22 CA ALA 12 22.348 -20.639 0.397 0.039
1536 ATOM 23 CB ALA 12 22.248 -20.763 -0.300 0.011
1537 ATOM 24 CA ALA 13 25.145 -22.815 1.598 0.015
1538 ATOM 25 CB ALA 13 25.455 -23.171 2.177 0.079
1539 ATOM 26 CA CYS 14 26.338 -26.107 0.039 0.014
1540 ATOM 27 CB CYS 14 27.014 -25.630 -0.894 0.034
1541 ATOM 28 CA ALA 15 28.041 -29.386 1.282 0.025
1542 ATOM 29 CB ALA 15 27.358 -29.745 1.453 0.051
1543 ATOM 30 CA ALA 16 31.600 -30.571 0.952 0.036
1544 ATOM 31 CB ALA 16 31.620 -30.760 1.588 0.028
1545 ATOM 32 CA ALA 17 33.549 -32.750 -1.616 0.032
1546 ATOM 33 CB ALA 17 34.261 -32.724 -1.983 0.064
1547 ATOM 34 CA GLY 18 34.149 -36.416 -0.872 0.000
1567 REMARK time 739.66 ENERGY 2.22282E+00
1568 ATOM 1 CA GLY 1 -2.786 4.069 -0.154 0.033
1569 ATOM 2 CA ALA 2 0.266 1.901 0.153 0.004
1570 ATOM 3 CB ALA 2 0.178 2.221 0.741 0.068
1571 ATOM 4 CA ALA 3 2.311 -0.368 -2.161 0.023
1572 ATOM 5 CB ALA 3 2.728 -0.044 -2.683 0.039
1573 ATOM 6 CA ALA 4 3.853 -3.790 -1.490 0.051
1574 ATOM 7 CB ALA 4 3.328 -4.327 -1.775 0.068
1575 ATOM 8 CA CYS 5 7.415 -4.677 -0.560 0.024
1576 ATOM 9 CB CYS 5 7.441 -4.898 0.698 0.038
1577 ATOM 10 CA ALA 6 8.794 -7.777 -2.229 0.000
1578 ATOM 11 CB ALA 6 9.142 -7.970 -2.863 0.149
1579 ATOM 12 CA ALA 7 10.876 -10.466 -0.564 0.010
1580 ATOM 13 CB ALA 7 10.350 -11.089 -0.594 0.025
1581 ATOM 14 CA ALA 8 14.500 -10.099 0.170 0.017
1582 ATOM 15 CB ALA 8 15.231 -10.095 0.452 0.045
1583 ATOM 16 CA ALA 9 16.410 -13.429 0.160 0.041
1584 ATOM 17 CB ALA 9 16.090 -13.431 -0.468 0.257
1585 ATOM 18 CA ALA 10 19.511 -14.442 2.015 0.044
1586 ATOM 19 CB ALA 10 19.221 -14.554 2.674 0.081
1587 ATOM 20 CA ALA 11 22.534 -16.541 1.065 0.038
1588 ATOM 21 CB ALA 11 23.151 -16.274 1.379 0.012
1589 ATOM 22 CA ALA 12 22.378 -20.354 1.542 0.010
1590 ATOM 23 CB ALA 12 22.044 -20.951 1.327 0.054
1591 ATOM 24 CA ALA 13 24.915 -23.040 2.491 0.019
1592 ATOM 25 CB ALA 13 24.555 -23.337 3.131 0.008
1593 ATOM 26 CA CYS 14 27.673 -24.386 0.239 0.017
1594 ATOM 27 CB CYS 14 28.555 -23.460 0.349 0.039
1595 ATOM 28 CA ALA 15 28.431 -28.123 -0.042 0.021
1596 ATOM 29 CB ALA 15 27.917 -28.669 -0.080 0.083
1597 ATOM 30 CA ALA 16 30.826 -30.673 -1.325 0.028
1598 ATOM 31 CB ALA 16 31.386 -30.214 -1.509 0.114
1599 ATOM 32 CA ALA 17 31.505 -34.346 -0.770 0.005
1600 ATOM 33 CB ALA 17 31.026 -34.649 -1.198 0.019
1601 ATOM 34 CA GLY 18 34.411 -35.929 0.999 0.000
1621 REMARK time 765.95 ENERGY -3.52124E-01
1622 ATOM 1 CA GLY 1 -3.101 4.338 -0.704 0.002
1623 ATOM 2 CA ALA 2 -0.237 2.155 0.751 0.024
1624 ATOM 3 CB ALA 2 -0.543 1.510 0.781 0.093
1625 ATOM 4 CA ALA 3 2.944 1.057 -0.845 0.005
1626 ATOM 5 CB ALA 3 3.537 1.523 -0.707 0.069
1627 ATOM 6 CA ALA 4 3.977 -2.293 -2.373 0.037
1628 ATOM 7 CB ALA 4 3.948 -2.397 -3.193 0.016
1629 ATOM 8 CA CYS 5 6.379 -4.983 -0.992 0.082
1630 ATOM 9 CB CYS 5 6.073 -5.071 0.153 0.029
1631 ATOM 10 CA ALA 6 8.574 -7.486 -2.971 0.051
1632 ATOM 11 CB ALA 6 9.093 -7.082 -3.389 0.156
1633 ATOM 12 CA ALA 7 9.711 -10.387 -0.699 0.004
1634 ATOM 13 CB ALA 7 9.530 -11.047 -0.415 0.099
1635 ATOM 14 CA ALA 8 13.407 -11.506 -0.455 0.048
1636 ATOM 15 CB ALA 8 13.505 -10.810 -0.169 0.061
1637 ATOM 16 CA ALA 9 15.543 -14.550 0.336 0.033
1638 ATOM 17 CB ALA 9 15.810 -15.070 -0.149 0.038
1639 ATOM 18 CA ALA 10 18.925 -15.400 2.023 0.039
1640 ATOM 19 CB ALA 10 18.566 -15.664 2.550 0.129
1641 ATOM 20 CA ALA 11 21.994 -17.289 1.070 0.045
1642 ATOM 21 CB ALA 11 22.635 -17.125 0.729 0.059
1643 ATOM 22 CA ALA 12 24.504 -19.629 2.818 0.012
1644 ATOM 23 CB ALA 12 23.948 -20.023 3.083 0.002
1645 ATOM 24 CA ALA 13 27.827 -21.291 2.069 0.016
1646 ATOM 25 CB ALA 13 28.243 -20.910 2.538 0.085
1647 ATOM 26 CA CYS 14 28.697 -24.621 0.273 0.030
1648 ATOM 27 CB CYS 14 28.589 -24.878 -0.887 0.005
1649 ATOM 28 CA ALA 15 29.639 -28.007 1.782 0.059
1650 ATOM 29 CB ALA 15 29.109 -28.509 1.982 0.019
1651 ATOM 30 CA ALA 16 31.548 -31.155 0.738 0.005
1652 ATOM 31 CB ALA 16 31.949 -31.085 1.407 0.004
1653 ATOM 32 CA ALA 17 31.120 -33.848 -1.939 0.018
1654 ATOM 33 CB ALA 17 31.152 -33.567 -2.601 0.035
1655 ATOM 34 CA GLY 18 30.828 -37.695 -2.077 0.000
1675 REMARK time 792.97 ENERGY 1.58880E+01
1676 ATOM 1 CA GLY 1 -0.127 4.746 0.462 0.062
1677 ATOM 2 CA ALA 2 -1.219 1.269 -0.487 0.008
1678 ATOM 3 CB ALA 2 -1.625 0.917 -0.920 0.004
1679 ATOM 4 CA ALA 3 2.365 0.318 -1.476 0.019
1680 ATOM 5 CB ALA 3 2.849 0.307 -0.863 0.073
1681 ATOM 6 CA ALA 4 4.312 -2.778 -2.547 0.009
1682 ATOM 7 CB ALA 4 4.424 -2.483 -3.145 0.039
1683 ATOM 8 CA CYS 5 6.633 -5.461 -0.931 0.041
1684 ATOM 9 CB CYS 5 6.172 -5.581 0.220 0.003
1685 ATOM 10 CA ALA 6 9.858 -7.313 -1.288 0.050
1686 ATOM 11 CB ALA 6 10.467 -7.473 -1.624 0.032
1687 ATOM 12 CA ALA 7 11.596 -9.074 1.672 0.010
1688 ATOM 13 CB ALA 7 11.662 -9.652 2.259 0.077
1689 ATOM 14 CA ALA 8 14.740 -10.964 0.561 0.036
1690 ATOM 15 CB ALA 8 15.225 -10.714 1.122 0.045
1691 ATOM 16 CA ALA 9 15.850 -14.489 -0.119 0.021
1692 ATOM 17 CB ALA 9 15.584 -14.651 -0.831 0.050
1693 ATOM 18 CA ALA 10 19.376 -15.727 -0.011 0.007
1694 ATOM 19 CB ALA 10 19.923 -16.103 0.308 0.033
1695 ATOM 20 CA ALA 11 20.392 -19.183 -1.324 0.037
1696 ATOM 21 CB ALA 11 20.848 -19.182 -1.867 0.055
1697 ATOM 22 CA ALA 12 22.183 -21.140 1.332 0.025
1698 ATOM 23 CB ALA 12 21.865 -21.763 1.412 0.119
1699 ATOM 24 CA ALA 13 25.724 -21.389 2.693 0.007
1700 ATOM 25 CB ALA 13 25.510 -21.252 3.461 0.005
1701 ATOM 26 CA CYS 14 28.045 -24.025 1.054 0.001
1702 ATOM 27 CB CYS 14 28.794 -23.871 0.050 0.001
1703 ATOM 28 CA ALA 15 29.868 -27.310 1.800 0.019
1704 ATOM 29 CB ALA 15 29.297 -27.692 2.208 0.054
1705 ATOM 30 CA ALA 16 31.860 -29.606 -0.522 0.015
1706 ATOM 31 CB ALA 16 32.517 -29.790 -0.800 0.068
1707 ATOM 32 CA ALA 17 30.589 -33.180 0.108 0.029
1708 ATOM 33 CB ALA 17 29.935 -32.943 -0.288 0.070
1709 ATOM 34 CA GLY 18 31.811 -36.186 -2.022 0.000
1729 REMARK time 816.39 ENERGY -5.18847E+00
1730 ATOM 1 CA GLY 1 -3.377 1.719 -4.482 0.020
1731 ATOM 2 CA ALA 2 -1.041 2.311 -1.529 0.007
1732 ATOM 3 CB ALA 2 -0.892 2.401 -0.847 0.059
1733 ATOM 4 CA ALA 3 2.384 0.802 -1.004 0.051
1734 ATOM 5 CB ALA 3 2.575 1.004 -0.261 0.129
1735 ATOM 6 CA ALA 4 3.456 -2.821 -0.323 0.039
1736 ATOM 7 CB ALA 4 3.230 -3.149 -0.980 0.025
1737 ATOM 8 CA CYS 5 6.700 -3.904 1.141 0.012
1738 ATOM 9 CB CYS 5 6.580 -3.832 2.337 0.024
1739 ATOM 10 CA ALA 6 9.638 -5.575 -0.599 0.036
1740 ATOM 11 CB ALA 6 10.251 -5.491 -0.991 0.083
1741 ATOM 12 CA ALA 7 11.213 -8.816 0.420 0.029
1742 ATOM 13 CB ALA 7 10.822 -9.288 0.854 0.021
1743 ATOM 14 CA ALA 8 14.514 -10.108 -0.922 0.015
1744 ATOM 15 CB ALA 8 15.271 -10.003 -0.770 0.057
1745 ATOM 16 CA ALA 9 15.751 -13.653 -0.554 0.002
1746 ATOM 17 CB ALA 9 15.418 -13.969 -1.134 0.072
1747 ATOM 18 CA ALA 10 18.983 -15.034 0.789 0.007
1748 ATOM 19 CB ALA 10 18.563 -15.247 1.422 0.115
1749 ATOM 20 CA ALA 11 21.532 -17.765 -0.156 0.025
1750 ATOM 21 CB ALA 11 21.906 -17.145 -0.198 0.156
1751 ATOM 22 CA ALA 12 21.925 -21.374 0.967 0.014
1752 ATOM 23 CB ALA 12 21.600 -21.979 0.660 0.011
1753 ATOM 24 CA ALA 13 25.298 -23.296 1.217 0.018
1754 ATOM 25 CB ALA 13 25.785 -23.102 1.764 0.035
1755 ATOM 26 CA CYS 14 27.133 -26.251 -0.352 0.051
1756 ATOM 27 CB CYS 14 27.639 -26.076 -1.504 0.063
1757 ATOM 28 CA ALA 15 28.601 -28.972 1.832 0.042
1758 ATOM 29 CB ALA 15 28.227 -29.667 1.802 0.043
1759 ATOM 30 CA ALA 16 31.946 -30.782 1.098 0.031
1760 ATOM 31 CB ALA 16 32.524 -30.526 1.561 0.117
1761 ATOM 32 CA ALA 17 33.602 -33.609 -0.746 0.024
1762 ATOM 33 CB ALA 17 33.840 -33.755 -1.453 0.113
1763 ATOM 34 CA GLY 18 36.446 -35.875 0.272 0.000
1783 REMARK time 841.01 ENERGY -6.83707E+00
1784 ATOM 1 CA GLY 1 -2.838 2.804 -3.811 0.011
1785 ATOM 2 CA ALA 2 -0.480 1.454 -1.193 0.005
1786 ATOM 3 CB ALA 2 -0.582 1.550 -0.470 0.074
1787 ATOM 4 CA ALA 3 2.513 -0.671 -2.327 0.044
1788 ATOM 5 CB ALA 3 2.524 -0.315 -3.011 0.044
1789 ATOM 6 CA ALA 4 4.366 -2.921 0.144 0.032
1790 ATOM 7 CB ALA 4 3.710 -3.265 0.332 0.057
1791 ATOM 8 CA CYS 5 8.007 -3.980 0.257 0.015
1792 ATOM 9 CB CYS 5 8.710 -3.164 0.962 0.041
1793 ATOM 10 CA ALA 6 9.128 -7.615 0.030 0.002
