1 REMARK time 76.89 ENERGY -8.93568E+01
2 HELIX 1 H1 ARG 2 LEU 20 1 18
3 HELIX 2 H2 ARG 25 LEU 43 1 18
4 HELIX 3 H3 GLU 48 LEU 66 1 18
5 ATOM 1 CA GLY 1 0.522 3.823 -1.145 0.062
6 ATOM 2 CA SER 2 3.946 2.198 -1.648 0.006
7 ATOM 3 CB SER 2 4.884 2.852 -1.798 0.041
8 ATOM 4 CA ARG 3 3.557 -1.512 -0.766 0.029
9 ATOM 5 CB ARG 3 0.914 -2.949 -0.596 0.019
10 ATOM 6 CA VAL 4 7.175 -2.162 -1.840 0.025
11 ATOM 7 CB VAL 4 7.882 -1.619 -2.854 0.024
12 ATOM 8 CA LYS 5 8.398 -0.781 1.514 0.003
13 ATOM 9 CB LYS 5 9.230 1.679 1.606 0.023
14 ATOM 10 CA ALA 6 6.284 -3.416 3.366 0.012
15 ATOM 11 CB ALA 6 5.617 -3.225 3.609 0.026
16 ATOM 12 CA LEU 7 8.118 -6.196 1.513 0.014
17 ATOM 13 CB LEU 7 8.385 -7.515 0.184 0.032
18 ATOM 14 CA GLU 8 11.511 -4.510 1.903 0.001
19 ATOM 15 CB GLU 8 12.252 -3.664 -0.020 0.003
20 ATOM 16 CA GLU 9 11.228 -5.236 5.583 0.012
21 ATOM 17 CB GLU 9 9.610 -4.163 6.690 0.002
22 ATOM 18 CA LYS 10 10.181 -8.820 4.950 0.018
23 ATOM 19 CB LYS 10 9.383 -11.065 5.804 0.052
24 ATOM 20 CA VAL 11 13.254 -9.073 2.674 0.004
25 ATOM 21 CB VAL 11 13.417 -8.546 1.333 0.004
26 ATOM 22 CA LYS 12 15.585 -7.704 5.331 0.024
27 ATOM 23 CB LYS 12 14.705 -5.282 5.483 0.014
28 ATOM 24 CA ALA 13 14.496 -10.615 7.478 0.013
29 ATOM 25 CB ALA 13 13.896 -10.522 7.866 0.048
30 ATOM 26 CA LEU 14 14.939 -13.176 4.706 0.045
31 ATOM 27 CB LEU 14 14.703 -13.414 2.780 0.002
32 ATOM 28 CA GLU 15 18.648 -12.456 4.239 0.028
33 ATOM 29 CB GLU 15 18.765 -12.174 1.961 0.007
34 ATOM 30 CA GLU 16 19.439 -12.696 7.936 0.023
35 ATOM 31 CB GLU 16 18.442 -11.336 9.580 0.004
36 ATOM 32 CA LYS 17 18.361 -16.346 8.009 0.011
37 ATOM 33 CB LYS 17 17.641 -18.713 8.550 0.017
38 ATOM 34 CA VAL 18 20.484 -17.104 4.928 0.009
39 ATOM 35 CB VAL 18 20.293 -16.962 3.529 0.038
40 ATOM 36 CA LYS 19 23.661 -16.903 6.995 0.003
41 ATOM 37 CB LYS 19 24.056 -14.418 6.686 0.007
42 ATOM 38 CA ALA 20 22.101 -19.003 9.649 0.012
43 ATOM 39 CB ALA 20 21.588 -18.764 10.110 0.002
44 ATOM 40 CA LEU 21 21.599 -21.733 7.007 0.002
45 ATOM 41 CB LEU 21 21.059 -23.356 6.222 0.008
46 ATOM 42 CA GLY 22 25.236 -21.834 5.940 0.011
47 ATOM 43 CA GLY 23 25.663 -24.461 3.175 0.018
48 ATOM 44 CA GLY 24 28.405 -25.644 0.729 0.011
49 ATOM 45 CA GLY 25 28.725 -23.347 -2.253 0.029
50 ATOM 46 CA ARG 26 25.010 -23.483 -2.926 0.008
51 ATOM 47 CB ARG 26 23.780 -26.127 -3.479 0.009
52 ATOM 48 CA ILE 27 24.284 -20.647 -0.545 0.006
53 ATOM 49 CB ILE 27 23.861 -20.231 1.057 0.009
54 ATOM 50 CA GLU 28 25.273 -18.203 -3.254 0.006
55 ATOM 51 CB GLU 28 26.678 -17.071 -1.959 0.035
56 ATOM 52 CA GLU 29 22.463 -19.212 -5.603 0.008
57 ATOM 53 CB GLU 29 23.167 -21.329 -5.942 0.038
58 ATOM 54 CA LEU 30 19.860 -18.648 -2.866 0.004
59 ATOM 55 CB LEU 30 19.567 -19.883 -1.391 0.025
60 ATOM 56 CA LYS 31 21.195 -15.136 -2.227 0.028
61 ATOM 57 CB LYS 31 23.554 -14.418 -1.557 0.029
62 ATOM 58 CA LYS 32 21.736 -14.209 -5.890 0.024
63 ATOM 59 CB LYS 32 22.336 -15.999 -7.597 0.024
64 ATOM 60 CA LYS 33 18.003 -14.472 -6.284 0.024
65 ATOM 61 CB LYS 33 16.442 -16.483 -6.744 0.013
66 ATOM 62 CA TRP 34 17.342 -12.058 -3.427 0.023
67 ATOM 63 CB TRP 34 14.807 -11.658 -2.598 0.017
68 ATOM 64 CA GLU 35 19.887 -9.451 -4.622 0.010
69 ATOM 65 CB GLU 35 20.694 -9.056 -2.583 0.012
70 ATOM 66 CA GLU 36 18.350 -8.916 -8.088 0.018
71 ATOM 67 CB GLU 36 17.977 -10.592 -9.458 0.027
72 ATOM 68 CA LEU 37 14.814 -9.336 -6.853 0.019
73 ATOM 69 CB LEU 37 13.403 -10.765 -6.693 0.025
74 ATOM 70 CA LYS 38 15.243 -6.610 -4.219 0.043
75 ATOM 71 CB LYS 38 16.572 -5.983 -2.134 0.007
76 ATOM 72 CA LYS 39 16.628 -4.157 -6.859 0.026
77 ATOM 73 CB LYS 39 18.648 -4.486 -8.374 0.007
78 ATOM 74 CA LYS 40 13.379 -4.147 -8.888 0.003
79 ATOM 75 CB LYS 40 12.865 -6.321 -10.075 0.004
80 ATOM 76 CA ILE 41 11.398 -3.996 -5.628 0.010
81 ATOM 77 CB ILE 41 11.249 -5.608 -4.909 0.052
82 ATOM 78 CA GLU 42 12.216 -0.269 -5.494 0.013
83 ATOM 79 CB GLU 42 13.595 1.446 -5.345 0.005
84 ATOM 80 CA GLU 43 10.768 0.286 -9.005 0.018
85 ATOM 81 CB GLU 43 12.473 -0.620 -10.068 0.013
86 ATOM 82 CA LEU 44 7.596 -1.705 -8.290 0.011
87 ATOM 83 CB LEU 44 7.375 -3.454 -7.570 0.003
88 ATOM 84 CA GLY 45 5.693 1.203 -6.859 0.035
89 ATOM 85 CA GLY 46 2.054 1.707 -7.751 0.017
90 ATOM 86 CA GLY 47 0.895 -1.758 -8.694 0.002
91 ATOM 87 CA GLY 48 0.583 -4.695 -6.295 0.021
92 ATOM 88 CA GLU 49 3.506 -6.666 -7.623 0.005
93 ATOM 89 CB GLU 49 5.020 -8.030 -8.606 0.041
94 ATOM 90 CA VAL 50 4.925 -6.720 -4.065 0.047
95 ATOM 91 CB VAL 50 4.511 -6.174 -2.824 0.054
96 ATOM 92 CA LYS 51 2.827 -9.835 -3.230 0.006
97 ATOM 93 CB LYS 51 0.336 -9.203 -2.757 0.014
98 ATOM 94 CA LYS 52 3.843 -11.937 -6.172 0.006
99 ATOM 95 CB LYS 52 3.151 -11.517 -8.602 0.013
100 ATOM 96 CA VAL 53 7.502 -11.059 -5.397 0.010
101 ATOM 97 CB VAL 53 8.206 -10.237 -6.313 0.057
102 ATOM 98 CA GLU 54 7.168 -12.224 -1.844 0.036
103 ATOM 99 CB GLU 54 6.340 -11.520 0.091 0.022
104 ATOM 100 CA GLU 55 6.574 -15.733 -3.157 0.063
105 ATOM 101 CB GLU 55 6.356 -15.960 -5.418 0.014
106 ATOM 102 CA GLU 56 10.291 -16.328 -3.349 0.019
107 ATOM 103 CB GLU 56 12.510 -15.761 -3.225 0.004
108 ATOM 104 CA VAL 57 10.625 -15.514 0.339 0.016
109 ATOM 105 CB VAL 57 10.396 -14.179 0.701 0.043
110 ATOM 106 CA LYS 58 7.814 -18.061 1.274 0.014
111 ATOM 107 CB LYS 58 5.931 -16.918 0.063 0.007
112 ATOM 108 CA LYS 59 9.639 -21.086 -0.161 0.019
113 ATOM 109 CB LYS 59 11.081 -21.506 -2.145 0.005
114 ATOM 110 CA LEU 60 13.198 -19.792 0.516 0.028
115 ATOM 111 CB LEU 60 14.515 -18.422 0.212 0.001
116 ATOM 112 CA GLU 61 12.833 -20.686 4.176 0.013
117 ATOM 113 CB GLU 61 11.922 -20.942 6.184 0.017
118 ATOM 114 CA GLU 62 12.016 -24.336 3.269 0.013
119 ATOM 115 CB GLU 62 10.162 -24.390 1.967 0.006
120 ATOM 116 CA GLU 63 14.648 -24.318 0.569 0.038
121 ATOM 117 CB GLU 63 15.479 -22.922 -0.909 0.028
122 ATOM 118 CA ILE 64 17.139 -23.082 3.075 0.017
123 ATOM 119 CB ILE 64 16.900 -21.411 3.762 0.008
124 ATOM 120 CA LYS 65 16.327 -26.015 5.280 0.002
125 ATOM 121 CB LYS 65 13.887 -25.410 5.844 0.007
126 ATOM 122 CA LYS 66 17.110 -28.477 2.536 0.014
127 ATOM 123 CB LYS 66 16.521 -27.848 0.158 0.005
128 ATOM 124 CA LEU 67 20.419 -26.671 1.727 0.000
129 ATOM 125 CB LEU 67 21.429 -25.466 0.620 0.003
199 REMARK time 176.89 ENERGY -1.15541E+02
200 HELIX 1 H1 ARG 2 LEU 20 1 18
201 HELIX 2 H2 ARG 25 LEU 43 1 18
202 HELIX 3 H3 GLU 48 LEU 66 1 18
203 ATOM 1 CA GLY 1 1.430 4.100 -0.584 0.010
204 ATOM 2 CA SER 2 4.383 1.958 -1.628 0.033
205 ATOM 3 CB SER 2 5.428 2.076 -2.106 0.076
206 ATOM 4 CA ARG 3 4.214 -1.629 -0.383 0.056
207 ATOM 5 CB ARG 3 1.714 -3.218 0.485 0.010
208 ATOM 6 CA VAL 4 7.583 -2.534 -2.023 0.039
209 ATOM 7 CB VAL 4 7.787 -1.839 -3.266 0.028
210 ATOM 8 CA LYS 5 9.444 -0.902 0.869 0.007
211 ATOM 9 CB LYS 5 9.095 1.551 1.316 0.006
212 ATOM 10 CA ALA 6 7.808 -3.248 3.378 0.024
213 ATOM 11 CB ALA 6 7.127 -3.014 3.618 0.022
214 ATOM 12 CA LEU 7 8.479 -6.344 1.212 0.010
215 ATOM 13 CB LEU 7 8.997 -7.971 0.312 0.003
216 ATOM 14 CA GLU 8 12.196 -5.633 1.305 0.005
217 ATOM 15 CB GLU 8 12.841 -4.205 -0.345 0.017
218 ATOM 16 CA GLU 9 11.826 -6.124 5.052 0.001
219 ATOM 17 CB GLU 9 10.348 -4.949 6.202 0.007
220 ATOM 18 CA LYS 10 10.647 -9.725 4.617 0.003
221 ATOM 19 CB LYS 10 10.986 -12.090 5.561 0.003
222 ATOM 20 CA VAL 11 13.796 -10.171 2.478 0.002
223 ATOM 21 CB VAL 11 13.802 -9.398 1.289 0.017
224 ATOM 22 CA LYS 12 16.069 -8.857 5.272 0.026
225 ATOM 23 CB LYS 12 15.005 -6.550 4.708 0.012
226 ATOM 24 CA ALA 13 14.675 -11.513 7.654 0.010
227 ATOM 25 CB ALA 13 13.985 -11.480 7.954 0.077
228 ATOM 26 CA LEU 14 15.372 -14.084 4.894 0.015
229 ATOM 27 CB LEU 14 14.549 -14.727 3.257 0.004
230 ATOM 28 CA GLU 15 19.099 -13.359 4.968 0.007
231 ATOM 29 CB GLU 15 19.541 -13.346 2.780 0.013
232 ATOM 30 CA GLU 16 19.068 -13.854 8.725 0.005
233 ATOM 31 CB GLU 16 18.678 -12.138 10.097 0.009
234 ATOM 32 CA LYS 17 17.748 -17.369 7.964 0.034
235 ATOM 33 CB LYS 17 17.081 -18.794 10.060 0.008
236 ATOM 34 CA VAL 18 20.766 -18.022 5.669 0.036
