1-> [THR A 8] PHI -132.1 -73.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.5 0.0 0.0 0.0 1.4 28.9 0.0 0.0 0.0 10.4 23.8 0.0 0.0 - 5 [ 0.0 .. 28.9] 2-> [THR A 8] PSI 119.2 160.8 4.1 0.0 0.0 5.5 0.0 0.2 0.0 26.0 0.0 0.0 0.0 0.0 0.0 19.0 4.2 0.0 11.4 25.5 0.0 0.0 - 8 [ 0.0 .. 26.0] 3-> [PHE A 9] PHI -172.7 -104.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.4 0.0 10.2 0.0 0.0 0.0 26.1 0.0 7.6 0.0 0.0 - 4 [ 0.0 .. 26.1] 4-> [PHE A 9] PSI 120.2 -169.2 0.0 0.0 0.0 0.0 31.0 0.0 0.0 0.0 0.0 7.3 0.0 9.4 31.6 0.0 0.0 0.0 15.2 10.5 31.3 0.0 - 7 [ 0.0 .. 31.6] 5-> [GLU A 10] PHI -160.5 -92.7 0.0 0.0 0.0 0.0 4.5 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 - 1 [ 0.0 .. 4.5] 6-> [GLU A 10] PSI 113.1 153.1 0.0 0.0 0.0 0.0 11.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.3 0.0 0.0 4.3 0.0 0.0 8.2 0.0 - 4 [ 0.0 .. 22.3] 8-> [ILE A 11] PSI 91.8 142.4 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 0.0 0.0 - 1 [ 0.0 .. 5.3] 10-> [GLU A 13] PSI 115.4 155.4 0.0 11.0 15.9 7.2 8.7 7.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.1 0.0 0.0 9.0 0.0 4.6 - 8 [ 0.0 .. 15.9] 11-> [HIS A 14] PHI -117.9 -72.5 0.0 0.0 31.8 0.3 0.0 17.6 0.0 0.0 0.0 8.0 0.0 0.0 8.4 4.2 8.4 0.0 0.0 1.1 0.0 0.0 - 8 [ 0.0 .. 31.8] 12-> [HIS A 14] PSI 77.1 143.5 0.0 3.5 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 0.0 0.0 0.0 3.0 - 3 [ 0.0 .. 3.5] 15-> [THR A 17] PHI -105.7 -65.7 7.5 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 4.9 0.0 0.0 2.1 4.5 0.0 0.0 0.0 6.9 7.2 14.1 - 8 [ 0.0 .. 14.1] 18-> [SER A 19] PSI 144.6 -175.4 0.0 0.0 10.6 3.7 0.0 0.0 1.6 0.0 1.1 0.0 0.0 7.2 0.0 1.2 0.0 2.1 0.0 2.1 0.0 0.0 - 8 [ 0.0 .. 10.6] 19-> [GLU A 20] PHI -154.6 -75.4 10.2 0.0 0.0 0.0 0.0 1.5 0.0 0.0 2.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 10.2] 20-> [GLU A 20] PSI 104.3 147.9 0.0 0.0 3.2 4.2 0.0 5.3 0.0 0.0 0.0 0.0 0.0 4.5 14.3 0.0 0.0 4.2 3.2 2.2 2.2 0.0 - 9 [ 0.0 .. 14.3] 21-> [ASN A 21] PHI -114.8 -74.8 0.0 0.0 0.0 0.0 0.0 40.0 0.0 6.3 0.0 0.0 15.2 0.0 3.3 0.0 0.0 0.0 0.0 44.5 0.0 0.0 - 5 [ 0.0 .. 44.5] 22-> [ASN A 21] PSI 125.8 -143.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.9 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9] 25-> [THR A 26] PHI -152.6 -87.4 0.0 0.0 0.0 32.5 0.0 0.0 0.0 0.0 26.1 0.0 13.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.0 - 4 [ 0.0 .. 32.5] 26-> [THR A 26] PSI 139.9 -178.3 7.9 2.3 18.5 20.3 24.2 14.9 16.3 20.5 10.9 12.6 4.2 1.6 9.8 7.7 23.4 19.0 14.9 24.3 21.6 40.4 - 20 [ 1.6 .. 40.4] 28-> [LYS A 27] PSI 116.3 166.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.5 0.6 - 3 [ 0.0 .. 10.5] 29-> [GLU A 28] PHI -169.2 -87.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.7 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 .. 