1-> [GLU A 2] PHI -135.0 -88.2 4.4 10.6 4.6 8.5 5.5 0.0 3.0 12.9 2.3 3.5 11.0 0.0 12.5 0.0 12.2 17.3 17.2 3.7 0.0 2.5 - 16 [ 0.0 .. 17.3] 2-> [GLU A 2] PSI 118.4 177.5 0.0 0.0 0.0 48.0 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 .. 48.0] 3-> [PHE A 3] PHI -138.5 -113.7 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.3 0.0 1.6 0.0 0.0 - 3 [ 0.0 .. 3.3] 4-> [PHE A 3] PSI 84.0 156.0 0.8 0.0 3.3 0.0 1.7 0.0 0.0 2.0 0.0 2.6 0.0 0.0 0.3 0.0 1.6 0.0 0.0 0.0 0.0 0.3 - 8 [ 0.0 .. 3.3] 5-> [PRO A 4] PSI 136.4 172.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 9.9] 6-> [THR A 7] PHI -160.4 -113.3 42.6 24.9 0.0 0.0 0.0 19.5 0.0 0.0 0.0 10.9 0.0 27.8 13.4 23.5 24.9 11.1 0.0 25.4 0.0 19.7 - 11 [ 0.0 .. 42.6] 7-> [THR A 7] PSI 140.4 171.8 8.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 10.4 0.0 15.4 11.6 0.0 15.7 8.1 0.0 14.3 0.0 0.0 - 7 [ 0.0 .. 15.7] 8-> [VAL A 8] PHI -145.7 -121.4 10.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.5 4.7 13.9 0.0 1.6 7.1 15.7 3.5 11.5 0.0 0.0 - 9 [ 0.0 .. 15.7] 9-> [VAL A 8] PSI 149.2 165.2 12.2 11.8 0.0 6.3 7.4 5.6 9.3 9.1 9.2 14.2 1.4 17.5 6.1 5.5 6.4 14.3 1.6 9.3 8.7 5.4 - 19 [ 0.0 .. 17.5] 11-> [GLU A 9] PSI 118.3 146.2 0.0 0.0 0.0 0.0 0.0 4.0 1.1 0.0 0.0 0.0 4.0 0.0 0.0 0.0 3.9 6.0 3.9 0.0 3.9 4.0 - 8 [ 0.0 .. 6.0] 14-> [LYS A 11] PHI -143.9 -128.6 5.5 10.6 4.2 8.1 14.4 7.6 8.2 7.2 8.6 15.3 16.0 11.0 9.4 3.3 11.4 12.2 17.9 8.5 0.7 7.5 - 20 [ 0.7 .. 17.9] 16-> [VAL A 15] PHI -132.9 -95.8 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 0.0 0.0 0.0 - 1 [ 0.0 .. 1.5] 18-> [VAL A 16] PHI -135.6 -122.4 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 5.7 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 5.7] 19-> [VAL A 16] PSI 136.2 163.1 1.2 0.0 1.2 0.0 0.0 0.0 1.9 0.0 0.0 0.0 0.0 1.6 0.0 1.2 0.0 1.2 1.5 0.0 1.1 1.7 - 9 [ 0.0 .. 1.9] 23-> [ASN A 19] PSI 9.2 42.3 0.0 0.0 0.0 0.0 0.0 0.0 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 - 1 [ 0.0 .. 1.1] 24-> [LEU A 21] PHI -116.0 -65.3 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 2.4 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 2.4] 25-> [LEU A 21] PSI 117.6 140.7 0.0 25.7 3.3 27.1 0.0 0.0 24.8 7.6 23.6 22.6 0.0 25.9 0.0 2.1 26.7 2.5 22.9 22.7 0.0 2.4 - 14 [ 0.0 .. 27.1] 26-> [ALA A 22] PHI -135.7 -114.4 0.0 19.3 10.2 19.0 0.0 0.0 18.8 1.9 17.0 19.3 0.0 19.1 0.0 4.9 19.7 4.7 18.8 20.7 2.2 6.2 - 15 [ 0.0 .. 20.7] 27-> [ALA A 22] PSI 133.0 156.2 14.2 27.1 0.0 28.0 12.2 12.2 28.5 1.7 27.3 22.0 0.3 27.5 11.8 0.0 25.4 0.0 5.3 29.1 0.0 0.0 - 15 [ 0.0 .. 