1794 ATOM 11 CB ALA 6 9.341 -7.897 -0.607 0.101
1795 ATOM 12 CA ALA 7 11.746 -9.070 2.346 0.030
1796 ATOM 13 CB ALA 7 11.417 -9.359 2.948 0.105
1797 ATOM 14 CA ALA 8 15.152 -9.659 0.875 0.069
1798 ATOM 15 CB ALA 8 15.239 -8.994 1.326 0.121
1799 ATOM 16 CA ALA 9 15.949 -13.162 -0.641 0.036
1800 ATOM 17 CB ALA 9 16.002 -13.130 -1.364 0.012
1801 ATOM 18 CA ALA 10 18.683 -15.336 0.810 0.012
1802 ATOM 19 CB ALA 10 18.279 -15.693 1.242 0.027
1803 ATOM 20 CA ALA 11 20.992 -17.958 -0.601 0.038
1804 ATOM 21 CB ALA 11 21.728 -17.871 -0.705 0.103
1805 ATOM 22 CA ALA 12 21.160 -21.726 -0.606 0.012
1806 ATOM 23 CB ALA 12 21.231 -21.644 -1.290 0.092
1807 ATOM 24 CA ALA 13 23.868 -23.865 0.875 0.033
1808 ATOM 25 CB ALA 13 23.554 -24.198 1.486 0.041
1809 ATOM 26 CA CYS 14 26.449 -25.972 -0.964 0.024
1810 ATOM 27 CB CYS 14 27.376 -25.217 -1.054 0.023
1811 ATOM 28 CA ALA 15 27.721 -29.128 0.704 0.020
1812 ATOM 29 CB ALA 15 27.632 -29.831 0.536 0.162
1813 ATOM 30 CA ALA 16 31.530 -29.683 1.042 0.002
1814 ATOM 31 CB ALA 16 31.455 -29.399 1.719 0.063
1815 ATOM 32 CA ALA 17 33.678 -32.616 -0.010 0.021
1816 ATOM 33 CB ALA 17 34.022 -32.931 -0.482 0.046
1817 ATOM 34 CA GLY 18 37.042 -33.374 1.609 0.000
1837 REMARK time 868.18 ENERGY 3.25527E+00
1838 ATOM 1 CA GLY 1 -1.794 2.777 -0.881 0.006
1839 ATOM 2 CA ALA 2 1.611 1.577 -1.703 0.024
1840 ATOM 3 CB ALA 2 2.218 1.807 -1.390 0.160
1841 ATOM 4 CA ALA 3 2.751 -2.022 -2.169 0.032
1842 ATOM 5 CB ALA 3 2.350 -2.049 -2.883 0.013
1843 ATOM 6 CA ALA 4 5.528 -3.955 -0.500 0.008
1844 ATOM 7 CB ALA 4 5.366 -4.149 0.133 0.025
1845 ATOM 8 CA CYS 5 8.695 -5.839 -1.684 0.021
1846 ATOM 9 CB CYS 5 9.565 -4.913 -1.795 0.027
1847 ATOM 10 CA ALA 6 9.817 -8.291 0.965 0.020
1848 ATOM 11 CB ALA 6 10.047 -8.944 0.776 0.065
1849 ATOM 12 CA ALA 7 12.455 -8.600 3.759 0.010
1850 ATOM 13 CB ALA 7 12.323 -8.631 4.497 0.103
1851 ATOM 14 CA ALA 8 15.128 -10.045 1.412 0.003
1852 ATOM 15 CB ALA 8 15.170 -9.361 1.412 0.097
1853 ATOM 16 CA ALA 9 15.760 -13.856 1.293 0.050
1854 ATOM 17 CB ALA 9 15.355 -14.178 0.666 0.072
1855 ATOM 18 CA ALA 10 18.849 -15.911 1.785 0.019
1856 ATOM 19 CB ALA 10 19.003 -16.164 2.513 0.016
1857 ATOM 20 CA ALA 11 20.414 -17.632 -1.258 0.005
1858 ATOM 21 CB ALA 11 21.120 -17.528 -1.185 0.082
1859 ATOM 22 CA ALA 12 19.691 -21.331 -1.902 0.044
1860 ATOM 23 CB ALA 12 19.591 -21.560 -2.533 0.112
1861 ATOM 24 CA ALA 13 22.068 -23.817 -0.335 0.031
1862 ATOM 25 CB ALA 13 21.717 -24.157 0.185 0.040
1863 ATOM 26 CA CYS 14 25.305 -25.561 -1.214 0.008
1864 ATOM 27 CB CYS 14 25.936 -24.465 -1.260 0.023
1865 ATOM 28 CA ALA 15 27.566 -28.251 0.201 0.047
1866 ATOM 29 CB ALA 15 27.223 -28.899 -0.034 0.062
1867 ATOM 30 CA ALA 16 31.333 -28.051 0.738 0.007
1868 ATOM 31 CB ALA 16 31.957 -27.969 1.143 0.099
1869 ATOM 32 CA ALA 17 33.875 -30.807 0.281 0.012
1870 ATOM 33 CB ALA 17 34.220 -30.764 -0.350 0.077
1871 ATOM 34 CA GLY 18 34.840 -31.450 3.880 0.000
1891 REMARK time 893.01 ENERGY 4.31714E+00
1892 ATOM 1 CA GLY 1 -0.730 3.427 -3.558 0.011
1893 ATOM 2 CA ALA 2 2.299 1.539 -2.348 0.008
1894 ATOM 3 CB ALA 2 2.876 1.636 -1.897 0.033
1895 ATOM 4 CA ALA 3 1.642 -2.223 -2.038 0.005
1896 ATOM 5 CB ALA 3 1.325 -2.424 -2.704 0.057
1897 ATOM 6 CA ALA 4 4.455 -2.565 0.538 0.023
1898 ATOM 7 CB ALA 4 4.251 -3.062 1.073 0.100
1899 ATOM 8 CA CYS 5 7.896 -3.914 -0.210 0.043
1900 ATOM 9 CB CYS 5 8.509 -3.105 -0.706 0.068
1901 ATOM 10 CA ALA 6 9.396 -7.038 1.209 0.022
1902 ATOM 11 CB ALA 6 9.477 -7.794 0.956 0.038
1903 ATOM 12 CA ALA 7 12.808 -8.065 2.616 0.046
1904 ATOM 13 CB ALA 7 13.149 -7.921 3.286 0.030
1905 ATOM 14 CA ALA 8 15.474 -10.330 1.191 0.069
1906 ATOM 15 CB ALA 8 15.645 -9.594 0.916 0.105
1907 ATOM 16 CA ALA 9 15.031 -14.066 2.081 0.017
1908 ATOM 17 CB ALA 9 14.499 -14.415 1.770 0.093
1909 ATOM 18 CA ALA 10 17.638 -16.847 2.330 0.017
1910 ATOM 19 CB ALA 10 17.755 -17.224 2.893 0.010
1911 ATOM 20 CA ALA 11 19.273 -19.111 -0.291 0.027
1912 ATOM 21 CB ALA 11 19.542 -18.447 -0.630 0.110
1913 ATOM 22 CA ALA 12 20.780 -22.623 -0.421 0.016
1914 ATOM 23 CB ALA 12 20.333 -23.194 -0.685 0.179
1915 ATOM 24 CA ALA 13 24.242 -23.430 -1.724 0.002
1916 ATOM 25 CB ALA 13 24.107 -22.937 -1.220 0.018
1917 ATOM 26 CA CYS 14 26.109 -26.515 -2.828 0.030
1918 ATOM 27 CB CYS 14 26.759 -26.202 -3.811 0.009
1919 ATOM 28 CA ALA 15 27.528 -29.243 -0.581 0.016
1920 ATOM 29 CB ALA 15 27.676 -29.903 -0.837 0.025
1921 ATOM 30 CA ALA 16 30.657 -28.913 1.604 0.016
1922 ATOM 31 CB ALA 16 30.426 -28.715 2.291 0.071
1923 ATOM 32 CA ALA 17 34.324 -29.862 1.106 0.024
1924 ATOM 33 CB ALA 17 34.869 -29.869 0.591 0.057
1925 ATOM 34 CA GLY 18 37.096 -30.194 3.635 0.000
1945 REMARK time 918.18 ENERGY 2.88870E+00
1946 ATOM 1 CA GLY 1 -2.001 1.749 -4.795 0.012
1947 ATOM 2 CA ALA 2 1.186 2.672 -2.896 0.044
1948 ATOM 3 CB ALA 2 1.276 2.877 -2.267 0.053
1949 ATOM 4 CA ALA 3 4.158 0.246 -2.559 0.004
1950 ATOM 5 CB ALA 3 4.775 -0.155 -2.671 0.086
1951 ATOM 6 CA ALA 4 4.887 -1.420 0.715 0.020
1952 ATOM 7 CB ALA 4 4.409 -1.963 0.710 0.134
1953 ATOM 8 CA CYS 5 8.025 -3.430 1.544 0.030
1954 ATOM 9 CB CYS 5 8.906 -2.784 0.862 0.015
1955 ATOM 10 CA ALA 6 7.922 -7.230 1.956 0.046
1956 ATOM 11 CB ALA 6 7.452 -7.424 1.398 0.070
1957 ATOM 12 CA ALA 7 11.017 -9.459 2.589 0.041
1958 ATOM 13 CB ALA 7 10.669 -9.236 3.234 0.146
1959 ATOM 14 CA ALA 8 13.024 -11.791 0.456 0.003
1960 ATOM 15 CB ALA 8 13.155 -12.179 -0.192 0.062
1961 ATOM 16 CA ALA 9 15.754 -14.000 1.877 0.003
1962 ATOM 17 CB ALA 9 15.533 -14.000 2.651 0.002
1963 ATOM 18 CA ALA 10 18.032 -15.809 -0.524 0.003
1964 ATOM 19 CB ALA 10 18.790 -15.906 -0.629 0.050
1965 ATOM 20 CA ALA 11 18.161 -19.651 -0.961 0.013
1966 ATOM 21 CB ALA 11 17.939 -19.818 -1.670 0.180
1967 ATOM 22 CA ALA 12 20.447 -22.340 0.422 0.006
1968 ATOM 23 CB ALA 12 19.799 -22.719 0.722 0.070
1969 ATOM 24 CA ALA 13 23.885 -23.652 -0.481 0.019
1970 ATOM 25 CB ALA 13 24.080 -22.963 -0.440 0.027
1971 ATOM 26 CA CYS 14 26.081 -26.767 -0.873 0.024
1972 ATOM 27 CB CYS 14 26.388 -27.277 -2.054 0.045
1973 ATOM 28 CA ALA 15 29.473 -27.591 0.567 0.014
1974 ATOM 29 CB ALA 15 29.497 -27.670 1.328 0.048
1975 ATOM 30 CA ALA 16 32.848 -28.996 -0.645 0.010
1976 ATOM 31 CB ALA 16 33.597 -28.804 -0.573 0.046
1977 ATOM 32 CA ALA 17 35.101 -31.810 0.536 0.048
1978 ATOM 33 CB ALA 17 35.209 -32.163 -0.127 0.021
1979 ATOM 34 CA GLY 18 37.587 -31.271 3.376 0.000
1999 REMARK time 945.22 ENERGY -1.80944E+00
2000 ATOM 1 CA GLY 1 -0.679 5.089 -5.127 0.014
2001 ATOM 2 CA ALA 2 1.243 3.307 -2.304 0.048
2002 ATOM 3 CB ALA 2 1.075 3.502 -1.653 0.019
2003 ATOM 4 CA ALA 3 3.516 0.299 -2.122 0.045
2004 ATOM 5 CB ALA 3 4.178 0.292 -2.630 0.054
2005 ATOM 6 CA ALA 4 4.961 -1.877 0.604 0.032
2006 ATOM 7 CB ALA 4 4.374 -2.345 0.605 0.075
2007 ATOM 8 CA CYS 5 8.413 -3.459 1.116 0.036
2008 ATOM 9 CB CYS 5 9.110 -3.196 2.088 0.006
2009 ATOM 10 CA ALA 6 7.764 -7.249 1.033 0.004
2010 ATOM 11 CB ALA 6 7.811 -7.369 0.282 0.025
2011 ATOM 12 CA ALA 7 9.971 -10.224 1.909 0.055
2012 ATOM 13 CB ALA 7 10.303 -10.891 2.182 0.020
2013 ATOM 14 CA ALA 8 12.407 -12.061 -0.469 0.008
2014 ATOM 15 CB ALA 8 13.118 -11.817 -0.506 0.076
2015 ATOM 16 CA ALA 9 13.263 -15.710 -0.418 0.021
2016 ATOM 17 CB ALA 9 13.356 -16.277 -0.827 0.054
2017 ATOM 18 CA ALA 10 16.657 -16.998 0.912 0.020
2018 ATOM 19 CB ALA 10 16.771 -16.885 1.657 0.049
2019 ATOM 20 CA ALA 11 19.098 -19.353 -0.810 0.099
2020 ATOM 21 CB ALA 11 19.089 -19.313 -1.528 0.143
2021 ATOM 22 CA ALA 12 22.660 -20.525 0.088 0.046
2022 ATOM 23 CB ALA 12 22.166 -20.723 0.606 0.558
2023 ATOM 24 CA ALA 13 24.817 -23.678 -0.611 0.020
2024 ATOM 25 CB ALA 13 24.981 -23.681 -1.276 0.009
2025 ATOM 26 CA CYS 14 27.173 -25.606 1.657 0.012
2026 ATOM 27 CB CYS 14 26.703 -26.684 2.064 0.004
2027 ATOM 28 CA ALA 15 30.808 -26.662 1.405 0.002
2028 ATOM 29 CB ALA 15 31.362 -26.239 1.801 0.010
2029 ATOM 30 CA ALA 16 31.687 -29.902 -0.339 0.007
2030 ATOM 31 CB ALA 16 31.490 -29.699 -1.013 0.026
2031 ATOM 32 CA ALA 17 35.197 -31.366 -0.151 0.022
2032 ATOM 33 CB ALA 17 35.434 -31.575 0.575 0.007