3.7] 34-> [ASN A 30] PSI 138.4 -174.6 0.0 0.0 0.0 0.0 0.0 4.4 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 0.0 - 1 [ 0.0 .. 4.4] 39-> [SER A 33] PHI -140.7 -74.3 0.0 0.0 0.0 0.0 0.0 22.8 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 22.8] 40-> [SER A 33] PSI 102.5 146.7 0.0 0.0 0.0 0.0 0.0 5.1 13.3 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 - 2 [ 0.0 .. 13.3] 42-> [PHE A 34] PSI 83.9 154.1 0.0 0.0 0.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 0.0 3.9 9.5 0.0 0.0 5.8 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 25.0] 46-> [PHE A 41] PSI 115.4 168.6 0.0 5.6 6.3 0.0 0.0 0.0 0.0 8.7 0.0 0.0 16.1 0.0 12.2 9.0 0.0 0.0 0.0 0.0 1.7 2.2 - 8 [ 0.0 .. 16.1] 49-> [ILE A 43] PHI -147.1 -91.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 1.3 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 1.3] 50-> [ILE A 43] PSI 104.9 147.3 5.7 2.9 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 6.4 0.0 0.0 - 5 [ 0.0 .. 10.7] 51-> [ARG A 44] PHI -163.1 -112.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.7 0.0 0.0 0.0 12.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.3] 53-> [ALA A 45] PHI -155.9 -91.3 0.0 0.0 0.0 1.4 3.7 7.2 2.4 0.0 0.0 0.0 8.1 9.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.7 - 7 [ 0.0 .. 9.5] 54-> [ALA A 45] PSI 101.6 164.0 0.0 0.0 13.6 0.0 0.0 7.8 0.0 0.0 0.0 0.0 0.0 6.7 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 - 4 [ 0.0 .. 24.8] 55-> [TRP A 46] PHI -156.7 -108.7 0.0 0.0 23.7 11.3 23.7 30.2 3.8 0.0 0.0 0.0 0.0 0.0 0.0 3.7 0.0 2.4 1.3 44.4 0.0 28.7 - 10 [ 0.0 .. 44.4] 56-> [TRP A 46] PSI 125.7 -172.7 0.0 0.0 4.0 0.0 0.0 0.0 18.9 0.0 0.0 10.8 0.0 0.0 0.0 1.3 0.0 0.0 0.0 3.2 0.0 0.0 - 5 [ 0.0 .. 18.9] 57-> [ILE A 57] PHI -161.5 -121.5 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 14.6 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 14.6] 58-> [ILE A 57] PSI 127.8 169.6 2.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.8 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 10.8] 61-> [LEU A 59] PHI -151.0 -100.4 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 1.8 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.8] 63-> [ASN A 61] PHI -80.6 -40.6 0.0 0.0 0.0 8.8 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 1.4 0.5 0.0 - 3 [ 0.0 .. 8.8] 64-> [ASN A 61] PSI -58.7 -18.7 22.0 12.0 0.0 31.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.7 6.3 7.3 0.0 2.7 0.0 23.3 21.1 0.0 - 9 [ 0.0 .. 31.3] 65-> [GLU A 62] PHI -84.8 -44.8 30.2 28.5 20.6 34.0 0.0 15.1 0.0 0.0 0.0 0.6 0.0 23.2 21.4 23.4 0.0 25.5 13.9 28.3 19.6 0.0 - 13 [ 0.0 .. 34.0] 72-> [GLN A 65] PSI -62.1 -21.9 1.2 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 - 1 [ 0.0 .. 1.2] 75-> [MET A 67] PHI -82.9 -42.9 1.0 0.0 0.0 0.0 1.9 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 0.0 - 3 [ 0.0 .. 