| 1 | E | 57.3 | Low | 70.1 | Confident | 195 Ų | 195 | 111.9 Ų | 111.9 | 91% | 0.911 | 67% | 0.671 | S | S | * | * | | | | 0 | 127.8 | 0 | -71.4 | 162.7 | 96.9 | 0 | 0 | 107.8 | | |
| 2 | A | 74.5 | Confident | 71.2 | Confident | 67 Ų | 67 | 116 Ų | 116 | 55% | 0.554 | 67% | 0.666 | S | S | * | * | | | trans | -71.3 | 134.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 109.1 | G4 A5 | A2-G4 VanDerWaalsContact O-N 3.07Å; A2-G4 PolarHBondContact O-N 3.3Å; A2-A5 WeakPolarHBondContact O-CB 3.36Å; A2-A5 PolarHBondContact O-N 3.33Å; A2-A5 HydrophobicContact CB-CB 4.47Å |
| 3 | P | 58.8 | Low | 72.1 | Confident | 139 Ų | 139 | 118.3 Ų | 118.3 | 90% | 0.903 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 113.6 | 176.8 | 25.3 | -31 | 0 | 0 | 0 | 108.8 | | |
| 4 | G | 67.1 | Low | 73.1 | Confident | 81 Ų | 81 | 111.9 Ų | 111.9 | 84% | 0.835 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 110.2 | -9.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | A2 | A2-G4 VanDerWaalsContact O-N 3.07Å; A2-G4 PolarHBondContact O-N 3.3Å |
| 5 | A | 69.8 | Low | 73.9 | Confident | 56 Ų | 56 | 109.4 Ų | 109.4 | 46% | 0.463 | 62% | 0.618 | S | S | . | * | S | Bend | trans | -72.8 | 133.9 | 164.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | A2 | A2-A5 WeakPolarHBondContact O-CB 3.36Å; A2-A5 PolarHBondContact O-N 3.33Å; A2-A5 HydrophobicContact CB-CB 4.47Å |
| 6 | P | 67.8 | Low | 74.9 | Confident | 107 Ų | 107 | 108.2 Ų | 108.2 | 70% | 0.695 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -53 | 139.4 | 169.5 | 23.2 | -31.3 | 0 | 0 | 0 | 107.8 | R8 | P6-R8 PolarHBondContact O-N 3.23Å; P6-R8 VanDerWaalsContact O-N 3.16Å |
| 7 | P | 69.4 | Low | 75.4 | Confident | 96 Ų | 96 | 109.6 Ų | 109.6 | 62% | 0.623 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 131.9 | 176 | 20.2 | -30.1 | 0 | 0 | 0 | 107 | T9 | P7-T9 PolarHBondContact O-N 2.77Š|
| 8 | R | 69.6 | Low | 76.1 | Confident | 218 Ų | 218 | 108.8 Ų | 108.8 | 82% | 0.823 | 60% | 0.6 | S | S | * | * | | | trans | -71.6 | 65.1 | 171.1 | -80.3 | -175.6 | 177.8 | 116.2 | -2.6 | 107.6 | P6 L10 | P6-R8 PolarHBondContact O-N 3.23Å; P6-R8 VanDerWaalsContact O-N 3.16Å; R8-L10 PolarHBondContact O-N 3.39Å; R8-L10 VanDerWaalsContact O-N 3.08Å |
| 9 | T | 77.3 | Confident | 76.5 | Confident | 100 Ų | 100 | 110.1 Ų | 110.1 | 61% | 0.613 | 60% | 0.595 | S | S | * | * | | | trans | -64 | 109.7 | 164.4 | -58.4 | 0 | 0 | 0 | 0 | 104.8 | P7 T11 | P7-T9 PolarHBondContact O-N 2.77Å; T9-T11 HydrophobicContact CG2-CG2 4.28Å; T9-T11 PolarHBondContact O-N 3.44Å |
| 10 | L | 75.4 | Confident | 76.8 | Confident | 104 Ų | 104 | 114 Ų | 114 | 55% | 0.545 | 60% | 0.602 | S | S | . | * | | | trans | -72.4 | 89.2 | 176.3 | -141.6 | 109.4 | 0 | 0 | 0 | 106.9 | R8 M15 | R8-L10 PolarHBondContact O-N 3.39Å; R8-L10 VanDerWaalsContact O-N 3.08Å; L10-M15 HydrophobicContact CD2-SD 4.36Å; L10-M15 HydrophobicContact CD2-CG 3.82Å; L10-M15 HydrophobicContact CD2-CE 3.36Å; L10-M15 HydrophobicContact CD2-CB 4.01Å |