2033 ATOM 34 CA GLY 18 36.372 -34.159 -2.379 0.000
2053 REMARK time 965.47 ENERGY 1.11906E+01
2054 ATOM 1 CA GLY 1 1.183 6.206 -4.726 0.040
2055 ATOM 2 CA ALA 2 1.108 4.046 -1.613 0.069
2056 ATOM 3 CB ALA 2 1.619 3.896 -1.223 0.092
2057 ATOM 4 CA ALA 3 3.431 0.929 -1.685 0.011
2058 ATOM 5 CB ALA 3 3.117 0.406 -2.150 0.020
2059 ATOM 6 CA ALA 4 4.120 -1.575 1.048 0.031
2060 ATOM 7 CB ALA 4 3.440 -1.931 1.190 0.041
2061 ATOM 8 CA CYS 5 7.208 -3.669 0.444 0.020
2062 ATOM 9 CB CYS 5 8.444 -3.441 0.743 0.030
2063 ATOM 10 CA ALA 6 7.297 -7.443 0.461 0.021
2064 ATOM 11 CB ALA 6 6.953 -8.033 0.098 0.074
2065 ATOM 12 CA ALA 7 10.045 -10.030 0.663 0.002
2066 ATOM 13 CB ALA 7 10.198 -10.591 1.180 0.101
2067 ATOM 14 CA ALA 8 11.886 -12.621 -1.342 0.008
2068 ATOM 15 CB ALA 8 12.143 -12.370 -1.996 0.022
2069 ATOM 16 CA ALA 9 14.049 -15.419 0.276 0.006
2070 ATOM 17 CB ALA 9 13.281 -15.442 0.329 0.005
2071 ATOM 18 CA ALA 10 17.594 -16.748 -0.055 0.031
2072 ATOM 19 CB ALA 10 17.749 -16.411 0.553 0.017
2073 ATOM 20 CA ALA 11 18.933 -20.267 0.278 0.006
2074 ATOM 21 CB ALA 11 18.988 -20.767 -0.232 0.104
2075 ATOM 22 CA ALA 12 22.042 -21.222 2.203 0.015
2076 ATOM 23 CB ALA 12 21.593 -21.421 2.756 0.101
2077 ATOM 24 CA ALA 13 24.947 -23.065 0.580 0.017
2078 ATOM 25 CB ALA 13 25.407 -22.763 0.034 0.054
2079 ATOM 26 CA CYS 14 27.961 -25.146 1.873 0.020
2080 ATOM 27 CB CYS 14 27.434 -26.287 1.846 0.027
2081 ATOM 28 CA ALA 15 31.233 -26.417 0.344 0.009
2082 ATOM 29 CB ALA 15 31.915 -26.044 0.412 0.100
2083 ATOM 30 CA ALA 16 32.116 -29.965 -0.597 0.031
2084 ATOM 31 CB ALA 16 31.566 -30.337 -0.815 0.051
2085 ATOM 32 CA ALA 17 35.426 -31.943 -0.800 0.014
2086 ATOM 33 CB ALA 17 35.975 -31.973 -0.270 0.005
2087 ATOM 34 CA GLY 18 35.925 -35.544 -2.138 0.000
2107 REMARK time 989.36 ENERGY 4.85634E+00
2108 ATOM 1 CA GLY 1 -1.057 5.767 -1.224 0.005
2109 ATOM 2 CA ALA 2 2.220 4.050 -0.225 0.091
2110 ATOM 3 CB ALA 2 2.419 3.625 0.310 0.036
2111 ATOM 4 CA ALA 3 4.348 1.910 -2.605 0.002
2112 ATOM 5 CB ALA 3 4.257 2.655 -2.585 0.161
2113 ATOM 6 CA ALA 4 4.193 -1.736 -1.478 0.066
2114 ATOM 7 CB ALA 4 3.490 -1.813 -1.295 0.107
2115 ATOM 8 CA CYS 5 6.885 -4.460 -1.724 0.019
2116 ATOM 9 CB CYS 5 7.891 -4.443 -1.033 0.054
2117 ATOM 10 CA ALA 6 6.810 -8.026 -0.551 0.018
2118 ATOM 11 CB ALA 6 6.556 -8.424 -1.137 0.013
2119 ATOM 12 CA ALA 7 9.524 -9.848 1.370 0.038
2120 ATOM 13 CB ALA 7 9.273 -9.932 2.010 0.023
2121 ATOM 14 CA ALA 8 11.873 -12.566 0.191 0.049
2122 ATOM 15 CB ALA 8 12.312 -12.876 -0.275 0.018
2123 ATOM 16 CA ALA 9 14.249 -14.959 2.146 0.019
2124 ATOM 17 CB ALA 9 13.825 -15.589 2.435 0.033
2125 ATOM 18 CA ALA 10 17.226 -16.866 0.740 0.015
2126 ATOM 19 CB ALA 10 17.507 -16.261 0.437 0.015
2127 ATOM 20 CA ALA 11 19.183 -20.106 0.952 0.035
2128 ATOM 21 CB ALA 11 18.546 -20.468 0.796 0.045
2129 ATOM 22 CA ALA 12 22.999 -20.433 0.928 0.021
2130 ATOM 23 CB ALA 12 23.648 -20.355 1.268 0.037
2131 ATOM 24 CA ALA 13 25.459 -23.146 -0.111 0.008
2132 ATOM 25 CB ALA 13 25.803 -22.698 -0.679 0.091
2133 ATOM 26 CA CYS 14 27.708 -25.445 1.721 0.020
2134 ATOM 27 CB CYS 14 27.229 -26.421 2.390 0.017
2135 ATOM 28 CA ALA 15 31.131 -27.122 1.077 0.006
2136 ATOM 29 CB ALA 15 31.675 -26.865 1.341 0.083
2137 ATOM 30 CA ALA 16 31.680 -30.456 -0.729 0.036
2138 ATOM 31 CB ALA 16 31.224 -30.369 -1.393 0.047
2139 ATOM 32 CA ALA 17 34.817 -32.685 -0.457 0.014
2140 ATOM 33 CB ALA 17 34.731 -33.514 -0.360 0.080
2141 ATOM 34 CA GLY 18 37.282 -32.303 -3.376 0.000
2161 REMARK time 1010.31 ENERGY 5.28052E+00
2162 ATOM 1 CA GLY 1 -0.448 6.560 -0.391 0.017
2163 ATOM 2 CA ALA 2 2.739 4.425 -0.806 0.005
2164 ATOM 3 CB ALA 2 3.092 4.854 -0.319 0.055
2165 ATOM 4 CA ALA 3 3.272 0.703 -1.478 0.027
2166 ATOM 5 CB ALA 3 3.491 0.491 -2.270 0.078
2167 ATOM 6 CA ALA 4 4.701 -2.646 -0.317 0.013
2168 ATOM 7 CB ALA 4 4.433 -2.849 0.271 0.183
2169 ATOM 8 CA CYS 5 7.124 -5.209 -1.895 0.025
2170 ATOM 9 CB CYS 5 8.360 -5.045 -1.795 0.037
2171 ATOM 10 CA ALA 6 6.783 -8.996 -1.374 0.044
2172 ATOM 11 CB ALA 6 6.396 -9.653 -1.349 0.143
2173 ATOM 12 CA ALA 7 9.686 -10.426 0.785 0.016
2174 ATOM 13 CB ALA 7 9.047 -10.109 1.028 0.050
2175 ATOM 14 CA ALA 8 12.857 -12.097 -0.466 0.003
2176 ATOM 15 CB ALA 8 12.903 -11.506 -0.940 0.044
2177 ATOM 16 CA ALA 9 14.292 -14.863 1.595 0.003
2178 ATOM 17 CB ALA 9 14.303 -15.398 1.928 0.059
2179 ATOM 18 CA ALA 10 17.677 -16.272 0.711 0.017
2180 ATOM 19 CB ALA 10 18.202 -15.743 0.735 0.014
2181 ATOM 20 CA ALA 11 19.419 -19.570 1.744 0.024
2182 ATOM 21 CB ALA 11 19.311 -19.943 1.175 0.126
2183 ATOM 22 CA ALA 12 23.124 -19.934 2.369 0.034
2184 ATOM 23 CB ALA 12 23.388 -20.082 3.040 0.020
2185 ATOM 24 CA ALA 13 25.580 -22.150 0.408 0.028
2186 ATOM 25 CB ALA 13 26.026 -21.861 -0.086 0.045
2187 ATOM 26 CA CYS 14 26.685 -25.670 1.292 0.002
2188 ATOM 27 CB CYS 14 25.683 -26.482 1.183 0.013
2189 ATOM 28 CA ALA 15 30.263 -26.838 0.469 0.035
2190 ATOM 29 CB ALA 15 30.926 -26.927 0.830 0.076
2191 ATOM 30 CA ALA 16 31.468 -30.143 -0.942 0.005
2192 ATOM 31 CB ALA 16 31.202 -30.387 -1.643 0.030
2193 ATOM 32 CA ALA 17 34.777 -31.813 -0.288 0.014
2194 ATOM 33 CB ALA 17 34.683 -32.202 0.346 0.066
2195 ATOM 34 CA GLY 18 36.602 -33.713 -3.093 0.000
2215 REMARK time 1030.36 ENERGY -5.14260E+00
2216 ATOM 1 CA GLY 1 1.664 6.877 0.377 0.022
2217 ATOM 2 CA ALA 2 3.381 4.076 -1.587 0.013
2218 ATOM 3 CB ALA 2 3.841 3.966 -1.019 0.005
2219 ATOM 4 CA ALA 3 2.062 0.524 -1.487 0.007
2220 ATOM 5 CB ALA 3 1.846 0.575 -2.218 0.025
2221 ATOM 6 CA ALA 4 3.648 -2.626 -0.118 0.019
2222 ATOM 7 CB ALA 4 3.187 -2.624 0.412 0.062
2223 ATOM 8 CA CYS 5 6.139 -4.818 -1.953 0.025
2224 ATOM 9 CB CYS 5 7.243 -4.507 -1.543 0.020
2225 ATOM 10 CA ALA 6 7.004 -8.395 -1.189 0.044
2226 ATOM 11 CB ALA 6 6.521 -8.901 -1.511 0.069
2227 ATOM 12 CA ALA 7 9.819 -10.169 0.550 0.025
2228 ATOM 13 CB ALA 7 9.892 -10.517 1.114 0.128
2229 ATOM 14 CA ALA 8 12.212 -12.755 -0.822 0.074
2230 ATOM 15 CB ALA 8 12.532 -12.225 -1.290 0.020
2231 ATOM 16 CA ALA 9 14.361 -15.293 0.958 0.000
2232 ATOM 17 CB ALA 9 14.641 -15.920 1.276 0.001
2233 ATOM 18 CA ALA 10 18.254 -15.701 1.301 0.022
2234 ATOM 19 CB ALA 10 18.801 -15.432 1.724 0.043
2235 ATOM 20 CA ALA 11 19.998 -19.082 1.290 0.015
2236 ATOM 21 CB ALA 11 19.763 -19.493 0.729 0.140
2237 ATOM 22 CA ALA 12 22.963 -20.483 3.385 0.034
2238 ATOM 23 CB ALA 12 22.752 -20.914 3.936 0.037
2239 ATOM 24 CA ALA 13 26.298 -21.714 1.966 0.107
2240 ATOM 25 CB ALA 13 26.930 -21.348 2.143 0.007
2241 ATOM 26 CA CYS 14 27.196 -25.089 0.464 0.022
2242 ATOM 27 CB CYS 14 26.808 -25.545 -0.535 0.020
2243 ATOM 28 CA ALA 15 30.453 -27.095 0.095 0.077
2244 ATOM 29 CB ALA 15 30.811 -27.239 0.803 0.282
2245 ATOM 30 CA ALA 16 31.312 -30.535 -1.249 0.018
2246 ATOM 31 CB ALA 16 30.810 -30.695 -1.820 0.044
2247 ATOM 32 CA ALA 17 34.669 -32.090 -0.435 0.001
2248 ATOM 33 CB ALA 17 34.807 -32.397 0.298 0.019
2249 ATOM 34 CA GLY 18 35.514 -35.328 -2.095 0.000
2269 REMARK time 1053.42 ENERGY 9.92753E+00
2270 ATOM 1 CA GLY 1 0.995 7.027 -1.294 0.026
2271 ATOM 2 CA ALA 2 3.160 3.940 -0.707 0.070
2272 ATOM 3 CB ALA 2 3.151 3.939 -0.056 0.001
2273 ATOM 4 CA ALA 3 2.414 0.460 -2.112 0.026
2274 ATOM 5 CB ALA 3 2.144 -0.197 -2.355 0.037
2275 ATOM 6 CA ALA 4 3.829 -2.554 -0.259 0.041
2276 ATOM 7 CB ALA 4 3.357 -2.976 0.151 0.136
2277 ATOM 8 CA CYS 5 6.710 -4.955 -1.093 0.002
2278 ATOM 9 CB CYS 5 7.933 -4.605 -1.051 0.061
2279 ATOM 10 CA ALA 6 6.767 -8.693 -0.648 0.004
2280 ATOM 11 CB ALA 6 6.291 -9.063 -0.727 0.092
2281 ATOM 12 CA ALA 7 10.322 -9.965 -0.011 0.008
2282 ATOM 13 CB ALA 7 10.917 -10.199 0.274 0.017
2283 ATOM 14 CA ALA 8 11.782 -13.417 -0.765 0.010
2284 ATOM 15 CB ALA 8 12.356 -13.678 -1.153 0.054
2285 ATOM 16 CA ALA 9 14.285 -15.351 1.344 0.024
2286 ATOM 17 CB ALA 9 14.243 -16.080 1.423 0.078
2287 ATOM 18 CA ALA 10 18.137 -15.257 1.557 0.019
2288 ATOM 19 CB ALA 10 18.154 -15.175 2.316 0.007
2289 ATOM 20 CA ALA 11 20.615 -18.037 0.559 0.024
2290 ATOM 21 CB ALA 11 21.201 -18.376 0.175 0.072
2291 ATOM 22 CA ALA 12 22.628 -20.561 2.446 0.005
