| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.1 | Very low | 49.3 | Very low | 243 Ų | 243 | 116 Ų | 116 | 100% | 1.197 | 71% | 0.71 | S | S | * | * | 0 | 108.9 | 0 | -71.9 | 169.2 | 127.2 | 0 | 0 | 106.8 | S3 | M1-S3 PolarHBondContact O-N 3.12Š| |||
| 2 | A | 38.6 | Very low | 52.5 | Low | 105 Ų | 105 | 112.6 Ų | 112.6 | 87% | 0.868 | 69% | 0.69 | S | S | * | * | trans | -79.9 | 111.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 108.1 | A4 | A2-A4 PolarHBondContact O-N 3.41Å; A2-A4 VanDerWaalsContact O-N 3.12Å | ||
| 3 | S | 39.7 | Very low | 55.1 | Low | 118 Ų | 118 | 107.3 Ų | 107.3 | 83% | 0.825 | 66% | 0.657 | S | S | * | * | trans | -60.3 | 112.8 | 170.6 | -53.4 | 0 | 0 | 0 | 0 | 107.9 | M1 | M1-S3 PolarHBondContact O-N 3.12Š| ||
| 4 | A | 37.6 | Very low | 57.5 | Low | 86 Ų | 86 | 110.3 Ų | 110.3 | 71% | 0.711 | 66% | 0.66 | S | S | * | * | trans | -55.5 | 134.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | A2 A6 | A2-A4 PolarHBondContact O-N 3.41Å; A2-A4 VanDerWaalsContact O-N 3.12Å; A4-A6 PolarHBondContact O-N 2.78Å | ||
| 5 | P | 40.3 | Very low | 59.6 | Low | 113 Ų | 113 | 108.5 Ų | 108.5 | 73% | 0.734 | 64% | 0.642 | S | S | * | * | trans | -57.3 | 121.4 | 169.5 | 24.3 | -30 | 0 | 0 | 0 | 106.3 | Q7 | P5-Q7 VanDerWaalsContact C-N 3.35Å; P5-Q7 PolarHBondContact O-N 3.02Å | ||
| 6 | A | 44 | Very low | 61.5 | Low | 95 Ų | 95 | 101.8 Ų | 101.8 | 79% | 0.785 | 60% | 0.602 | S | S | * | * | trans | -52.1 | 105 | 174.1 | 0 | 0 | 0 | 0 | 0 | 106.8 | A4 Q8 | A4-A6 PolarHBondContact O-N 2.78Å; A6-Q8 VanDerWaalsContact C-N 3.35Å; A6-Q8 PolarHBondContact O-N 3.23Å | ||
| 7 | Q | 43.6 | Very low | 63.2 | Low | 188 Ų | 188 | 101.7 Ų | 101.7 | 88% | 0.879 | 59% | 0.589 | S | S | * | * | trans | -61.4 | 103.1 | -177.7 | -71.4 | 174.4 | -74.9 | 0 | 0 | 105.8 | P5 | P5-Q7 VanDerWaalsContact C-N 3.35Å; P5-Q7 PolarHBondContact O-N 3.02Å | ||
| 8 | Q | 51.5 | Low | 64.8 | Low | 139 Ų | 139 | 99.8 Ų | 99.8 | 65% | 0.65 | 58% | 0.579 | S | S | * | * | trans | -56.8 | 132.6 | 173.9 | -69.8 | 176.2 | -41.7 | 0 | 0 | 106.8 | A6 T10 | A6-Q8 VanDerWaalsContact C-N 3.35Å; A6-Q8 PolarHBondContact O-N 3.23Å; Q8-T10 VanDerWaalsContact C-N 3.3Å; Q8-T10 PolarHBondContact O-N 3.01Å | ||
| 9 | P | 56.2 | Low | 66.2 | Low | 57 Ų | 57 | 94.5 Ų | 94.5 | 37% | 0.37 | 55% | 0.548 | S | S | . | . | trans | -62.2 | 97.5 | 174.7 | 23 | -30.4 | 0 | 0 | 0 | 108.6 | L11 F71 | P9-L11 PolarHBondContact O-N 2.84Å; P9-F71 HydrophobicContact CG-CE2 4.38Å; P9-F71 HydrophobicContact CG-CZ 4.39Å | ||
