1 REMARK CASP3 ff protein A -144.87053 min -144.8800 ENERGY -2.36753E+02
2 ATOM 1 CA GLN 1 3.800 0.000 0.000 0.000
3 ATOM 2 CB GLN 1 4.563 1.944 0.811 0.000
4 ATOM 3 CA GLN 2 4.008 -3.794 0.000 0.000
5 ATOM 4 CB GLN 2 4.813 -5.833 -0.462 0.000
6 ATOM 5 CA ASN 3 6.237 -3.800 -3.078 0.000
7 ATOM 6 CB ASN 3 5.528 -2.856 -4.279 0.000
8 ATOM 7 CA ALA 4 8.127 -0.899 -1.511 0.000
9 ATOM 8 CB ALA 4 7.845 -0.232 -1.346 0.000
10 ATOM 9 CA PHE 5 8.304 -2.926 1.698 0.000
11 ATOM 10 CB PHE 5 6.495 -2.418 3.022 0.000
12 ATOM 11 CA TYR 6 9.008 -5.979 -0.453 0.000
13 ATOM 12 CB TYR 6 9.155 -8.085 -1.762 0.000
14 ATOM 13 CA GLU 7 11.539 -3.854 -2.330 0.000
15 ATOM 14 CB GLU 7 11.231 -1.900 -3.410 0.000
16 ATOM 15 CA ILE 8 12.700 -2.638 1.078 0.000
17 ATOM 16 CB ILE 8 11.617 -1.259 1.360 0.000
18 ATOM 17 CA LEU 9 12.567 -6.291 2.117 0.000
19 ATOM 18 CB LEU 9 10.963 -6.124 3.194 0.000
20 ATOM 19 CA HIS 10 14.469 -6.925 -1.111 0.000
21 ATOM 20 CB HIS 10 13.140 -5.340 -1.543 0.000
22 ATOM 21 CA LEU 11 16.733 -4.080 -0.004 0.000
23 ATOM 22 CB LEU 11 16.556 -2.150 0.053 0.000
24 ATOM 23 CA PRO 12 17.006 -5.929 3.304 0.000
25 ATOM 24 CB PRO 12 16.309 -6.713 2.462 0.000
26 ATOM 25 CA ASN 13 20.803 -5.864 3.159 0.000
27 ATOM 26 CB ASN 13 21.037 -5.550 1.521 0.000
28 ATOM 27 CA LEU 14 20.798 -2.138 3.906 0.000
29 ATOM 28 CB LEU 14 20.071 -0.346 3.765 0.000
30 ATOM 29 CA ASN 15 21.314 -2.633 7.638 0.000
31 ATOM 30 CB ASN 15 22.362 -1.388 8.069 0.000
32 ATOM 31 CA GLU 16 17.978 -4.374 8.170 0.000
33 ATOM 32 CB GLU 16 17.423 -5.974 6.683 0.000
34 ATOM 33 CA GLU 17 17.475 -1.962 11.063 0.000
35 ATOM 34 CB GLU 17 18.698 -2.021 12.956 0.000
36 ATOM 35 CA GLN 18 18.244 0.852 8.627 0.000
37 ATOM 36 CB GLN 18 18.993 2.664 7.544 0.000
38 ATOM 37 CA ARG 19 15.982 -0.937 6.153 0.000
39 ATOM 38 CB ARG 19 14.661 -3.179 4.620 0.000
40 ATOM 39 CA ASN 20 13.512 -1.308 9.016 0.000
41 ATOM 40 CB ASN 20 13.688 -2.905 9.521 0.000
42 ATOM 41 CA GLY 21 14.220 2.347 9.781 0.000
43 ATOM 42 CA PHE 22 13.833 2.952 6.049 0.000
44 ATOM 43 CB PHE 22 14.975 1.749 4.457 0.000
45 ATOM 44 CA ILE 23 10.788 0.686 6.224 0.000
46 ATOM 45 CB ILE 23 10.693 -1.083 6.355 0.000