| 11 | T | 83.9 | Confident | 77 | Confident | 68 Ų | 68 | 115.1 Ų | 115.1 | 42% | 0.417 | 61% | 0.608 | S | S | . | * | | | trans | -70.1 | 155.1 | 173.6 | 64.7 | 0 | 0 | 0 | 0 | 109 | T9 E13 A14 M15 | T9-T11 HydrophobicContact CG2-CG2 4.28Å; T9-T11 PolarHBondContact O-N 3.44Å; T11-E13 PolarHBondContact O-N 3.01Å; T11-A14 PolarHBondContact O-N 2.95Å; T11-A14 VanDerWaalsContact O-N 3.09Å; T11-A14 WeakPolarHBondContact OG1-CB 3.3Å; T11-A14 PolarHBondContact OG1-N 3.31Å; T11-A14 VanDerWaalsContact OG1-N 3.13Å; T11-M15 PolarHBondContact O-N 3.5Å |
| 12 | W | 83.3 | Confident | 77.8 | Confident | 161 Ų | 161 | 110.6 Ų | 110.6 | 61% | 0.61 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -53.9 | -42.6 | 175.3 | -179.6 | -99.7 | 0 | 0 | 0 | 111.4 | A14 M15 E16 | W12-A14 PolarHBondContact O-N 3.13Å; W12-M15 HydrophobicContact CZ3-SD 4.48Å; W12-M15 WeakPolarHBondContact O-CB 3.45Å; W12-M15 PolarHBondContact O-N 3.05Å; W12-M15 VanDerWaalsContact O-N 3.15Å; W12-E16 PolarHBondContact O-N 3.44Å; W12-E16 PolarHBondContact NE1-OE1 3.09Å; W12-E16 PolarHBondContact NE1-OE2 3.48Å |
| 13 | E | 83.6 | Confident | 76.9 | Confident | 146 Ų | 146 | 115.1 Ų | 115.1 | 68% | 0.682 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -61.5 | -43 | 175.5 | -62.8 | -172.9 | 89.2 | 0 | 0 | 112.8 | T11 M15 E16 Q17 | T11-E13 PolarHBondContact O-N 3.01Å; E13-M15 VanDerWaalsContact C-N 3.28Å; E13-M15 PolarHBondContact O-N 3.48Å; E13-E16 PolarHBondContact O-N 3.13Å; E13-Q17 WeakPolarHBondContact O-CG 3.39Å; E13-Q17 PolarHBondContact O-N 3Å |
| 14 | A | 84.9 | Confident | 77.9 | Confident | 28 Ų | 28 | 114 Ų | 114 | 23% | 0.231 | 61% | 0.612 | C | S | . | * | H | α-helix | trans | -64.8 | -34.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T11 W12 Q17 I18 | T11-A14 PolarHBondContact O-N 2.95Å; T11-A14 VanDerWaalsContact O-N 3.09Å; T11-A14 WeakPolarHBondContact OG1-CB 3.3Å; T11-A14 PolarHBondContact OG1-N 3.31Å; T11-A14 VanDerWaalsContact OG1-N 3.13Å; W12-A14 PolarHBondContact O-N 3.13Å; A14-Q17 PolarHBondContact O-N 3.29Å; A14-I18 WeakPolarHBondContact O-CD1 3.36Å; A14-I18 VanDerWaalsContact O-CG1 3.25Å; A14-I18 WeakPolarHBondContact O-CG1 3.25Å; A14-I18 PolarHBondContact O-N 3.06Å |
| 15 | M | 86.4 | Confident | 78.4 | Confident | 75 Ų | 75 | 115.7 Ų | 115.7 | 37% | 0.369 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -68.4 | -36.3 | 176.1 | -156.6 | -173.6 | -69.5 | 0 | 0 | 111.7 | L10 T11 W12 E13 R19 | L10-M15 HydrophobicContact CD2-SD 4.36Å; L10-M15 HydrophobicContact CD2-CG 3.82Å; L10-M15 HydrophobicContact CD2-CE 3.36Å; L10-M15 HydrophobicContact CD2-CB 4.01Å; T11-M15 PolarHBondContact O-N 3.5Å; W12-M15 HydrophobicContact CZ3-SD 4.48Å; W12-M15 WeakPolarHBondContact O-CB 3.45Å; W12-M15 PolarHBondContact O-N 3.05Å; W12-M15 VanDerWaalsContact O-N 3.15Å; E13-M15 VanDerWaalsContact C-N 3.28Å; E13-M15 PolarHBondContact O-N 3.48Å; M15-R19 PolarHBondContact O-NE 3.15Å; M15-R19 VanDerWaalsContact O-N 3.13Å; M15-R19 WeakPolarHBondContact O-CG 3.34Å; M15-R19 PolarHBondContact O-N 3.25Å |
| 16 | E | 89.4 | Confident | 78.9 | Confident | 90 Ų | 90 | 119 Ų | 119 | 42% | 0.421 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -66.6 | -42.5 | 172.9 | -74.4 | -179 | 122.6 | 0 | 0 | 112.5 | W12 E13 R19 Y20 | W12-E16 PolarHBondContact O-N 3.44Å; W12-E16 PolarHBondContact NE1-OE1 3.09Å; W12-E16 PolarHBondContact NE1-OE2 3.48Å; E13-E16 PolarHBondContact O-N 3.13Å; E16-R19 PolarHBondContact O-N 2.97Å; E16-Y20 PolarHBondContact O-N 2.95Å |