2292 ATOM 23 CB ALA 12 22.625 -21.217 2.120 0.051
2293 ATOM 24 CA ALA 13 25.952 -21.632 1.040 0.005
2294 ATOM 25 CB ALA 13 26.395 -21.230 1.491 0.177
2295 ATOM 26 CA CYS 14 27.300 -25.160 0.683 0.030
2296 ATOM 27 CB CYS 14 26.956 -25.509 -0.482 0.003
2297 ATOM 28 CA ALA 15 30.443 -27.100 1.602 0.039
2298 ATOM 29 CB ALA 15 30.497 -27.053 2.303 0.112
2299 ATOM 30 CA ALA 16 31.954 -29.982 -0.472 0.006
2300 ATOM 31 CB ALA 16 31.432 -29.540 -0.895 0.060
2301 ATOM 32 CA ALA 17 34.491 -32.839 -0.429 0.016
2302 ATOM 33 CB ALA 17 33.962 -33.228 -0.059 0.058
2303 ATOM 34 CA GLY 18 33.875 -34.831 -3.570 0.000
2323 REMARK time 1079.10 ENERGY -5.26714E+00
2324 ATOM 1 CA GLY 1 -0.870 6.425 -2.236 0.007
2325 ATOM 2 CA ALA 2 1.290 3.686 -0.686 0.026
2326 ATOM 3 CB ALA 2 1.612 3.336 -0.060 0.132
2327 ATOM 4 CA ALA 3 3.433 0.738 -1.915 0.003
2328 ATOM 5 CB ALA 3 3.862 1.015 -2.432 0.028
2329 ATOM 6 CA ALA 4 4.601 -2.653 -0.527 0.057
2330 ATOM 7 CB ALA 4 4.362 -3.222 -0.195 0.077
2331 ATOM 8 CA CYS 5 7.264 -5.241 -1.359 0.002
2332 ATOM 9 CB CYS 5 8.302 -4.787 -0.952 0.042
2333 ATOM 10 CA ALA 6 6.696 -8.591 0.394 0.062
2334 ATOM 11 CB ALA 6 6.245 -9.068 -0.033 0.069
2335 ATOM 12 CA ALA 7 9.888 -10.285 1.587 0.018
2336 ATOM 13 CB ALA 7 10.133 -10.658 2.165 0.265
2337 ATOM 14 CA ALA 8 12.455 -12.147 -0.402 0.002
2338 ATOM 15 CB ALA 8 12.732 -11.740 -0.969 0.094
2339 ATOM 16 CA ALA 9 14.853 -15.096 -0.182 0.067
2340 ATOM 17 CB ALA 9 14.841 -15.821 -0.516 0.071
2341 ATOM 18 CA ALA 10 18.419 -15.478 0.947 0.024
2342 ATOM 19 CB ALA 10 18.823 -15.352 1.590 0.036
2343 ATOM 20 CA ALA 11 20.430 -18.726 0.550 0.071
2344 ATOM 21 CB ALA 11 20.533 -18.499 -0.139 0.287
2345 ATOM 22 CA ALA 12 22.920 -20.489 2.792 0.071
2346 ATOM 23 CB ALA 12 22.857 -21.151 3.036 0.172
2347 ATOM 24 CA ALA 13 26.200 -21.515 1.183 0.007
2348 ATOM 25 CB ALA 13 26.720 -21.040 1.504 0.165
2349 ATOM 26 CA CYS 14 26.925 -25.233 0.876 0.007
2350 ATOM 27 CB CYS 14 26.731 -25.739 -0.270 0.012
2351 ATOM 28 CA ALA 15 30.282 -27.072 0.625 0.004
2352 ATOM 29 CB ALA 15 30.685 -26.972 1.268 0.047
2353 ATOM 30 CA ALA 16 31.251 -30.256 -1.234 0.001
2354 ATOM 31 CB ALA 16 31.292 -29.979 -1.915 0.035
2355 ATOM 32 CA ALA 17 32.852 -33.618 -0.734 0.003
2356 ATOM 33 CB ALA 17 32.279 -33.807 -0.954 0.021
2357 ATOM 34 CA GLY 18 36.551 -33.368 -0.056 0.000
2377 REMARK time 1104.40 ENERGY 1.60446E+00
2378 ATOM 1 CA GLY 1 -1.382 6.372 -3.294 0.017
2379 ATOM 2 CA ALA 2 0.200 3.940 -0.792 0.018
2380 ATOM 3 CB ALA 2 0.165 3.871 -0.079 0.001
2381 ATOM 4 CA ALA 3 1.769 0.710 -1.847 0.046
2382 ATOM 5 CB ALA 3 2.042 0.374 -2.391 0.054
2383 ATOM 6 CA ALA 4 2.951 -2.437 -0.218 0.005
2384 ATOM 7 CB ALA 4 2.153 -2.619 -0.096 0.045
2385 ATOM 8 CA CYS 5 6.544 -3.907 -0.167 0.052
2386 ATOM 9 CB CYS 5 7.134 -2.761 -0.512 0.104
2387 ATOM 10 CA ALA 6 8.076 -7.362 -0.027 0.039
2388 ATOM 11 CB ALA 6 7.988 -7.866 -0.547 0.035
2389 ATOM 12 CA ALA 7 11.406 -8.935 0.803 0.007
2390 ATOM 13 CB ALA 7 11.403 -9.432 1.401 0.039
2391 ATOM 14 CA ALA 8 13.468 -11.695 -0.814 0.020
2392 ATOM 15 CB ALA 8 13.980 -11.540 -1.357 0.064
2393 ATOM 16 CA ALA 9 14.951 -14.842 0.840 0.059
2394 ATOM 17 CB ALA 9 14.362 -15.123 0.623 0.068
2395 ATOM 18 CA ALA 10 18.206 -16.625 1.694 0.005
2396 ATOM 19 CB ALA 10 18.067 -16.379 2.338 0.029
2397 ATOM 20 CA ALA 11 20.343 -19.347 0.324 0.003
2398 ATOM 21 CB ALA 11 20.436 -19.254 -0.437 0.337
2399 ATOM 22 CA ALA 12 22.901 -21.319 2.236 0.035
2400 ATOM 23 CB ALA 12 22.318 -21.680 2.392 0.160
2401 ATOM 24 CA ALA 13 26.307 -22.551 0.994 0.002
2402 ATOM 25 CB ALA 13 26.948 -22.131 0.937 0.068
2403 ATOM 26 CA CYS 14 27.763 -25.972 0.174 0.028
2404 ATOM 27 CB CYS 14 27.405 -26.687 -0.715 0.013
2405 ATOM 28 CA ALA 15 31.135 -27.605 0.952 0.023
2406 ATOM 29 CB ALA 15 31.420 -27.518 1.613 0.008
2407 ATOM 30 CA ALA 16 32.879 -30.144 -1.295 0.037
2408 ATOM 31 CB ALA 16 32.878 -29.619 -1.847 0.046
2409 ATOM 32 CA ALA 17 33.339 -33.443 0.565 0.052
2410 ATOM 33 CB ALA 17 32.691 -33.492 0.932 0.006
2411 ATOM 34 CA GLY 18 34.979 -36.073 -1.704 0.000
2431 REMARK time 1127.57 ENERGY 1.05387E+01
2432 ATOM 1 CA GLY 1 -3.240 2.865 0.463 0.024
2433 ATOM 2 CA ALA 2 0.108 3.193 -1.411 0.031
2434 ATOM 3 CB ALA 2 0.503 3.666 -1.119 0.024
2435 ATOM 4 CA ALA 3 2.096 0.246 -2.804 0.010
2436 ATOM 5 CB ALA 3 2.257 0.276 -3.561 0.058
2437 ATOM 6 CA ALA 4 3.912 -2.055 -0.406 0.009
2438 ATOM 7 CB ALA 4 3.521 -2.475 0.025 0.101
2439 ATOM 8 CA CYS 5 7.370 -3.836 -0.629 0.004
2440 ATOM 9 CB CYS 5 8.265 -3.081 -0.229 0.005
2441 ATOM 10 CA ALA 6 8.447 -7.506 -0.392 0.006
2442 ATOM 11 CB ALA 6 8.290 -7.933 -0.937 0.154
2443 ATOM 12 CA ALA 7 11.751 -8.878 0.874 0.033
2444 ATOM 13 CB ALA 7 11.805 -8.836 1.563 0.029
2445 ATOM 14 CA ALA 8 13.423 -12.127 -0.135 0.012
2446 ATOM 15 CB ALA 8 13.964 -12.292 -0.650 0.026
2447 ATOM 16 CA ALA 9 15.433 -14.786 1.634 0.024
2448 ATOM 17 CB ALA 9 14.888 -15.182 1.972 0.052
2449 ATOM 18 CA ALA 10 19.000 -15.618 0.910 0.055
2450 ATOM 19 CB ALA 10 19.464 -15.152 1.203 0.075
2451 ATOM 20 CA ALA 11 20.753 -18.724 -0.380 0.016
2452 ATOM 21 CB ALA 11 20.596 -18.498 -0.968 0.130
2453 ATOM 22 CA ALA 12 22.498 -21.282 1.640 0.084
2454 ATOM 23 CB ALA 12 22.124 -21.895 1.660 0.191
2455 ATOM 24 CA ALA 13 25.938 -22.297 0.377 0.079
2456 ATOM 25 CB ALA 13 25.687 -22.238 0.980 0.138
2457 ATOM 26 CA CYS 14 26.800 -25.918 0.588 0.076
2458 ATOM 27 CB CYS 14 26.353 -25.972 -0.604 0.023
2459 ATOM 28 CA ALA 15 29.875 -27.836 1.582 0.018
2460 ATOM 29 CB ALA 15 29.988 -27.912 2.288 0.238
2461 ATOM 30 CA ALA 16 31.874 -29.835 -0.832 0.031
2462 ATOM 31 CB ALA 16 32.560 -29.730 -1.323 0.059
2463 ATOM 32 CA ALA 17 32.653 -33.557 -0.334 0.010
2464 ATOM 33 CB ALA 17 32.080 -34.006 -0.671 0.034
2465 ATOM 34 CA GLY 18 36.389 -34.253 0.068 0.000
2485 REMARK time 1156.17 ENERGY 1.85395E+01
2486 ATOM 1 CA GLY 1 -4.446 3.416 -2.390 0.008
2487 ATOM 2 CA ALA 2 -0.922 2.680 -1.289 0.013
2488 ATOM 3 CB ALA 2 -0.684 2.963 -0.643 0.009
2489 ATOM 4 CA ALA 3 1.428 -0.311 -1.712 0.013
2490 ATOM 5 CB ALA 3 1.287 -0.712 -2.314 0.030
2491 ATOM 6 CA ALA 4 4.438 -1.385 0.368 0.058
2492 ATOM 7 CB ALA 4 4.420 -1.445 1.082 0.007
2493 ATOM 8 CA CYS 5 7.291 -3.536 -0.875 0.052
2494 ATOM 9 CB CYS 5 8.216 -2.967 -1.418 0.020
2495 ATOM 10 CA ALA 6 8.659 -6.652 0.919 0.077
2496 ATOM 11 CB ALA 6 8.322 -7.129 0.995 0.043
2497 ATOM 12 CA ALA 7 12.239 -8.190 1.313 0.030
2498 ATOM 13 CB ALA 7 12.102 -8.634 0.740 0.090
2499 ATOM 14 CA ALA 8 13.611 -11.211 -0.590 0.038
2500 ATOM 15 CB ALA 8 13.675 -11.062 -1.398 0.220
2501 ATOM 16 CA ALA 9 15.464 -14.254 0.727 0.007
2502 ATOM 17 CB ALA 9 15.268 -15.054 0.484 0.036
2503 ATOM 18 CA ALA 10 18.923 -15.553 0.448 0.062
2504 ATOM 19 CB ALA 10 19.159 -15.172 1.071 0.032
2505 ATOM 20 CA ALA 11 21.103 -18.498 -0.479 0.156
2506 ATOM 21 CB ALA 11 21.174 -18.487 -1.199 0.122
2507 ATOM 22 CA ALA 12 23.405 -20.670 1.583 0.027
2508 ATOM 23 CB ALA 12 22.898 -20.988 2.162 0.014
2509 ATOM 24 CA ALA 13 26.179 -23.051 0.672 0.051
2510 ATOM 25 CB ALA 13 26.763 -22.649 0.991 0.038
2511 ATOM 26 CA CYS 14 26.253 -26.849 0.745 0.012
2512 ATOM 27 CB CYS 14 26.152 -26.753 -0.511 0.017
2513 ATOM 28 CA ALA 15 28.674 -29.470 2.086 0.035
2514 ATOM 29 CB ALA 15 28.298 -29.804 2.678 0.023
2515 ATOM 30 CA ALA 16 31.536 -30.383 -0.261 0.005
2516 ATOM 31 CB ALA 16 32.019 -30.026 -0.690 0.076
2517 ATOM 32 CA ALA 17 33.919 -33.408 0.126 0.003
2518 ATOM 33 CB ALA 17 34.143 -34.133 0.102 0.025
2519 ATOM 34 CA GLY 18 36.801 -33.687 -2.333 0.000
2539 REMARK time 1180.73 ENERGY 6.17234E+00
2540 ATOM 1 CA GLY 1 -2.876 4.645 -1.395 0.004
2541 ATOM 2 CA ALA 2 -0.297 2.045 -2.386 0.005
2542 ATOM 3 CB ALA 2 0.193 2.286 -1.825 0.009
2543 ATOM 4 CA ALA 3 1.000 -1.354 -1.410 0.005
2544 ATOM 5 CB ALA 3 0.888 -1.934 -1.757 0.095
2545 ATOM 6 CA ALA 4 3.754 -2.009 1.041 0.039
2546 ATOM 7 CB ALA 4 3.133 -1.908 1.324 0.046
2547 ATOM 8 CA CYS 5 7.111 -3.660 0.244 0.011
2548 ATOM 9 CB CYS 5 7.817 -2.854 -0.456 0.012
2549 ATOM 10 CA ALA 6 8.925 -7.070 0.481 0.023
2550 ATOM 11 CB ALA 6 8.443 -7.486 0.246 0.257
