13-> [SER A 9] PHI 180.0 -70.0 0.0 0.6 4.9 0.1 1.5 0.0 3.6 0.0 1.0 0.0 1.9 0.0 4.9 0.0 0.0 6.6 3.6 4.2 5.9 2.2 - 13 [ 0.0 .. 6.6] 44-> [ASP A 31] PSI -75.0 5.0 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 9.4 0.0 0.0 - 1 [ 0.0 .. 9.4] 47-> [GLN A 41] PHI -100.0 -30.0 0.0 0.0 0.0 0.0 0.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.7 0.0 0.0 0.0 - 2 [ 0.0 .. 17.7] 48-> [GLN A 41] PSI -75.0 5.0 0.0 0.0 0.0 0.0 11.9 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 .. 11.9] 53-> [GLU A 44] PHI -100.0 -30.0 0.0 0.0 1.5 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 .. 1.5] 61-> [LYS A 48] PHI -100.0 -30.0 0.0 0.0 0.0 0.0 0.0 0.0 20.0 7.2 0.0 0.0 0.0 0.0 0.0 0.0 6.9 1.4 10.0 0.0 12.3 15.8 - 9 [ 0.0 .. 20.0] 75-> [GLU A 62] PHI 180.0 -70.0 0.0 8.1 0.0 0.0 0.0 0.0 4.8 0.0 0.0 10.0 14.9 2.2 0.8 14.2 0.0 2.9 0.0 0.0 0.0 9.0 - 10 [ 0.0 .. 14.9] 85-> [ALA A 74] PHI 180.0 -70.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.6 0.0 0.0 0.0 0.0 11.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 11.0] 101-> [LEU A 109] PHI -100.0 -30.0 0.0 4.3 5.0 0.0 0.0 0.0 10.9 0.0 0.0 0.0 18.6 0.0 0.0 3.9 9.2 0.0 5.3 0.0 22.0 14.3 - 9 [ 0.0 .. 22.0] 102-> [LEU A 109] PSI -75.0 5.0 0.0 25.5 0.0 0.0 0.0 0.0 0.0 0.0 1.4 0.0 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 25.2 0.0 - 4 [ 0.0 .. 25.5] 105-> [ASP A 111] PHI -100.0 -30.0 0.0 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.6 0.0 0.0 0.0 0.0 0.0 6.1 2.5 10.0 8.4 7.3 0.9 - 9 [ 0.0 .. 10.0] 106-> [ASP A 111] PSI -75.0 5.0 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 13.7 0.0 20.0 0.0 18.8 0.0 - 3 [ 0.0 .. 20.0] 107-> [HIS A 112] PHI -100.0 -30.0 0.0 0.0 0.1 0.0 0.0 6.0 3.6 1.5 0.0 0.0 0.0 17.3 12.7 4.0 23.9 0.0 27.3 0.0 30.9 0.0 - 10 [ 0.0 .. 30.9] ---- 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 : 0 2 3 0 1 1 3 2 2 1 1 1 1 3 3 4 2 3 2 2 1.85 > 10. degrees : 0 1 0 0 1 0 2 0 0 0 2 1 1 2 2 0 5 0 5 2 1.20 Total : 0 4 4 2 5 1 5 2 4 2 3 2 3 6 6 4 7 4 7 5 3.80 Minimum Violation : 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 0.0 0.0 0.00 Maximum Violation : 0.0 25.5 5.0 0.2 11.9 6.0 20.0 7.2 2.6 10.0 18.6 17.3 12.7 14.2 23.9 6.6 27.3 9.4 30.9 15.8 30.89 Max PHI Viol : 0.0 8.1 5.0 0.2 1.5 6.0 20.0 7.2 2.6 10.0 18.6 17.3 12.7 14.2 23.9 6.6 27.3 8.4 30.9 15.8 30.89 Max PSI Viol : 0.0 25.5 0.0 0.0 11.9 0.0 0.0 0.0 1.4 0.0 0.0 0.0 0.0 1.1 13.7 0.0 20.0 9.4 25.2 0.0 25.53 Average Violation : 0.0 0.4 0.1 0.0 0.1 0.1 0.4 0.1 0.1 0.1 0.3 0.2 0.2 0.3 0.6 0.1 0.9 0.2 1.1 0.4 0.278 Avge PHI Viol : 0.000 0.491 0.461 0.067 0.214 0.333 0.891 0.401 0.278 0.430 0.810 0.601 0.584 0.785 0.924 0.500 1.170 0.482 1.206 0.884 0.661 Avge PSI Viol : 0.000 0.688 0.000 0.000 0.469 0.000 0.000 0.000 0.164 0.000 0.000 0.000 0.000 0.144 0.503 0.000 0.609 0.417 0.903 0.000 0.343 RMS Violation : 0.000 2.611 0.688 0.017 1.156 0.575 2.293 0.710 0.307 0.961 2.303 1.677 1.315 1.812 2.928 0.751 3.971 1.275 4.972 2.236 2.063 RMS PHI Viol : 0.000 1.252 0.974 0.024 0.233 0.813 3.243 1.004 0.386 1.359 3.258 2.372 1.860 2.557 3.698 1.062 4.911 1.273 5.579 3.162 2.497 RMS PSI Viol : 0.000 3.474 0.000 0.000 1.617 0.000 0.000 0.000 0.197 0.000 0.000 0.000 0.000 0.152 1.862 0.000 2.726 1.277 4.281 0.000 1.510 Final --global-- Summary for 20 models, 108 ACOs/model, 2160 ACOs total ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Summ. Viol. : 599.51 Summ. Sq. Viol. : 9193.40 Max. Viol. : 30.892 Avg. Viol. : 0.27755 RMS Viol. : 2.06306 Std. Dev. Viol. : 2.04430