1.9] 76-> [MET A 67] PSI -66.0 -26.0 6.0 0.0 0.0 0.0 6.1 1.8 0.0 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 - 4 [ 0.0 .. 6.1] 79-> [ASP A 69] PHI -87.1 -47.1 0.0 0.0 0.0 0.0 0.0 7.8 0.0 0.0 7.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9] 83-> [PHE A 71] PHI -107.8 -37.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.1 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 14.1] 86-> [LYS A 72] PSI -59.2 7.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 8.4] 87-> [THR B 8] PHI -132.1 -73.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 18.5 0.0 0.0 0.0 1.4 28.9 0.0 0.0 0.0 10.4 23.8 0.0 0.0 - 5 [ 0.0 .. 28.9] 88-> [THR B 8] PSI 119.2 160.8 4.2 0.0 0.0 5.5 0.0 0.3 0.0 26.1 0.0 0.0 0.0 0.0 0.0 19.2 4.2 0.0 11.4 25.4 0.0 0.0 - 8 [ 0.0 .. 26.1] 89-> [PHE B 9] PHI -172.7 -104.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 17.4 0.0 10.1 0.0 0.0 0.0 26.1 0.0 7.6 0.0 0.0 - 4 [ 0.0 .. 26.1] 90-> [PHE B 9] PSI 120.2 -169.2 0.0 0.0 0.0 0.0 30.9 0.0 0.0 0.0 0.0 7.2 0.0 9.4 31.5 0.0 0.0 0.0 15.2 10.5 31.2 0.0 - 7 [ 0.0 .. 31.5] 91-> [GLU B 10] PHI -160.5 -92.7 0.0 0.0 0.0 0.0 4.3 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 - 1 [ 0.0 .. 4.3] 92-> [GLU B 10] PSI 113.1 153.1 0.0 0.0 0.0 0.0 11.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 22.2 0.0 0.0 4.3 0.0 0.0 8.1 0.0 - 4 [ 0.0 .. 22.2] 94-> [ILE B 11] PSI 91.8 142.4 0.0 5.2 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 .. 5.2] 96-> [GLU B 13] PSI 115.4 155.4 0.0 10.9 15.9 7.2 8.6 7.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.1 0.0 0.0 9.1 0.0 4.5 - 8 [ 0.0 .. 15.9] 97-> [HIS B 14] PHI -117.9 -72.5 0.0 0.0 31.9 0.3 0.0 17.6 0.0 0.0 0.0 7.9 0.0 0.0 8.4 4.1 8.2 0.0 0.0 1.1 0.0 0.0 - 8 [ 0.0 .. 31.9] 98-> [HIS B 14] PSI 77.1 143.5 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.0 - 3 [ 0.0 .. 3.6] 101-> [THR B 17] PHI -105.7 -65.7 7.5 0.0 0.0 0.0 8.8 0.0 0.0 0.0 0.0 5.0 0.0 0.0 2.2 4.4 0.0 0.0 0.0 6.8 7.3 14.1 - 8 [ 0.0 .. 14.1] 104-> [SER B 19] PSI 144.6 -175.4 0.0 0.0 10.6 3.7 0.0 0.0 1.7 0.0 1.1 0.0 0.0 7.3 0.0 1.2 0.0 2.1 0.0 2.2 0.0 0.0 - 8 [ 0.0 .. 10.6] 105-> [GLU B 20] PHI -154.6 -75.4 10.2 0.0 0.0 0.0 0.0 1.5 0.0 0.0 2.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 10.2] 106-> [GLU B 20] PSI 104.3 147.9 0.0 0.0 3.3 4.2 0.0 5.3 0.0 0.0 0.0 0.0 0.0 4.5 14.4 0.0 0.0 4.3 3.3 2.2 2.1 0.0 - 9 [ 0.0 .. 14.4] 107-> [ASN B 21] PHI -114.8 -74.8 0.0 0.0 0.0 0.0 0.0 40.0 0.0 6.3 0.0 0.0 15.2 0.0 3.2 0.0 0.0 0.0 0.0 44.5 0.0 0.0 - 5 [ 0.0 .. 44.5] 108-> [ASN B 21] PSI 125.8 -143.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.8 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.8] 111-> [THR B 26] PHI -152.6 -87.4 0.0 0.0 0.0 32.3 0.0 0.0 0.0 0.0 26.0 0.0 13.