2551 ATOM 12 CA ALA 7 12.528 -8.199 0.405 0.018
2552 ATOM 13 CB ALA 7 12.465 -8.221 1.100 0.101
2553 ATOM 14 CA ALA 8 14.406 -10.733 -1.662 0.016
2554 ATOM 15 CB ALA 8 14.907 -10.854 -2.296 0.101
2555 ATOM 16 CA ALA 9 16.362 -13.134 0.517 0.017
2556 ATOM 17 CB ALA 9 15.840 -13.476 0.555 0.086
2557 ATOM 18 CA ALA 10 19.194 -15.397 -0.384 0.031
2558 ATOM 19 CB ALA 10 19.735 -14.936 -0.118 0.030
2559 ATOM 20 CA ALA 11 20.242 -19.089 -0.389 0.024
2560 ATOM 21 CB ALA 11 20.131 -18.794 -1.085 0.193
2561 ATOM 22 CA ALA 12 21.992 -21.272 2.278 0.010
2562 ATOM 23 CB ALA 12 21.897 -21.926 2.624 0.012
2563 ATOM 24 CA ALA 13 25.554 -22.632 1.728 0.002
2564 ATOM 25 CB ALA 13 26.288 -22.537 1.840 0.093
2565 ATOM 26 CA CYS 14 26.417 -26.291 1.184 0.006
2566 ATOM 27 CB CYS 14 26.357 -26.791 0.044 0.014
2567 ATOM 28 CA ALA 15 29.525 -28.459 1.772 0.016
2568 ATOM 29 CB ALA 15 29.518 -29.061 2.205 0.042
2569 ATOM 30 CA ALA 16 31.582 -30.205 -0.931 0.002
2570 ATOM 31 CB ALA 16 31.856 -29.547 -1.189 0.091
2571 ATOM 32 CA ALA 17 33.280 -33.700 -1.017 0.027
2572 ATOM 33 CB ALA 17 32.824 -33.947 -1.462 0.057
2573 ATOM 34 CA GLY 18 36.886 -34.529 0.022 0.000
2593 REMARK time 1204.31 ENERGY 1.74812E+00
2594 ATOM 1 CA GLY 1 -2.137 3.386 -3.571 0.026
2595 ATOM 2 CA ALA 2 -0.108 2.534 -0.506 0.025
2596 ATOM 3 CB ALA 2 0.056 2.411 0.265 0.033
2597 ATOM 4 CA ALA 3 0.872 -1.116 -0.687 0.025
2598 ATOM 5 CB ALA 3 1.155 -1.508 -1.313 0.005
2599 ATOM 6 CA ALA 4 3.885 -2.772 0.969 0.033
2600 ATOM 7 CB ALA 4 3.763 -2.824 1.670 0.196
2601 ATOM 8 CA CYS 5 6.621 -4.325 -1.235 0.032
2602 ATOM 9 CB CYS 5 7.122 -3.702 -2.084 0.011
2603 ATOM 10 CA ALA 6 9.008 -6.579 0.611 0.020
2604 ATOM 11 CB ALA 6 9.207 -7.177 0.998 0.010
2605 ATOM 12 CA ALA 7 12.615 -7.699 0.034 0.013
2606 ATOM 13 CB ALA 7 13.201 -7.896 0.345 0.112
2607 ATOM 14 CA ALA 8 14.448 -10.566 -1.511 0.040
2608 ATOM 15 CB ALA 8 14.995 -10.161 -1.684 0.089
2609 ATOM 16 CA ALA 9 16.154 -13.529 0.218 0.005
2610 ATOM 17 CB ALA 9 15.598 -13.927 0.171 0.061
2611 ATOM 18 CA ALA 10 19.711 -14.917 -0.193 0.020
2612 ATOM 19 CB ALA 10 20.330 -14.895 0.169 0.032
2613 ATOM 20 CA ALA 11 20.353 -18.625 0.162 0.016
2614 ATOM 21 CB ALA 11 20.369 -19.156 -0.476 0.103
2615 ATOM 22 CA ALA 12 22.196 -21.051 2.386 0.009
2616 ATOM 23 CB ALA 12 21.707 -21.357 2.857 0.012
2617 ATOM 24 CA ALA 13 25.517 -22.632 1.255 0.013
2618 ATOM 25 CB ALA 13 25.956 -22.019 1.477 0.028
2619 ATOM 26 CA CYS 14 26.236 -26.383 1.097 0.058
2620 ATOM 27 CB CYS 14 26.043 -27.098 0.060 0.020
2621 ATOM 28 CA ALA 15 29.439 -28.246 1.935 0.031
2622 ATOM 29 CB ALA 15 29.120 -28.885 2.276 0.024
2623 ATOM 30 CA ALA 16 31.981 -29.948 -0.178 0.003
2624 ATOM 31 CB ALA 16 32.701 -29.922 -0.462 0.028
2625 ATOM 32 CA ALA 17 32.732 -33.661 -0.500 0.002
2626 ATOM 33 CB ALA 17 32.107 -34.086 -0.782 0.090
2627 ATOM 34 CA GLY 18 36.028 -34.081 -2.234 0.000
2647 REMARK time 1226.41 ENERGY -2.94635E+00
2648 ATOM 1 CA GLY 1 -2.631 3.164 1.081 0.010
2649 ATOM 2 CA ALA 2 -0.220 2.135 -1.646 0.036
2650 ATOM 3 CB ALA 2 0.049 2.636 -2.135 0.031
2651 ATOM 4 CA ALA 3 1.128 -1.488 -1.949 0.009
2652 ATOM 5 CB ALA 3 1.700 -1.575 -2.470 0.122
2653 ATOM 6 CA ALA 4 3.535 -2.953 0.579 0.050
2654 ATOM 7 CB ALA 4 3.275 -3.365 1.116 0.078
2655 ATOM 8 CA CYS 5 7.074 -3.544 -0.770 0.069
2656 ATOM 9 CB CYS 5 7.729 -2.560 -0.869 0.019
2657 ATOM 10 CA ALA 6 8.641 -6.839 0.072 0.031
2658 ATOM 11 CB ALA 6 8.314 -7.404 -0.243 0.014
2659 ATOM 12 CA ALA 7 12.290 -7.852 0.043 0.074
2660 ATOM 13 CB ALA 7 12.653 -7.850 0.598 0.044
2661 ATOM 14 CA ALA 8 14.237 -10.706 -1.550 0.010
2662 ATOM 15 CB ALA 8 14.677 -10.985 -1.922 0.031
2663 ATOM 16 CA ALA 9 16.104 -13.552 0.128 0.015
2664 ATOM 17 CB ALA 9 15.794 -14.290 0.350 0.030
2665 ATOM 18 CA ALA 10 19.704 -14.898 0.186 0.025
2666 ATOM 19 CB ALA 10 19.951 -14.599 0.799 0.008
2667 ATOM 20 CA ALA 11 20.832 -18.532 -0.137 0.012
2668 ATOM 21 CB ALA 11 21.268 -18.815 -0.753 0.269
2669 ATOM 22 CA ALA 12 22.470 -21.076 2.135 0.017
2670 ATOM 23 CB ALA 12 22.202 -21.747 2.191 0.072
2671 ATOM 24 CA ALA 13 25.848 -22.696 1.817 0.007
2672 ATOM 25 CB ALA 13 26.198 -22.164 2.232 0.090
2673 ATOM 26 CA CYS 14 26.726 -26.388 1.223 0.019
2674 ATOM 27 CB CYS 14 26.481 -26.227 0.022 0.014
2675 ATOM 28 CA ALA 15 29.798 -28.150 2.604 0.005
2676 ATOM 29 CB ALA 15 29.718 -28.631 3.177 0.022
2677 ATOM 30 CA ALA 16 31.795 -30.091 -0.036 0.048
2678 ATOM 31 CB ALA 16 32.408 -29.780 -0.329 0.018
2679 ATOM 32 CA ALA 17 31.759 -33.629 -1.618 0.005
2680 ATOM 33 CB ALA 17 31.537 -33.976 -2.155 0.078
2681 ATOM 34 CA GLY 18 35.123 -35.401 -1.491 0.000
2701 REMARK time 1255.05 ENERGY 1.43762E+00
2702 ATOM 1 CA GLY 1 -3.854 3.015 -2.480 0.001
2703 ATOM 2 CA ALA 2 -1.383 1.255 -0.251 0.011
2704 ATOM 3 CB ALA 2 -1.697 0.748 0.223 0.080
2705 ATOM 4 CA ALA 3 1.767 -0.894 -1.112 0.018
2706 ATOM 5 CB ALA 3 1.682 -0.811 -1.855 0.064
2707 ATOM 6 CA ALA 4 5.274 -1.361 0.276 0.010
2708 ATOM 7 CB ALA 4 5.458 -1.540 0.997 0.009
2709 ATOM 8 CA CYS 5 7.625 -3.791 -1.373 0.027
2710 ATOM 9 CB CYS 5 8.505 -3.204 -1.889 0.005
2711 ATOM 10 CA ALA 6 8.176 -7.121 0.395 0.021
2712 ATOM 11 CB ALA 6 7.556 -7.591 0.275 0.169
2713 ATOM 12 CA ALA 7 11.546 -8.923 0.293 0.029
2714 ATOM 13 CB ALA 7 11.949 -8.802 0.903 0.084
2715 ATOM 14 CA ALA 8 13.519 -11.569 -1.740 0.012
2716 ATOM 15 CB ALA 8 13.813 -11.396 -2.394 0.087
2717 ATOM 16 CA ALA 9 15.910 -14.126 -0.348 0.027
2718 ATOM 17 CB ALA 9 15.881 -14.873 -0.149 0.071
2719 ATOM 18 CA ALA 10 19.428 -14.731 0.872 0.005
2720 ATOM 19 CB ALA 10 19.181 -14.231 1.380 0.002
2721 ATOM 20 CA ALA 11 22.095 -17.366 0.008 0.048
2722 ATOM 21 CB ALA 11 22.690 -17.149 -0.406 0.130
2723 ATOM 22 CA ALA 12 23.054 -20.209 2.260 0.018
2724 ATOM 23 CB ALA 12 22.686 -20.727 2.716 0.007
2725 ATOM 24 CA ALA 13 26.476 -21.900 2.221 0.013
2726 ATOM 25 CB ALA 13 27.217 -21.631 2.399 0.013
2727 ATOM 26 CA CYS 14 26.903 -25.522 1.164 0.021
2728 ATOM 27 CB CYS 14 27.373 -26.074 0.138 0.042
2729 ATOM 28 CA ALA 15 29.303 -28.288 2.000 0.005
2730 ATOM 29 CB ALA 15 28.860 -28.748 2.416 0.009
2731 ATOM 30 CA ALA 16 31.247 -30.489 -0.395 0.007
2732 ATOM 31 CB ALA 16 31.953 -30.582 -0.376 0.093
2733 ATOM 32 CA ALA 17 31.273 -34.178 -1.415 0.051
2734 ATOM 33 CB ALA 17 30.702 -34.392 -1.697 0.071
2735 ATOM 34 CA GLY 18 34.406 -36.347 -1.715 0.000
2755 REMARK time 1277.44 ENERGY 4.10639E+00
2756 ATOM 1 CA GLY 1 0.296 3.637 -0.163 0.015
2757 ATOM 2 CA ALA 2 -1.926 0.769 -1.211 0.018
2758 ATOM 3 CB ALA 2 -2.245 0.174 -1.554 0.084
2759 ATOM 4 CA ALA 3 1.097 -1.641 -1.792 0.031
2760 ATOM 5 CB ALA 3 1.437 -1.754 -2.455 0.112
2761 ATOM 6 CA ALA 4 4.329 -2.369 0.011 0.061
2762 ATOM 7 CB ALA 4 4.276 -2.320 0.733 0.039
2763 ATOM 8 CA CYS 5 7.666 -3.792 -1.148 0.008
2764 ATOM 9 CB CYS 5 8.596 -3.132 -0.695 0.003
2765 ATOM 10 CA ALA 6 8.876 -7.206 0.159 0.018
2766 ATOM 11 CB ALA 6 8.559 -7.878 -0.001 0.157
2767 ATOM 12 CA ALA 7 12.149 -8.964 0.837 0.004
2768 ATOM 13 CB ALA 7 12.013 -8.893 1.590 0.020
2769 ATOM 14 CA ALA 8 13.791 -11.480 -1.318 0.023
2770 ATOM 15 CB ALA 8 14.163 -10.820 -1.522 0.013
2771 ATOM 16 CA ALA 9 15.940 -14.244 0.225 0.008
2772 ATOM 17 CB ALA 9 15.705 -14.923 0.095 0.086
2773 ATOM 18 CA ALA 10 19.714 -14.472 -0.034 0.024
2774 ATOM 19 CB ALA 10 20.136 -14.055 0.357 0.188
2775 ATOM 20 CA ALA 11 21.555 -17.818 -0.489 0.053
2776 ATOM 21 CB ALA 11 21.701 -18.002 -1.196 0.032
2777 ATOM 22 CA ALA 12 23.085 -19.824 2.248 0.005
2778 ATOM 23 CB ALA 12 22.653 -20.457 2.226 0.132
2779 ATOM 24 CA ALA 13 26.259 -21.964 2.265 0.023
2780 ATOM 25 CB ALA 13 26.827 -22.037 2.662 0.018
2781 ATOM 26 CA CYS 14 27.114 -25.382 0.894 0.032
2782 ATOM 27 CB CYS 14 27.358 -25.296 -0.277 0.026
2783 ATOM 28 CA ALA 15 29.949 -27.455 2.044 0.010
2784 ATOM 29 CB ALA 15 29.798 -27.818 2.646 0.086
2785 ATOM 30 CA ALA 16 31.708 -30.193 -0.063 0.035
2786 ATOM 31 CB ALA 16 32.095 -30.716 -0.475 0.044
2787 ATOM 32 CA ALA 17 30.103 -33.575 -1.100 0.032
2788 ATOM 33 CB ALA 17 29.423 -33.656 -1.321 0.007
2789 ATOM 34 CA GLY 18 32.199 -36.773 -1.631 0.000