237 ATOM 35 CB VAL 18 20.901 -17.764 4.292 0.040
238 ATOM 36 CA LYS 19 23.212 -16.862 8.339 0.032
239 ATOM 37 CB LYS 19 22.775 -14.408 8.216 0.004
240 ATOM 38 CA ALA 20 21.510 -19.295 10.788 0.004
241 ATOM 39 CB ALA 20 21.020 -19.172 11.330 0.014
242 ATOM 40 CA LEU 21 21.249 -22.101 8.279 0.019
243 ATOM 41 CB LEU 21 20.827 -22.701 6.528 0.044
244 ATOM 42 CA GLY 22 24.991 -22.549 7.869 0.005
245 ATOM 43 CA GLY 23 24.752 -24.444 4.596 0.007
246 ATOM 44 CA GLY 24 26.680 -25.571 1.538 0.006
247 ATOM 45 CA GLY 25 28.294 -23.748 -1.386 0.033
248 ATOM 46 CA ARG 26 25.082 -22.863 -3.198 0.016
249 ATOM 47 CB ARG 26 22.367 -23.305 -4.451 0.007
250 ATOM 48 CA ILE 27 24.158 -20.445 -0.399 0.024
251 ATOM 49 CB ILE 27 24.082 -20.612 1.373 0.036
252 ATOM 50 CA GLU 28 26.221 -17.797 -2.170 0.014
253 ATOM 51 CB GLU 28 28.145 -17.546 -0.888 0.035
254 ATOM 52 CA GLU 29 23.934 -18.144 -5.172 0.003
255 ATOM 53 CB GLU 29 24.211 -19.696 -6.785 0.021
256 ATOM 54 CA LEU 30 20.823 -17.774 -3.064 0.012
257 ATOM 55 CB LEU 30 20.452 -19.611 -2.441 0.004
258 ATOM 56 CA LYS 31 22.199 -14.591 -1.571 0.001
259 ATOM 57 CB LYS 31 24.321 -14.481 -0.212 0.039
260 ATOM 58 CA LYS 32 22.627 -13.115 -5.035 0.036
261 ATOM 59 CB LYS 32 23.715 -13.888 -7.185 0.010
262 ATOM 60 CA LYS 33 18.930 -13.676 -5.778 0.008
263 ATOM 61 CB LYS 33 17.609 -15.846 -6.053 0.080
264 ATOM 62 CA TRP 34 17.976 -11.595 -2.774 0.023
265 ATOM 63 CB TRP 34 16.065 -13.250 -2.374 0.010
266 ATOM 64 CA GLU 35 19.871 -8.554 -4.047 0.051
267 ATOM 65 CB GLU 35 21.888 -7.972 -4.735 0.005
268 ATOM 66 CA GLU 36 18.590 -9.257 -7.517 0.040
269 ATOM 67 CB GLU 36 19.657 -10.831 -8.806 0.009
270 ATOM 68 CA LEU 37 15.053 -9.329 -6.177 0.045
271 ATOM 69 CB LEU 37 13.931 -9.948 -4.771 0.017
272 ATOM 70 CA LYS 38 15.451 -6.139 -4.151 0.023
273 ATOM 71 CB LYS 38 16.447 -5.530 -1.927 0.012
274 ATOM 72 CA LYS 39 16.628 -4.333 -7.294 0.003
275 ATOM 73 CB LYS 39 18.455 -5.144 -8.793 0.075
276 ATOM 74 CA LYS 40 13.421 -5.374 -9.132 0.011
277 ATOM 75 CB LYS 40 12.115 -7.465 -9.905 0.028
278 ATOM 76 CA ILE 41 11.067 -3.988 -6.497 0.025
279 ATOM 77 CB ILE 41 11.245 -5.045 -5.059 0.009
280 ATOM 78 CA GLU 42 12.092 -0.511 -7.344 0.038
281 ATOM 79 CB GLU 42 13.823 -0.590 -5.895 0.006
282 ATOM 80 CA GLU 43 10.744 -0.841 -10.957 0.036
283 ATOM 81 CB GLU 43 9.996 -2.820 -11.681 0.031
284 ATOM 82 CA LEU 44 7.314 -1.895 -9.492 0.012
285 ATOM 83 CB LEU 44 6.868 -3.464 -8.344 0.004
286 ATOM 84 CA GLY 45 6.957 1.508 -7.815 0.001
287 ATOM 85 CA GLY 46 3.219 2.076 -7.825 0.009
288 ATOM 86 CA GLY 47 2.254 -1.549 -6.922 0.017
289 ATOM 87 CA GLY 48 -0.514 -3.769 -5.422 0.029
290 ATOM 88 CA GLU 49 1.231 -6.976 -6.580 0.007
291 ATOM 89 CB GLU 49 2.303 -7.023 -8.487 0.004
292 ATOM 90 CA VAL 50 3.323 -6.882 -3.449 0.006
293 ATOM 91 CB VAL 50 3.966 -6.228 -2.402 0.010
294 ATOM 92 CA LYS 51 1.434 -9.795 -1.896 0.012
295 ATOM 93 CB LYS 51 -0.977 -9.237 -1.943 0.007
296 ATOM 94 CA LYS 52 3.085 -12.054 -4.379 0.053
297 ATOM 95 CB LYS 52 2.226 -11.903 -6.787 0.014
298 ATOM 96 CA VAL 53 6.651 -10.656 -3.778 0.056
299 ATOM 97 CB VAL 53 7.020 -9.339 -3.958 0.013
300 ATOM 98 CA GLU 54 6.606 -11.555 -0.154 0.029
301 ATOM 99 CB GLU 54 5.328 -10.017 0.788 0.003
302 ATOM 100 CA GLU 55 5.195 -14.946 -1.029 0.012
303 ATOM 101 CB GLU 55 4.162 -15.840 -2.805 0.015
304 ATOM 102 CA GLU 56 8.062 -15.419 -3.449 0.010
305 ATOM 103 CB GLU 56 9.349 -13.955 -4.670 0.012
306 ATOM 104 CA VAL 57 10.282 -14.823 -0.478 0.020
307 ATOM 105 CB VAL 57 10.163 -13.707 0.369 0.048
308 ATOM 106 CA LYS 58 8.461 -17.385 1.588 0.016
309 ATOM 107 CB LYS 58 6.012 -17.107 2.145 0.067
310 ATOM 108 CA LYS 59 9.066 -20.032 -1.002 0.023
311 ATOM 109 CB LYS 59 9.483 -18.941 -3.349 0.094
312 ATOM 110 CA LEU 60 12.814 -19.615 -0.889 0.009
313 ATOM 111 CB LEU 60 14.414 -19.110 -1.788 0.045
314 ATOM 112 CA GLU 61 12.662 -20.752 2.669 0.014
315 ATOM 113 CB GLU 61 11.852 -19.217 4.149 0.004
316 ATOM 114 CA GLU 62 12.064 -24.336 1.363 0.036
317 ATOM 115 CB GLU 62 10.761 -23.671 -0.385 0.005
318 ATOM 116 CA GLU 63 14.806 -23.975 -1.242 0.013
319 ATOM 117 CB GLU 63 16.328 -23.303 -2.804 0.007
320 ATOM 118 CA ILE 64 17.443 -23.045 1.455 0.001
321 ATOM 119 CB ILE 64 17.308 -21.418 2.233 0.018
322 ATOM 120 CA LYS 65 16.891 -26.394 3.171 0.012
323 ATOM 121 CB LYS 65 15.014 -25.294 4.526 0.002
324 ATOM 122 CA LYS 66 16.771 -28.392 -0.110 0.000
325 ATOM 123 CB LYS 66 16.048 -27.391 -2.325 0.022
326 ATOM 124 CA LEU 67 20.161 -27.143 -1.212 0.000
327 ATOM 125 CB LEU 67 21.180 -25.802 -0.263 0.003
397 REMARK time 276.89 ENERGY -8.92624E+01
398 HELIX 1 H1 ARG 2 LEU 20 1 18
399 HELIX 2 H2 ARG 25 LEU 43 1 18
400 HELIX 3 H3 GLU 48 LEU 66 1 18
401 ATOM 1 CA GLY 1 0.416 2.890 -0.316 0.016
402 ATOM 2 CA SER 2 3.493 0.677 -0.390 0.008
403 ATOM 3 CB SER 2 4.563 0.392 -0.578 0.037
404 ATOM 4 CA ARG 3 3.867 -2.876 0.877 0.004
405 ATOM 5 CB ARG 3 2.306 -3.119 3.433 0.003
406 ATOM 6 CA VAL 4 7.326 -3.109 -0.700 0.045
407 ATOM 7 CB VAL 4 7.899 -2.611 -1.916 0.014
408 ATOM 8 CA LYS 5 8.829 -1.345 2.325 0.019
409 ATOM 9 CB LYS 5 7.590 0.190 3.993 0.040
410 ATOM 10 CA ALA 6 7.925 -4.449 4.263 0.012
411 ATOM 11 CB ALA 6 7.296 -4.779 4.279 0.038
412 ATOM 12 CA LEU 7 9.494 -6.676 1.649 0.007
413 ATOM 13 CB LEU 7 8.491 -7.844 0.521 0.005
414 ATOM 14 CA GLU 8 13.025 -5.266 2.361 0.021
415 ATOM 15 CB GLU 8 14.453 -4.597 0.684 0.052
416 ATOM 16 CA GLU 9 12.442 -5.530 6.124 0.054
417 ATOM 17 CB GLU 9 11.291 -4.373 7.691 0.023
418 ATOM 18 CA LYS 10 11.316 -9.143 5.927 0.009
419 ATOM 19 CB LYS 10 9.562 -10.721 4.969 0.011
420 ATOM 20 CA VAL 11 13.953 -9.809 3.260 0.005
421 ATOM 21 CB VAL 11 13.994 -9.927 1.834 0.014
422 ATOM 22 CA LYS 12 16.862 -9.226 5.645 0.006
423 ATOM 23 CB LYS 12 17.730 -7.209 6.958 0.004
424 ATOM 24 CA ALA 13 15.243 -11.306 8.482 0.060
425 ATOM 25 CB ALA 13 14.789 -11.221 9.070 0.029
426 ATOM 26 CA LEU 14 15.058 -14.308 6.208 0.052
427 ATOM 27 CB LEU 14 14.106 -14.320 4.554 0.025
428 ATOM 28 CA GLU 15 18.699 -13.795 5.192 0.011
429 ATOM 29 CB GLU 15 17.997 -13.396 3.134 0.076
430 ATOM 30 CA GLU 16 19.603 -13.772 8.863 0.013
431 ATOM 31 CB GLU 16 18.133 -13.283 10.505 0.020
432 ATOM 32 CA LYS 17 17.895 -17.059 9.165 0.017
433 ATOM 33 CB LYS 17 15.406 -17.048 9.059 0.032
434 ATOM 34 CA VAL 18 20.084 -18.620 6.366 0.017
435 ATOM 35 CB VAL 18 19.805 -18.353 5.048 0.006
436 ATOM 36 CA LYS 19 23.156 -17.067 7.855 0.018
437 ATOM 37 CB LYS 19 22.794 -14.542 7.708 0.016
438 ATOM 38 CA ALA 20 22.556 -19.310 10.830 0.009
439 ATOM 39 CB ALA 20 21.960 -19.249 11.156 0.031
440 ATOM 40 CA LEU 21 22.367 -22.354 8.513 0.031
441 ATOM 41 CB LEU 21 20.840 -22.805 7.519 0.001
442 ATOM 42 CA GLY 22 25.399 -21.365 6.497 0.020
443 ATOM 43 CA GLY 23 25.881 -24.154 3.929 0.002
444 ATOM 44 CA GLY 24 28.419 -25.334 1.271 0.002
445 ATOM 45 CA GLY 25 29.220 -22.404 -1.029 0.001
446 ATOM 46 CA ARG 26 25.762 -22.273 -2.498 0.005
447 ATOM 47 CB ARG 26 23.686 -24.457 -2.936 0.018
448 ATOM 48 CA ILE 27 24.441 -19.756 0.046 0.015
449 ATOM 49 CB ILE 27 23.893 -20.450 1.553 0.016
450 ATOM 50 CA GLU 28 25.992 -16.985 -2.090 0.003
451 ATOM 51 CB GLU 28 26.105 -15.338 -0.583 0.015
452 ATOM 52 CA GLU 29 24.321 -18.427 -5.206 0.007
453 ATOM 53 CB GLU 29 25.038 -20.534 -5.398 0.003
454 ATOM 54 CA LEU 30 20.920 -18.214 -3.476 0.020
455 ATOM 55 CB LEU 30 20.152 -18.693 -1.831 0.037
456 ATOM 56 CA LYS 31 21.561 -14.461 -2.842 0.005
457 ATOM 57 CB LYS 31 23.609 -13.048 -2.457 0.047
458 ATOM 58 CA LYS 32 22.600 -14.210 -6.509 0.024
459 ATOM 59 CB LYS 32 23.067 -16.251 -8.044 0.008
460 ATOM 60 CA LYS 33 18.925 -14.418 -7.470 0.006
461 ATOM 61 CB LYS 33 17.243 -15.939 -6.313 0.002
462 ATOM 62 CA TRP 34 18.130 -11.831 -4.776 0.001
463 ATOM 63 CB TRP 34 16.689 -12.480 -2.752 0.020
464 ATOM 64 CA GLU 35 20.051 -9.132 -6.632 0.018
465 ATOM 65 CB GLU 35 22.054 -8.600 -7.324 0.011
466 ATOM 66 CA GLU 36 17.228 -8.997 -9.131 0.033
467 ATOM 67 CB GLU 36 15.734 -9.221 -10.848 0.012
