5-> [ALA A 6] PHI -170.1 -94.1 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.2 0.2 0.0 0.0 0.0 0.0 0.0 0.2 0.1 0.5 1.0 0.0 1.0 - 8 [ 0.0 .. 1.0] 12-> [ARG A 9] PSI 119.2 139.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 1.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 1.2] 14-> [ILE A 10] PSI 119.0 148.7 0.0 1.9 1.5 1.9 3.0 1.3 2.3 1.4 0.0 2.2 0.4 2.4 2.0 0.1 2.2 2.2 1.6 1.6 1.7 2.2 - 18 [ 0.0 .. 3.0] 20-> [ASP A 14] PSI 48.2 -167.2 0.0 0.0 0.0 0.0 0.0 0.0 2.4 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 .. 2.4] 22-> [LYS A 15] PSI 129.3 -178.8 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 0.9 1.3 0.0 0.5 2.2 0.7 1.5 - 6 [ 0.0 .. 2.2] 23-> [MET A 18] PHI -74.3 -54.3 0.0 0.0 0.0 0.0 1.2 0.5 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 1.2] 24-> [MET A 18] PSI -49.7 -28.9 1.7 0.0 2.1 0.0 0.8 0.0 2.3 1.8 2.6 2.1 1.7 1.9 0.0 1.6 0.0 0.0 0.0 1.0 1.1 0.0 - 12 [ 0.0 .. 2.6] 27-> [ASN A 20] PHI -76.0 -54.2 0.3 0.0 0.4 0.1 0.3 0.7 0.0 0.1 0.0 0.0 0.0 0.1 0.6 0.4 0.0 0.0 0.0 0.0 0.4 1.1 - 11 [ 0.0 .. 1.1] 28-> [ASN A 20] PSI -48.0 -28.0 0.5 0.7 0.6 1.4 0.7 1.3 0.0 0.1 0.0 0.3 0.0 0.0 0.0 0.0 0.7 0.0 0.1 0.0 0.7 1.5 - 12 [ 0.0 .. 1.5] 32-> [ILE A 22] PSI -51.9 -29.7 2.3 1.8 2.4 2.0 2.4 1.7 1.4 2.1 2.7 3.0 2.8 2.4 1.1 1.7 1.1 1.9 1.9 1.7 2.4 2.5 - 20 [ 1.1 .. 3.0] 34-> [THR A 23] PSI -49.9 -28.0 0.6 0.1 0.6 1.9 1.1 0.6 0.3 0.8 0.3 1.4 1.2 1.0 0.4 0.3 1.0 0.4 1.2 1.1 0.8 0.2 - 20 [ 0.1 .. 1.9] 42-> [SER A 27] PSI -51.1 -22.7 1.8 0.0 0.0 0.0 0.7 0.4 0.4 1.4 0.7 0.7 0.4 1.1 2.1 0.3 2.1 1.0 0.0 1.6 1.0 0.0 - 15 [ 0.0 .. 2.1] 54-> [VAL A 37] PSI 105.5 147.6 2.1 0.6 0.7 0.3 1.3 1.2 0.8 0.0 0.0 2.1 0.0 0.0 0.0 0.0 0.9 0.7 0.7 0.0 0.8 0.4 - 13 [ 0.0 .. 2.1] 55-> [LEU A 38] PHI -143.5 -94.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.1 1.1 0.0 1.6 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 2.1] 60-> [ALA A 40] PSI 101.7 157.7 0.0 0.0 0.0 0.0 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 - 1 [ 0.0 .. 1.5] 71-> [LEU A 49] PHI -150.5 -99.1 0.3 0.5 0.4 1.0 0.4 1.8 0.9 1.0 0.0 1.0 0.0 0.4 0.2 0.4 0.1 0.9 0.4 0.1 0.7 0.9 - 18 [ 0.0 .. 1.8] 85-> [LYS A 58] PHI -78.3 -58.3 0.0 0.4 0.0 0.1 0.0 0.0 0.9 1.1 0.0 0.9 1.1 0.3 0.0 0.0 1.0 0.4 0.0 0.6 0.0 0.0 - 10 [ 0.0 .. 1.1] 88-> [LEU A 59] PSI -47.2 -27.2 1.1 1.7 0.1 0.8 0.2 0.4 0.9 0.5 0.3 0.9 0.2 0.8 0.7 1.4 0.6 0.8 0.8 1.0 0.0 0.0 - 18 [ 0.0 .. 1.7] 90-> [THR A 60] PSI -48.5 -28.5 0.0 0.0 1.2 0.