| 17 | Q | 83.3 | Confident | 79.5 | Confident | 133 Ų | 133 | 119.7 Ų | 119.7 | 62% | 0.621 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.5 | -41.8 | 176.3 | -72.6 | -177.3 | -22.1 | 0 | 0 | 112.6 | E13 A14 R19 Y20 L21 | E13-Q17 WeakPolarHBondContact O-CG 3.39Å; E13-Q17 PolarHBondContact O-N 3Å; A14-Q17 PolarHBondContact O-N 3.29Å; Q17-R19 VanDerWaalsContact C-N 3.34Å; Q17-R19 PolarHBondContact O-N 3.41Å; Q17-Y20 PolarHBondContact O-N 3.43Å; Q17-L21 WeakPolarHBondContact O-CG 3.49Å; Q17-L21 PolarHBondContact O-N 3.08Å; Q17-L21 VanDerWaalsContact O-CG 3.3Å |
| 18 | I | 87.3 | Confident | 80.2 | Confident | 94 Ų | 94 | 121.2 Ų | 121.2 | 48% | 0.482 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -63.2 | -41.8 | 176.1 | -68.5 | 162.3 | 0 | 0 | 0 | 110.9 | A14 Y20 L21 S22 | A14-I18 WeakPolarHBondContact O-CD1 3.36Å; A14-I18 VanDerWaalsContact O-CG1 3.25Å; A14-I18 WeakPolarHBondContact O-CG1 3.25Å; A14-I18 PolarHBondContact O-N 3.06Å; I18-Y20 VanDerWaalsContact C-N 3.35Å; I18-L21 PolarHBondContact O-N 3.01Å; I18-S22 PolarHBondContact O-N 3.16Å; I18-S22 PolarHBondContact O-OG 3.3Å |
| 19 | R | 84.3 | Confident | 80.9 | Confident | 134 Ų | 134 | 114.7 Ų | 114.7 | 51% | 0.506 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62.4 | -42.1 | 176 | -78.1 | -173.8 | -72.1 | 178.2 | -3.5 | 112 | M15 E16 Q17 S22 | M15-R19 PolarHBondContact O-NE 3.15Å; M15-R19 VanDerWaalsContact O-N 3.13Å; M15-R19 WeakPolarHBondContact O-CG 3.34Å; M15-R19 PolarHBondContact O-N 3.25Å; E16-R19 PolarHBondContact O-N 2.97Å; Q17-R19 VanDerWaalsContact C-N 3.34Å; Q17-R19 PolarHBondContact O-N 3.41Å; R19-S22 PolarHBondContact O-N 2.7Å |
| 20 | Y | 82.9 | Confident | 81.1 | Confident | 187 Ų | 187 | 115.8 Ų | 115.8 | 73% | 0.733 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -64.3 | -43.3 | 178.4 | -178.9 | -101.7 | 0 | 0 | 0 | 112.5 | E16 Q17 I18 S22 S23 | E16-Y20 PolarHBondContact O-N 2.95Å; Q17-Y20 PolarHBondContact O-N 3.43Å; I18-Y20 VanDerWaalsContact C-N 3.35Å; Y20-S22 PolarHBondContact O-N 2.86Å; Y20-S23 PolarHBondContact O-N 3.07Å |
| 21 | L | 81.8 | Confident | 81.6 | Confident | 138 Ų | 138 | 116.7 Ų | 116.7 | 72% | 0.723 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -70.9 | -9.7 | 179.5 | -69 | 169.3 | 0 | 0 | 0 | 114.2 | Q17 I18 | Q17-L21 WeakPolarHBondContact O-CG 3.49Å; Q17-L21 PolarHBondContact O-N 3.08Å; Q17-L21 VanDerWaalsContact O-CG 3.3Å; I18-L21 PolarHBondContact O-N 3.01Å |
| 22 | S | 72.9 | Confident | 81.4 | Confident | 100 Ų | 100 | 120.8 Ų | 120.8 | 70% | 0.699 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99 | 2.8 | -179.2 | -54.7 | 0 | 0 | 0 | 0 | 113.4 | I18 R19 Y20 | I18-S22 PolarHBondContact O-N 3.16Å; I18-S22 PolarHBondContact O-OG 3.3Å; R19-S22 PolarHBondContact O-N 2.7Å; Y20-S22 PolarHBondContact O-N 2.86Å |
| 23 | S | 56.8 | Low | 81.2 | Confident | 163 Ų | 163 | 117.1 Ų | 117.1 | 100% | 1.14 | 60% | 0.601 | S | S | * | * | | | trans | -107.4 | 0 | 173.6 | -176 | 0 | 0 | 0 | 0 | 111.1 | Y20 | Y20-S23 PolarHBondContact O-N 3.07Š|