29.1] 28-> [GLU A 23] PHI -136.2 -100.7 7.4 16.6 0.0 22.3 17.1 14.9 23.0 11.3 21.6 18.4 8.6 27.3 14.2 0.0 22.1 1.2 0.0 15.6 0.0 0.0 - 15 [ 0.0 .. 27.3] 30-> [TYR A 24] PHI -141.9 -123.4 4.7 3.3 3.4 1.0 0.1 1.2 0.0 0.0 0.5 2.1 0.0 0.0 0.9 2.3 0.8 2.9 1.0 1.9 3.7 1.2 - 16 [ 0.0 .. 4.7] 31-> [TYR A 24] PSI 151.3 166.2 6.2 3.0 0.0 6.7 6.3 5.9 0.2 2.6 4.2 4.4 1.4 6.2 0.0 0.0 6.2 6.5 1.7 5.9 6.3 0.0 - 16 [ 0.0 .. 6.7] 32-> [GLU A 25] PHI -142.8 -122.0 12.1 0.0 0.0 8.2 0.0 11.9 0.0 5.0 2.5 0.0 0.0 0.0 0.0 0.0 8.1 0.0 0.0 11.7 10.1 0.0 - 8 [ 0.0 .. 12.1] 33-> [GLU A 25] PSI 128.1 157.9 0.0 13.1 0.0 7.1 11.6 0.0 0.0 0.0 7.0 13.1 13.1 0.0 0.0 0.0 8.6 12.0 15.9 5.8 4.0 0.0 - 11 [ 0.0 .. 15.9] 35-> [VAL A 26] PSI 115.1 130.4 7.9 5.7 2.3 14.2 0.6 5.4 8.7 8.1 6.5 3.0 0.0 6.1 13.6 7.4 13.2 5.2 0.0 2.2 4.2 6.0 - 18 [ 0.0 .. 14.2] 38-> [VAL A 28] PHI -124.1 -106.6 0.0 0.6 0.0 0.0 5.9 0.9 2.8 1.9 10.6 0.9 3.9 0.0 8.4 2.3 0.0 0.0 5.7 2.5 4.8 0.0 - 13 [ 0.0 .. 10.6] 39-> [VAL A 28] PSI 123.9 136.0 4.5 0.0 0.4 0.0 0.0 0.0 0.0 0.0 0.0 0.4 3.8 3.3 0.0 0.0 0.0 1.3 3.8 3.8 3.9 0.0 - 9 [ 0.0 .. 4.5] 40-> [LYS A 29] PHI -152.5 -109.9 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 7.5 0.0 0.0 0.0 0.0 0.0 6.2 0.0 3.9 0.0 - 4 [ 0.0 .. 7.5] 41-> [LYS A 29] PSI 139.1 164.2 6.6 6.3 0.0 0.0 0.0 6.7 0.0 0.0 0.0 0.0 0.0 9.9 3.5 8.1 6.3 0.0 0.0 9.4 0.0 3.7 - 9 [ 0.0 .. 9.9] 42-> [ASN A 30] PHI -143.0 -100.4 12.4 8.5 0.0 6.3 0.0 6.2 0.0 0.0 0.0 0.0 0.0 8.1 4.6 8.7 11.2 0.0 0.0 8.4 0.0 4.3 - 10 [ 0.0 .. 12.4] 43-> [ASN A 30] PSI 130.4 162.2 25.4 25.2 18.9 16.6 19.8 21.7 16.9 17.4 14.8 21.0 17.6 23.7 24.5 20.1 25.9 23.6 19.2 21.6 17.0 20.3 - 20 [ 14.8 .. 25.9] 44-> [GLY A 33] PHI 46.9 87.4 3.0 9.7 9.5 0.0 7.8 0.0 4.2 18.7 9.4 10.4 0.0 1.2 5.5 0.0 3.2 2.4 4.6 1.0 3.2 5.1 - 16 [ 0.0 .. 18.7] 45-> [GLY A 33] PSI 13.3 55.5 11.9 16.0 23.3 10.3 18.6 0.0 6.1 20.7 19.6 20.1 0.0 16.9 18.9 0.0 15.6 0.0 15.8 1.5 17.4 16.1 - 16 [ 0.0 .. 23.3] 46-> [ILE A 34] PHI -136.9 -108.4 0.0 6.0 0.0 0.0 0.0 13.9 13.2 0.0 0.0 0.0 6.6 0.0 0.0 6.2 0.0 17.7 0.0 14.8 0.5 0.0 - 9 [ 0.0 .. 17.7] 47-> [ILE A 34] PSI 133.9 162.0 13.2 23.4 18.9 10.0 20.8 3.5 2.8 14.1 19.3 20.1 7.0 21.4 18.4 3.5 18.8 3.6 29.9 3.2 18.4 10.1 - 20 [ 2.8 .. 29.9] 49-> [VAL A 36] PSI 114.4 154.0 11.7 9.0 4.0 13.8 4.1 0.9 5.3 7.0 10.3 8.8 5.2 5.6 5.2 5.3 1.7 0.0 4.6 0.0 7.2 6.5 - 18 [ 0.0 .. 13.8] 50-> [PRO A 37] PSI -28.8 -12.2 0.0 0.9 0.0 4.7 2.3 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 2.4 0.0 - 4 [ 0.0 .. 4.7] 51-> [SER A 38] PHI -111.9 -82.0 0.0 8.1 8.1 2.6 8.1 0.0 3.1 0.0 0.0 4.2 0.0 0.0 0.0 0.0 0.0 0.0 3.0 0.0 9.9 3.1 - 9 [ 0.0 .. 