468 ATOM 68 CA LEU 37 14.541 -9.266 -6.330 0.011
469 ATOM 69 CB LEU 37 13.097 -10.109 -5.395 0.005
470 ATOM 70 CA LYS 38 16.013 -6.367 -4.356 0.010
471 ATOM 71 CB LYS 38 18.109 -6.675 -2.891 0.014
472 ATOM 72 CA LYS 39 16.526 -4.262 -7.496 0.006
473 ATOM 73 CB LYS 39 18.143 -5.686 -8.934 0.033
474 ATOM 74 CA LYS 40 12.953 -4.967 -8.767 0.017
475 ATOM 75 CB LYS 40 11.671 -7.167 -8.902 0.011
476 ATOM 76 CA ILE 41 11.658 -4.167 -5.343 0.007
477 ATOM 77 CB ILE 41 11.617 -5.463 -4.137 0.009
478 ATOM 78 CA GLU 42 12.365 -0.455 -5.726 0.004
479 ATOM 79 CB GLU 42 13.806 1.108 -4.928 0.031
480 ATOM 80 CA GLU 43 10.228 -0.185 -8.867 0.067
481 ATOM 81 CB GLU 43 9.432 0.363 -10.919 0.008
482 ATOM 82 CA LEU 44 7.367 -2.257 -7.499 0.014
483 ATOM 83 CB LEU 44 6.436 -3.831 -6.894 0.034
484 ATOM 84 CA GLY 45 6.002 0.689 -5.565 0.038
485 ATOM 85 CA GLY 46 3.382 1.046 -8.253 0.005
486 ATOM 86 CA GLY 47 2.234 -2.581 -8.442 0.011
487 ATOM 87 CA GLY 48 -0.251 -3.028 -5.586 0.019
488 ATOM 88 CA GLU 49 0.087 -6.847 -5.330 0.001
489 ATOM 89 CB GLU 49 -1.900 -7.600 -5.947 0.025
490 ATOM 90 CA VAL 50 3.150 -7.092 -3.244 0.011
491 ATOM 91 CB VAL 50 3.095 -6.665 -1.934 0.020
492 ATOM 92 CA LYS 51 2.708 -10.833 -3.363 0.003
493 ATOM 93 CB LYS 51 0.434 -11.966 -3.711 0.031
494 ATOM 94 CA LYS 52 4.088 -10.936 -6.922 0.007
495 ATOM 95 CB LYS 52 3.226 -9.056 -8.531 0.041
496 ATOM 96 CA VAL 53 7.531 -9.946 -5.637 0.018
497 ATOM 97 CB VAL 53 7.656 -8.761 -4.908 0.013
498 ATOM 98 CA GLU 54 7.219 -12.848 -3.180 0.029
499 ATOM 99 CB GLU 54 6.599 -12.575 -1.074 0.021
500 ATOM 100 CA GLU 55 6.916 -15.171 -6.116 0.035
501 ATOM 101 CB GLU 55 4.810 -15.851 -6.305 0.012
502 ATOM 102 CA GLU 56 10.699 -15.347 -6.510 0.012
503 ATOM 103 CB GLU 56 12.582 -14.497 -7.360 0.053
504 ATOM 104 CA VAL 57 11.226 -14.823 -2.792 0.013
505 ATOM 105 CB VAL 57 11.132 -13.677 -1.901 0.021
506 ATOM 106 CA LYS 58 8.878 -17.518 -1.625 0.005
507 ATOM 107 CB LYS 58 6.460 -16.907 -1.570 0.006
508 ATOM 108 CA LYS 59 11.133 -20.213 -3.022 0.019
509 ATOM 109 CB LYS 59 10.871 -19.831 -5.493 0.019
510 ATOM 110 CA LEU 60 13.853 -19.095 -0.533 0.020
511 ATOM 111 CB LEU 60 15.170 -17.792 0.093 0.063
512 ATOM 112 CA GLU 61 11.661 -20.008 2.418 0.013
513 ATOM 113 CB GLU 61 10.950 -17.887 2.188 0.013
514 ATOM 114 CA GLU 62 11.406 -23.474 0.767 0.035
515 ATOM 115 CB GLU 62 9.676 -23.516 -0.619 0.002
516 ATOM 116 CA GLU 63 15.047 -23.530 -0.296 0.006
517 ATOM 117 CB GLU 63 16.046 -22.735 -2.224 0.017
518 ATOM 118 CA ILE 64 16.201 -22.723 3.210 0.036
519 ATOM 119 CB ILE 64 15.501 -21.164 3.732 0.034
520 ATOM 120 CA LYS 65 14.851 -25.951 4.518 0.003
521 ATOM 121 CB LYS 65 12.320 -26.322 4.571 0.019
522 ATOM 122 CA LYS 66 16.246 -27.735 1.477 0.015
523 ATOM 123 CB LYS 66 15.797 -26.781 -0.756 0.006
524 ATOM 124 CA LEU 67 19.872 -27.006 2.490 0.000
525 ATOM 125 CB LEU 67 21.257 -26.163 3.534 0.013
595 REMARK time 376.89 ENERGY -9.53182E+01
596 HELIX 1 H1 ARG 2 LEU 20 1 18
597 HELIX 2 H2 ARG 25 LEU 43 1 18
598 HELIX 3 H3 GLU 48 LEU 66 1 18
599 ATOM 1 CA GLY 1 2.643 4.642 -0.470 0.001
600 ATOM 2 CA SER 2 2.687 1.085 -1.844 0.007
601 ATOM 3 CB SER 2 3.730 0.607 -1.697 0.069
602 ATOM 4 CA ARG 3 3.052 -2.008 0.371 0.012
603 ATOM 5 CB ARG 3 0.869 -3.526 1.846 0.026
604 ATOM 6 CA VAL 4 6.330 -2.909 -1.349 0.004
605 ATOM 7 CB VAL 4 6.561 -2.568 -2.706 0.039
606 ATOM 8 CA LYS 5 8.125 -1.055 1.400 0.014
607 ATOM 9 CB LYS 5 7.877 1.203 0.282 0.011
608 ATOM 10 CA ALA 6 6.379 -3.064 4.072 0.007
609 ATOM 11 CB ALA 6 5.655 -3.197 4.008 0.026
610 ATOM 12 CA LEU 7 7.584 -6.403 2.682 0.022
611 ATOM 13 CB LEU 7 7.607 -7.420 1.013 0.012
612 ATOM 14 CA GLU 8 11.117 -5.135 3.026 0.014
613 ATOM 15 CB GLU 8 11.893 -4.099 1.185 0.015
614 ATOM 16 CA GLU 9 10.947 -5.761 6.722 0.008
615 ATOM 17 CB GLU 9 8.868 -4.940 6.966 0.004
616 ATOM 18 CA LYS 10 10.222 -9.476 6.110 0.025
617 ATOM 19 CB LYS 10 9.016 -11.565 5.716 0.005
618 ATOM 20 CA VAL 11 12.743 -9.708 3.299 0.026
619 ATOM 21 CB VAL 11 12.386 -8.978 2.178 0.007
620 ATOM 22 CA LYS 12 15.746 -9.033 5.473 0.015
621 ATOM 23 CB LYS 12 15.931 -6.527 5.778 0.025
622 ATOM 24 CA ALA 13 14.651 -11.884 7.700 0.031
623 ATOM 25 CB ALA 13 14.174 -12.205 8.101 0.006
624 ATOM 26 CA LEU 14 15.114 -14.325 4.722 0.025
625 ATOM 27 CB LEU 14 13.247 -14.850 4.466 0.039
626 ATOM 28 CA GLU 15 18.712 -13.089 4.339 0.007
627 ATOM 29 CB GLU 15 19.645 -12.014 2.550 0.019
628 ATOM 30 CA GLU 16 19.499 -13.604 7.999 0.009
629 ATOM 31 CB GLU 16 18.943 -11.728 9.141 0.008
630 ATOM 32 CA LYS 17 18.010 -17.113 7.759 0.036
631 ATOM 33 CB LYS 17 15.469 -17.303 7.652 0.004
632 ATOM 34 CA VAL 18 19.844 -17.874 4.593 0.017
633 ATOM 35 CB VAL 18 19.546 -16.973 3.531 0.039
634 ATOM 36 CA LYS 19 23.239 -17.344 6.100 0.010
635 ATOM 37 CB LYS 19 23.360 -14.947 6.992 0.020
636 ATOM 38 CA ALA 20 22.443 -19.582 9.053 0.002
637 ATOM 39 CB ALA 20 21.977 -19.158 9.519 0.029
638 ATOM 40 CA LEU 21 22.000 -22.453 6.588 0.060
639 ATOM 41 CB LEU 21 21.759 -23.898 5.334 0.013
640 ATOM 42 CA GLY 22 25.320 -21.830 4.895 0.035
641 ATOM 43 CA GLY 23 24.865 -24.667 2.384 0.003
642 ATOM 44 CA GLY 24 27.170 -25.023 -0.623 0.006
643 ATOM 45 CA GLY 25 27.355 -23.289 -3.963 0.009
644 ATOM 46 CA ARG 26 23.544 -22.876 -4.146 0.008
645 ATOM 47 CB ARG 26 20.879 -23.981 -4.832 0.012
646 ATOM 48 CA ILE 27 23.601 -20.535 -1.117 0.008
647 ATOM 49 CB ILE 27 22.680 -20.556 0.372 0.012
648 ATOM 50 CA GLU 28 25.607 -17.870 -2.960 0.016
649 ATOM 51 CB GLU 28 27.322 -16.610 -3.698 0.016
650 ATOM 52 CA GLU 29 22.869 -17.464 -5.533 0.031
651 ATOM 53 CB GLU 29 22.956 -19.070 -7.102 0.032
652 ATOM 54 CA LEU 30 20.407 -16.904 -2.714 0.022
653 ATOM 55 CB LEU 30 19.303 -18.209 -1.827 0.027
654 ATOM 56 CA LYS 31 22.726 -14.438 -0.962 0.032
655 ATOM 57 CB LYS 31 24.810 -15.383 0.059 0.003
656 ATOM 58 CA LYS 32 22.712 -12.325 -4.167 0.006
657 ATOM 59 CB LYS 32 24.043 -13.992 -5.589 0.005
658 ATOM 60 CA LYS 33 18.891 -12.762 -4.551 0.022
659 ATOM 61 CB LYS 33 17.498 -14.799 -4.033 0.035
660 ATOM 62 CA TRP 34 18.270 -10.202 -1.748 0.006
661 ATOM 63 CB TRP 34 17.171 -12.192 -0.470 0.027
662 ATOM 64 CA GLU 35 20.288 -7.466 -3.440 0.024
663 ATOM 65 CB GLU 35 22.590 -7.310 -3.624 0.041
664 ATOM 66 CA GLU 36 18.630 -8.490 -6.673 0.005
665 ATOM 67 CB GLU 36 17.978 -10.150 -8.028 0.013
666 ATOM 68 CA LEU 37 15.210 -8.394 -5.167 0.010
667 ATOM 69 CB LEU 37 14.028 -8.981 -3.776 0.009
668 ATOM 70 CA LYS 38 15.793 -4.870 -3.861 0.051
669 ATOM 71 CB LYS 38 17.537 -5.045 -1.980 0.008
670 ATOM 72 CA LYS 39 17.045 -3.610 -7.245 0.027
671 ATOM 73 CB LYS 39 19.062 -5.181 -7.317 0.017
672 ATOM 74 CA LYS 40 13.728 -4.905 -8.620 0.004
673 ATOM 75 CB LYS 40 13.852 -7.434 -8.399 0.032
674 ATOM 76 CA ILE 41 11.641 -3.412 -5.764 0.014
675 ATOM 77 CB ILE 41 11.280 -4.341 -4.367 0.020
676 ATOM 78 CA GLU 42 12.318 0.095 -6.862 0.035
677 ATOM 79 CB GLU 42 13.376 0.724 -4.966 0.040
678 ATOM 80 CA GLU 43 11.187 -0.662 -10.437 0.014
679 ATOM 81 CB GLU 43 12.384 -1.825 -11.987 0.035
680 ATOM 82 CA LEU 44 8.183 -2.508 -9.297 0.006
681 ATOM 83 CB LEU 44 7.917 -4.143 -8.299 0.002
682 ATOM 84 CA GLY 45 6.011 0.589 -9.209 0.010
683 ATOM 85 CA GLY 46 3.130 -0.844 -11.276 0.030
684 ATOM 86 CA GLY 47 2.877 -3.845 -8.953 0.046
685 ATOM 87 CA GLY 48 3.027 -1.712 -5.729 0.010
686 ATOM 88 CA GLU 49 1.132 -4.405 -3.794 0.095
687 ATOM 89 CB GLU 49 -0.919 -5.207 -3.780 0.020
688 ATOM 90 CA VAL 50 3.467 -7.318 -4.547 0.060
689 ATOM 91 CB VAL 50 4.827 -7.036 -4.216 0.041
690 ATOM 92 CA LYS 51 2.787 -10.862 -3.342 0.009
691 ATOM 93 CB LYS 51 0.381 -11.561 -3.225 0.030
692 ATOM 94 CA LYS 52 5.267 -12.180 -5.801 0.001
693 ATOM 95 CB LYS 52 5.905 -11.075 -7.997 0.007
694 ATOM 96 CA VAL 53 8.303 -10.996 -3.892 0.004
695 ATOM 97 CB VAL 53 8.850 -10.039 -4.699 0.001
696 ATOM 98 CA GLU 54 6.785 -12.040 -0.604 0.003
697 ATOM 99 CB GLU 54 5.777 -12.067 1.412 0.023
698 ATOM 100 CA GLU 55 6.370 -15.476 -2.149 0.011