| 10 | T | 66.3 | Low | 67.4 | Low | 117 Ų | 117 | 89.9 Ų | 89.9 | 72% | 0.718 | 52% | 0.521 | S | S | * | . | trans | -79.3 | 91.8 | 169.3 | 30.8 | 0 | 0 | 0 | 0 | 107.5 | Q8 | Q8-T10 VanDerWaalsContact C-N 3.3Å; Q8-T10 PolarHBondContact O-N 3.01Å | ||
| 11 | L | 82.1 | Confident | 68.6 | Low | 15 Ų | 15 | 87.2 Ų | 87.2 | 8% | 0.079 | 51% | 0.508 | C | S | . | . | trans | -61.3 | 138.9 | 164.1 | -62.6 | 177.7 | 0 | 0 | 0 | 108.8 | P9 Q15 V19 Y69 F71 F81 L84 Y88 | P9-L11 PolarHBondContact O-N 2.84Å; L11-Q15 HydrophobicContact CB-CB 3.99Å; L11-Q15 HydrophobicContact CD2-CB 4.08Å; L11-V19 HydrophobicContact CD1-CG2 3.94Å; L11-Y69 HydrophobicContact CD2-CD1 4.38Å; L11-F71 HydrophobicContact CD1-CE2 3.48Å; L11-F71 VanDerWaalsContact CD1-CE2 3.48Å; L11-F71 HydrophobicContact CD1-CZ 3.82Å; L11-F71 HydrophobicContact CD2-CE2 4.28Å; L11-F71 HydrophobicContact CG-CE2 3.75Å; L11-F71 HydrophobicContact CG-CZ 4.06Å; L11-F81 HydrophobicContact CD1-CD2 4.17Å; L11-F81 HydrophobicContact CD1-CE2 4.17Å; L11-L84 HydrophobicContact CB-CD1 4.36Å; L11-L84 HydrophobicContact CB-CD2 4.09Å; L11-L84 HydrophobicContact CD1-CD2 4.44Å; L11-Y88 WeakPolarHBondContact O-CE2 3.32Å; L11-Y88 PolarHBondContact O-OH 3.35Å | ||
| 12 | T | 87.9 | Confident | 71.1 | Confident | 75 Ų | 75 | 79.7 Ų | 79.7 | 46% | 0.46 | 47% | 0.47 | S | S | . | . | trans | -72.1 | 170.3 | 170.5 | 61.4 | 0 | 0 | 0 | 0 | 110.8 | E14 Q15 T16 | T12-E14 VanDerWaalsContact C-N 3.28Å; T12-E14 PolarHBondContact O-N 2.83Å; T12-Q15 PolarHBondContact O-N 3.31Å; T12-Q15 WeakPolarHBondContact OG1-CG 3.29Å; T12-Q15 PolarHBondContact OG1-N 3.24Å; T12-T16 WeakPolarHBondContact O-CB 3.38Å; T12-T16 PolarHBondContact O-N 2.77Å; T12-T16 PolarHBondContact O-OG1 3.47Å | ||
| 13 | V | 87.2 | Confident | 73.6 | Confident | 44 Ų | 44 | 74.7 Ų | 74.7 | 27% | 0.267 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -51.9 | -49.6 | 173.6 | 179.4 | 0 | 0 | 0 | 0 | 110.4 | Q15 T16 R17 Y88 D92 I95 | V13-Q15 PolarHBondContact O-N 3.47Å; V13-T16 WeakPolarHBondContact O-CB 3.13Å; V13-T16 PolarHBondContact O-N 3.3Å; V13-R17 WeakPolarHBondContact O-CB 3.47Å; V13-R17 PolarHBondContact O-N 3.21Å; V13-Y88 HydrophobicContact CB-CD1 4.43Å; V13-Y88 HydrophobicContact CG2-CD1 3.48Å; V13-Y88 VanDerWaalsContact CG2-CD1 3.48Å; V13-Y88 HydrophobicContact CG2-CE1 3.44Å; V13-Y88 VanDerWaalsContact CG2-CE1 3.44Å; V13-Y88 HydrophobicContact CG2-CG 4.28Å; V13-D92 HydrophobicContact CG1-CB 3.99Å; V13-I95 HydrophobicContact CG1-CD1 3.69Å |