9.9] 52-> [SER A 38] PSI -20.9 5.0 58.1 45.0 45.1 37.9 45.1 1.0 30.0 5.4 4.5 35.8 0.0 4.6 0.0 0.0 0.3 34.9 35.8 11.8 46.8 35.5 - 17 [ 0.0 .. 58.1] 53-> [THR A 39] PHI -128.9 -96.1 1.2 12.2 12.6 7.2 8.3 41.3 25.7 41.1 39.9 25.5 38.2 40.6 40.7 40.1 40.2 11.2 14.6 36.4 9.4 26.2 - 20 [ 1.2 .. 41.3] 55-> [LYS A 40] PHI -121.2 -89.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 0.0 0.0 8.7 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 8.7] 56-> [LYS A 40] PSI 114.6 130.5 0.0 0.0 0.0 9.4 4.7 10.3 17.3 4.9 8.9 2.5 11.3 3.6 12.9 17.7 6.9 5.7 7.7 8.8 1.8 0.7 - 17 [ 0.0 .. 17.7] 57-> [VAL A 41] PHI -130.9 -104.9 0.0 0.0 0.0 5.1 0.0 0.0 6.8 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 - 2 [ 0.0 .. 6.8] 58-> [VAL A 41] PSI 119.2 139.1 6.1 0.0 0.0 0.0 0.0 0.0 0.0 3.1 0.0 0.0 0.2 0.0 0.0 0.0 0.0 0.0 4.0 0.0 0.3 0.0 - 5 [ 0.0 .. 6.1] 59-> [ARG A 42] PHI -141.1 -115.7 0.0 5.6 0.0 0.0 0.0 0.0 0.3 0.0 2.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.3 0.0 0.0 0.0 - 4 [ 0.0 .. 5.6] 60-> [ARG A 42] PSI 138.0 166.6 23.7 0.0 15.3 15.7 0.0 25.2 0.0 20.6 13.3 24.0 23.4 21.0 18.2 22.8 24.3 24.8 18.4 0.0 19.0 20.6 - 16 [ 0.0 .. 25.2] 61-> [VAL A 43] PHI -139.2 -122.2 25.6 6.6 19.4 22.6 7.7 28.8 11.5 22.8 20.9 24.6 23.3 26.7 18.8 24.2 25.0 23.0 20.5 3.2 19.8 24.9 - 20 [ 3.2 .. 28.8] 62-> [VAL A 43] PSI 120.7 146.8 10.8 11.6 8.4 11.8 9.4 12.4 17.5 11.9 15.3 18.0 13.6 13.9 10.4 7.9 13.0 7.1 10.7 1.2 5.7 8.9 - 20 [ 1.2 .. 18.0] 63-> [TYR A 44] PHI -137.5 -112.4 11.3 13.7 10.3 15.2 2.3 14.9 17.3 16.4 13.8 18.7 21.4 12.5 12.3 12.0 14.1 13.0 16.3 4.4 8.0 9.6 - 20 [ 2.3 .. 21.4] 64-> [TYR A 44] PSI 137.7 163.4 0.0 0.0 0.0 0.0 25.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.6 0.0 0.0 - 2 [ 0.0 .. 25.0] 66-> [ILE A 45] PSI 108.1 141.4 1.6 7.8 1.1 11.5 6.3 0.0 4.5 0.9 6.7 0.0 3.4 1.8 7.3 6.0 7.8 6.8 7.2 0.0 7.5 0.4 - 17 [ 0.0 .. 11.5] 67-> [ASN A 46] PHI 48.6 59.9 0.7 2.9 0.0 3.8 2.5 0.0 0.0 0.0 0.7 0.0 0.0 0.0 2.7 2.7 0.0 2.8 2.2 0.1 3.3 0.0 - 11 [ 0.0 .. 3.8] 68-> [ASN A 46] PSI 35.1 48.0 2.8 3.4 0.8 4.7 4.7 0.9 4.9 3.8 4.6 5.1 2.5 3.1 4.8 3.9 1.8 4.1 5.2 0.7 3.4 0.1 - 20 [ 0.1 .. 5.2] 69-> [THR A 48] PHI -113.7 -82.5 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 4.8 0.0 0.0 - 1 [ 0.0 .. 4.8] 70-> [THR A 48] PSI 117.6 152.5 2.6 0.7 0.0 6.0 1.9 0.0 1.9 0.0 3.2 0.0 1.3 0.0 2.7 2.5 5.3 3.5 0.0 0.0 2.7 0.9 - 13 [ 0.0 .. 6.0] 71-> [LEU A 49] PHI -81.6 -62.6 2.4 2.4 2.4 2.5 2.3 1.4 1.9 2.2 2.3 0.0 0.2 2.4 2.5 3.9 0.1 2.6 0.9 5.3 2.7 2.7 - 19 [ 0.0 .. 