699 ATOM 101 CB GLU 55 6.217 -16.396 -4.244 0.020
700 ATOM 102 CA GLU 56 9.986 -15.605 -3.286 0.029
701 ATOM 103 CB GLU 56 10.881 -14.129 -4.818 0.030
702 ATOM 104 CA VAL 57 11.233 -15.109 0.273 0.004
703 ATOM 105 CB VAL 57 10.663 -13.846 0.515 0.014
704 ATOM 106 CA LYS 58 8.750 -17.194 2.133 0.009
705 ATOM 107 CB LYS 58 6.534 -16.169 1.139 0.003
706 ATOM 108 CA LYS 59 9.363 -20.144 -0.280 0.010
707 ATOM 109 CB LYS 59 9.429 -19.541 -2.692 0.013
708 ATOM 110 CA LEU 60 13.081 -19.508 0.026 0.017
709 ATOM 111 CB LEU 60 14.530 -18.883 1.206 0.023
710 ATOM 112 CA GLU 61 13.235 -21.807 3.000 0.019
711 ATOM 113 CB GLU 61 13.724 -21.666 5.146 0.013
712 ATOM 114 CA GLU 62 11.775 -24.520 0.851 0.016
713 ATOM 115 CB GLU 62 9.995 -23.947 -0.345 0.017
714 ATOM 116 CA GLU 63 14.717 -24.185 -1.587 0.005
715 ATOM 117 CB GLU 63 15.115 -23.540 -3.688 0.037
716 ATOM 118 CA ILE 64 17.308 -24.280 1.323 0.012
717 ATOM 119 CB ILE 64 17.676 -23.179 2.672 0.014
718 ATOM 120 CA LYS 65 16.881 -28.057 1.784 0.015
719 ATOM 121 CB LYS 65 14.901 -27.882 3.352 0.004
720 ATOM 122 CA LYS 66 16.786 -28.601 -2.003 0.019
721 ATOM 123 CB LYS 66 14.829 -27.667 -3.368 0.004
722 ATOM 124 CA LEU 67 20.431 -27.415 -2.387 0.000
723 ATOM 125 CB LEU 67 20.698 -25.960 -1.217 0.002
793 REMARK time 475.80 ENERGY -1.20801E+02
794 HELIX 1 H1 ARG 2 LEU 20 1 18
795 HELIX 2 H2 ARG 25 LEU 43 1 18
796 HELIX 3 H3 GLU 48 LEU 66 1 18
797 ATOM 1 CA GLY 1 -0.318 1.244 2.652 0.078
798 ATOM 2 CA SER 2 2.867 0.234 0.847 0.034
799 ATOM 3 CB SER 2 3.767 0.335 0.186 0.082
800 ATOM 4 CA ARG 3 4.327 -3.262 1.341 0.007
801 ATOM 5 CB ARG 3 2.007 -5.234 1.564 0.004
802 ATOM 6 CA VAL 4 7.398 -2.704 -0.808 0.039
803 ATOM 7 CB VAL 4 7.725 -1.944 -1.931 0.006
804 ATOM 8 CA LYS 5 9.390 -1.309 2.144 0.053
805 ATOM 9 CB LYS 5 8.660 0.588 3.691 0.025
806 ATOM 10 CA ALA 6 8.137 -4.155 4.382 0.016
807 ATOM 11 CB ALA 6 7.418 -4.195 4.524 0.111
808 ATOM 12 CA LEU 7 9.218 -6.804 1.845 0.002
809 ATOM 13 CB LEU 7 7.982 -7.333 0.465 0.042
810 ATOM 14 CA GLU 8 12.673 -5.293 1.764 0.006
811 ATOM 15 CB GLU 8 12.985 -4.482 -0.274 0.008
812 ATOM 16 CA GLU 9 13.061 -6.036 5.457 0.010
813 ATOM 17 CB GLU 9 12.778 -4.012 6.428 0.015
814 ATOM 18 CA LYS 10 11.428 -9.520 5.286 0.010
815 ATOM 19 CB LYS 10 10.889 -11.979 5.671 0.044
816 ATOM 20 CA VAL 11 13.748 -10.482 2.431 0.002
817 ATOM 21 CB VAL 11 13.571 -9.713 1.223 0.025
818 ATOM 22 CA LYS 12 16.673 -9.113 4.412 0.016
819 ATOM 23 CB LYS 12 16.499 -7.102 5.937 0.002
820 ATOM 24 CA ALA 13 16.092 -11.757 7.130 0.013
821 ATOM 25 CB ALA 13 15.437 -11.863 7.421 0.062
822 ATOM 26 CA LEU 14 16.434 -14.536 4.608 0.009
823 ATOM 27 CB LEU 14 14.760 -15.137 3.857 0.022
824 ATOM 28 CA GLU 15 19.964 -13.606 3.579 0.002
825 ATOM 29 CB GLU 15 19.385 -12.731 1.546 0.016
826 ATOM 30 CA GLU 16 20.993 -13.747 7.236 0.013
827 ATOM 31 CB GLU 16 20.027 -11.752 7.777 0.007
828 ATOM 32 CA LYS 17 18.999 -16.928 7.878 0.034
829 ATOM 33 CB LYS 17 17.023 -18.453 7.185 0.008
830 ATOM 34 CA VAL 18 21.121 -18.759 5.303 0.048
831 ATOM 35 CB VAL 18 20.819 -17.921 4.237 0.024
832 ATOM 36 CA LYS 19 24.357 -18.392 7.314 0.006
833 ATOM 37 CB LYS 19 24.467 -15.900 6.774 0.029
834 ATOM 38 CA ALA 20 22.872 -20.280 10.260 0.013
835 ATOM 39 CB ALA 20 22.353 -19.987 10.690 0.026
836 ATOM 40 CA LEU 21 21.431 -22.945 7.987 0.008
837 ATOM 41 CB LEU 21 19.503 -22.754 7.884 0.017
838 ATOM 42 CA GLY 22 24.826 -23.341 6.367 0.007
839 ATOM 43 CA GLY 23 24.212 -25.562 3.340 0.018
840 ATOM 44 CA GLY 24 26.690 -25.900 0.434 0.011
841 ATOM 45 CA GLY 25 27.475 -22.925 -1.805 0.002
842 ATOM 46 CA ARG 26 23.982 -22.342 -3.159 0.011
843 ATOM 47 CB ARG 26 21.201 -23.386 -2.558 0.017
844 ATOM 48 CA ILE 27 22.957 -21.047 0.243 0.001
845 ATOM 49 CB ILE 27 22.305 -21.840 1.641 0.034
846 ATOM 50 CA GLU 28 25.226 -18.016 0.064 0.016
847 ATOM 51 CB GLU 28 25.887 -16.566 1.681 0.023
848 ATOM 52 CA GLU 29 24.462 -17.681 -3.641 0.013
849 ATOM 53 CB GLU 29 24.205 -19.143 -5.360 0.022
850 ATOM 54 CA LEU 30 20.826 -16.877 -3.043 0.007
851 ATOM 55 CB LEU 30 19.885 -18.306 -2.120 0.017
852 ATOM 56 CA LYS 31 21.764 -13.775 -1.137 0.005
853 ATOM 57 CB LYS 31 23.396 -12.824 0.664 0.025
854 ATOM 58 CA LYS 32 23.507 -12.589 -4.321 0.011
855 ATOM 59 CB LYS 32 25.668 -13.622 -5.168 0.004
856 ATOM 60 CA LYS 33 20.238 -12.867 -6.185 0.006
857 ATOM 61 CB LYS 33 18.542 -14.684 -6.622 0.004
858 ATOM 62 CA TRP 34 18.203 -11.226 -3.348 0.010
859 ATOM 63 CB TRP 34 16.300 -13.064 -3.230 0.015
860 ATOM 64 CA GLU 35 19.804 -7.893 -4.248 0.014
861 ATOM 65 CB GLU 35 21.908 -7.100 -4.224 0.017
862 ATOM 66 CA GLU 36 17.874 -7.784 -7.538 0.012
863 ATOM 67 CB GLU 36 18.026 -9.091 -9.396 0.013
864 ATOM 68 CA LEU 37 14.616 -8.652 -5.900 0.015
865 ATOM 69 CB LEU 37 13.669 -9.790 -4.666 0.015
866 ATOM 70 CA LYS 38 14.955 -5.597 -3.778 0.033
867 ATOM 71 CB LYS 38 16.545 -6.353 -1.825 0.016
868 ATOM 72 CA LYS 39 15.819 -3.426 -6.792 0.005
869 ATOM 73 CB LYS 39 16.859 -4.022 -8.954 0.042
870 ATOM 74 CA LYS 40 12.675 -4.474 -8.770 0.009
871 ATOM 75 CB LYS 40 11.744 -6.518 -9.944 0.019
872 ATOM 76 CA ILE 41 10.570 -4.005 -5.745 0.051
873 ATOM 77 CB ILE 41 10.601 -5.321 -4.569 0.062
874 ATOM 78 CA GLU 42 11.418 -0.306 -5.639 0.012
875 ATOM 79 CB GLU 42 12.129 1.760 -5.218 0.014
876 ATOM 80 CA GLU 43 9.909 0.268 -9.082 0.003
877 ATOM 81 CB GLU 43 10.302 -0.956 -10.941 0.002
878 ATOM 82 CA LEU 44 6.854 -1.830 -8.018 0.002
879 ATOM 83 CB LEU 44 6.650 -3.672 -7.779 0.011
880 ATOM 84 CA GLY 45 5.527 1.023 -5.890 0.009
881 ATOM 85 CA GLY 46 2.714 1.564 -8.472 0.016
882 ATOM 86 CA GLY 47 1.882 -2.142 -8.677 0.021
883 ATOM 87 CA GLY 48 0.627 -1.968 -5.107 0.001
884 ATOM 88 CA GLU 49 -0.617 -5.519 -4.864 0.006
885 ATOM 89 CB GLU 49 -1.564 -6.632 -3.143 0.034
886 ATOM 90 CA VAL 50 2.766 -7.150 -4.374 0.006
887 ATOM 91 CB VAL 50 4.030 -6.522 -4.081 0.005
888 ATOM 92 CA LYS 51 1.673 -10.752 -3.871 0.007
889 ATOM 93 CB LYS 51 -0.581 -11.344 -4.728 0.016
890 ATOM 94 CA LYS 52 4.186 -11.763 -6.553 0.032
891 ATOM 95 CB LYS 52 4.084 -10.886 -8.933 0.008
892 ATOM 96 CA VAL 53 7.102 -10.213 -4.760 0.005
893 ATOM 97 CB VAL 53 7.752 -9.224 -5.484 0.020
894 ATOM 98 CA GLU 54 6.484 -12.043 -1.440 0.006
895 ATOM 99 CB GLU 54 6.573 -12.241 0.824 0.013
896 ATOM 100 CA GLU 55 6.141 -15.341 -3.271 0.001
897 ATOM 101 CB GLU 55 6.382 -14.981 -5.455 0.033
898 ATOM 102 CA GLU 56 9.652 -14.952 -4.582 0.046
899 ATOM 103 CB GLU 56 11.082 -13.840 -6.012 0.072
900 ATOM 104 CA VAL 57 11.012 -14.445 -1.040 0.003
901 ATOM 105 CB VAL 57 10.661 -13.132 -0.652 0.038
902 ATOM 106 CA LYS 58 8.734 -17.317 0.116 0.017
903 ATOM 107 CB LYS 58 6.367 -16.317 0.257 0.001
904 ATOM 108 CA LYS 59 10.484 -19.702 -2.314 0.040
905 ATOM 109 CB LYS 59 11.261 -18.725 -4.484 0.059
906 ATOM 110 CA LEU 60 13.885 -18.908 -0.691 0.015
907 ATOM 111 CB LEU 60 15.133 -17.425 -0.395 0.020
908 ATOM 112 CA GLU 61 13.019 -20.858 2.455 0.037
909 ATOM 113 CB GLU 61 12.458 -19.441 4.077 0.010
910 ATOM 114 CA GLU 62 11.551 -23.666 0.401 0.031
911 ATOM 115 CB GLU 62 9.647 -24.126 -0.593 0.025
912 ATOM 116 CA GLU 63 14.787 -24.110 -1.602 0.004
913 ATOM 117 CB GLU 63 15.614 -22.486 -2.985 0.017
914 ATOM 118 CA ILE 64 17.012 -23.789 1.491 0.009
915 ATOM 119 CB ILE 64 17.220 -22.296 2.324 0.021
916 ATOM 120 CA LYS 65 15.873 -27.149 2.870 0.038
917 ATOM 121 CB LYS 65 13.415 -27.645 2.989 0.008
918 ATOM 122 CA LYS 66 16.167 -28.903 -0.494 0.023
919 ATOM 123 CB LYS 66 14.965 -28.366 -2.686 0.033
920 ATOM 124 CA LEU 67 19.912 -29.623 -0.498 0.000
921 ATOM 125 CB LEU 67 20.327 -27.912 0.382 0.030
991 REMARK time 575.80 ENERGY -9.10444E+01
992 HELIX 1 H1 ARG 2 LEU 20 1 18
993 HELIX 2 H2 ARG 25 LEU 43 1 18
994 HELIX 3 H3 GLU 48 LEU 66 1 18
995 ATOM 1 CA GLY 1 1.593 3.880 2.859 0.022
996 ATOM 2 CA SER 2 3.468 1.222 0.934 0.040
997 ATOM 3 CB SER 2 4.347 0.839 0.415 0.005
998 ATOM 4 CA ARG 3 3.564 -2.490 1.723 0.006
999 ATOM 5 CB ARG 3 1.574 -3.121 -0.472 0.018