2809 REMARK time 1303.08 ENERGY -3.44880E+00
2810 ATOM 1 CA GLY 1 -1.279 4.951 -2.893 0.031
2811 ATOM 2 CA ALA 2 -0.818 1.650 -1.167 0.050
2812 ATOM 3 CB ALA 2 -1.424 1.176 -1.335 0.017
2813 ATOM 4 CA ALA 3 1.275 -1.390 -1.994 0.010
2814 ATOM 5 CB ALA 3 1.447 -1.579 -2.622 0.033
2815 ATOM 6 CA ALA 4 3.234 -3.309 0.699 0.006
2816 ATOM 7 CB ALA 4 2.829 -3.830 1.058 0.050
2817 ATOM 8 CA CYS 5 6.924 -3.841 0.012 0.004
2818 ATOM 9 CB CYS 5 7.844 -3.198 0.422 0.006
2819 ATOM 10 CA ALA 6 8.361 -7.271 -0.050 0.009
2820 ATOM 11 CB ALA 6 8.220 -7.691 -0.730 0.037
2821 ATOM 12 CA ALA 7 11.738 -8.894 0.951 0.003
2822 ATOM 13 CB ALA 7 11.716 -9.494 1.356 0.102
2823 ATOM 14 CA ALA 8 14.014 -11.078 -1.294 0.026
2824 ATOM 15 CB ALA 8 14.452 -10.960 -1.849 0.072
2825 ATOM 16 CA ALA 9 16.230 -14.012 -0.487 0.041
2826 ATOM 17 CB ALA 9 16.181 -14.533 -0.980 0.060
2827 ATOM 18 CA ALA 10 19.836 -14.519 0.587 0.031
2828 ATOM 19 CB ALA 10 19.950 -14.138 1.142 0.088
2829 ATOM 20 CA ALA 11 22.052 -17.485 -0.249 0.027
2830 ATOM 21 CB ALA 11 22.076 -17.398 -1.010 0.072
2831 ATOM 22 CA ALA 12 24.551 -19.192 2.152 0.002
2832 ATOM 23 CB ALA 12 23.918 -19.408 2.492 0.139
2833 ATOM 24 CA ALA 13 27.307 -21.810 1.756 0.015
2834 ATOM 25 CB ALA 13 27.814 -21.390 2.010 0.154
2835 ATOM 26 CA CYS 14 27.100 -25.624 1.423 0.003
2836 ATOM 27 CB CYS 14 26.784 -25.242 0.194 0.023
2837 ATOM 28 CA ALA 15 29.931 -28.041 1.822 0.007
2838 ATOM 29 CB ALA 15 30.133 -28.510 2.433 0.304
2839 ATOM 30 CA ALA 16 30.898 -30.794 -0.651 0.051
2840 ATOM 31 CB ALA 16 31.453 -30.475 -1.054 0.024
2841 ATOM 32 CA ALA 17 30.592 -34.604 -0.446 0.002
2842 ATOM 33 CB ALA 17 29.936 -34.881 -0.205 0.150
2843 ATOM 34 CA GLY 18 32.072 -37.374 -2.548 0.000
2863 REMARK time 1325.11 ENERGY 2.46579E+00
2864 ATOM 1 CA GLY 1 -2.462 4.352 -2.430 0.040
2865 ATOM 2 CA ALA 2 0.752 2.202 -2.054 0.062
2866 ATOM 3 CB ALA 2 1.351 2.269 -1.684 0.061
2867 ATOM 4 CA ALA 3 1.050 -1.454 -2.434 0.045
2868 ATOM 5 CB ALA 3 1.772 -1.548 -2.763 0.055
2869 ATOM 6 CA ALA 4 2.890 -3.825 -0.076 0.027
2870 ATOM 7 CB ALA 4 2.464 -4.425 -0.115 0.036
2871 ATOM 8 CA CYS 5 6.454 -4.781 0.935 0.006
2872 ATOM 9 CB CYS 5 6.921 -4.336 1.921 0.046
2873 ATOM 10 CA ALA 6 8.199 -7.903 -0.326 0.046
2874 ATOM 11 CB ALA 6 8.057 -7.625 -0.975 0.026
2875 ATOM 12 CA ALA 7 11.876 -8.841 0.155 0.074
2876 ATOM 13 CB ALA 7 12.326 -9.080 0.694 0.027
2877 ATOM 14 CA ALA 8 14.601 -10.818 -1.537 0.027
2878 ATOM 15 CB ALA 8 15.256 -10.544 -1.789 0.047
2879 ATOM 16 CA ALA 9 16.382 -13.149 1.032 0.063
2880 ATOM 17 CB ALA 9 16.109 -13.810 1.025 0.059
2881 ATOM 18 CA ALA 10 19.987 -14.165 1.101 0.003
2882 ATOM 19 CB ALA 10 20.405 -13.951 1.622 0.131
2883 ATOM 20 CA ALA 11 21.546 -17.575 0.567 0.013
2884 ATOM 21 CB ALA 11 21.703 -17.796 -0.104 0.011
2885 ATOM 22 CA ALA 12 24.935 -18.754 1.838 0.012
2886 ATOM 23 CB ALA 12 25.175 -19.127 2.418 0.037
2887 ATOM 24 CA ALA 13 27.138 -21.527 0.419 0.012
2888 ATOM 25 CB ALA 13 27.697 -21.114 0.690 0.053
2889 ATOM 26 CA CYS 14 26.903 -25.246 1.261 0.002
2890 ATOM 27 CB CYS 14 26.083 -25.657 0.504 0.026
2891 ATOM 28 CA ALA 15 29.300 -28.247 0.922 0.009
2892 ATOM 29 CB ALA 15 29.231 -28.324 1.642 0.051
2893 ATOM 30 CA ALA 16 30.089 -31.046 -1.495 0.051
2894 ATOM 31 CB ALA 16 30.419 -30.580 -2.028 0.087
2895 ATOM 32 CA ALA 17 30.489 -34.757 -0.720 0.025
2896 ATOM 33 CB ALA 17 30.247 -35.470 -0.630 0.042
2897 ATOM 34 CA GLY 18 33.953 -36.157 0.324 0.000
2917 REMARK time 1353.37 ENERGY 4.91228E+00
2918 ATOM 1 CA GLY 1 -3.015 2.700 -3.557 0.052
2919 ATOM 2 CA ALA 2 -0.506 1.917 -0.836 0.005
2920 ATOM 3 CB ALA 2 -0.691 1.870 -0.086 0.007
2921 ATOM 4 CA ALA 3 2.464 0.049 -2.355 0.070
2922 ATOM 5 CB ALA 3 2.888 -0.454 -2.715 0.079
2923 ATOM 6 CA ALA 4 3.773 -3.111 -0.398 0.025
2924 ATOM 7 CB ALA 4 3.372 -3.701 -0.395 0.117
2925 ATOM 8 CA CYS 5 6.793 -5.121 -1.531 0.032
2926 ATOM 9 CB CYS 5 7.661 -4.227 -1.727 0.041
2927 ATOM 10 CA ALA 6 8.339 -8.016 0.308 0.025
2928 ATOM 11 CB ALA 6 8.258 -8.770 0.290 0.024
2929 ATOM 12 CA ALA 7 12.085 -8.489 0.800 0.060
2930 ATOM 13 CB ALA 7 12.559 -8.071 1.290 0.020
2931 ATOM 14 CA ALA 8 13.598 -11.886 1.412 0.028
2932 ATOM 15 CB ALA 8 13.752 -12.427 0.990 0.118
2933 ATOM 16 CA ALA 9 17.005 -11.990 3.117 0.018
2934 ATOM 17 CB ALA 9 17.050 -12.105 3.898 0.086
2935 ATOM 18 CA ALA 10 19.909 -13.481 1.023 0.015
2936 ATOM 19 CB ALA 10 20.452 -13.106 0.933 0.054
2937 ATOM 20 CA ALA 11 20.983 -17.073 0.195 0.011
2938 ATOM 21 CB ALA 11 21.089 -17.070 -0.594 0.051
2939 ATOM 22 CA ALA 12 23.599 -19.646 1.275 0.010
2940 ATOM 23 CB ALA 12 23.425 -20.169 1.747 0.012
2941 ATOM 24 CA ALA 13 26.042 -22.003 -0.343 0.008
2942 ATOM 25 CB ALA 13 26.644 -21.489 -0.176 0.009
2943 ATOM 26 CA CYS 14 27.093 -25.612 0.249 0.016
2944 ATOM 27 CB CYS 14 25.881 -25.756 0.009 0.005
2945 ATOM 28 CA ALA 15 29.919 -28.118 0.962 0.010
2946 ATOM 29 CB ALA 15 30.346 -28.325 1.513 0.143
2947 ATOM 30 CA ALA 16 30.069 -31.527 -0.915 0.037
2948 ATOM 31 CB ALA 16 30.279 -31.657 -1.684 0.026
2949 ATOM 32 CA ALA 17 32.429 -34.233 0.040 0.001
2950 ATOM 33 CB ALA 17 32.231 -34.340 0.756 0.051
2951 ATOM 34 CA GLY 18 32.841 -37.427 -1.925 0.000
2971 REMARK time 1382.91 ENERGY 9.32055E+00
2972 ATOM 1 CA GLY 1 -3.653 2.589 -2.962 0.006
2973 ATOM 2 CA ALA 2 -1.400 -0.097 -1.457 0.045
2974 ATOM 3 CB ALA 2 -1.629 -0.709 -0.996 0.057
2975 ATOM 4 CA ALA 3 1.981 0.717 -2.958 0.006
2976 ATOM 5 CB ALA 3 2.143 1.479 -3.096 0.141
2977 ATOM 6 CA ALA 4 5.161 -0.930 -1.793 0.048
2978 ATOM 7 CB ALA 4 5.297 -0.437 -1.262 0.006
2979 ATOM 8 CA CYS 5 7.098 -4.196 -1.239 0.064
2980 ATOM 9 CB CYS 5 8.338 -3.937 -1.305 0.007
2981 ATOM 10 CA ALA 6 8.223 -6.781 1.322 0.008
2982 ATOM 11 CB ALA 6 7.884 -7.422 1.450 0.042
2983 ATOM 12 CA ALA 7 11.873 -7.736 1.896 0.034
2984 ATOM 13 CB ALA 7 12.452 -7.886 2.343 0.023
2985 ATOM 14 CA ALA 8 13.432 -11.021 0.499 0.066
2986 ATOM 15 CB ALA 8 13.612 -10.515 -0.068 0.084
2987 ATOM 16 CA ALA 9 15.757 -13.710 1.887 0.009
2988 ATOM 17 CB ALA 9 15.181 -14.254 1.634 0.085
2989 ATOM 18 CA ALA 10 19.146 -15.308 1.438 0.061
2990 ATOM 19 CB ALA 10 19.115 -14.689 1.824 0.149
2991 ATOM 20 CA ALA 11 21.231 -18.479 1.966 0.008
2992 ATOM 21 CB ALA 11 21.202 -18.917 1.372 0.007
2993 ATOM 22 CA ALA 12 24.921 -19.358 1.802 0.036
2994 ATOM 23 CB ALA 12 25.288 -19.346 2.473 0.047
2995 ATOM 24 CA ALA 13 25.644 -22.595 -0.100 0.109
2996 ATOM 25 CB ALA 13 25.417 -22.398 -0.729 0.058
2997 ATOM 26 CA CYS 14 27.437 -25.730 1.062 0.011
2998 ATOM 27 CB CYS 14 27.377 -26.380 2.125 0.025
2999 ATOM 28 CA ALA 15 28.655 -28.559 -1.312 0.020
3000 ATOM 29 CB ALA 15 29.146 -28.446 -1.908 0.031
3001 ATOM 30 CA ALA 16 29.650 -32.144 -0.982 0.004
3002 ATOM 31 CB ALA 16 29.193 -32.569 -1.147 0.018
3003 ATOM 32 CA ALA 17 33.343 -33.012 -1.040 0.001
3004 ATOM 33 CB ALA 17 33.770 -32.992 -0.462 0.054
3005 ATOM 34 CA GLY 18 34.438 -36.599 -0.875 0.000
3025 REMARK time 1406.92 ENERGY 3.51995E+00
3026 ATOM 1 CA GLY 1 -4.070 0.753 -3.704 0.016
3027 ATOM 2 CA ALA 2 -0.978 0.572 -1.627 0.039
3028 ATOM 3 CB ALA 2 -1.532 0.562 -1.128 0.071
3029 ATOM 4 CA ALA 3 1.972 -1.671 -1.995 0.003
3030 ATOM 5 CB ALA 3 2.275 -1.592 -2.691 0.042
3031 ATOM 6 CA ALA 4 5.497 -0.450 -1.086 0.031
3032 ATOM 7 CB ALA 4 5.486 0.215 -0.644 0.066
3033 ATOM 8 CA CYS 5 8.569 -2.705 -1.275 0.010
3034 ATOM 9 CB CYS 5 9.539 -2.702 -2.133 0.044
3035 ATOM 10 CA ALA 6 9.337 -5.640 0.977 0.007
3036 ATOM 11 CB ALA 6 8.695 -6.122 1.088 0.115
3037 ATOM 12 CA ALA 7 12.204 -7.991 1.198 0.048
3038 ATOM 13 CB ALA 7 12.885 -7.565 1.201 0.043
3039 ATOM 14 CA ALA 8 13.054 -11.678 1.731 0.005
3040 ATOM 15 CB ALA 8 12.350 -11.465 1.490 0.246
3041 ATOM 16 CA ALA 9 16.297 -13.238 2.618 0.008
3042 ATOM 17 CB ALA 9 16.663 -13.182 3.294 0.058
3043 ATOM 18 CA ALA 10 17.906 -16.016 0.590 0.004
3044 ATOM 19 CB ALA 10 18.156 -15.369 0.388 0.056
3045 ATOM 20 CA ALA 11 19.364 -19.156 2.085 0.033
3046 ATOM 21 CB ALA 11 18.890 -19.696 2.062 0.040
3047 ATOM 22 CA ALA 12 22.686 -20.749 1.324 0.024
3048 ATOM 23 CB ALA 12 23.334 -20.602 1.709 0.052