5.3] 72-> [LEU A 49] PSI 115.5 135.1 2.5 1.7 0.0 5.3 5.5 1.1 0.0 0.7 2.7 0.0 2.0 0.0 3.8 1.7 2.6 2.9 0.9 5.5 2.7 4.4 - 16 [ 0.0 .. 5.5] 73-> [TYR A 50] PHI -105.0 -83.0 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 9.8 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 9.8] 74-> [TYR A 50] PSI -42.6 -33.4 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 16.2 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 16.2] 76-> [LYS A 51] PSI 150.7 167.4 7.4 9.4 4.0 8.1 0.0 10.7 19.4 10.4 10.7 9.6 8.8 20.6 7.6 0.0 10.6 5.3 9.4 4.1 6.9 8.9 - 18 [ 0.0 .. 20.6] 77-> [ASN A 52] PHI -160.7 -124.6 0.0 0.0 0.0 0.0 0.0 0.0 27.0 0.0 0.0 0.0 0.0 35.8 0.0 0.0 4.1 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 35.8] 78-> [ASN A 52] PSI 136.4 166.7 0.0 0.0 0.0 0.0 0.0 0.0 6.8 0.0 0.0 0.0 0.0 14.0 4.7 0.0 13.2 0.0 0.0 0.1 0.0 0.0 - 5 [ 0.0 .. 14.0] 79-> [TRP A 53] PHI -154.6 -130.3 0.0 0.0 0.0 0.0 0.0 0.0 2.2 0.0 0.0 0.0 0.0 10.5 6.1 0.0 10.4 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 10.5] 80-> [TRP A 53] PSI 133.9 148.6 13.1 1.3 6.4 6.3 14.7 14.1 7.5 16.7 1.4 1.3 16.2 0.0 0.0 6.8 0.0 9.4 16.2 16.4 12.0 17.2 - 17 [ 0.0 .. 17.2] 81-> [THR A 54] PHI -131.2 -83.4 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 0.0 0.0 0.0 0.8 1.6 - 3 [ 0.0 .. 1.6] 82-> [THR A 54] PSI 120.6 150.1 2.3 0.8 9.0 10.2 0.0 0.0 0.0 0.0 0.0 2.6 0.0 0.0 0.0 0.0 0.0 11.1 0.5 1.1 1.2 1.4 - 10 [ 0.0 .. 11.1] 83-> [VAL A 55] PHI -147.1 -130.9 2.2 0.0 6.9 0.0 2.3 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 0.2 0.0 4.0 2.1 1.6 1.3 5.2 - 10 [ 0.0 .. 6.9] 84-> [VAL A 55] PSI 161.4 172.5 0.0 0.0 0.0 0.0 0.0 1.4 13.3 0.0 1.4 0.0 0.0 21.3 22.1 0.0 21.2 0.0 0.0 0.0 0.0 0.0 - 6 [ 0.0 .. 22.1] 85-> [SER A 56] PHI -134.2 -106.2 0.0 0.7 1.2 0.0 0.0 0.0 3.9 0.0 0.0 1.2 0.0 1.1 2.3 0.0 4.3 0.0 0.9 0.0 1.6 0.0 - 9 [ 0.0 .. 4.3] 86-> [SER A 56] PSI 134.1 153.7 9.4 12.7 11.9 7.8 12.9 3.1 16.6 18.6 13.8 11.9 19.8 16.5 17.6 15.2 13.5 1.0 14.1 9.5 11.7 12.6 - 20 [ 1.0 .. 19.8] 87-> [LEU A 57] PHI -148.0 -118.6 0.0 0.0 0.0 1.1 0.0 0.0 0.0 0.0 0.0 0.0 5.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 5.1] 88-> [LEU A 57] PSI 121.8 141.8 15.8 19.2 3.0 18.1 16.7 0.0 5.9 12.9 12.7 18.7 7.1 0.0 16.0 7.7 9.6 0.0 16.9 6.7 16.0 0.0 - 16 [ 0.0 .. 19.2] 90-> [GLU A 61] PSI 123.8 155.3 0.0 0.0 0.0 2.8 2.9 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 0.6 0.0 - 3 [ 0.0 .. 2.9] 91-> [GLU A 62] PHI -134.6 -104.7 0.0 0.0 10.4 0.0 6.8 0.0 0.0 6.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 9.7 0.0 - 4 [ 0.0 .. 