1000 ATOM 6 CA VAL 4 6.516 -2.918 -0.550 0.012
1001 ATOM 7 CB VAL 4 6.919 -2.317 -1.766 0.006
1002 ATOM 8 CA LYS 5 8.907 -2.018 2.275 0.016
1003 ATOM 9 CB LYS 5 8.030 0.313 2.594 0.018
1004 ATOM 10 CA ALA 6 7.225 -4.738 4.325 0.015
1005 ATOM 11 CB ALA 6 6.542 -4.792 4.443 0.068
1006 ATOM 12 CA LEU 7 8.200 -7.207 1.558 0.024
1007 ATOM 13 CB LEU 7 8.615 -8.407 0.062 0.023
1008 ATOM 14 CA GLU 8 11.824 -6.112 2.141 0.005
1009 ATOM 15 CB GLU 8 12.979 -4.206 2.301 0.005
1010 ATOM 16 CA GLU 9 11.357 -6.549 5.890 0.005
1011 ATOM 17 CB GLU 9 10.329 -6.158 7.819 0.011
1012 ATOM 18 CA LYS 10 10.479 -10.202 5.576 0.008
1013 ATOM 19 CB LYS 10 8.343 -11.544 6.138 0.011
1014 ATOM 20 CA VAL 11 13.273 -10.627 3.049 0.011
1015 ATOM 21 CB VAL 11 13.310 -9.778 1.898 0.021
1016 ATOM 22 CA LYS 12 15.862 -9.600 5.669 0.005
1017 ATOM 23 CB LYS 12 15.378 -7.263 6.553 0.022
1018 ATOM 24 CA ALA 13 14.828 -12.609 7.771 0.014
1019 ATOM 25 CB ALA 13 14.195 -12.683 8.115 0.021
1020 ATOM 26 CA LEU 14 14.857 -14.833 4.685 0.017
1021 ATOM 27 CB LEU 14 12.963 -15.167 4.589 0.031
1022 ATOM 28 CA GLU 15 18.550 -13.963 4.131 0.003
1023 ATOM 29 CB GLU 15 18.812 -12.772 2.289 0.045
1024 ATOM 30 CA GLU 16 19.420 -14.226 7.814 0.013
1025 ATOM 31 CB GLU 16 18.348 -12.848 9.280 0.008
1026 ATOM 32 CA LYS 17 18.890 -17.994 7.809 0.007
1027 ATOM 33 CB LYS 17 17.880 -20.312 7.930 0.003
1028 ATOM 34 CA VAL 18 21.381 -18.635 5.040 0.019
1029 ATOM 35 CB VAL 18 20.822 -18.326 3.802 0.019
1030 ATOM 36 CA LYS 19 24.019 -16.251 6.550 0.027
1031 ATOM 37 CB LYS 19 23.133 -14.535 8.201 0.030
1032 ATOM 38 CA ALA 20 24.895 -18.725 9.254 0.063
1033 ATOM 39 CB ALA 20 24.449 -18.937 9.821 0.018
1034 ATOM 40 CA LEU 21 24.927 -21.548 6.684 0.013
1035 ATOM 41 CB LEU 21 23.304 -22.463 6.184 0.022
1036 ATOM 42 CA GLY 22 28.088 -20.234 5.160 0.014
1037 ATOM 43 CA GLY 23 28.470 -22.264 1.952 0.005
1038 ATOM 44 CA GLY 24 29.440 -22.438 -1.752 0.007
1039 ATOM 45 CA GLY 25 27.515 -21.184 -4.766 0.007
1040 ATOM 46 CA ARG 26 24.534 -23.370 -4.117 0.011
1041 ATOM 47 CB ARG 26 25.666 -24.500 -6.716 0.018
1042 ATOM 48 CA ILE 27 23.106 -21.081 -1.460 0.016
1043 ATOM 49 CB ILE 27 22.117 -21.765 -0.139 0.009
1044 ATOM 50 CA GLU 28 24.580 -18.015 -3.228 0.025
1045 ATOM 51 CB GLU 28 26.033 -16.365 -2.599 0.014
1046 ATOM 52 CA GLU 29 21.880 -18.113 -5.931 0.024
1047 ATOM 53 CB GLU 29 21.152 -20.172 -6.589 0.006
1048 ATOM 54 CA LEU 30 19.132 -17.649 -3.267 0.005
1049 ATOM 55 CB LEU 30 18.717 -19.312 -2.298 0.038
1050 ATOM 56 CA LYS 31 20.780 -14.366 -2.088 0.013
1051 ATOM 57 CB LYS 31 23.125 -13.457 -1.455 0.004
1052 ATOM 58 CA LYS 32 20.929 -13.343 -5.693 0.013
1053 ATOM 59 CB LYS 32 21.618 -14.878 -7.575 0.005
1054 ATOM 60 CA LYS 33 17.129 -13.075 -5.857 0.004
1055 ATOM 61 CB LYS 33 16.137 -15.317 -6.389 0.013
1056 ATOM 62 CA TRP 34 16.841 -11.434 -2.415 0.016
1057 ATOM 63 CB TRP 34 15.171 -12.760 -0.909 0.025
1058 ATOM 64 CA GLU 35 19.227 -8.753 -3.488 0.044
1059 ATOM 65 CB GLU 35 21.353 -9.356 -3.810 0.017
1060 ATOM 66 CA GLU 36 17.130 -8.140 -6.651 0.005
1061 ATOM 67 CB GLU 36 16.040 -9.158 -8.294 0.008
1062 ATOM 68 CA LEU 37 13.981 -7.957 -4.605 0.022
1063 ATOM 69 CB LEU 37 13.074 -9.361 -3.731 0.016
1064 ATOM 70 CA LYS 38 15.345 -4.791 -2.790 0.035
1065 ATOM 71 CB LYS 38 16.483 -4.185 -0.586 0.024
1066 ATOM 72 CA LYS 39 16.745 -3.055 -5.876 0.012
1067 ATOM 73 CB LYS 39 18.105 -5.140 -6.092 0.015
1068 ATOM 74 CA LYS 40 13.512 -3.695 -7.786 0.026
1069 ATOM 75 CB LYS 40 12.952 -5.987 -8.777 0.008
1070 ATOM 76 CA ILE 41 11.298 -2.947 -4.804 0.030
1071 ATOM 77 CB ILE 41 11.279 -4.088 -3.480 0.053
1072 ATOM 78 CA GLU 42 12.785 0.487 -4.533 0.006
1073 ATOM 79 CB GLU 42 14.328 0.757 -2.928 0.049
1074 ATOM 80 CA GLU 43 12.378 1.092 -8.256 0.014
1075 ATOM 81 CB GLU 43 13.888 0.156 -9.709 0.055
1076 ATOM 82 CA LEU 44 8.959 -0.520 -8.573 0.015
1077 ATOM 83 CB LEU 44 7.904 -2.063 -8.161 0.030
1078 ATOM 84 CA GLY 45 7.333 1.849 -6.011 0.018
1079 ATOM 85 CA GLY 46 4.587 2.730 -8.530 0.016
1080 ATOM 86 CA GLY 47 3.114 -0.808 -8.536 0.013
1081 ATOM 87 CA GLY 48 1.617 -1.744 -5.149 0.002
1082 ATOM 88 CA GLU 49 0.914 -5.312 -5.894 0.005
1083 ATOM 89 CB GLU 49 -0.894 -6.054 -7.109 0.034
1084 ATOM 90 CA VAL 50 4.290 -6.928 -6.502 0.018
1085 ATOM 91 CB VAL 50 4.765 -6.641 -5.197 0.016
1086 ATOM 92 CA LYS 51 2.841 -10.352 -7.149 0.003
1087 ATOM 93 CB LYS 51 0.847 -10.538 -8.683 0.045
1088 ATOM 94 CA LYS 52 5.990 -12.151 -8.116 0.007
1089 ATOM 95 CB LYS 52 7.180 -10.856 -10.002 0.012
1090 ATOM 96 CA VAL 53 7.948 -10.667 -5.261 0.012
1091 ATOM 97 CB VAL 53 8.347 -9.337 -5.554 0.005
1092 ATOM 98 CA GLU 54 5.998 -12.565 -2.610 0.013
1093 ATOM 99 CB GLU 54 4.852 -10.760 -1.738 0.021
1094 ATOM 100 CA GLU 55 6.365 -15.674 -4.828 0.027
1095 ATOM 101 CB GLU 55 4.723 -16.880 -5.798 0.008
1096 ATOM 102 CA GLU 56 9.916 -16.170 -3.737 0.006
1097 ATOM 103 CB GLU 56 11.886 -15.129 -4.261 0.081
1098 ATOM 104 CA VAL 57 9.330 -15.631 -0.001 0.013
1099 ATOM 105 CB VAL 57 9.116 -14.409 0.664 0.034
1100 ATOM 106 CA LYS 58 7.126 -18.628 0.654 0.015
1101 ATOM 107 CB LYS 58 5.160 -18.622 -0.913 0.001
1102 ATOM 108 CA LYS 59 8.756 -21.051 -1.721 0.021
1103 ATOM 109 CB LYS 59 8.393 -20.115 -4.014 0.008
1104 ATOM 110 CA LEU 60 12.076 -19.929 -0.388 0.041
1105 ATOM 111 CB LEU 60 12.986 -18.371 -1.113 0.008
1106 ATOM 112 CA GLU 61 11.592 -21.322 3.081 0.026
1107 ATOM 113 CB GLU 61 12.642 -20.011 4.600 0.017
1108 ATOM 114 CA GLU 62 11.648 -24.933 1.843 0.002
1109 ATOM 115 CB GLU 62 11.720 -27.210 1.701 0.012
1110 ATOM 116 CA GLU 63 14.299 -24.216 -0.721 0.010
1111 ATOM 117 CB GLU 63 14.422 -22.659 -2.377 0.009
1112 ATOM 118 CA ILE 64 16.584 -22.618 1.910 0.010
1113 ATOM 119 CB ILE 64 16.563 -20.888 2.325 0.015
1114 ATOM 120 CA LYS 65 16.188 -25.390 4.380 0.019
1115 ATOM 121 CB LYS 65 13.833 -25.018 5.210 0.028
1116 ATOM 122 CA LYS 66 18.269 -27.961 2.484 0.012
1117 ATOM 123 CB LYS 66 18.065 -27.786 -0.022 0.001
1118 ATOM 124 CA LEU 67 21.533 -27.243 4.207 0.000
1119 ATOM 125 CB LEU 67 23.443 -27.606 4.441 0.007
1189 REMARK time 675.80 ENERGY -9.86777E+01
1190 HELIX 1 H1 ARG 2 LEU 20 1 18
1191 HELIX 2 H2 ARG 25 LEU 43 1 18
1192 HELIX 3 H3 GLU 48 LEU 66 1 18
1193 ATOM 1 CA GLY 1 -0.783 0.802 2.704 0.014
1194 ATOM 2 CA SER 2 1.870 -0.853 0.535 0.008
1195 ATOM 3 CB SER 2 3.024 -1.072 0.502 0.008
1196 ATOM 4 CA ARG 3 2.223 -4.587 1.027 0.004
1197 ATOM 5 CB ARG 3 -0.083 -3.532 -0.643 0.006
1198 ATOM 6 CA VAL 4 5.826 -4.519 -0.184 0.004
1199 ATOM 7 CB VAL 4 6.607 -3.880 -1.175 0.024
1200 ATOM 8 CA LYS 5 6.949 -2.351 2.805 0.011
1201 ATOM 9 CB LYS 5 6.729 0.187 2.678 0.010
1202 ATOM 10 CA ALA 6 5.921 -5.185 5.154 0.004
1203 ATOM 11 CB ALA 6 5.250 -5.459 5.214 0.093
1204 ATOM 12 CA LEU 7 7.937 -7.747 3.203 0.003
1205 ATOM 13 CB LEU 7 7.757 -8.292 1.329 0.020
1206 ATOM 14 CA GLU 8 10.757 -5.170 2.836 0.006
1207 ATOM 15 CB GLU 8 10.370 -4.034 0.924 0.019
1208 ATOM 16 CA GLU 9 11.560 -5.889 6.464 0.015
1209 ATOM 17 CB GLU 9 9.682 -5.048 7.289 0.008
1210 ATOM 18 CA LYS 10 11.060 -9.658 6.019 0.007
1211 ATOM 19 CB LYS 10 9.275 -11.295 5.175 0.007
1212 ATOM 20 CA VAL 11 13.692 -9.351 3.222 0.006
1213 ATOM 21 CB VAL 11 13.752 -8.566 2.056 0.002
1214 ATOM 22 CA LYS 12 16.357 -8.199 5.671 0.015
1215 ATOM 23 CB LYS 12 15.786 -7.407 7.970 0.026
1216 ATOM 24 CA ALA 13 15.618 -11.273 7.735 0.007
1217 ATOM 25 CB ALA 13 15.019 -11.366 8.196 0.016
1218 ATOM 26 CA LEU 14 15.767 -13.535 4.714 0.002
1219 ATOM 27 CB LEU 14 15.695 -13.600 2.768 0.013
1220 ATOM 28 CA GLU 15 19.442 -12.761 4.405 0.027
1221 ATOM 29 CB GLU 15 21.116 -13.023 2.933 0.036
1222 ATOM 30 CA GLU 16 20.130 -13.800 8.002 0.034
1223 ATOM 31 CB GLU 16 18.837 -13.500 9.753 0.006
1224 ATOM 32 CA LYS 17 18.403 -17.095 7.389 0.020
1225 ATOM 33 CB LYS 17 17.540 -19.326 8.190 0.015
1226 ATOM 34 CA VAL 18 20.941 -17.920 4.663 0.012
1227 ATOM 35 CB VAL 18 20.766 -17.449 3.347 0.064
1228 ATOM 36 CA LYS 19 23.587 -17.252 7.364 0.003