3049 ATOM 24 CA ALA 13 24.257 -23.974 0.005 0.005
3050 ATOM 25 CB ALA 13 23.856 -23.812 -0.621 0.051
3051 ATOM 26 CA CYS 14 27.812 -25.164 0.713 0.008
3052 ATOM 27 CB CYS 14 27.835 -25.166 1.973 0.005
3053 ATOM 28 CA ALA 15 29.895 -27.489 -1.469 0.017
3054 ATOM 29 CB ALA 15 30.402 -27.257 -1.989 0.030
3055 ATOM 30 CA ALA 16 30.350 -31.208 -0.756 0.003
3056 ATOM 31 CB ALA 16 30.110 -31.894 -0.950 0.013
3057 ATOM 32 CA ALA 17 33.625 -33.100 -0.486 0.003
3058 ATOM 33 CB ALA 17 34.094 -33.138 0.180 0.033
3059 ATOM 34 CA GLY 18 34.365 -36.531 -1.939 0.000
3079 REMARK time 1432.43 ENERGY -2.19470E+00
3080 ATOM 1 CA GLY 1 -3.148 2.711 -1.678 0.015
3081 ATOM 2 CA ALA 2 -0.664 0.690 -3.688 0.018
3082 ATOM 3 CB ALA 2 -0.013 0.883 -4.055 0.031
3083 ATOM 4 CA ALA 3 1.324 -1.195 -1.149 0.042
3084 ATOM 5 CB ALA 3 0.970 -1.779 -1.146 0.008
3085 ATOM 6 CA ALA 4 5.175 -0.847 -0.704 0.032
3086 ATOM 7 CB ALA 4 5.540 -0.434 -0.158 0.054
3087 ATOM 8 CA CYS 5 8.009 -3.250 -1.267 0.020
3088 ATOM 9 CB CYS 5 8.565 -3.307 -2.341 0.059
3089 ATOM 10 CA ALA 6 9.825 -5.217 1.477 0.025
3090 ATOM 11 CB ALA 6 9.615 -5.541 2.130 0.242
3091 ATOM 12 CA ALA 7 12.605 -7.754 0.897 0.012
3092 ATOM 13 CB ALA 7 13.261 -7.892 0.684 0.228
3093 ATOM 14 CA ALA 8 13.278 -11.376 1.634 0.019
3094 ATOM 15 CB ALA 8 13.287 -12.062 1.312 0.065
3095 ATOM 16 CA ALA 9 16.353 -13.597 2.070 0.038
3096 ATOM 17 CB ALA 9 16.981 -13.949 2.299 0.054
3097 ATOM 18 CA ALA 10 17.445 -17.032 0.780 0.035
3098 ATOM 19 CB ALA 10 17.309 -16.927 -0.017 0.071
3099 ATOM 20 CA ALA 11 19.628 -19.422 2.644 0.004
3100 ATOM 21 CB ALA 11 19.290 -20.091 2.679 0.166
3101 ATOM 22 CA ALA 12 23.143 -20.497 1.716 0.019
3102 ATOM 23 CB ALA 12 23.710 -20.342 2.167 0.015
3103 ATOM 24 CA ALA 13 24.276 -23.205 -0.718 0.043
3104 ATOM 25 CB ALA 13 24.309 -23.563 -1.400 0.028
3105 ATOM 26 CA CYS 14 26.755 -25.664 0.830 0.012
3106 ATOM 27 CB CYS 14 26.393 -25.998 2.034 0.009
3107 ATOM 28 CA ALA 15 29.756 -27.185 -1.119 0.004
3108 ATOM 29 CB ALA 15 30.270 -26.737 -1.283 0.002
3109 ATOM 30 CA ALA 16 30.876 -30.799 -1.217 0.006
3110 ATOM 31 CB ALA 16 30.553 -31.225 -1.680 0.027
3111 ATOM 32 CA ALA 17 34.090 -32.625 -0.391 0.014
3112 ATOM 33 CB ALA 17 34.013 -32.242 0.279 0.078
3113 ATOM 34 CA GLY 18 34.720 -36.150 -1.564 0.000
3133 REMARK time 1458.91 ENERGY -2.44813E+00
3134 ATOM 1 CA GLY 1 -2.901 4.192 -2.210 0.024
3135 ATOM 2 CA ALA 2 0.041 2.402 -3.581 0.203
3136 ATOM 3 CB ALA 2 0.406 2.768 -4.121 0.318
3137 ATOM 4 CA ALA 3 1.952 0.621 -0.804 0.124
3138 ATOM 5 CB ALA 3 1.770 -0.124 -0.935 0.178
3139 ATOM 6 CA ALA 4 5.511 -0.836 -1.286 0.040
3140 ATOM 7 CB ALA 4 5.881 -0.676 -0.839 0.121
3141 ATOM 8 CA CYS 5 6.037 -4.615 -0.527 0.015
3142 ATOM 9 CB CYS 5 5.665 -5.016 -1.567 0.016
3143 ATOM 10 CA ALA 6 8.841 -6.510 1.138 0.013
3144 ATOM 11 CB ALA 6 8.354 -6.719 1.650 0.093
3145 ATOM 12 CA ALA 7 12.247 -8.158 0.789 0.001
3146 ATOM 13 CB ALA 7 12.984 -7.917 0.864 0.037
3147 ATOM 14 CA ALA 8 13.394 -11.772 0.929 0.018
3148 ATOM 15 CB ALA 8 13.426 -12.373 0.457 0.047
3149 ATOM 16 CA ALA 9 16.682 -13.087 2.334 0.002
3150 ATOM 17 CB ALA 9 16.930 -13.430 2.879 0.008
3151 ATOM 18 CA ALA 10 18.873 -15.707 0.633 0.021
3152 ATOM 19 CB ALA 10 19.081 -15.223 0.081 0.008
3153 ATOM 20 CA ALA 11 20.343 -18.762 2.422 0.001
3154 ATOM 21 CB ALA 11 19.717 -18.863 2.778 0.066
3155 ATOM 22 CA ALA 12 23.365 -20.993 1.828 0.018
3156 ATOM 23 CB ALA 12 23.800 -20.783 2.394 0.052
3157 ATOM 24 CA ALA 13 23.521 -24.417 0.175 0.005
3158 ATOM 25 CB ALA 13 23.356 -24.138 -0.542 0.014
3159 ATOM 26 CA CYS 14 26.236 -27.053 0.634 0.009
3160 ATOM 27 CB CYS 14 26.315 -27.784 1.558 0.007
3161 ATOM 28 CA ALA 15 29.478 -27.570 -1.330 0.046
3162 ATOM 29 CB ALA 15 29.830 -26.882 -1.232 0.020
3163 ATOM 30 CA ALA 16 31.641 -30.585 -1.903 0.028
3164 ATOM 31 CB ALA 16 31.695 -30.946 -2.552 0.048
3165 ATOM 32 CA ALA 17 34.225 -32.333 0.281 0.030
3166 ATOM 33 CB ALA 17 34.322 -32.637 0.954 0.016
3167 ATOM 34 CA GLY 18 36.866 -34.461 -1.472 0.000
3187 REMARK time 1479.75 ENERGY -1.34692E+00
3188 ATOM 1 CA GLY 1 -1.839 5.474 -2.405 0.006
3189 ATOM 2 CA ALA 2 0.343 2.670 -3.866 0.013
3190 ATOM 3 CB ALA 2 0.776 3.094 -4.344 0.040
3191 ATOM 4 CA ALA 3 1.774 0.115 -1.443 0.033
3192 ATOM 5 CB ALA 3 1.546 -0.445 -1.164 0.019
3193 ATOM 6 CA ALA 4 5.161 -1.493 -1.068 0.131
3194 ATOM 7 CB ALA 4 5.863 -1.160 -0.821 0.082
3195 ATOM 8 CA CYS 5 6.351 -4.555 0.919 0.022
3196 ATOM 9 CB CYS 5 6.210 -5.592 0.213 0.057
3197 ATOM 10 CA ALA 6 9.855 -6.051 0.919 0.016
3198 ATOM 11 CB ALA 6 10.368 -6.345 1.379 0.007
3199 ATOM 12 CA ALA 7 11.086 -9.388 -0.380 0.018
3200 ATOM 13 CB ALA 7 11.455 -9.568 -0.984 0.187
3201 ATOM 14 CA ALA 8 12.995 -12.343 1.062 0.020
3202 ATOM 15 CB ALA 8 12.469 -12.835 1.357 0.131
3203 ATOM 16 CA ALA 9 16.734 -12.725 1.726 0.013
3204 ATOM 17 CB ALA 9 17.080 -12.431 2.349 0.036
3205 ATOM 18 CA ALA 10 19.223 -15.638 0.827 0.011
3206 ATOM 19 CB ALA 10 19.758 -15.188 0.501 0.019
3207 ATOM 20 CA ALA 11 19.793 -18.835 2.795 0.000
3208 ATOM 21 CB ALA 11 19.597 -19.336 2.346 0.072
3209 ATOM 22 CA ALA 12 22.864 -20.955 2.177 0.009
3210 ATOM 23 CB ALA 12 23.463 -20.966 2.684 0.010
3211 ATOM 24 CA ALA 13 23.531 -23.769 -0.261 0.007
3212 ATOM 25 CB ALA 13 23.764 -23.333 -0.873 0.027
3213 ATOM 26 CA CYS 14 26.008 -26.543 0.388 0.028
3214 ATOM 27 CB CYS 14 25.280 -27.463 0.829 0.002
3215 ATOM 28 CA ALA 15 29.284 -27.708 -1.161 0.013
3216 ATOM 29 CB ALA 15 29.937 -27.365 -1.427 0.043
3217 ATOM 30 CA ALA 16 31.248 -30.921 -1.010 0.067
3218 ATOM 31 CB ALA 16 31.298 -31.480 -1.488 0.077
3219 ATOM 32 CA ALA 17 34.923 -31.553 -0.129 0.002
3220 ATOM 33 CB ALA 17 34.945 -31.666 0.549 0.048
3221 ATOM 34 CA GLY 18 37.484 -34.080 -1.338 0.000
3241 REMARK time 1505.35 ENERGY 1.33284E+01
3242 ATOM 1 CA GLY 1 0.541 6.763 -4.351 0.014
3243 ATOM 2 CA ALA 2 0.707 3.027 -3.559 0.017
3244 ATOM 3 CB ALA 2 1.227 2.936 -4.074 0.030
3245 ATOM 4 CA ALA 3 1.549 0.511 -0.887 0.008
3246 ATOM 5 CB ALA 3 0.871 0.574 -0.680 0.169
3247 ATOM 6 CA ALA 4 4.417 -2.016 -0.891 0.007
3248 ATOM 7 CB ALA 4 5.133 -1.682 -0.793 0.073
3249 ATOM 8 CA CYS 5 6.196 -5.047 0.567 0.035
3250 ATOM 9 CB CYS 5 5.736 -5.919 -0.360 0.002
3251 ATOM 10 CA ALA 6 9.196 -6.620 2.211 0.096
3252 ATOM 11 CB ALA 6 8.948 -6.820 2.908 0.028
3253 ATOM 12 CA ALA 7 11.507 -8.860 0.167 0.049
3254 ATOM 13 CB ALA 7 12.198 -8.690 -0.281 0.014
3255 ATOM 14 CA ALA 8 13.759 -11.237 1.990 0.002
3256 ATOM 15 CB ALA 8 13.798 -12.003 2.314 0.015
3257 ATOM 16 CA ALA 9 16.419 -13.202 0.263 0.011
3258 ATOM 17 CB ALA 9 17.055 -12.945 0.233 0.027
3259 ATOM 18 CA ALA 10 17.290 -16.982 0.283 0.058
3260 ATOM 19 CB ALA 10 17.298 -16.732 -0.393 0.026
3261 ATOM 20 CA ALA 11 19.882 -18.867 2.375 0.003
3262 ATOM 21 CB ALA 11 19.500 -19.598 2.426 0.003
3263 ATOM 22 CA ALA 12 23.069 -20.522 0.821 0.062
3264 ATOM 23 CB ALA 12 23.567 -20.158 1.105 0.173
3265 ATOM 24 CA ALA 13 23.919 -24.124 0.047 0.044
3266 ATOM 25 CB ALA 13 23.764 -24.399 -0.599 0.038
3267 ATOM 26 CA CYS 14 26.540 -26.504 1.461 0.034
3268 ATOM 27 CB CYS 14 26.080 -27.669 1.532 0.006
3269 ATOM 28 CA ALA 15 29.772 -27.424 -0.396 0.008
3270 ATOM 29 CB ALA 15 30.259 -27.112 -0.024 0.053
3271 ATOM 30 CA ALA 16 31.546 -30.506 -1.702 0.019
3272 ATOM 31 CB ALA 16 31.213 -30.570 -2.290 0.020
3273 ATOM 32 CA ALA 17 34.688 -31.801 0.098 0.009
3274 ATOM 33 CB ALA 17 34.718 -32.280 0.584 0.033
3275 ATOM 34 CA GLY 18 37.614 -33.544 -1.540 0.000
3295 REMARK time 1526.36 ENERGY -3.45665E-01
3296 ATOM 1 CA GLY 1 -0.573 5.995 -4.765 0.005
3297 ATOM 2 CA ALA 2 0.947 2.680 -3.989 0.013
3298 ATOM 3 CB ALA 2 1.440 2.292 -4.302 0.123
3299 ATOM 4 CA ALA 3 2.623 1.544 -0.804 0.028
3300 ATOM 5 CB ALA 3 2.103 1.331 -0.418 0.107
3301 ATOM 6 CA ALA 4 4.903 -1.314 0.069 0.007
3302 ATOM 7 CB ALA 4 5.259 -0.708 0.309 0.101
3303 ATOM 8 CA CYS 5 5.852 -4.921 0.613 0.027
3304 ATOM 9 CB CYS 5 5.637 -4.995 -0.578 0.012
3305 ATOM 10 CA ALA 6 9.027 -6.436 2.052 0.045
3306 ATOM 11 CB ALA 6 8.896 -6.724 2.792 0.042