10.4] 92-> [GLU A 62] PSI 126.5 153.6 0.0 0.0 0.0 14.1 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 4.8 - 2 [ 0.0 .. 14.1] 93-> [LYS A 63] PHI -145.1 -117.2 0.0 2.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.5 0.8 0.0 1.0 0.0 0.0 0.0 0.1 0.0 0.9 4.7 - 7 [ 0.0 .. 4.7] 94-> [LYS A 63] PSI 116.6 160.7 0.0 0.0 3.4 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 0.0 0.0 0.0 - 1 [ 0.0 .. 3.4] 95-> [VAL A 64] PHI -119.7 -101.4 0.0 0.0 0.0 5.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 6.1 5.8 0.0 4.9 0.0 0.0 0.0 0.0 2.1 - 5 [ 0.0 .. 6.1] 96-> [VAL A 64] PSI 114.0 125.5 0.2 0.0 0.2 1.6 0.0 0.0 1.6 0.0 0.0 0.0 0.0 9.6 4.8 0.0 10.4 0.5 0.0 0.0 0.0 0.0 - 8 [ 0.0 .. 10.4] 97-> [LEU A 65] PHI -113.7 -82.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 4.9 0.0 0.0 0.0 0.0 0.0 4.7 0.0 0.0 0.0 - 2 [ 0.0 .. 4.9] 98-> [LEU A 65] PSI 126.3 146.0 3.4 26.3 30.0 1.1 0.0 0.0 3.9 7.1 26.2 26.3 23.8 11.2 6.0 0.1 6.4 17.2 25.3 0.0 25.8 3.8 - 17 [ 0.0 .. 30.0] 99-> [THR A 66] PHI -137.9 -114.1 0.0 9.6 18.9 0.0 0.0 0.0 0.3 0.0 12.6 10.2 14.3 3.7 1.8 0.0 2.4 7.9 15.7 0.0 10.6 0.0 - 12 [ 0.0 .. 18.9] 100-> [THR A 66] PSI 147.5 170.5 0.0 17.4 0.0 0.0 11.6 0.0 0.0 0.0 0.0 15.3 0.0 19.3 0.0 0.0 0.0 9.2 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 19.3] 101-> [PHE A 67] PHI -159.2 -144.6 0.0 0.1 0.1 0.0 0.0 0.0 2.4 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 1.8 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 2.4] 102-> [PHE A 67] PSI 149.3 162.1 0.0 7.8 1.8 0.0 0.0 0.0 7.4 0.0 7.6 0.0 0.0 8.3 1.7 4.9 2.9 0.0 0.0 2.8 2.9 0.0 - 10 [ 0.0 .. 8.3] 103-> [SER A 68] PHI -140.7 -111.1 0.0 0.0 0.0 3.5 6.1 4.9 0.0 1.5 0.0 4.5 1.6 0.0 0.0 0.0 0.0 0.0 1.6 0.0 0.0 0.0 - 7 [ 0.0 .. 6.1] 104-> [SER A 68] PSI 115.7 156.1 19.7 5.6 0.0 6.8 5.7 6.0 3.8 0.0 6.7 0.1 0.0 0.0 6.1 0.0 12.8 0.0 0.0 14.9 0.0 0.0 - 11 [ 0.0 .. 19.7] 105-> [TRP A 69] PHI -150.5 -98.8 8.8 7.7 0.0 12.2 20.5 15.8 13.4 0.0 12.4 0.0 0.0 13.6 8.7 0.0 20.6 0.0 0.0 13.9 0.0 0.0 - 11 [ 0.0 .. 20.6] 106-> [TRP A 69] PSI 121.2 136.5 0.0 1.6 0.0 0.0 0.0 0.0 0.0 6.6 0.0 8.8 3.5 0.0 0.0 1.6 0.0 0.0 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 8.8] 108-> [THR A 70] PSI 101.7 126.1 2.5 0.0 1.6 1.1 24.4 24.7 1.4 5.4 1.2 1.5 2.6 4.6 11.7 0.0 0.5 0.0 0.0 0.0 0.0 3.0 - 14 [ 0.0 .. 24.7] 109-> [GLN A 73] PHI -142.9 -84.2 6.7 0.0 4.3 16.7 1.9 0.0 16.5 22.4 17.2 27.4 21.0 0.0 15.7 14.6 17.1 0.0 0.0 0.0 0.0 2.6 - 13 [ 0.0 .. 27.4] 110-> [GLN A 73] PSI 126.4 145.9 0.0 1.5 0.0 0.0 0.0 0.0 0.0 0.0 14.8 24.0 0.0 3.8 0.0 0.0 0.0 0.0 0.0 4.3 0.0 0.0 - 5 [ 0.0 .. 24.0] 111-> [GLU A 74] PHI -117.6 -58.