1229 ATOM 37 CB LYS 19 23.074 -16.445 9.763 0.022
1230 ATOM 38 CA ALA 20 22.560 -20.307 9.361 0.003
1231 ATOM 39 CB ALA 20 21.888 -20.291 9.672 0.025
1232 ATOM 40 CA LEU 21 21.994 -22.347 6.201 0.019
1233 ATOM 41 CB LEU 21 20.150 -22.143 5.515 0.034
1234 ATOM 42 CA GLY 22 25.625 -22.547 5.203 0.004
1235 ATOM 43 CA GLY 23 25.295 -26.130 3.875 0.006
1236 ATOM 44 CA GLY 24 25.246 -26.460 0.113 0.040
1237 ATOM 45 CA GLY 25 26.226 -24.943 -3.215 0.037
1238 ATOM 46 CA ARG 26 22.831 -23.332 -3.760 0.006
1239 ATOM 47 CB ARG 26 23.359 -25.619 -5.684 0.015
1240 ATOM 48 CA ILE 27 22.897 -21.190 -0.633 0.005
1241 ATOM 49 CB ILE 27 22.735 -22.357 0.709 0.013
1242 ATOM 50 CA GLU 28 26.191 -19.657 -1.819 0.009
1243 ATOM 51 CB GLU 28 27.085 -20.435 0.090 0.024
1244 ATOM 52 CA GLU 29 24.504 -18.304 -4.953 0.006
1245 ATOM 53 CB GLU 29 23.384 -17.281 -6.599 0.001
1246 ATOM 54 CA LEU 30 21.510 -16.991 -3.075 0.033
1247 ATOM 55 CB LEU 30 20.024 -18.114 -2.994 0.016
1248 ATOM 56 CA LYS 31 23.843 -14.941 -0.877 0.046
1249 ATOM 57 CB LYS 31 25.840 -15.273 0.672 0.057
1250 ATOM 58 CA LYS 32 24.910 -13.005 -4.016 0.010
1251 ATOM 59 CB LYS 32 26.493 -14.383 -5.401 0.030
1252 ATOM 60 CA LYS 33 21.362 -12.374 -5.097 0.013
1253 ATOM 61 CB LYS 33 19.698 -14.224 -5.630 0.046
1254 ATOM 62 CA TRP 34 20.389 -10.521 -1.906 0.002
1255 ATOM 63 CB TRP 34 19.411 -12.922 -1.283 0.007
1256 ATOM 64 CA GLU 35 21.539 -7.222 -3.523 0.019
1257 ATOM 65 CB GLU 35 23.846 -6.939 -3.587 0.020
1258 ATOM 66 CA GLU 36 19.332 -7.990 -6.451 0.006
1259 ATOM 67 CB GLU 36 18.494 -9.744 -7.748 0.010
1260 ATOM 68 CA LEU 37 16.269 -8.318 -4.246 0.015
1261 ATOM 69 CB LEU 37 15.296 -9.509 -2.999 0.012
1262 ATOM 70 CA LYS 38 16.278 -4.561 -3.494 0.019
1263 ATOM 71 CB LYS 38 18.007 -3.226 -2.103 0.018
1264 ATOM 72 CA LYS 39 16.613 -3.646 -7.198 0.018
1265 ATOM 73 CB LYS 39 18.180 -5.015 -8.649 0.030
1266 ATOM 74 CA LYS 40 13.574 -5.641 -8.155 0.003
1267 ATOM 75 CB LYS 40 13.399 -8.191 -7.979 0.011
1268 ATOM 76 CA ILE 41 11.694 -4.608 -5.019 0.006
1269 ATOM 77 CB ILE 41 11.410 -6.025 -4.013 0.011
1270 ATOM 78 CA GLU 42 11.745 -0.842 -5.732 0.029
1271 ATOM 79 CB GLU 42 13.321 0.748 -5.999 0.012
1272 ATOM 80 CA GLU 43 9.691 -1.299 -8.876 0.035
1273 ATOM 81 CB GLU 43 10.705 -3.210 -9.365 0.003
1274 ATOM 82 CA LEU 44 6.822 -2.623 -6.778 0.011
1275 ATOM 83 CB LEU 44 7.465 -4.487 -6.564 0.024
1276 ATOM 84 CA GLY 45 5.705 0.959 -6.277 0.019
1277 ATOM 85 CA GLY 46 3.425 0.770 -9.234 0.003
1278 ATOM 86 CA GLY 47 1.871 -2.457 -8.123 0.040
1279 ATOM 87 CA GLY 48 -0.089 -1.763 -4.875 0.003
1280 ATOM 88 CA GLU 49 -2.189 -4.776 -3.789 0.001
1281 ATOM 89 CB GLU 49 -2.320 -6.331 -2.096 0.009
1282 ATOM 90 CA VAL 50 -0.131 -7.539 -5.411 0.035
1283 ATOM 91 CB VAL 50 1.011 -7.023 -6.032 0.009
1284 ATOM 92 CA LYS 51 0.190 -11.279 -4.839 0.000
1285 ATOM 93 CB LYS 51 -1.494 -12.563 -6.123 0.038
1286 ATOM 94 CA LYS 52 3.722 -11.354 -6.267 0.023
1287 ATOM 95 CB LYS 52 4.537 -10.091 -8.329 0.041
1288 ATOM 96 CA VAL 53 5.325 -8.947 -3.793 0.006
1289 ATOM 97 CB VAL 53 4.762 -7.643 -3.537 0.051
1290 ATOM 98 CA GLU 54 5.771 -11.550 -1.092 0.002
1291 ATOM 99 CB GLU 54 4.339 -12.279 0.524 0.005
1292 ATOM 100 CA GLU 55 6.133 -14.368 -3.648 0.066
1293 ATOM 101 CB GLU 55 5.160 -14.938 -5.561 0.016
1294 ATOM 102 CA GLU 56 9.335 -12.865 -5.045 0.035
1295 ATOM 103 CB GLU 56 10.441 -10.969 -5.421 0.016
1296 ATOM 104 CA VAL 57 11.352 -13.873 -1.983 0.007
1297 ATOM 105 CB VAL 57 11.383 -13.143 -0.724 0.006
1298 ATOM 106 CA LYS 58 9.525 -17.200 -1.876 0.003
1299 ATOM 107 CB LYS 58 7.453 -17.853 -3.228 0.001
1300 ATOM 108 CA LYS 59 11.638 -18.712 -4.647 0.044
1301 ATOM 109 CB LYS 59 11.240 -17.078 -6.567 0.004
1302 ATOM 110 CA LEU 60 14.793 -17.742 -2.748 0.034
1303 ATOM 111 CB LEU 60 15.174 -15.899 -2.865 0.041
1304 ATOM 112 CA GLU 61 13.658 -19.537 0.389 0.024
1305 ATOM 113 CB GLU 61 12.780 -18.870 2.350 0.061
1306 ATOM 114 CA GLU 62 12.216 -22.687 -1.295 0.026
1307 ATOM 115 CB GLU 62 10.959 -23.499 -2.940 0.015
1308 ATOM 116 CA GLU 63 15.700 -23.927 -2.356 0.012
1309 ATOM 117 CB GLU 63 17.071 -23.421 -4.063 0.014
1310 ATOM 118 CA ILE 64 17.466 -22.560 0.715 0.004
1311 ATOM 119 CB ILE 64 17.202 -20.831 1.103 0.096
1312 ATOM 120 CA LYS 65 15.124 -24.060 3.260 0.011
1313 ATOM 121 CB LYS 65 12.759 -23.255 2.772 0.006
1314 ATOM 122 CA LYS 66 15.541 -27.510 1.563 0.017
1315 ATOM 123 CB LYS 66 14.425 -27.254 -0.710 0.036
1316 ATOM 124 CA LEU 67 18.887 -28.513 2.983 0.000
1317 ATOM 125 CB LEU 67 19.997 -27.806 4.401 0.030
1387 REMARK time 775.80 ENERGY -9.09710E+01
1388 HELIX 1 H1 ARG 2 LEU 20 1 18
1389 HELIX 2 H2 ARG 25 LEU 43 1 18
1390 HELIX 3 H3 GLU 48 LEU 66 1 18
1391 ATOM 1 CA GLY 1 2.407 4.556 4.099 0.004
1392 ATOM 2 CA SER 2 3.878 1.613 2.163 0.012
1393 ATOM 3 CB SER 2 5.034 1.252 2.120 0.064
1394 ATOM 4 CA ARG 3 3.747 -2.063 3.090 0.005
1395 ATOM 5 CB ARG 3 1.872 -1.391 5.396 0.006
1396 ATOM 6 CA VAL 4 5.974 -2.933 0.144 0.014
1397 ATOM 7 CB VAL 4 5.786 -2.305 -1.087 0.063
1398 ATOM 8 CA LYS 5 9.185 -2.218 2.016 0.043
1399 ATOM 9 CB LYS 5 9.767 -0.216 3.498 0.018
1400 ATOM 10 CA ALA 6 7.863 -4.671 4.545 0.011
1401 ATOM 11 CB ALA 6 7.259 -4.841 5.054 0.142
1402 ATOM 12 CA LEU 7 8.237 -7.389 1.879 0.007
1403 ATOM 13 CB LEU 7 8.375 -8.142 0.139 0.040
1404 ATOM 14 CA GLU 8 11.922 -6.700 1.607 0.026
1405 ATOM 15 CB GLU 8 13.374 -5.121 1.043 0.004
1406 ATOM 16 CA GLU 9 11.991 -7.166 5.377 0.028
1407 ATOM 17 CB GLU 9 11.598 -5.237 6.489 0.007
1408 ATOM 18 CA LYS 10 10.971 -10.797 4.788 0.024
1409 ATOM 19 CB LYS 10 9.938 -13.088 4.679 0.036
1410 ATOM 20 CA VAL 11 13.735 -10.990 2.279 0.014
1411 ATOM 21 CB VAL 11 13.760 -10.124 1.134 0.039
1412 ATOM 22 CA LYS 12 16.087 -10.291 5.235 0.021
1413 ATOM 23 CB LYS 12 15.431 -8.222 6.622 0.011
1414 ATOM 24 CA ALA 13 14.531 -13.237 7.029 0.029
1415 ATOM 25 CB ALA 13 14.107 -13.735 7.298 0.013
1416 ATOM 26 CA LEU 14 15.520 -15.540 4.146 0.011
1417 ATOM 27 CB LEU 14 14.232 -15.436 2.712 0.045
1418 ATOM 28 CA GLU 15 19.120 -14.355 4.617 0.025
1419 ATOM 29 CB GLU 15 20.047 -12.447 3.796 0.003
1420 ATOM 30 CA GLU 16 18.962 -15.706 8.182 0.015
1421 ATOM 31 CB GLU 16 18.227 -14.076 9.476 0.014
1422 ATOM 32 CA LYS 17 17.699 -19.072 6.944 0.000
1423 ATOM 33 CB LYS 17 18.060 -21.607 7.116 0.019
1424 ATOM 34 CA VAL 18 20.761 -19.367 4.638 0.028
1425 ATOM 35 CB VAL 18 21.045 -18.428 3.566 0.035
1426 ATOM 36 CA LYS 19 22.911 -18.869 7.786 0.033
1427 ATOM 37 CB LYS 19 22.313 -16.468 8.185 0.006
1428 ATOM 38 CA ALA 20 21.364 -21.794 9.651 0.011
1429 ATOM 39 CB ALA 20 20.707 -21.930 10.113 0.164
1430 ATOM 40 CA LEU 21 21.829 -24.125 6.716 0.038
1431 ATOM 41 CB LEU 21 21.501 -23.667 4.934 0.005
1432 ATOM 42 CA GLY 22 25.544 -23.870 7.214 0.037
1433 ATOM 43 CA GLY 23 26.272 -25.014 3.697 0.026
1434 ATOM 44 CA GLY 24 28.798 -24.177 0.905 0.022
1435 ATOM 45 CA GLY 25 29.668 -21.181 -1.311 0.038
1436 ATOM 46 CA ARG 26 26.189 -21.103 -2.855 0.011
1437 ATOM 47 CB ARG 26 24.104 -22.492 -4.494 0.004
1438 ATOM 48 CA ILE 27 24.750 -20.163 0.540 0.008
1439 ATOM 49 CB ILE 27 25.098 -20.315 2.312 0.006
1440 ATOM 50 CA GLU 28 25.558 -16.547 -0.140 0.024
1441 ATOM 51 CB GLU 28 27.334 -17.238 1.013 0.023
1442 ATOM 52 CA GLU 29 23.995 -16.722 -3.613 0.046
1443 ATOM 53 CB GLU 29 23.317 -17.498 -5.598 0.014
1444 ATOM 54 CA LEU 30 20.677 -16.547 -1.930 0.015
1445 ATOM 55 CB LEU 30 20.608 -18.488 -1.942 0.016
1446 ATOM 56 CA LYS 31 21.791 -13.467 -0.137 0.015
1447 ATOM 57 CB LYS 31 23.372 -13.376 1.862 0.003
1448 ATOM 58 CA LYS 32 22.755 -11.929 -3.493 0.017
1449 ATOM 59 CB LYS 32 24.579 -12.902 -4.931 0.025
1450 ATOM 60 CA LYS 33 19.531 -13.050 -5.132 0.016
1451 ATOM 61 CB LYS 33 18.364 -15.347 -5.008 0.004
1452 ATOM 62 CA TRP 34 17.553 -10.921 -2.673 0.006
1453 ATOM 63 CB TRP 34 17.227 -13.208 -1.578 0.021
1454 ATOM 64 CA GLU 35 19.481 -7.798 -3.773 0.033
1455 ATOM 65 CB GLU 35 20.669 -6.438 -2.371 0.065
1456 ATOM 66 CA GLU 36 17.571 -7.956 -7.077 0.059