| 14 | E | 88.7 | Confident | 76.1 | Confident | 149 Ų | 149 | 69.7 Ų | 69.7 | 70% | 0.696 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -61.9 | -45.4 | -179.7 | -60.8 | -173.1 | 96.9 | 0 | 0 | 112 | T12 T16 R17 V18 | T12-E14 VanDerWaalsContact C-N 3.28Å; T12-E14 PolarHBondContact O-N 2.83Å; E14-T16 VanDerWaalsContact C-N 3.34Å; E14-T16 PolarHBondContact O-N 3.19Å; E14-R17 WeakPolarHBondContact O-CB 3.41Å; E14-R17 PolarHBondContact O-N 3.25Å; E14-V18 WeakPolarHBondContact O-CG2 3.48Å; E14-V18 PolarHBondContact O-N 2.77Å |
| 15 | Q | 88.6 | Confident | 78.7 | Confident | 84 Ų | 84 | 71 Ų | 71 | 39% | 0.393 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -62.6 | -43.3 | 176.7 | -71.4 | -66.1 | -54.3 | 0 | 0 | 111.3 | L11 T12 V13 R17 V18 V19 | L11-Q15 HydrophobicContact CB-CB 3.99Å; L11-Q15 HydrophobicContact CD2-CB 4.08Å; T12-Q15 PolarHBondContact O-N 3.31Å; T12-Q15 WeakPolarHBondContact OG1-CG 3.29Å; T12-Q15 PolarHBondContact OG1-N 3.24Å; V13-Q15 PolarHBondContact O-N 3.47Å; Q15-R17 VanDerWaalsContact C-N 3.27Å; Q15-R17 PolarHBondContact O-N 3.25Å; Q15-V18 PolarHBondContact O-N 2.84Å; Q15-V19 WeakPolarHBondContact O-CB 3.41Å; Q15-V19 WeakPolarHBondContact O-CG2 3Å; Q15-V19 PolarHBondContact O-N 3.36Å |
| 16 | T | 89.9 | Confident | 81.2 | Confident | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -57.9 | -44 | 176.5 | -53.6 | 0 | 0 | 0 | 0 | 110.9 | T12 V13 E14 V19 L20 F81 L84 V85 Y88 I95 | T12-T16 WeakPolarHBondContact O-CB 3.38Å; T12-T16 PolarHBondContact O-N 2.77Å; T12-T16 PolarHBondContact O-OG1 3.47Å; V13-T16 WeakPolarHBondContact O-CB 3.13Å; V13-T16 PolarHBondContact O-N 3.3Å; E14-T16 VanDerWaalsContact C-N 3.34Å; E14-T16 PolarHBondContact O-N 3.19Å; T16-V19 PolarHBondContact O-N 3.06Å; T16-L20 VanDerWaalsContact O-CB 3.23Å; T16-L20 WeakPolarHBondContact O-CB 3.48Å; T16-L20 PolarHBondContact O-N 3.01Å; T16-F81 HydrophobicContact CG2-CE2 4.28Å; T16-L84 HydrophobicContact CG2-CD2 3.73Å; T16-L84 WeakPolarHBondContact OG1-CD2 3.32Å; T16-V85 HydrophobicContact CG2-CG2 3.78Å; T16-Y88 HydrophobicContact CG2-CD2 4.04Å; T16-Y88 WeakPolarHBondContact OG1-CD2 3.45Å; T16-Y88 WeakPolarHBondContact OG1-CE2 3.45Å; T16-I95 HydrophobicContact CG2-CD1 4.26Å |
| 17 | R | 90.6 | Very high | 83.4 | Confident | 101 Ų | 101 | 62.4 Ų | 62.4 | 38% | 0.381 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 178.6 | -161.7 | -177.1 | 97.3 | 148.1 | 14.6 | 112.4 | V13 E14 Q15 L20 S21 E94 I95 M98 | V13-R17 WeakPolarHBondContact O-CB 3.47Å; V13-R17 PolarHBondContact O-N 3.21Å; E14-R17 WeakPolarHBondContact O-CB 3.41Å; E14-R17 PolarHBondContact O-N 3.25Å; Q15-R17 VanDerWaalsContact C-N 3.27Å; Q15-R17 PolarHBondContact O-N 3.25Å; R17-L20 PolarHBondContact O-N 3Å; R17-S21 PolarHBondContact O-N 3.4Å; R17-S21 PolarHBondContact O-OG 