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 11.9 0.0 0.8 14.9 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 14.9] 112-> [GLU A 74] PSI 112.4 149.6 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 20.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 1 [ 0.0 .. 20.4] 114-> [GLY A 75] PSI 160.4 -168.3 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.4 0.0 0.1 1.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 2.4] 115-> [MET A 76] PHI -99.0 -67.3 0.0 0.0 0.0 0.0 2.8 0.0 0.0 5.7 0.0 5.5 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 6.1] 118-> [TYR A 77] PSI 112.4 155.0 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 6.1 0.0 0.0 - 1 [ 0.0 .. 6.1] 119-> [ARG A 78] PHI -123.1 -92.9 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 0.0 0.0 7.0 0.0 0.0 - 1 [ 0.0 .. 7.0] 120-> [ARG A 78] PSI 111.4 125.1 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 1.2 0.0 0.0 - 1 [ 0.0 .. 1.2] 121-> [ILE A 79] PHI -115.9 -96.0 8.5 13.3 4.7 10.8 12.5 3.0 12.5 10.0 13.7 10.5 7.9 14.7 10.2 10.8 15.5 12.6 9.7 0.0 11.2 4.9 - 19 [ 0.0 .. 15.5] 124-> [ASN A 80] PSI 128.1 163.4 19.7 0.0 15.7 21.9 18.8 20.7 20.2 21.3 19.7 23.1 23.0 23.2 21.0 21.0 23.2 23.1 22.1 17.8 19.6 17.4 - 19 [ 0.0 .. 23.2] 125-> [ALA A 81] PHI -141.4 -112.6 18.3 0.0 16.3 15.9 16.4 20.2 17.2 17.5 17.8 17.0 17.6 18.3 18.9 17.7 18.4 16.2 17.3 15.9 17.6 17.5 - 19 [ 0.0 .. 20.2] 126-> [ALA A 81] PSI 133.6 160.6 28.6 8.4 22.2 20.1 17.9 28.4 24.8 25.0 28.6 22.0 23.5 29.1 28.7 29.0 28.5 25.5 26.5 6.5 28.0 28.2 - 20 [ 6.5 .. 29.1] 127-> [THR A 82] PHI -137.6 -123.8 20.5 0.0 14.2 21.0 9.8 25.0 17.5 16.6 21.4 12.3 19.1 19.6 24.6 26.4 22.3 23.7 18.3 0.0 23.6 22.4 - 18 [ 0.0 .. 26.4] 128-> [THR A 82] PSI 141.4 163.7 17.6 0.0 11.4 21.8 13.6 13.8 6.4 16.5 18.9 16.0 13.4 0.0 16.3 17.8 16.1 0.0 15.4 11.4 16.2 15.4 - 17 [ 0.0 .. 21.8] 129-> [VAL A 83] PHI -149.2 -101.8 0.0 0.0 0.0 10.7 0.0 0.0 0.0 0.0 2.3 0.0 0.0 0.0 0.0 0.0 5.8 0.0 3.5 0.0 0.0 0.0 - 4 [ 0.0 .. 10.7] 130-> [VAL A 83] PSI 142.3 170.8 16.8 10.0 10.9 12.6 18.3 9.8 3.8 11.8 14.3 12.1 14.9 8.7 11.4 15.3 19.5 7.5 21.2 17.4 17.3 13.5 - 20 [ 3.8 .. 21.2] 131-> [GLU A 85] PHI -64.3 -51.8 0.0 0.7 0.0 1.8 0.0 0.0 8.3 0.0 0.0 0.0 0.0 0.0 1.0 0.0 0.0 6.6 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 8.3] 132-> [GLU A 85] PSI -46.0 -33.9 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 13.5 15.1 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 15.1] 133-> [GLU A 86] PHI -92.3 -68.2 0.0 0.0 0.0 1.6 0.0 0.0 0.0 0.0 4.5 0.0 0.0 0.0 5.5 3.2 0.0 0.0 4.2 0.0 0.0 0.0 - 5 [ 0.0 .. 