1457 ATOM 67 CB GLU 36 17.252 -9.254 -8.936 0.019
1458 ATOM 68 CA LEU 37 14.213 -8.309 -5.484 0.029
1459 ATOM 69 CB LEU 37 12.877 -9.212 -4.362 0.031
1460 ATOM 70 CA LYS 38 14.761 -4.990 -3.763 0.013
1461 ATOM 71 CB LYS 38 16.632 -4.015 -2.392 0.007
1462 ATOM 72 CA LYS 39 15.209 -3.033 -7.049 0.023
1463 ATOM 73 CB LYS 39 16.427 -3.744 -9.111 0.041
1464 ATOM 74 CA LYS 40 12.318 -4.902 -8.667 0.002
1465 ATOM 75 CB LYS 40 11.879 -7.339 -8.973 0.006
1466 ATOM 76 CA ILE 41 10.032 -3.941 -5.824 0.019
1467 ATOM 77 CB ILE 41 10.243 -4.379 -4.099 0.007
1468 ATOM 78 CA GLU 42 11.049 -0.304 -6.192 0.005
1469 ATOM 79 CB GLU 42 12.386 1.517 -6.107 0.021
1470 ATOM 80 CA GLU 43 9.460 -0.327 -9.697 0.005
1471 ATOM 81 CB GLU 43 9.584 -2.270 -10.819 0.004
1472 ATOM 82 CA LEU 44 6.370 -2.005 -8.127 0.018
1473 ATOM 83 CB LEU 44 5.970 -3.803 -8.639 0.014
1474 ATOM 84 CA GLY 45 5.454 1.107 -6.068 0.016
1475 ATOM 85 CA GLY 46 5.816 3.346 -9.104 0.004
1476 ATOM 86 CA GLY 47 3.979 0.986 -11.409 0.009
1477 ATOM 87 CA GLY 48 1.343 -1.310 -9.834 0.015
1478 ATOM 88 CA GLU 49 0.972 -4.011 -7.174 0.003
1479 ATOM 89 CB GLU 49 -1.196 -4.486 -6.652 0.043
1480 ATOM 90 CA VAL 50 3.823 -6.066 -5.563 0.004
1481 ATOM 91 CB VAL 50 4.971 -6.088 -4.657 0.016
1482 ATOM 92 CA LYS 51 1.952 -9.173 -4.402 0.005
1483 ATOM 93 CB LYS 51 -0.543 -8.891 -4.550 0.021
1484 ATOM 94 CA LYS 52 4.112 -11.321 -6.781 0.050
1485 ATOM 95 CB LYS 52 4.461 -10.938 -9.300 0.005
1486 ATOM 96 CA VAL 53 7.537 -10.314 -5.295 0.050
1487 ATOM 97 CB VAL 53 7.998 -9.062 -5.933 0.044
1488 ATOM 98 CA GLU 54 6.501 -11.831 -1.971 0.010
1489 ATOM 99 CB GLU 54 5.582 -11.952 0.078 0.011
1490 ATOM 100 CA GLU 55 4.761 -14.832 -3.445 0.004
1491 ATOM 101 CB GLU 55 2.668 -15.262 -2.538 0.006
1492 ATOM 102 CA GLU 56 7.973 -15.799 -5.332 0.001
1493 ATOM 103 CB GLU 56 9.976 -15.828 -6.444 0.010
1494 ATOM 104 CA VAL 57 9.911 -15.120 -2.103 0.009
1495 ATOM 105 CB VAL 57 10.061 -13.832 -1.545 0.016
1496 ATOM 106 CA LYS 58 8.255 -18.141 -0.433 0.008
1497 ATOM 107 CB LYS 58 6.524 -17.832 1.333 0.010
1498 ATOM 108 CA LYS 59 9.010 -20.440 -3.381 0.017
1499 ATOM 109 CB LYS 59 8.367 -19.639 -5.707 0.026
1500 ATOM 110 CA LEU 60 12.673 -20.267 -2.399 0.014
1501 ATOM 111 CB LEU 60 13.554 -18.551 -2.445 0.003
1502 ATOM 112 CA GLU 61 11.783 -21.253 1.197 0.027
1503 ATOM 113 CB GLU 61 11.151 -19.592 2.592 0.022
1504 ATOM 114 CA GLU 62 12.249 -24.916 0.161 0.028
1505 ATOM 115 CB GLU 62 12.204 -26.789 1.396 0.046
1506 ATOM 116 CA GLU 63 15.392 -24.161 -1.867 0.003
1507 ATOM 117 CB GLU 63 16.988 -23.470 -3.325 0.020
1508 ATOM 118 CA ILE 64 17.388 -22.842 1.046 0.027
1509 ATOM 119 CB ILE 64 16.796 -21.482 2.015 0.018
1510 ATOM 120 CA LYS 65 17.762 -26.402 2.439 0.001
1511 ATOM 121 CB LYS 65 15.736 -26.573 4.041 0.015
1512 ATOM 122 CA LYS 66 18.256 -27.977 -1.019 0.023
1513 ATOM 123 CB LYS 66 16.879 -27.379 -3.061 0.018
1514 ATOM 124 CA LEU 67 21.183 -26.304 -2.832 0.000
1515 ATOM 125 CB LEU 67 21.750 -24.904 -1.653 0.006
1585 REMARK time 873.86 ENERGY -1.01391E+02
1586 HELIX 1 H1 ARG 2 LEU 20 1 18
1587 HELIX 2 H2 ARG 25 LEU 43 1 18
1588 HELIX 3 H3 GLU 48 LEU 66 1 18
1589 ATOM 1 CA GLY 1 -1.923 -3.747 0.008 0.021
1590 ATOM 2 CA SER 2 1.694 -2.827 0.279 0.013
1591 ATOM 3 CB SER 2 1.987 -2.002 -0.420 0.075
1592 ATOM 4 CA ARG 3 4.406 -5.483 0.619 0.007
1593 ATOM 5 CB ARG 3 1.928 -6.190 -1.036 0.001
1594 ATOM 6 CA VAL 4 7.136 -2.761 0.981 0.037
1595 ATOM 7 CB VAL 4 7.472 -1.865 -0.080 0.019
1596 ATOM 8 CA LYS 5 7.053 -2.772 4.814 0.007
1597 ATOM 9 CB LYS 5 5.543 -0.756 5.047 0.007
1598 ATOM 10 CA ALA 6 6.484 -6.558 5.024 0.021
1599 ATOM 11 CB ALA 6 5.728 -6.713 4.920 0.035
1600 ATOM 12 CA LEU 7 9.287 -7.416 2.584 0.003
1601 ATOM 13 CB LEU 7 8.561 -7.709 0.856 0.022
1602 ATOM 14 CA GLU 8 11.796 -5.229 4.430 0.003
1603 ATOM 15 CB GLU 8 13.109 -4.599 2.764 0.003
1604 ATOM 16 CA GLU 9 11.281 -7.441 7.548 0.004
1605 ATOM 17 CB GLU 9 9.957 -8.766 8.910 0.030
1606 ATOM 18 CA LYS 10 11.006 -10.710 5.623 0.014
1607 ATOM 19 CB LYS 10 11.076 -13.275 5.647 0.004
1608 ATOM 20 CA VAL 11 14.423 -9.998 3.878 0.014
1609 ATOM 21 CB VAL 11 14.711 -9.080 2.855 0.015
1610 ATOM 22 CA LYS 12 16.189 -9.938 7.172 0.021
1611 ATOM 23 CB LYS 12 14.688 -9.578 9.203 0.003
1612 ATOM 24 CA ALA 13 15.151 -13.578 7.798 0.033
1613 ATOM 25 CB ALA 13 14.446 -13.748 8.052 0.044
1614 ATOM 26 CA LEU 14 15.991 -14.407 4.212 0.033
1615 ATOM 27 CB LEU 14 15.256 -13.955 2.437 0.048
1616 ATOM 28 CA GLU 15 19.590 -13.540 4.598 0.000
1617 ATOM 29 CB GLU 15 21.693 -12.661 4.849 0.014
1618 ATOM 30 CA GLU 16 19.803 -15.347 7.918 0.018
1619 ATOM 31 CB GLU 16 18.653 -15.488 9.873 0.007
1620 ATOM 32 CA LYS 17 18.364 -18.443 6.342 0.030
1621 ATOM 33 CB LYS 17 18.405 -20.974 6.792 0.008
1622 ATOM 34 CA VAL 18 21.647 -18.610 4.420 0.065
1623 ATOM 35 CB VAL 18 21.738 -17.892 3.250 0.034
1624 ATOM 36 CA LYS 19 23.637 -17.900 7.527 0.035
1625 ATOM 37 CB LYS 19 22.814 -15.646 8.349 0.007
1626 ATOM 38 CA ALA 20 22.228 -21.007 9.168 0.025
1627 ATOM 39 CB ALA 20 21.546 -21.113 9.337 0.021
1628 ATOM 40 CA LEU 21 22.908 -23.105 6.097 0.009
1629 ATOM 41 CB LEU 21 21.746 -23.406 4.572 0.008
1630 ATOM 42 CA GLY 22 26.617 -23.804 5.708 0.008
1631 ATOM 43 CA GLY 23 26.262 -25.419 2.197 0.005
1632 ATOM 44 CA GLY 24 27.827 -24.969 -1.285 0.004
1633 ATOM 45 CA GLY 25 27.750 -22.364 -4.116 0.001
1634 ATOM 46 CA ARG 26 23.984 -21.999 -4.095 0.018
1635 ATOM 47 CB ARG 26 23.734 -22.766 -7.032 0.009
1636 ATOM 48 CA ILE 27 24.158 -19.827 -0.997 0.026
1637 ATOM 49 CB ILE 27 24.913 -20.251 0.537 0.011
1638 ATOM 50 CA GLU 28 25.836 -17.137 -3.017 0.020
1639 ATOM 51 CB GLU 28 26.392 -15.111 -2.228 0.028
1640 ATOM 52 CA GLU 29 22.866 -17.388 -5.416 0.020
1641 ATOM 53 CB GLU 29 21.788 -18.116 -7.231 0.040
1642 ATOM 54 CA LEU 30 20.400 -16.781 -2.642 0.018
1643 ATOM 55 CB LEU 30 19.940 -18.627 -2.610 0.020
1644 ATOM 56 CA LYS 31 22.437 -13.695 -1.573 0.004
1645 ATOM 57 CB LYS 31 23.970 -13.232 0.404 0.003
1646 ATOM 58 CA LYS 32 22.504 -12.326 -5.157 0.002
1647 ATOM 59 CB LYS 32 22.753 -13.854 -7.160 0.008
1648 ATOM 60 CA LYS 33 18.741 -12.028 -5.320 0.009
1649 ATOM 61 CB LYS 33 16.803 -13.732 -5.673 0.015
1650 ATOM 62 CA TRP 34 18.659 -10.574 -1.833 0.000
1651 ATOM 63 CB TRP 34 18.804 -12.998 -0.813 0.008
1652 ATOM 64 CA GLU 35 20.332 -7.321 -2.963 0.035
1653 ATOM 65 CB GLU 35 22.355 -7.188 -3.934 0.018
1654 ATOM 66 CA GLU 36 18.333 -7.295 -6.146 0.023
1655 ATOM 67 CB GLU 36 18.799 -8.012 -8.264 0.014
1656 ATOM 68 CA LEU 37 14.995 -7.393 -4.302 0.015
1657 ATOM 69 CB LEU 37 15.217 -9.131 -3.520 0.014
1658 ATOM 70 CA LYS 38 15.837 -4.260 -2.323 0.009
1659 ATOM 71 CB LYS 38 17.344 -4.184 -0.167 0.039
1660 ATOM 72 CA LYS 39 15.338 -1.729 -5.116 0.013
1661 ATOM 73 CB LYS 39 17.657 -1.621 -6.121 0.011
1662 ATOM 74 CA LYS 40 13.395 -4.239 -7.256 0.010
1663 ATOM 75 CB LYS 40 13.065 -6.728 -7.311 0.002
1664 ATOM 76 CA ILE 41 10.463 -3.956 -4.850 0.024
1665 ATOM 77 CB ILE 41 10.540 -4.100 -3.073 0.012
1666 ATOM 78 CA GLU 42 10.499 -0.157 -4.853 0.014
1667 ATOM 79 CB GLU 42 11.454 0.459 -2.849 0.005
1668 ATOM 80 CA GLU 43 10.613 -0.297 -8.705 0.019
1669 ATOM 81 CB GLU 43 11.718 -1.551 -10.259 0.007
1670 ATOM 82 CA LEU 44 7.860 -2.873 -8.955 0.018
1671 ATOM 83 CB LEU 44 7.487 -4.769 -8.490 0.025
1672 ATOM 84 CA GLY 45 5.175 -0.373 -7.733 0.051
1673 ATOM 85 CA GLY 46 5.334 1.510 -11.064 0.032
1674 ATOM 86 CA GLY 47 4.946 -1.655 -13.109 0.008
1675 ATOM 87 CA GLY 48 2.183 -3.450 -11.179 0.022
1676 ATOM 88 CA GLU 49 2.075 -4.508 -7.591 0.047
1677 ATOM 89 CB GLU 49 0.302 -4.223 -6.200 0.016
1678 ATOM 90 CA VAL 50 4.530 -6.318 -5.275 0.019
1679 ATOM 91 CB VAL 50 5.277 -5.820 -4.176 0.046
1680 ATOM 92 CA LYS 51 2.307 -9.380 -4.774 0.006
1681 ATOM 93 CB LYS 51 0.497 -9.994 -6.481 0.008
1682 ATOM 94 CA LYS 52 4.842 -11.657 -6.623 0.024
1683 ATOM 95 CB LYS 52 6.267 -11.539 -8.722 0.086
1684 ATOM 96 CA VAL 53 7.576 -10.186 -4.340 0.030