2.77Å; R17-E94 WeakPolarHBondContact CD-OE1 3.35Å; R17-E94 WeakPolarHBondContact CG-OE1 3.48Å; R17-E94 IonicContact CZ-OE1 2.93Å; R17-E94 IonicContact CZ-OE2 3.5Å; R17-E94 IonicContact NE-OE1 2.69Å; R17-E94 PolarHBondContact NE-OE1 3.43Å; R17-E94 IonicContact NH1-OE1 3.02Å; R17-E94 PolarHBondContact NH1-OE1 3.02Å; R17-E94 IonicContact NH1-OE2 2.78Å; R17-E94 PolarHBondContact NH1-OE2 3.2Å; R17-E94 IonicContact NH2-OE1 3.57Å; R17-I95 HydrophobicContact CB-CD1 4.38Å; R17-I95 HydrophobicContact CB-CG1 4.14Å; R17-I95 HydrophobicContact CG-CG1 4.24Å; R17-M98 HydrophobicContact CG-CE 3.96Å; R17-M98 HydrophobicContact CG-SD 4.02Å |
| 18 | V | 91.6 | Very high | 85.5 | Confident | 67 Ų | 67 | 57.7 Ų | 57.7 | 41% | 0.406 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.2 | -51.9 | 174.8 | 173.2 | 0 | 0 | 0 | 0 | 110.1 | E14 Q15 L20 S21 E22 | E14-V18 WeakPolarHBondContact O-CG2 3.48Å; E14-V18 PolarHBondContact O-N 2.77Å; Q15-V18 PolarHBondContact O-N 2.84Å; V18-L20 VanDerWaalsContact C-N 3.28Å; V18-L20 PolarHBondContact O-N 2.79Å; V18-S21 WeakPolarHBondContact O-CB 3.34Å; V18-S21 PolarHBondContact O-N 2.84Å; V18-S21 VanDerWaalsContact O-N 3.16Å; V18-E22 HydrophobicContact CG1-CG 4.37Å; V18-E22 WeakPolarHBondContact O-CG 3.49Å; V18-E22 PolarHBondContact O-N 2.89Å |
| 19 | V | 91.4 | Very high | 87.5 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58.8 | -41.2 | 178.8 | 178.3 | 0 | 0 | 0 | 0 | 111.2 | L11 Q15 T16 E22 V23 V65 I66 Y69 F81 | L11-V19 HydrophobicContact CD1-CG2 3.94Å; Q15-V19 WeakPolarHBondContact O-CB 3.41Å; Q15-V19 WeakPolarHBondContact O-CG2 3Å; Q15-V19 PolarHBondContact O-N 3.36Å; T16-V19 PolarHBondContact O-N 3.06Å; V19-E22 PolarHBondContact O-N 3.16Å; V19-V23 HydrophobicContact CG1-CG2 4.41Å; V19-V23 WeakPolarHBondContact O-CB 3.26Å; V19-V23 VanDerWaalsContact O-CG2 3.24Å; V19-V23 WeakPolarHBondContact O-CG2 3.21Å; V19-V23 PolarHBondContact O-N 3.44Å; V19-V65 HydrophobicContact CG1-CG1 4.42Å; V19-I66 HydrophobicContact CG1-CG2 3.74Å; V19-Y69 HydrophobicContact CB-CE2 4.49Å; V19-Y69 HydrophobicContact CG1-CD2 4.38Å; V19-Y69 HydrophobicContact CG1-CE2 4.44Å; V19-Y69 HydrophobicContact CG2-CD1 3.49Å; V19-Y69 VanDerWaalsContact CG2-CD1 3.49Å; V19-Y69 HydrophobicContact CG2-CD2 3.72Å; V19-Y69 HydrophobicContact CG2-CE1 3.42Å; V19-Y69 VanDerWaalsContact CG2-CE1 3.42Å; V19-Y69 HydrophobicContact CG2-CE2 3.68Å; V19-Y69 HydrophobicContact CG2-CG 3.64Å; V19-F81 HydrophobicContact CB-CE2 3.86Å; V19-F81 HydrophobicContact CB-CZ 4.07Å; V19-F81 HydrophobicContact CG1-CD2 4.14Å; V19-F81 HydrophobicContact CG1-CE1 4.36Å; V19-F81 HydrophobicContact CG1-CE2 3.35Å; V19-F81 HydrophobicContact CG1-CZ 3.48Å; V19-F81 VanDerWaalsContact CG1-CZ 3.48Å |