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.9 - 4 [ 0.0 .. 32.3] 112-> [THR B 26] PSI 139.9 -178.3 7.8 2.3 18.5 20.2 24.2 14.9 16.2 20.4 10.8 12.7 4.2 1.6 9.9 7.7 23.3 18.9 15.0 24.4 21.6 40.4 - 20 [ 1.6 .. 40.4] 114-> [LYS B 27] PSI 116.3 166.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.5 0.6 - 3 [ 0.0 .. 10.5] 115-> [GLU B 28] PHI -169.2 -87.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.8 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 .. 3.8] 120-> [ASN B 30] PSI 138.4 -174.6 0.0 0.0 0.0 0.0 0.0 4.4 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 0.0 - 1 [ 0.0 .. 4.4] 125-> [SER B 33] PHI -140.7 -74.3 0.0 0.0 0.0 0.0 0.0 22.6 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 22.6] 126-> [SER B 33] PSI 102.5 146.7 0.0 0.0 0.0 0.0 0.0 5.1 13.3 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 - 2 [ 0.0 .. 13.3] 128-> [PHE B 34] PSI 83.9 154.1 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 0.0 0.0 0.0 3.9 9.6 0.0 0.0 5.9 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 24.8] 132-> [PHE B 41] PSI 115.4 168.6 0.0 5.6 6.3 0.0 0.0 0.0 0.0 8.7 0.0 0.0 16.1 0.0 12.1 8.9 0.0 0.0 0.0 0.0 1.7 2.1 - 8 [ 0.0 .. 16.1] 135-> [ILE B 43] PHI -147.1 -91.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 1.4 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 1.4] 136-> [ILE B 43] PSI 104.9 147.3 5.7 2.8 0.0 0.0 0.0 10.8 0.0 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 6.4 0.0 0.0 - 5 [ 0.0 .. 10.8] 137-> [ARG B 44] PHI -163.1 -112.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.6 0.0 0.0 0.0 12.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.2] 139-> [ALA B 45] PHI -155.9 -91.3 0.0 0.0 0.0 1.5 3.8 7.3 2.3 0.0 0.0 0.0 8.0 9.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.8 - 7 [ 0.0 .. 9.4] 140-> [ALA B 45] PSI 101.6 164.0 0.0 0.0 13.6 0.0 0.0 7.8 0.0 0.0 0.0 0.0 0.0 6.6 0.0 0.0 0.0 0.0 0.0 0.0 24.8 0.0 - 4 [ 0.0 .. 24.8] 141-> [TRP B 46] PHI -156.7 -108.7 0.0 0.0 23.7 11.4 23.7 30.2 3.9 0.0 0.0 0.0 0.0 0.0 0.0 3.7 0.0 2.5 1.3 44.4 0.0 28.7 - 10 [ 0.0 .. 44.4] 142-> [TRP B 46] PSI 125.7 -172.7 0.0 0.0 4.0 0.0 0.0 0.0 18.9 0.0 0.0 10.8 0.0 0.0 0.0 1.3 0.0 0.0 0.0 3.2 0.0 0.0 - 5 [ 0.0 .. 18.9] 143-> [ILE B 57] PHI -161.5 -121.5 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 14.6 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 14.6] 144-> [ILE B 57] PSI 127.8 169.6 2.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 10.7] 147-> [LEU B 59] PHI -151.0 -100.4 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 1.7 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 1.7] 149-> [ASN B 61] PHI -80.6 -40.6 0.0 0.0 0.0 8.8 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 1.4 0.6 0.0 - 3 [ 0.0 .. 8.8] 150-> [ASN B 61] PSI -58.7 -18.7 22.0 12.0 0.0 31.