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.1 0.1 0.0 0.0 0.2 - 5 [ 0.0 .. 1.2] 96-> [MET A 63] PSI -53.6 -33.6 1.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 1.5] 98-> [ASP A 64] PSI -53.3 -33.3 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 0.0 1.0 0.0 0.0 - 1 [ 0.0 .. 1.0] 104-> [ARG A 67] PSI -53.6 -8.8 1.2 1.1 2.3 1.4 2.1 0.0 0.4 1.4 0.4 0.0 0.0 2.3 2.4 1.3 1.5 1.4 1.0 0.0 0.9 2.0 - 17 [ 0.0 .. 2.4] 105-> [LYS A 68] PHI -121.0 -72.8 1.3 1.4 1.7 0.0 2.1 0.4 0.0 0.3 0.0 1.6 0.0 0.8 2.0 0.5 0.1 1.2 0.1 1.1 0.1 0.7 - 16 [ 0.0 .. 2.1] 110-> [THR A 74] PSI 119.1 174.4 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 1.2 0.0 0.0 0.4 0.0 0.0 0.0 - 2 [ 0.0 .. 1.2] 112-> [VAL A 75] PSI 105.5 157.5 2.2 2.6 0.7 2.7 0.6 0.0 2.4 0.4 0.2 1.2 0.3 1.5 2.0 0.6 0.6 1.5 3.0 3.6 0.0 2.4 - 18 [ 0.0 .. 3.6] ---- 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 : 9 6 6 6 7 5 6 8 3 7 5 7 7 5 5 5 5 9 3 8 6.10 > 10. degrees : 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0.00 Total : 19 13 13 13 17 14 15 19 14 14 11 16 17 14 15 16 18 17 14 17 15.30 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 : 2.3 2.6 2.4 2.7 3.0 1.8 2.4 2.1 2.7 3.0 2.8 2.4 2.4 1.7 2.2 2.2 3.0 3.6 2.4 2.5 3.59 Max PHI Viol : 1.3 1.4 1.7 1.0 2.1 1.8 0.9 2.1 1.1 1.6 1.6 0.8 2.0 0.5 1.0 1.2 0.5 1.1 0.7 1.1 2.14 Max PSI Viol : 2.3 2.6 2.4 2.7 3.0 1.7 2.4 2.1 2.7 3.0 2.8 2.4 2.4 1.7 2.2 2.2 3.0 3.6 2.4 2.5 3.59 Average Violation : 0.2 0.1 0.1 0.1 0.1 0.1 0.2 0.1 0.1 0.2 0.1 0.1 0.2 0.1 0.1 0.1 0.1 0.2 0.1 0.2 0.128 Avge PHI Viol : 0.207 0.218 0.209 0.141 0.266 0.241 0.175 0.289 0.165 0.254 0.217 0.167 0.248 0.148 0.152 0.232 0.132 0.236 0.187 0.303 0.215 Avge PSI Viol : 0.533 0.432 0.458 0.475 0.477 0.361 0.520 0.442 0.366 0.494 0.362 0.516 0.498 0.403 0.459 0.422 0.460 0.524 0.417 0.481 0.458 RMS Violation : 0.502 0.431 0.456 0.457 0.512 0.332 0.511 0.433 0.375 0.523 0.377 0.492 0.491 0.328 0.398 0.391 0.414 0.534 0.361 0.514 0.446 RMS PHI Viol : 0.187 0.211 0.235 0.128 0.331 0.263 0.166 0.341 0.154 0.277 0.256 0.128 0.283 0.097 0.130 0.214 0.078 0.217 0.138 0.290 0.220 RMS PSI Viol : 0.684 0.572 0.601 0.633 0.644 0.390 0.703 0.508 0.507 0.686 0.467 0.683 0.634 0.454 0.548 0.510 0.580 0.724 0.492 0.667 0.592 Final --global-- Summary for 20 models, 116 ACOs/model, 2320 ACOs total ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Summ. Viol. : 296.99 Summ. Sq. Viol. : 462.26 Max. Viol. : 3.590 Avg. Viol. : 0.12801 RMS Viol. : 0.44637 Std. Dev. Viol. : 0.42762