| 20 | L | 91.1 | Very high | 89.1 | Confident | 1 Ų | 1 | 56.4 Ų | 56.4 | 1% | 0.005 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -66.6 | -39.6 | 179.4 | -152.6 | 69.6 | 0 | 0 | 0 | 111.7 | T16 R17 V18 V23 I24 F81 V85 I95 M98 L102 | T16-L20 VanDerWaalsContact O-CB 3.23Å; T16-L20 WeakPolarHBondContact O-CB 3.48Å; T16-L20 PolarHBondContact O-N 3.01Å; R17-L20 PolarHBondContact O-N 3Å; V18-L20 VanDerWaalsContact C-N 3.28Å; V18-L20 PolarHBondContact O-N 2.79Å; L20-V23 PolarHBondContact O-N 3.16Å; L20-I24 WeakPolarHBondContact O-CD1 3.07Å; L20-I24 VanDerWaalsContact O-CG1 3.25Å; L20-I24 WeakPolarHBondContact O-CG1 3.39Å; L20-I24 PolarHBondContact O-N 3.31Å; L20-F81 HydrophobicContact CB-CZ 4.43Å; L20-F81 HydrophobicContact CD1-CE1 3.68Å; L20-F81 HydrophobicContact CD1-CZ 3.64Å; L20-V85 HydrophobicContact CD1-CG1 4.1Å; L20-V85 HydrophobicContact CD1-CG2 3.63Å; L20-V85 HydrophobicContact CD2-CG1 4.14Å; L20-I95 HydrophobicContact CD2-CG2 4.13Å; L20-M98 HydrophobicContact CB-SD 4.29Å; L20-M98 HydrophobicContact CD2-CB 3.29Å; L20-M98 HydrophobicContact CD2-CG 4.41Å; L20-M98 HydrophobicContact CD2-SD 4.33Å; L20-M98 HydrophobicContact CG-CB 3.95Å; L20-L102 HydrophobicContact CD1-CD2 3.94Å |
| 21 | S | 92.4 | Very high | 90.4 | Very high | 35 Ų | 35 | 57.7 Ų | 57.7 | 25% | 0.245 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.1 | -46.9 | 172.8 | -68.6 | 0 | 0 | 0 | 0 | 111.4 | R17 V18 V23 I24 Q25 M98 | R17-S21 PolarHBondContact O-N 3.4Å; R17-S21 PolarHBondContact O-OG 2.77Å; V18-S21 WeakPolarHBondContact O-CB 3.34Å; V18-S21 PolarHBondContact O-N 2.84Å; V18-S21 VanDerWaalsContact O-N 3.16Å; S21-V23 VanDerWaalsContact C-N 3.31Å; S21-V23 PolarHBondContact O-N 2.99Å; S21-I24 PolarHBondContact O-N 3.45Å; S21-I24 VanDerWaalsContact O-N 3.16Å; S21-Q25 WeakPolarHBondContact O-CB 3.27Å; S21-Q25 WeakPolarHBondContact O-CG 3.48Å; S21-Q25 PolarHBondContact O-N 2.88Å; S21-M98 WeakPolarHBondContact OG-CE 3.45Å; S21-M98 PolarHBondContact OG-SD 3.35Å |
| 22 | E | 93.4 | Very high | 90.9 | Very high | 85 Ų | 85 | 58.1 Ų | 58.1 | 40% | 0.397 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -59.6 | -42.1 | 176.7 | -71.8 | -76.1 | 96.1 | 0 | 0 | 111.4 | V18 V19 Q25 A26 V65 | V18-E22 HydrophobicContact CG1-CG 4.37Å; V18-E22 WeakPolarHBondContact O-CG 3.49Å; V18-E22 PolarHBondContact O-N 2.89Å; V19-E22 PolarHBondContact O-N 3.16Å; E22-Q25 PolarHBondContact O-N 2.85Å; E22-A26 WeakPolarHBondContact O-CB 3.47Å; E22-A26 PolarHBondContact O-N 3.16Å; E22-V65 HydrophobicContact CB-CG1 3.63Å |