5.5] 134-> [GLU A 86] PSI -25.2 10.4 0.0 0.0 0.0 4.7 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 5.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 5.0] 136-> [VAL A 89] PSI 112.7 141.0 0.0 0.0 0.0 18.1 0.0 18.0 19.0 0.0 0.0 0.0 24.0 0.0 0.0 19.3 0.0 18.9 0.0 0.0 0.0 0.0 - 6 [ 0.0 .. 24.0] 137-> [VAL A 90] PHI -105.1 -84.0 15.0 9.2 8.9 0.0 9.7 0.0 0.0 6.5 11.9 9.0 0.0 4.9 9.7 7.2 13.5 0.0 11.2 10.9 15.2 7.2 - 15 [ 0.0 .. 15.2] 139-> [GLU A 91] PHI -141.9 -92.7 0.0 6.1 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 3.0 0.0 0.0 1.3 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 6.1] 140-> [GLU A 91] PSI 156.5 -165.6 6.7 7.5 0.0 0.0 0.0 0.0 5.8 0.0 7.2 0.0 0.0 0.0 0.0 26.9 0.0 0.0 6.6 0.0 6.4 0.0 - 7 [ 0.0 .. 26.9] 141-> [LEU A 92] PHI -85.3 -59.7 0.0 0.0 0.0 0.0 0.0 3.1 0.0 0.0 0.0 0.0 33.5 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 33.5] 142-> [LEU A 92] PSI -38.1 -16.2 0.0 18.7 0.0 0.0 0.0 5.0 0.0 4.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.5 - 4 [ 0.0 .. 18.7] 143-> [GLU A 94] PHI -129.0 -84.9 18.9 22.5 0.0 12.7 5.2 0.0 0.0 0.0 19.2 0.0 21.9 0.0 0.0 21.5 18.5 0.0 0.0 0.0 14.3 0.0 - 9 [ 0.0 .. 22.5] 144-> [GLU A 94] PSI -23.7 30.0 0.0 3.5 0.0 0.0 0.0 0.0 0.0 0.0 0.4 0.0 1.7 0.0 0.0 5.8 0.0 0.0 0.0 0.0 0.0 0.0 - 4 [ 0.0 .. 5.8] 145-> [ASN A 95] PHI -107.2 -64.5 0.0 12.8 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 7.4 0.0 0.0 0.0 0.0 - 2 [ 0.0 .. 12.8] 146-> [ASN A 95] PSI -42.5 16.7 0.0 22.9 2.8 0.0 8.7 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 - 3 [ 0.0 .. 22.9] 147-> [ASN A 96] PHI -113.2 -87.3 12.4 0.0 6.6 18.5 6.8 0.0 0.0 0.0 12.2 0.0 0.0 15.3 0.0 0.0 15.4 14.1 0.0 0.0 0.0 0.0 - 8 [ 0.0 .. 18.5] 148-> [ASN A 96] PSI -22.5 36.6 12.8 0.0 0.0 1.2 0.0 0.0 0.0 0.0 0.0 5.1 0.0 1.0 0.0 0.0 0.0 1.9 0.0 0.0 0.0 0.0 - 5 [ 0.0 .. 12.8] 150-> [VAL A 98] PSI 130.0 168.3 25.2 28.0 3.4 3.8 0.0 9.5 6.5 5.0 1.4 9.0 5.8 8.5 9.2 5.3 8.9 15.2 7.0 2.8 5.0 10.0 - 19 [ 0.0 .. 28.0] 151-> [ALA A 99] PHI -145.2 -114.9 18.5 0.0 0.3 4.8 0.0 19.9 5.0 0.4 5.8 0.3 14.8 0.4 15.1 14.4 12.3 5.3 17.2 0.0 14.7 16.4 - 17 [ 0.0 .. 19.9] 152-> [ALA A 99] PSI 115.8 142.5 0.0 0.0 1.7 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 .. 1.7] 153-> [THR A 100] PHI -128.2 -105.2 0.0 5.9 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 0.0 0.0 0.0 - 1 [ 0.0 .. 5.9] 156-> [PHE A 101] PSI 118.1 140.4 7.0 8.1 3.1 7.7 13.6 3.0 8.2 10.6 8.2 15.5 12.2 8.1 8.1 8.9 8.1 10.2 9.7 9.8 10.6 7.2 - 20 [ 3.0 .. 