1 1IGD bench -2.350741E+02
2 SEED=-14385 ENERGY PDBOUT
3 WSC=1.00000 WSCP=1.54864 WELEC=0.20016 WANG=1.00572 WSCLOC=0.06764 &
4 WTOR=1.70537 WTORD=1.24442 WCORRH=0.91583 WCORR5=0.00607 WCORR6=0.02316 &
5 WEL_LOC=1.51083 WTURN3=2.00764 WTURN4=0.05345 WTURN6=0.05282 &
6 CUTOFF=7.00000 WCORR4=0.00000
8 D MET THR PRO ALA VAL THR THR TYR LYS LEU VAL ILE ASN GLY LYS THR LEU LYS GLY
9 GLU THR THR THR LYS ALA VAL ASP ALA GLU THR ALA GLU LYS ALA PHE LYS GLN TYR ALA
10 ASN ASP ASN GLY VAL ASP GLY VAL TRP THR TYR ASP ASP ALA THR LYS THR PHE THR VAL
14 91.6470 129.0917 107.0207 137.4279 94.4490 119.9641 135.2839 122.0634
15 124.2908 124.8161 125.2345 128.9969 97.1746 98.8032 94.7568 128.0136
16 127.6992 121.8948 135.8909 146.1227 123.0377 135.2580 130.3221 93.3822
17 117.4891 95.2519 107.5480 91.4600 91.7656 93.3985 91.0916 91.5421
18 91.9611 91.5472 92.4394 92.0069 91.5115 91.6783 90.9446 94.4910
19 96.8856 152.3961 104.1261 114.8292 94.9346 126.4944 123.4442 126.4998
20 117.7979 137.4342 115.5622 113.6268 91.1152 95.6776 125.4558 126.6483
21 132.1314 124.2232 133.1789 122.5268 120.2945
22 -7.3973 -91.1131 155.5604 -157.0358 30.6351 -161.6319 -167.4026 -160.8940
23 -151.2166 -130.0402 -148.9993 -161.0668 -67.6838 -12.3342 85.1196 -119.3336
24 -173.6187 -76.0964 -49.6961 -170.7987 -138.6580 -175.4524 -156.8055 39.4465
25 -171.5347 128.6436 -102.9778 57.3284 39.6954 46.0908 47.5083 42.8910
26 44.3017 45.4573 47.2476 43.3705 44.1536 59.8793 60.5250 34.4841
27 66.9715 -106.9111 -29.0558 -141.5658 140.9527 58.1587 -154.0736 -166.8524
28 -162.1449 -151.5630 -167.8526 -59.6967 -24.7732 97.2465 -131.1121 -166.6709
29 -151.8820 -168.9160 -171.2054 -132.9532
30 127.0510 112.4612 99.0100 169.4585 127.9530 165.5150 155.3287 141.1042
31 143.0106 161.2124 167.6309 157.3852 125.1071 172.5757 120.3411 172.0430
32 160.7722 143.8365 171.1067 147.0654 114.8669 139.4715 163.5172 116.0145
33 120.7671 95.6547 150.6249 131.9506 121.6611 96.2584 123.6816 116.6120
34 142.7429 126.8102 173.2144 133.5186 110.8624 112.3640 128.9793 87.8548
35 90.1261 114.6718 0.0000 163.1721 97.6486 0.0000 165.4165 140.0693
36 150.0124 136.8354 147.8414 148.6212 128.4691 142.0578 128.8893 153.0339
37 147.7676 166.3251 164.7234 176.1206 135.2365
38 -97.2720 -75.9072 -83.2283 -81.4106 -85.4799 -106.0160 -35.7311 -146.4352
39 -93.5445 154.2168 17.5346 126.5567 -115.2783 -70.4402 65.3768 -96.4617
40 0.4914 -104.5543 2.0644 28.8894 -135.7062 -80.8887 10.5846 22.2164
41 -111.5389 7.1847 -1.7598 -78.7869 -14.7052 -100.3909 -73.9781 134.8112
42 -75.9023 -75.5891 178.1378 -148.0398 -68.8958 -38.2914 -76.6902 -90.0650
43 -87.9734 -72.9189 0.0000 -148.6107 -93.6007 0.0000 178.6476 84.0190
44 39.8324 137.2136 165.7529 -1.4318 -75.5634 -74.1681 -55.9539 21.6463
45 -131.1708 -52.9743 -110.3616 -56.2043 -170.6528