| 23 | V | 91.9 | Very high | 91.1 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.9 | -51.3 | 173.8 | 166.4 | 0 | 0 | 0 | 0 | 110.6 | V19 L20 S21 Q25 A26 F27 Q62 V65 F81 L102 | V19-V23 HydrophobicContact CG1-CG2 4.41Å; V19-V23 WeakPolarHBondContact O-CB 3.26Å; V19-V23 VanDerWaalsContact O-CG2 3.24Å; V19-V23 WeakPolarHBondContact O-CG2 3.21Å; V19-V23 PolarHBondContact O-N 3.44Å; L20-V23 PolarHBondContact O-N 3.16Å; S21-V23 VanDerWaalsContact C-N 3.31Å; S21-V23 PolarHBondContact O-N 2.99Å; V23-Q25 VanDerWaalsContact C-N 3.28Å; V23-Q25 PolarHBondContact O-N 2.63Å; V23-A26 WeakPolarHBondContact O-CB 3.35Å; V23-A26 PolarHBondContact O-N 3.2Å; V23-A26 VanDerWaalsContact O-N 3.1Å; V23-F27 HydrophobicContact CG1-CD2 4.1Å; V23-F27 HydrophobicContact CG1-CE2 3.71Å; V23-F27 WeakPolarHBondContact O-CD2 3.28Å; V23-F27 PolarHBondContact O-N 3.24Å; V23-F27 VanDerWaalsContact O-N 3.13Å; V23-Q62 HydrophobicContact CG1-CG 3.68Å; V23-V65 HydrophobicContact CG2-CB 3.81Å; V23-V65 HydrophobicContact CG2-CG1 3.81Å; V23-V65 HydrophobicContact CG2-CG2 4.26Å; V23-F81 HydrophobicContact CG2-CE1 4.37Å; V23-L102 HydrophobicContact CG1-CD1 3.67Å; V23-L102 HydrophobicContact CG1-CD2 3.88Å; V23-L102 HydrophobicContact CG1-CG 4.44Å |
| 24 | I | 91.6 | Very high | 91.3 | Very high | 13 Ų | 13 | 57.1 Ų | 57.1 | 7% | 0.067 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -61.5 | -39.2 | 179.7 | -67.4 | 163.1 | 0 | 0 | 0 | 111.1 | L20 S21 F27 S28 M98 K101 L102 L105 | L20-I24 WeakPolarHBondContact O-CD1 3.07Å; L20-I24 VanDerWaalsContact O-CG1 3.25Å; L20-I24 WeakPolarHBondContact O-CG1 3.39Å; L20-I24 PolarHBondContact O-N 3.31Å; S21-I24 PolarHBondContact O-N 3.45Å; S21-I24 VanDerWaalsContact O-N 3.16Å; I24-F27 PolarHBondContact O-N 3.45Å; I24-S28 PolarHBondContact O-N 3.38Å; I24-S28 PolarHBondContact O-OG 3.46Å; I24-M98 HydrophobicContact CD1-CB 3.86Å; I24-M98 HydrophobicContact CD1-CG 4.22Å; I24-K101 HydrophobicContact CG2-CD 4.22Å; I24-L102 HydrophobicContact CG1-CB 4.24Å; I24-L102 HydrophobicContact CG1-CD1 4.36Å; I24-L105 HydrophobicContact CG2-CD1 4.46Å |
| 25 | Q | 92.1 | Very high | 91.5 | Very high | 114 Ų | 114 | 54.6 Ų | 54.6 | 53% | 0.533 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -66.2 | -38.3 | 174.4 | -75 | -177.2 | -105.1 | 0 | 0 | 111.7 | S21 E22 V23 F27 S28 V29 | S21-Q25 WeakPolarHBondContact O-CB 3.27Å; S21-Q25 WeakPolarHBondContact O-CG 3.48Å; S21-Q25 PolarHBondContact O-N 2.88Å; E22-Q25 PolarHBondContact O-N 2.85Å; V23-Q25 VanDerWaalsContact C-N 3.28Å; V23-Q25 PolarHBondContact O-N 2.63Å; Q25-F27 VanDerWaalsContact C-N 3.27Å; Q25-F27 PolarHBondContact O-N 3.26Å; Q25-S28 CarbonylContact O-C 3.55Å; Q25-S28 WeakPolarHBondContact O-CA 3.26Å; Q25-S28 WeakPolarHBondContact O-CB 3.24Å; Q25-S28 PolarHBondContact O-N 3.36Å; Q25-V29 PolarHBondContact O-N 2.8Å |