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.7 6.4 7.3 0.0 2.8 0.0 23.5 21.0 0.0 - 9 [ 0.0 .. 31.3] 151-> [GLU B 62] PHI -84.8 -44.8 30.2 28.5 20.5 34.0 0.0 15.1 0.0 0.0 0.0 0.6 0.0 23.2 21.5 23.3 0.0 25.6 14.0 28.3 19.5 0.0 - 13 [ 0.0 .. 34.0] 158-> [GLN B 65] PSI -62.1 -21.9 1.1 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 0.0 0.0 - 1 [ 0.0 .. 1.1] 161-> [MET B 67] PHI -82.9 -42.9 1.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 1.9] 162-> [MET B 67] PSI -66.0 -26.0 6.0 0.0 0.0 0.0 6.0 2.0 0.0 0.0 4.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 6.0] 165-> [ASP B 69] PHI -87.1 -47.1 0.0 0.0 0.0 0.0 0.0 7.9 0.0 0.0 7.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 7.9] 169-> [PHE B 71] PHI -107.8 -37.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 14.2 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 14.2] 172-> [LYS B 72] PSI -59.2 7.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 8.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 8.4] ---- 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 : 14 10 6 12 12 18 6 6 14 8 4 22 18 20 6 12 4 18 8 6 11.20 > 10. degrees : 6 6 14 10 8 14 8 6 4 6 8 4 14 8 2 6 10 16 12 6 8.40 Total : 22 16 20 24 20 34 14 12 20 18 12 26 34 30 10 18 14 34 24 18 21.00 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 : 30.2 28.5 31.9 34.0 31.0 40.0 25.0 26.1 26.1 17.4 16.1 23.2 31.6 23.4 23.4 26.1 15.2 44.5 31.3 40.4 44.53 Max PHI Viol : 30.2 28.5 31.9 34.0 23.7 40.0 3.9 18.5 26.1 17.4 15.2 23.2 28.9 23.4 8.4 26.1 14.0 44.5 19.6 28.7 44.53 Max PSI Viol : 22.0 12.0 18.5 31.3 31.0 14.9 25.0 26.1 10.9 12.7 16.1 9.4 31.6 19.2 23.4 19.0 15.2 25.5 31.3 40.4 40.39 Average Violation : 1.1 0.8 1.7 1.9 1.4 2.3 0.9 1.0 0.7 0.8 0.8 1.0 2.4 1.3 0.5 1.1 0.8 3.1 1.7 1.1 1.328 Avge PHI Viol : 1.066 0.814 1.330 1.434 0.995 1.819 0.380 0.760 1.003 0.850 1.087 1.029 1.392 1.114 0.462 1.122 0.771 1.917 0.801 1.017 1.123 Avge PSI Viol : 1.074 0.995 1.295 1.294 1.372 1.158 1.321 1.170 0.632 0.947 0.686 1.015 1.684 1.144 0.858 0.943 1.021 1.575 1.679 1.085 1.182 RMS Violation : 4.465 3.675 5.861 6.748 5.341 6.998 4.095 4.271 3.252 3.016 3.326 3.480 6.621 4.165 2.748 4.554 3.231 9.319 6.025 5.594 5.114 RMS PHI Viol : 4.998 4.346 6.813 7.495 3.969 9.254 0.689 2.983 4.222 3.014 3.964 4.140 6.048 4.355 1.277 5.583 2.657 11.235 3.182 4.885 5.351 RMS PSI Viol : 3.858 2.851 4.719 5.908 6.426 3.507 5.750 5.253 1.823 3.017 2.531 2.662 7.149 3.964 3.670 3.211 3.718 6.889 7.904 6.223 4.865 Final --global-- Summary for 20 models, 172 ACOs/model, 3440 ACOs total ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Summ. Viol. : 4569.06 Summ. Sq. Viol. : 89961.11 Max. Viol. : 44.529 Avg. Viol. : 1.32822 RMS Viol. : 5.11385 Std. Dev. Viol. : 4.93835