3307 ATOM 12 CA ALA 7 10.888 -9.258 0.466 0.067
3308 ATOM 13 CB ALA 7 11.086 -8.969 -0.222 0.018
3309 ATOM 14 CA ALA 8 12.598 -12.562 1.443 0.035
3310 ATOM 15 CB ALA 8 12.382 -13.302 1.533 0.052
3311 ATOM 16 CA ALA 9 16.223 -13.641 1.342 0.003
3312 ATOM 17 CB ALA 9 16.424 -13.524 2.081 0.180
3313 ATOM 18 CA ALA 10 17.856 -16.603 -0.380 0.008
3314 ATOM 19 CB ALA 10 18.070 -16.451 -1.113 0.006
3315 ATOM 20 CA ALA 11 19.493 -19.456 1.534 0.005
3316 ATOM 21 CB ALA 11 19.205 -20.059 1.970 0.063
3317 ATOM 22 CA ALA 12 23.037 -20.674 0.691 0.032
3318 ATOM 23 CB ALA 12 23.578 -20.179 0.902 0.001
3319 ATOM 24 CA ALA 13 24.106 -24.309 0.091 0.014
3320 ATOM 25 CB ALA 13 23.969 -24.580 -0.567 0.001
3321 ATOM 26 CA CYS 14 27.244 -26.186 1.054 0.029
3322 ATOM 27 CB CYS 14 27.041 -26.516 2.257 0.033
3323 ATOM 28 CA ALA 15 30.004 -27.405 -1.162 0.101
3324 ATOM 29 CB ALA 15 30.569 -27.085 -1.429 0.018
3325 ATOM 30 CA ALA 16 31.297 -30.930 -0.855 0.022
3326 ATOM 31 CB ALA 16 31.003 -30.582 -1.459 0.251
3327 ATOM 32 CA ALA 17 34.966 -31.539 -0.450 0.014
3328 ATOM 33 CB ALA 17 35.295 -31.389 0.212 0.196
3329 ATOM 34 CA GLY 18 36.769 -34.858 -0.478 0.000
3349 REMARK time 1546.80 ENERGY -7.29927E-01
3350 ATOM 1 CA GLY 1 -1.277 5.674 -4.095 0.013
3351 ATOM 2 CA ALA 2 0.794 2.461 -3.689 0.069
3352 ATOM 3 CB ALA 2 1.400 2.267 -4.001 0.064
3353 ATOM 4 CA ALA 3 2.744 1.474 -0.599 0.002
3354 ATOM 5 CB ALA 3 2.292 1.637 -0.043 0.004
3355 ATOM 6 CA ALA 4 5.770 -0.851 -0.825 0.044
3356 ATOM 7 CB ALA 4 5.972 -0.205 -0.969 0.039
3357 ATOM 8 CA CYS 5 6.625 -4.601 -0.169 0.050
3358 ATOM 9 CB CYS 5 6.360 -5.376 -1.058 0.065
3359 ATOM 10 CA ALA 6 9.013 -6.469 2.133 0.009
3360 ATOM 11 CB ALA 6 8.798 -7.034 2.622 0.067
3361 ATOM 12 CA ALA 7 11.700 -8.946 1.175 0.048
3362 ATOM 13 CB ALA 7 12.422 -8.969 1.300 0.088
3363 ATOM 14 CA ALA 8 11.655 -12.657 0.961 0.022
3364 ATOM 15 CB ALA 8 11.373 -12.874 0.281 0.002
3365 ATOM 16 CA ALA 9 14.322 -15.028 2.306 0.036
3366 ATOM 17 CB ALA 9 13.790 -15.562 2.482 0.047
3367 ATOM 18 CA ALA 10 17.545 -16.505 0.955 0.020
3368 ATOM 19 CB ALA 10 17.861 -15.826 1.077 0.057
3369 ATOM 20 CA ALA 11 19.416 -19.725 1.588 0.045
3370 ATOM 21 CB ALA 11 19.250 -20.291 1.133 0.023
3371 ATOM 22 CA ALA 12 23.012 -20.684 0.868 0.033
3372 ATOM 23 CB ALA 12 23.650 -20.619 1.272 0.089
3373 ATOM 24 CA ALA 13 24.843 -23.076 -1.388 0.049
3374 ATOM 25 CB ALA 13 24.880 -23.167 -2.123 0.007
3375 ATOM 26 CA CYS 14 27.432 -25.346 0.229 0.073
3376 ATOM 27 CB CYS 14 27.366 -24.785 1.311 0.037
3377 ATOM 28 CA ALA 15 29.261 -28.309 -1.195 0.073
3378 ATOM 29 CB ALA 15 29.863 -28.514 -1.654 0.028
3379 ATOM 30 CA ALA 16 31.319 -31.083 0.183 0.003
3380 ATOM 31 CB ALA 16 30.869 -31.695 -0.105 0.019
3381 ATOM 32 CA ALA 17 35.054 -31.822 -0.082 0.007
3382 ATOM 33 CB ALA 17 35.486 -31.339 0.200 0.065
3383 ATOM 34 CA GLY 18 37.496 -34.807 -0.601 0.000
3403 REMARK time 1576.80 ENERGY 7.51875E+00
3404 ATOM 1 CA GLY 1 -1.729 5.253 -3.201 0.004
3405 ATOM 2 CA ALA 2 1.336 3.011 -3.459 0.012
3406 ATOM 3 CB ALA 2 1.889 3.464 -3.621 0.013
3407 ATOM 4 CA ALA 3 2.980 0.288 -1.359 0.023
3408 ATOM 5 CB ALA 3 2.426 -0.242 -1.518 0.003
3409 ATOM 6 CA ALA 4 6.166 -1.116 0.269 0.014
3410 ATOM 7 CB ALA 4 5.889 -0.989 0.898 0.034
3411 ATOM 8 CA CYS 5 7.971 -4.134 -1.192 0.024
3412 ATOM 9 CB CYS 5 7.068 -4.137 -2.000 0.015
3413 ATOM 10 CA ALA 6 9.011 -6.543 1.464 0.015
3414 ATOM 11 CB ALA 6 8.401 -6.527 1.986 0.133
3415 ATOM 12 CA ALA 7 10.301 -10.004 0.579 0.045
3416 ATOM 13 CB ALA 7 10.593 -10.036 -0.159 0.090
3417 ATOM 14 CA ALA 8 12.483 -12.087 2.833 0.000
3418 ATOM 15 CB ALA 8 12.269 -12.355 3.459 0.031
3419 ATOM 16 CA ALA 9 15.689 -13.965 2.381 0.032
3420 ATOM 17 CB ALA 9 16.321 -13.840 2.866 0.103
3421 ATOM 18 CA ALA 10 16.173 -17.514 0.875 0.027
3422 ATOM 19 CB ALA 10 16.157 -17.626 0.077 0.043
3423 ATOM 20 CA ALA 11 18.843 -20.077 1.516 0.067
3424 ATOM 21 CB ALA 11 18.685 -20.847 1.638 0.075
3425 ATOM 22 CA ALA 12 22.032 -21.154 -0.280 0.033
3426 ATOM 23 CB ALA 12 22.581 -20.988 0.142 0.123
3427 ATOM 24 CA ALA 13 24.123 -24.243 -0.910 0.011
3428 ATOM 25 CB ALA 13 24.235 -24.158 -1.705 0.058
3429 ATOM 26 CA CYS 14 27.303 -25.468 0.733 0.011
3430 ATOM 27 CB CYS 14 27.607 -25.413 1.812 0.095
3431 ATOM 28 CA ALA 15 29.960 -27.141 -1.476 0.030
3432 ATOM 29 CB ALA 15 30.571 -26.881 -1.743 0.038
3433 ATOM 30 CA ALA 16 31.712 -30.505 -1.309 0.055
3434 ATOM 31 CB ALA 16 31.297 -30.912 -1.733 0.011
3435 ATOM 32 CA ALA 17 35.109 -30.909 0.390 0.012
3436 ATOM 33 CB ALA 17 35.353 -30.877 1.129 0.007
3437 ATOM 34 CA GLY 18 36.515 -34.434 0.732 0.000
3457 REMARK time 1603.71 ENERGY 6.49986E-01
3458 ATOM 1 CA GLY 1 -1.398 5.903 -1.891 0.012
3459 ATOM 2 CA ALA 2 1.031 3.273 -3.351 0.014
3460 ATOM 3 CB ALA 2 1.516 3.727 -3.601 0.056
3461 ATOM 4 CA ALA 3 2.775 0.288 -1.668 0.022
3462 ATOM 5 CB ALA 3 2.187 -0.102 -1.645 0.016
3463 ATOM 6 CA ALA 4 6.130 -1.196 -0.928 0.035
3464 ATOM 7 CB ALA 4 6.744 -0.967 -0.576 0.134
3465 ATOM 8 CA CYS 5 6.814 -4.714 0.368 0.025
3466 ATOM 9 CB CYS 5 6.219 -5.339 -0.480 0.007
3467 ATOM 10 CA ALA 6 9.712 -6.647 1.879 0.030
3468 ATOM 11 CB ALA 6 9.336 -6.892 2.359 0.028
3469 ATOM 12 CA ALA 7 12.044 -8.636 -0.287 0.013
3470 ATOM 13 CB ALA 7 12.658 -8.450 -0.697 0.106
3471 ATOM 14 CA ALA 8 12.911 -12.241 0.558 0.000
3472 ATOM 15 CB ALA 8 12.813 -12.685 0.023 0.036
3473 ATOM 16 CA ALA 9 16.081 -13.897 1.818 0.036
3474 ATOM 17 CB ALA 9 16.376 -14.311 2.303 0.028
3475 ATOM 18 CA ALA 10 15.610 -17.597 1.194 0.030
3476 ATOM 19 CB ALA 10 15.352 -17.925 0.564 0.106
3477 ATOM 20 CA ALA 11 18.364 -20.055 1.857 0.026
3478 ATOM 21 CB ALA 11 18.122 -20.794 2.138 0.092
3479 ATOM 22 CA ALA 12 21.383 -21.257 -0.070 0.020
3480 ATOM 23 CB ALA 12 21.380 -20.469 0.008 0.054
3481 ATOM 24 CA ALA 13 23.519 -24.417 -0.051 0.022
3482 ATOM 25 CB ALA 13 23.265 -24.807 -0.597 0.066
3483 ATOM 26 CA CYS 14 27.169 -25.039 0.747 0.013
3484 ATOM 27 CB CYS 14 27.450 -25.400 1.827 0.033
3485 ATOM 28 CA ALA 15 29.840 -27.477 -0.494 0.064
3486 ATOM 29 CB ALA 15 30.394 -27.175 -0.869 0.012
3487 ATOM 30 CA ALA 16 31.883 -30.578 0.434 0.013
3488 ATOM 31 CB ALA 16 31.319 -31.231 0.494 0.113
3489 ATOM 32 CA ALA 17 35.610 -31.340 -0.126 0.009
3490 ATOM 33 CB ALA 17 36.054 -31.504 0.528 0.175
3491 ATOM 34 CA GLY 18 37.569 -32.536 -3.113 0.000
3511 REMARK time 1630.65 ENERGY 3.88618E+00
3512 ATOM 1 CA GLY 1 0.901 6.826 -1.825 0.009
3513 ATOM 2 CA ALA 2 0.673 3.136 -2.900 0.005
3514 ATOM 3 CB ALA 2 1.157 2.917 -3.362 0.018
3515 ATOM 4 CA ALA 3 1.880 0.628 -0.372 0.004
3516 ATOM 5 CB ALA 3 1.892 0.093 0.176 0.131
3517 ATOM 6 CA ALA 4 5.513 -0.597 -0.304 0.025
3518 ATOM 7 CB ALA 4 6.229 -0.440 -0.035 0.003
3519 ATOM 8 CA CYS 5 6.211 -4.302 -0.352 0.020
3520 ATOM 9 CB CYS 5 5.550 -4.623 -1.326 0.024
3521 ATOM 10 CA ALA 6 9.218 -6.202 1.085 0.017
3522 ATOM 11 CB ALA 6 9.234 -6.334 1.797 0.039
3523 ATOM 12 CA ALA 7 11.718 -8.670 -0.573 0.013
3524 ATOM 13 CB ALA 7 12.428 -8.514 -0.693 0.002
3525 ATOM 14 CA ALA 8 11.799 -12.431 0.000 0.023
3526 ATOM 15 CB ALA 8 11.506 -13.126 -0.332 0.002
3527 ATOM 16 CA ALA 9 14.911 -14.558 0.802 0.013
3528 ATOM 17 CB ALA 9 15.045 -14.716 1.495 0.055
3529 ATOM 18 CA ALA 10 17.309 -17.079 -0.619 0.039
3530 ATOM 19 CB ALA 10 17.962 -16.888 -1.010 0.044
3531 ATOM 20 CA ALA 11 19.524 -19.632 1.044 0.019
3532 ATOM 21 CB ALA 11 19.210 -20.144 1.526 0.001
3533 ATOM 22 CA ALA 12 22.818 -21.362 0.304 0.000
3534 ATOM 23 CB ALA 12 23.406 -21.173 0.641 0.021
3535 ATOM 24 CA ALA 13 23.830 -25.066 0.790 0.010
3536 ATOM 25 CB ALA 13 23.688 -25.220 0.059 0.054
3537 ATOM 26 CA CYS 14 26.724 -26.604 2.818 0.011
3538 ATOM 27 CB CYS 14 26.762 -27.598 3.619 0.019
3539 ATOM 28 CA ALA 15 29.475 -27.929 0.527 0.106
3540 ATOM 29 CB ALA 15 29.062 -27.784 -0.029 0.224
3541 ATOM 30 CA ALA 16 32.815 -29.608 0.726 0.054
3542 ATOM 31 CB ALA 16 32.633 -30.257 0.640 0.682
3543 ATOM 32 CA ALA 17 35.269 -30.603 -1.994 0.068
3544 ATOM 33 CB ALA 17 35.161 -30.060 -2.404 0.041
3545 ATOM 34 CA GLY 18 38.099 -33.314 -2.114 0.000
projects / unres.git / blob