| 26 | A | 92.6 | Very high | 91.5 | Very high | 13 Ų | 13 | 51.6 Ų | 51.6 | 11% | 0.107 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60 | -37.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | E22 V23 S28 V29 N32 I61 V65 | E22-A26 WeakPolarHBondContact O-CB 3.47Å; E22-A26 PolarHBondContact O-N 3.16Å; V23-A26 WeakPolarHBondContact O-CB 3.35Å; V23-A26 PolarHBondContact O-N 3.2Å; V23-A26 VanDerWaalsContact O-N 3.1Å; A26-S28 PolarHBondContact O-N 3.03Å; A26-V29 WeakPolarHBondContact O-CB 3.43Å; A26-V29 PolarHBondContact O-N 3.38Å; A26-N32 WeakPolarHBondContact O-CB 3.43Å; A26-N32 PolarHBondContact O-ND2 3.3Å; A26-I61 HydrophobicContact CB-CG2 3.66Å; A26-V65 HydrophobicContact CB-CG2 3.59Å |
| 27 | F | 90 | Very high | 91.5 | Very high | 14 Ų | 14 | 55.6 Ų | 55.6 | 6% | 0.061 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.3 | -23 | 171.4 | -78 | -80.1 | 0 | 0 | 0 | 113.9 | V23 I24 Q25 M36 A58 I61 Q62 L102 L105 L106 | V23-F27 HydrophobicContact CG1-CD2 4.1Å; V23-F27 HydrophobicContact CG1-CE2 3.71Å; V23-F27 WeakPolarHBondContact O-CD2 3.28Å; V23-F27 PolarHBondContact O-N 3.24Å; V23-F27 VanDerWaalsContact O-N 3.13Å; I24-F27 PolarHBondContact O-N 3.45Å; Q25-F27 VanDerWaalsContact C-N 3.27Å; Q25-F27 PolarHBondContact O-N 3.26Å; F27-M36 HydrophobicContact CD1-CE 3.96Å; F27-M36 HydrophobicContact CD1-CG 3.95Å; F27-M36 HydrophobicContact CD1-SD 4.13Å; F27-M36 HydrophobicContact CE1-CE 3.75Å; F27-M36 HydrophobicContact CE1-CG 4.13Å; F27-M36 HydrophobicContact CE1-SD 3.74Å; F27-A58 HydrophobicContact CE1-CB 3.83Å; F27-A58 HydrophobicContact CZ-CB 3.83Å; F27-I61 HydrophobicContact CD1-CD1 3.81Å; F27-I61 HydrophobicContact CD1-CG2 4.37Å; F27-I61 HydrophobicContact CD2-CG2 4.13Å; F27-I61 HydrophobicContact CE1-CB 4.16Å; F27-I61 HydrophobicContact CE1-CD1 3.6Å; F27-I61 HydrophobicContact CE1-CG1 4.49Å; F27-I61 HydrophobicContact CE1-CG2 4.25Å; F27-I61 HydrophobicContact CE2-CB 4.37Å; F27-I61 HydrophobicContact CE2-CG2 3.95Å; F27-I61 HydrophobicContact CG-CG2 4.28Å; F27-I61 HydrophobicContact CZ-CB 3.95Å; F27-I61 HydrophobicContact CZ-CD1 4.28Å; F27-I61 HydrophobicContact CZ-CG2 4.01Å; F27-Q62 HydrophobicContact CE2-CG 3.96Å; F27-Q62 HydrophobicContact CZ-CG 4.12Å; F27-L102 HydrophobicContact CD2-CD1 3.77Å; F27-L102 HydrophobicContact CE2-CD1 3.49Å; F27-L102 VanDerWaalsContact CE2-CD1 3.49Å; F27-L102 HydrophobicContact CZ-CD1 4.34Å; F27-L105 HydrophobicContact CB-CD1 4.22Å; F27-L106 HydrophobicContact CD1-CD2 4.32Å; F27-L106 HydrophobicContact CE1-CD2 3.49Å; F27-L106 VanDerWaalsContact CE1-CD2 3.49Å; F27-L106 HydrophobicContact CE2-CD2 4.32Å; F27-L106 HydrophobicContact CZ-CD2 3.52Å |