1685 ATOM 97 CB VAL 53 8.436 -9.134 -4.734 0.042
1686 ATOM 98 CA GLU 54 5.912 -11.470 -1.140 0.023
1687 ATOM 99 CB GLU 54 4.473 -10.054 0.010 0.022
1688 ATOM 100 CA GLU 55 4.985 -14.764 -2.808 0.033
1689 ATOM 101 CB GLU 55 3.582 -15.516 -4.494 0.022
1690 ATOM 102 CA GLU 56 8.529 -14.953 -4.254 0.018
1691 ATOM 103 CB GLU 56 8.930 -13.608 -5.972 0.031
1692 ATOM 104 CA VAL 57 9.982 -14.573 -0.703 0.009
1693 ATOM 105 CB VAL 57 9.963 -13.465 0.186 0.021
1694 ATOM 106 CA LYS 58 8.248 -17.736 0.469 0.005
1695 ATOM 107 CB LYS 58 5.725 -17.826 1.037 0.049
1696 ATOM 108 CA LYS 59 9.515 -19.403 -2.720 0.004
1697 ATOM 109 CB LYS 59 8.674 -18.604 -4.907 0.008
1698 ATOM 110 CA LEU 60 13.137 -18.567 -1.894 0.004
1699 ATOM 111 CB LEU 60 14.578 -17.338 -2.045 0.029
1700 ATOM 112 CA GLU 61 12.581 -19.316 1.745 0.009
1701 ATOM 113 CB GLU 61 12.154 -17.148 2.360 0.008
1702 ATOM 114 CA GLU 62 11.100 -22.740 1.038 0.041
1703 ATOM 115 CB GLU 62 9.451 -23.636 -0.214 0.005
1704 ATOM 116 CA GLU 63 13.820 -23.517 -1.534 0.015
1705 ATOM 117 CB GLU 63 15.495 -23.834 -2.998 0.013
1706 ATOM 118 CA ILE 64 16.622 -22.512 0.780 0.013
1707 ATOM 119 CB ILE 64 16.823 -20.799 1.137 0.027
1708 ATOM 120 CA LYS 65 15.645 -25.371 3.146 0.002
1709 ATOM 121 CB LYS 65 13.313 -25.120 4.188 0.022
1710 ATOM 122 CA LYS 66 16.067 -28.042 0.394 0.012
1711 ATOM 123 CB LYS 66 13.783 -28.136 -0.792 0.022
1712 ATOM 124 CA LEU 67 19.186 -26.445 -1.045 0.000
1713 ATOM 125 CB LEU 67 20.695 -25.363 -0.719 0.023
1783 REMARK time 973.86 ENERGY -1.03122E+02
1784 HELIX 1 H1 ARG 2 LEU 20 1 18
1785 HELIX 2 H2 ARG 25 LEU 43 1 18
1786 HELIX 3 H3 GLU 48 LEU 66 1 18
1787 ATOM 1 CA GLY 1 3.285 2.991 0.582 0.021
1788 ATOM 2 CA SER 2 4.948 1.434 3.517 0.005
1789 ATOM 3 CB SER 2 5.451 2.158 4.295 0.010
1790 ATOM 4 CA ARG 3 3.805 -2.063 2.526 0.005
1791 ATOM 5 CB ARG 3 3.707 -5.054 3.209 0.005
1792 ATOM 6 CA VAL 4 6.820 -2.604 0.406 0.030
1793 ATOM 7 CB VAL 4 7.209 -2.072 -0.829 0.037
1794 ATOM 8 CA LYS 5 8.957 -2.056 3.497 0.038
1795 ATOM 9 CB LYS 5 9.226 0.445 3.568 0.032
1796 ATOM 10 CA ALA 6 6.868 -4.629 5.410 0.020
1797 ATOM 11 CB ALA 6 6.310 -4.301 5.624 0.084
1798 ATOM 12 CA LEU 7 7.213 -7.082 2.502 0.016
1799 ATOM 13 CB LEU 7 7.172 -7.649 0.628 0.006
1800 ATOM 14 CA GLU 8 10.957 -6.683 2.622 0.003
1801 ATOM 15 CB GLU 8 12.165 -5.029 1.659 0.027
1802 ATOM 16 CA GLU 9 10.998 -8.102 6.148 0.014
1803 ATOM 17 CB GLU 9 10.093 -7.420 8.114 0.035
1804 ATOM 18 CA LYS 10 10.508 -11.685 4.848 0.005
1805 ATOM 19 CB LYS 10 10.325 -14.042 5.781 0.073
1806 ATOM 20 CA VAL 11 13.520 -11.306 2.579 0.041
1807 ATOM 21 CB VAL 11 13.765 -10.321 1.683 0.049
1808 ATOM 22 CA LYS 12 15.497 -9.853 5.521 0.024
1809 ATOM 23 CB LYS 12 15.040 -8.172 7.314 0.011
1810 ATOM 24 CA ALA 13 14.499 -12.758 7.643 0.008
1811 ATOM 25 CB ALA 13 13.909 -12.742 8.186 0.085
1812 ATOM 26 CA LEU 14 15.174 -15.234 4.868 0.060
1813 ATOM 27 CB LEU 14 15.083 -16.027 3.083 0.007
1814 ATOM 28 CA GLU 15 18.763 -14.206 4.439 0.007
1815 ATOM 29 CB GLU 15 19.651 -13.899 2.409 0.021
1816 ATOM 30 CA GLU 16 19.332 -14.173 8.208 0.026
1817 ATOM 31 CB GLU 16 18.190 -13.374 9.970 0.021
1818 ATOM 32 CA LYS 17 18.416 -17.889 8.094 0.014
1819 ATOM 33 CB LYS 17 16.760 -19.849 8.253 0.012
1820 ATOM 34 CA VAL 18 20.651 -18.653 5.173 0.019
1821 ATOM 35 CB VAL 18 20.239 -18.238 3.935 0.022
1822 ATOM 36 CA LYS 19 23.668 -17.585 7.286 0.002
1823 ATOM 37 CB LYS 19 22.540 -16.509 9.259 0.011
1824 ATOM 38 CA ALA 20 22.421 -20.120 9.796 0.020
1825 ATOM 39 CB ALA 20 21.688 -20.222 10.045 0.030
1826 ATOM 40 CA LEU 21 22.591 -22.858 7.177 0.009
1827 ATOM 41 CB LEU 21 20.827 -23.631 6.862 0.039
1828 ATOM 42 CA GLY 22 26.349 -22.774 6.783 0.015
1829 ATOM 43 CA GLY 23 26.443 -25.331 3.957 0.013
1830 ATOM 44 CA GLY 24 28.220 -24.842 0.686 0.020
1831 ATOM 45 CA GLY 25 28.638 -22.543 -2.299 0.027
1832 ATOM 46 CA ARG 26 25.285 -23.343 -3.892 0.008
1833 ATOM 47 CB ARG 26 25.844 -25.593 -1.887 0.006
1834 ATOM 48 CA ILE 27 23.498 -21.351 -1.279 0.009
1835 ATOM 49 CB ILE 27 23.481 -21.293 0.464 0.011
1836 ATOM 50 CA GLU 28 25.323 -18.218 -2.519 0.005
1837 ATOM 51 CB GLU 28 26.446 -16.469 -3.421 0.011
1838 ATOM 52 CA GLU 29 23.353 -18.207 -5.786 0.023
1839 ATOM 53 CB GLU 29 22.671 -20.141 -6.787 0.056
1840 ATOM 54 CA LEU 30 20.140 -17.401 -3.853 0.024
1841 ATOM 55 CB LEU 30 19.710 -18.953 -2.757 0.035
1842 ATOM 56 CA LYS 31 21.825 -14.332 -2.440 0.027
1843 ATOM 57 CB LYS 31 22.943 -13.770 -0.266 0.004
1844 ATOM 58 CA LYS 32 22.837 -12.885 -5.863 0.011
1845 ATOM 59 CB LYS 32 23.955 -14.702 -7.266 0.038
1846 ATOM 60 CA LYS 33 19.222 -12.747 -6.851 0.010
1847 ATOM 61 CB LYS 33 18.462 -14.862 -8.118 0.032
1848 ATOM 62 CA TRP 34 18.123 -11.498 -3.398 0.003
1849 ATOM 63 CB TRP 34 17.794 -13.788 -2.208 0.008
1850 ATOM 64 CA GLU 35 19.811 -8.152 -3.975 0.006
1851 ATOM 65 CB GLU 35 22.017 -8.234 -3.629 0.004
1852 ATOM 66 CA GLU 36 17.921 -7.461 -7.135 0.018
1853 ATOM 67 CB GLU 36 17.120 -8.913 -8.746 0.011
1854 ATOM 68 CA LEU 37 14.560 -8.151 -5.491 0.013
1855 ATOM 69 CB LEU 37 14.240 -9.657 -4.358 0.021
1856 ATOM 70 CA LYS 38 15.245 -5.211 -3.199 0.012
1857 ATOM 71 CB LYS 38 16.460 -5.041 -0.955 0.002
1858 ATOM 72 CA LYS 39 16.284 -2.892 -5.965 0.003
1859 ATOM 73 CB LYS 39 18.219 -3.690 -7.458 0.005
1860 ATOM 74 CA LYS 40 12.904 -2.942 -7.724 0.022
1861 ATOM 75 CB LYS 40 12.376 -5.075 -8.989 0.008
1862 ATOM 76 CA ILE 41 10.859 -3.930 -4.698 0.014
1863 ATOM 77 CB ILE 41 11.059 -5.322 -3.534 0.010
1864 ATOM 78 CA GLU 42 10.265 -0.306 -3.629 0.021
1865 ATOM 79 CB GLU 42 10.804 1.810 -3.085 0.035
1866 ATOM 80 CA GLU 43 9.124 0.433 -7.169 0.013
1867 ATOM 81 CB GLU 43 10.735 -0.194 -8.547 0.037
1868 ATOM 82 CA LEU 44 6.148 -1.876 -6.757 0.008
1869 ATOM 83 CB LEU 44 6.688 -3.505 -7.589 0.024
1870 ATOM 84 CA GLY 45 4.330 0.749 -4.636 0.020
1871 ATOM 85 CA GLY 46 3.707 2.991 -7.635 0.006
1872 ATOM 86 CA GLY 47 3.045 0.243 -10.161 0.030
1873 ATOM 87 CA GLY 48 0.237 -1.696 -8.427 0.006
1874 ATOM 88 CA GLU 49 0.085 -3.851 -5.295 0.009
1875 ATOM 89 CB GLU 49 -1.520 -5.113 -4.348 0.006
1876 ATOM 90 CA VAL 50 2.995 -6.321 -4.993 0.055
1877 ATOM 91 CB VAL 50 4.037 -5.970 -4.146 0.020
1878 ATOM 92 CA LYS 51 1.803 -9.811 -3.954 0.034
1879 ATOM 93 CB LYS 51 -0.626 -10.469 -4.412 0.012
1880 ATOM 94 CA LYS 52 3.856 -11.248 -6.748 0.036
1881 ATOM 95 CB LYS 52 5.091 -9.718 -8.470 0.004
1882 ATOM 96 CA VAL 53 6.970 -10.288 -4.789 0.019
1883 ATOM 97 CB VAL 53 7.928 -9.397 -5.361 0.020
1884 ATOM 98 CA GLU 54 5.889 -11.874 -1.510 0.004
1885 ATOM 99 CB GLU 54 4.011 -10.756 -0.881 0.006
1886 ATOM 100 CA GLU 55 5.876 -15.210 -3.312 0.033
1887 ATOM 101 CB GLU 55 4.876 -16.010 -5.086 0.036
1888 ATOM 102 CA GLU 56 9.218 -14.534 -5.084 0.026
1889 ATOM 103 CB GLU 56 10.868 -13.524 -6.172 0.001
1890 ATOM 104 CA VAL 57 10.960 -14.000 -1.769 0.012
1891 ATOM 105 CB VAL 57 10.543 -12.652 -1.597 0.005
1892 ATOM 106 CA LYS 58 9.151 -17.078 -0.305 0.017
1893 ATOM 107 CB LYS 58 7.013 -15.932 -0.563 0.063
1894 ATOM 108 CA LYS 59 10.388 -19.261 -3.165 0.016
1895 ATOM 109 CB LYS 59 9.971 -18.229 -5.472 0.025
1896 ATOM 110 CA LEU 60 13.930 -18.348 -2.233 0.068
1897 ATOM 111 CB LEU 60 14.340 -16.853 -3.386 0.016
1898 ATOM 112 CA GLU 61 13.088 -20.151 0.996 0.029
1899 ATOM 113 CB GLU 61 12.049 -19.508 2.900 0.003
1900 ATOM 114 CA GLU 62 12.437 -23.450 -0.827 0.015
1901 ATOM 115 CB GLU 62 12.228 -24.403 -2.847 0.004
1902 ATOM 116 CA GLU 63 15.988 -23.034 -2.244 0.013
1903 ATOM 117 CB GLU 63 16.621 -21.941 -4.114 0.042
1904 ATOM 118 CA ILE 64 17.498 -22.898 1.261 0.024
1905 ATOM 119 CB ILE 64 16.995 -21.673 2.474 0.008
1906 ATOM 120 CA LYS 65 16.082 -26.350 2.037 0.001
1907 ATOM 121 CB LYS 65 13.648 -25.833 1.385 0.018
1908 ATOM 122 CA LYS 66 17.025 -27.671 -1.421 0.029
1909 ATOM 123 CB LYS 66 15.576 -27.541 -3.503 0.024
1910 ATOM 124 CA LEU 67 20.651 -26.594 -1.179 0.000
1911 ATOM 125 CB LEU 67 21.706 -25.996 0.377 0.031
projects / unres.git / blob