1-> [MET A 4] PHI 180.0 -70.0 0.0 0.0 7.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 7.1] 7-> [LYS A 7] CHI1 170.0 -170.0 101.9 99.7 98.5 0.0 0.0 100.8 100.1 0.0 0.0 0.0 0.0 101.2 0.0 98.7 103.4 0.0 0.0 98.5 0.0 0.0 - 9 [ 0.0 .. 103.4] 8-> [LYS A 7] CHI2 150.0 170.0 14.9 9.3 9.9 6.9 7.4 9.2 10.0 7.3 7.6 7.5 9.1 7.7 6.7 10.7 9.2 7.0 8.2 10.5 7.4 7.5 - 20 [ 6.7 .. 14.9] 9-> [LYS A 7] CHI3 40.0 60.0 121.0 116.2 119.4 119.4 118.2 118.4 123.2 118.9 118.5 118.8 118.1 117.3 119.1 119.2 119.4 119.1 118.8 123.9 118.1 119.1 - 20 [ 116.2 .. 123.9] 10-> [LYS A 17] UNKN 60.0 160.0 33.6 31.6 54.4 32.2 32.4 46.6 31.5 33.9 33.7 32.0 32.5 35.8 36.3 33.8 34.8 40.0 61.8 35.0 37.4 35.8 - 20 [ 31.5 .. 61.8] 12-> [ASP A 31] CHI1 -110.0 -50.0 42.2 116.6 118.6 48.9 0.0 0.0 45.6 0.0 116.0 118.8 44.7 118.7 119.5 117.8 42.3 0.0 39.3 53.8 50.1 116.4 - 16 [ 0.0 .. 119.5] 13-> [ASP A 31] CHI2 135.0 -165.0 143.3 122.3 120.4 127.5 147.1 145.5 133.0 145.6 123.9 120.5 142.6 121.2 120.0 119.6 141.8 147.4 141.2 97.1 97.1 120.8 - 20 [ 97.1 .. 147.4] 14-> [ARG A 10] PHI 180.0 -70.0 0.0 0.0 0.0 0.0 0.0 0.0 10.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.2 0.0 - 2 [ 0.0 .. 10.2] 22-> [THR A 14] PHI 180.0 -70.0 0.0 0.0 0.0 5.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.3] 23-> [THR A 14] PSI 60.0 180.0 0.0 4.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 4.8] 29-> [ASP A 21] PSI 60.0 180.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.9] 43-> [ILE A 39] PSI 60.0 180.0 1.4 0.0 0.0 0.0 1.8 0.0 0.9 0.0 0.0 0.0 0.1 0.0 0.6 0.0 0.0 1.9 0.0 0.0 0.0 0.0 - 6 [ 0.0 .. 1.9] ---- ACOSummary Of Residual ACO Constraint Violations ---- Mod 1 Mod 2 Mod 3 Mod 4 Mod 5 Mod 6 Mod 7 Mod 8 Mod 9 Mod 10 Mod 11 Mod 12 Mod 13 Mod 14 Mod 15 Mod 16 Mod 17 Mod 18 Mod 19 Mod 20 Averages ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~ ~~~~~~~~~~~ 1 - 10. degrees : 1 2 2 2 2 1 1 1 2 1 1 1 1 0 1 2 1 0 1 1 1.20 > 10. degrees : 6 5 5 4 3 4 6 3 4 4 4 5 4 6 5 3 4 6 5 4 4.50 Total : 7 7 7 6 5 5 8 4 6 5 6 6 6 6 6 5 5 6 6 5 5.85 Minimum Violation : -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.0 -569.00 Maximum Violation : 143.3 122.3 120.4 127.5 147.1 145.5 133.0 145.6 123.9 120.5 142.6 121.2 120.0 119.6 141.8 147.4 141.2 123.9 118.1 120.8 147.35 Max PHI Viol : 0.0 0.0 7.1 5.3 0.0 0.0 10.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.2 0.0 10.20 Max PSI Viol : 1.4 4.8 0.0 0.0 1.8 0.0 0.9 0.0 1.9 0.0 0.1 0.0 0.6 0.0 0.0 1.9 0.0 0.0 0.0 0.0 4.78 Max CHI1 Viol : 101.9 116.6 118.6 48.9 0.0 100.8 100.1 0.0 116.0 118.8 44.7 118.7 119.5 117.8 103.4 0.0 39.3 98.5 50.1 116.4 119.46 Max CHI2 Viol : 143.3 122.3 120.4 127.5 147.1 145.5 133.0 145.6 123.9 120.5 142.6 121.2 120.0 119.6 141.8 147.4 141.2 97.1 97.1 120.8 147.35 Average Violation : 10.7 11.6 12.3 7.9 7.1 9.8 10.6 7.1 9.3 9.2 8.1 11.7 9.4 11.6 10.5 7.3 8.6 9.7 7.4 9.3 9.464 Avge PHI Viol : 0.000 0.000 0.629 0.545 0.000 0.000 0.752 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.753 0.000 0.302 Avge PSI Viol : 0.280 0.515 0.000 0.000 0.318 0.000 0.226 0.000 0.328 0.000 0.070 0.000 0.185 0.000 0.000 0.325 0.000 0.000 0.000 0.000 0.193 Avge CHI1 Viol : 8.487 10.400 10.419 4.944 0.000 7.100 8.534 0.000 7.617 7.709 4.728 10.487 7.728 10.406 8.533 0.000 4.431 8.727 5.007 7.629 7.437 Avge CHI2 Viol : 8.894 8.113 8.070 8.197 8.790 8.795 8.456 8.746 8.108 7.998 8.708 8.027 7.958 8.072 8.687 8.786 8.643 7.333 7.227 8.010 8.294 RMS Violation : 33.648 35.146 35.962 28.119 29.223 33.274 32.762 29.159 32.008 31.929 29.496 35.483 32.067 35.244 33.454 29.551 30.307 30.003 25.265 31.869 31.816 RMS PHI Viol : 0.000 0.000 1.678 1.260 0.000 0.000 2.397 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 2.403 0.000 0.892 RMS PSI Viol : 0.331 1.126 0.000 0.000 0.428 0.000 0.217 0.000 0.456 0.000 0.021 0.000 0.145 0.000 0.000 0.448 0.000 0.000 0.000 0.000 0.319 RMS CHI1 Viol : 77.972 108.488 109.016 34.562 0.000 71.297 77.755 0.000 82.059 84.036 31.610 110.323 84.470 108.711 78.957 0.000 27.768 79.367 35.455 82.316 73.930 RMS CHI2 Viol : 101.875 86.755 85.388 90.282 104.161 103.109 94.327 103.114 87.780 85.344 101.009 85.867 84.960 84.910 100.453 104.312 100.041 69.051 68.832 85.605 91.969 Final --global-- Summary for 20 models, 43 ACOs/model, 860 ACOs total ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Summ. Viol. : 8139.24 Summ. Sq. Viol. : 870526.44 Max. Viol. : 147.352 Avg. Viol. : 9.46423 RMS Viol. : 31.81572 Std. Dev. Viol. : 30.37546