47 ATOM 46 CA GLN 24 9.738 2.774 9.220 0.000
48 ATOM 47 CB GLN 24 10.489 1.249 10.678 0.000
49 ATOM 48 CA SER 25 10.756 5.854 7.240 0.000
50 ATOM 49 CB SER 25 11.790 5.721 6.756 0.000
51 ATOM 50 CA LEU 26 9.074 4.185 4.269 0.000
52 ATOM 51 CB LEU 26 8.856 2.749 2.984 0.000
53 ATOM 52 CA LYS 27 6.092 3.539 6.534 0.000
54 ATOM 53 CB LYS 27 6.248 1.018 6.811 0.000
55 ATOM 54 CA ASP 28 6.441 7.080 7.866 0.000
56 ATOM 55 CB ASP 28 7.101 6.947 9.437 0.000
57 ATOM 56 CA ASP 29 7.072 8.309 4.326 0.000
58 ATOM 57 CB ASP 29 8.614 7.713 3.893 0.000
59 ATOM 58 CA PRO 30 4.688 5.880 2.637 0.000
60 ATOM 59 CB PRO 30 4.566 5.739 3.969 0.000
61 ATOM 60 CA SER 31 3.802 8.554 0.086 0.000
62 ATOM 61 CB SER 31 3.526 9.571 0.548 0.000
63 ATOM 62 CA GLN 32 7.485 9.246 -0.545 0.000
64 ATOM 63 CB GLN 32 9.511 8.349 -0.875 0.000
65 ATOM 64 CA SER 33 8.311 5.542 -0.738 0.000
66 ATOM 65 CB SER 33 7.501 4.793 -1.061 0.000
67 ATOM 66 CA ALA 34 9.939 6.095 -4.126 0.000
68 ATOM 67 CB ALA 34 9.582 6.290 -4.748 0.000
69 ATOM 68 CA ASN 35 11.713 9.168 -2.766 0.000
70 ATOM 69 CB ASN 35 11.288 10.294 -3.944 0.000
71 ATOM 70 CA LEU 36 12.617 7.061 0.265 0.000
72 ATOM 71 CB LEU 36 12.909 6.447 2.081 0.000
73 ATOM 72 CA LEU 37 13.389 4.245 -2.167 0.000
74 ATOM 73 CB LEU 37 11.988 2.925 -1.931 0.000
75 ATOM 74 CA ALA 38 15.464 6.876 -3.959 0.000
76 ATOM 75 CB ALA 38 15.190 7.491 -4.273 0.000
77 ATOM 76 CA GLU 39 16.803 7.796 -0.524 0.000
78 ATOM 77 CB GLU 39 16.828 9.158 1.272 0.000
79 ATOM 78 CA ALA 40 17.108 4.045 0.000 0.000
80 ATOM 79 CB ALA 40 16.552 3.553 -0.026 0.000
81 ATOM 80 CA LYS 41 18.892 3.968 -3.354 0.000
82 ATOM 81 CB LYS 41 17.060 2.893 -4.748 0.000
83 ATOM 82 CA LYS 42 20.772 7.059 -2.192 0.000
84 ATOM 83 CB LYS 42 21.019 9.305 -1.030 0.000
85 ATOM 84 CA LEU 43 21.173 5.352 1.179 0.000
86 ATOM 85 CB LEU 43 19.973 5.544 2.690 0.000
87 ATOM 86 CA ASN 44 22.077 2.221 -0.776 0.000
88 ATOM 87 CB ASN 44 20.513 1.601 -0.683 0.000
89 ATOM 88 CA ASP 45 24.512 4.458 -2.648 0.000
90 ATOM 89 CB ASP 45 23.629 5.858 -3.073 0.000
91 ATOM 90 CA ALA 46 25.725 5.965 0.623 0.000
92 ATOM 91 CB ALA 46 25.285 6.115 1.202 0.000