15.5] 157-> [ASP A 102] PHI -130.9 -93.7 9.1 6.8 9.3 8.5 15.3 7.9 4.3 8.2 6.1 9.7 8.5 7.2 8.9 6.2 5.5 6.5 8.8 15.5 7.2 11.8 - 20 [ 4.3 .. 15.5] 158-> [ASP A 102] PSI 118.4 136.9 0.0 4.0 0.0 7.6 10.7 0.0 3.4 9.4 2.8 0.0 12.6 2.5 9.0 8.5 3.0 5.9 8.9 4.5 8.4 0.0 - 15 [ 0.0 .. 12.6] 159-> [VAL A 103] PHI -128.7 -112.9 0.0 1.5 0.0 0.0 0.0 0.0 3.3 7.1 0.0 1.9 10.4 0.0 0.2 12.4 0.0 8.7 2.2 5.0 11.9 0.0 - 11 [ 0.0 .. 12.4] 160-> [VAL A 103] PSI 129.0 146.5 0.0 0.2 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 2.0 - 2 [ 0.0 .. 2.0] 162-> [SER A 104] PSI 114.1 144.9 2.0 0.0 3.4 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.1 0.0 0.0 0.0 0.0 1.6 4.2 - 5 [ 0.0 .. 4.2] 163-> [VAL A 105] PHI -112.8 -89.8 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.9 0.0 0.8 2.2 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 - 3 [ 0.0 .. 2.9] ---- 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 : 31 36 32 39 32 22 38 31 29 24 32 27 30 35 31 36 31 36 36 35 32.15 > 10. degrees : 30 27 19 32 24 23 24 25 32 35 29 33 28 22 39 25 27 22 24 18 26.90 Total : 64 71 60 72 60 49 65 59 64 69 65 61 64 60 74 63 64 62 66 59 63.55 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 : 58.1 45.0 45.1 48.0 45.1 41.3 30.0 41.1 39.9 35.8 38.2 40.6 40.7 40.1 40.2 34.9 35.8 36.4 46.8 35.5 58.12 Max PHI Viol : 42.6 24.9 19.4 22.6 20.5 41.3 27.0 41.1 39.9 27.4 38.2 40.6 40.7 40.1 40.2 23.7 20.5 36.4 23.6 26.2 42.61 Max PSI Viol : 58.1 45.0 45.1 48.0 45.1 28.4 30.0 25.0 28.6 35.8 24.0 29.1 28.7 29.0 28.5 34.9 35.8 29.1 46.8 35.5 58.12 Average Violation : 4.4 4.3 2.9 4.7 3.6 3.3 3.9 3.5 4.3 4.5 4.1 4.8 4.0 3.7 5.3 3.7 4.0 3.4 3.6 3.1 3.949 Avge PHI Viol : 1.856 1.784 1.512 1.851 1.556 1.789 1.826 1.786 1.943 1.847 2.070 2.042 1.854 1.854 2.230 1.766 1.751 1.750 1.648 1.599 1.823 Avge PSI Viol : 2.296 2.343 1.871 2.421 2.178 1.841 2.092 1.968 2.180 2.373 1.999 2.339 2.116 1.976 2.353 2.045 2.225 1.935 2.112 1.888 2.135 RMS Violation : 9.424 8.753 6.973 9.112 7.652 7.839 7.973 7.528 8.557 9.047 8.541 9.787 7.994 8.052 9.626 7.542 8.291 7.306 7.745 7.070 8.281 RMS PHI Viol : 8.014 6.446 5.165 6.943 5.270 8.247 7.324 7.652 8.262 7.487 9.081 9.669 7.666 8.145 9.581 6.554 6.562 7.206 5.920 6.355 7.481 RMS PSI Viol : 10.621 10.528 8.369 10.818 9.412 7.418 8.560 7.404 8.836 10.345 7.979 9.900 8.302 7.961 9.670 8.396 9.685 7.402 9.182 7.703 8.994 Final --global-- Summary for 20 models, 166 ACOs/model, 3320 ACOs total ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Summ. Viol. : 13110.49 Summ. Sq. Viol. : 227665.14 Max. Viol. : 58.122 Avg. Viol. : 3.94894 RMS Viol. : 8.28093 Std. Dev. Viol. : 7.27872