| 28 | S | 89.1 | Confident | 91.5 | Very high | 88 Ų | 88 | 57.2 Ų | 57.2 | 62% | 0.615 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -90.6 | -8.3 | 179 | -51.5 | 0 | 0 | 0 | 0 | 113.1 | I24 Q25 A26 | I24-S28 PolarHBondContact O-N 3.38Å; I24-S28 PolarHBondContact O-OG 3.46Å; Q25-S28 CarbonylContact O-C 3.55Å; Q25-S28 WeakPolarHBondContact O-CA 3.26Å; Q25-S28 WeakPolarHBondContact O-CB 3.24Å; Q25-S28 PolarHBondContact O-N 3.36Å; A26-S28 PolarHBondContact O-N 3.03Å |
| 29 | V | 92.6 | Very high | 91.4 | Very high | 63 Ų | 63 | 54.5 Ų | 54.5 | 38% | 0.382 | 30% | 0.302 | S | S | . | . | S | Bend | trans | -65.1 | 132.9 | 174.3 | 174.1 | 0 | 0 | 0 | 0 | 108.4 | Q25 A26 E31 N32 A33 | Q25-V29 PolarHBondContact O-N 2.8Å; A26-V29 WeakPolarHBondContact O-CB 3.43Å; A26-V29 PolarHBondContact O-N 3.38Å; V29-E31 HydrophobicContact CG1-CB 4.36Å; V29-E31 PolarHBondContact O-N 3.25Å; V29-E31 VanDerWaalsContact O-N 3.13Å; V29-N32 HydrophobicContact CB-CB 4.39Å; V29-N32 PolarHBondContact O-N 2.95Å; V29-A33 WeakPolarHBondContact O-CB 3.42Å; V29-A33 PolarHBondContact O-N 2.7Å |
| 30 | P | 91.2 | Very high | 91.2 | Very high | 107 Ų | 107 | 61 Ų | 61 | 70% | 0.695 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -54.5 | -38.1 | -173.2 | 18 | -32.2 | 0 | 0 | 0 | 113.6 | A34 | P30-A34 VanDerWaalsContact O-CB 3.29Å; P30-A34 WeakPolarHBondContact O-CB 3.36Å; P30-A34 PolarHBondContact O-N 2.96Å |
| 31 | E | 92.7 | Very high | 91.1 | Very high | 143 Ų | 143 | 67.5 Ų | 67.5 | 67% | 0.668 | 36% | 0.357 | S | S | * | . | H | α-helix | trans | -63.2 | -47 | 176.5 | -175.9 | 168.9 | 83.1 | 0 | 0 | 112.5 | V29 R35 | V29-E31 HydrophobicContact CG1-CB 4.36Å; V29-E31 PolarHBondContact O-N 3.25Å; V29-E31 VanDerWaalsContact O-N 3.13Å; E31-R35 WeakPolarHBondContact O-CG 3.06Å; E31-R35 PolarHBondContact O-N 2.91Å |
| 32 | N | 93.3 | Very high | 90.8 | Very high | 24 Ų | 24 | 69.1 Ų | 69.1 | 13% | 0.128 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -72.7 | -38.2 | 179.6 | -70.7 | -27.5 | 0 | 0 | 0 | 112.1 | A26 V29 R35 M36 I61 | A26-N32 WeakPolarHBondContact O-CB 3.43Å; A26-N32 PolarHBondContact O-ND2 3.3Å; V29-N32 HydrophobicContact CB-CB 4.39Å; V29-N32 PolarHBondContact O-N 2.95Å; N32-R35 PolarHBondContact O-N 3.24Å; N32-M36 WeakPolarHBondContact O-CG 3.33Å; N32-M36 PolarHBondContact O-N 3.27Å; N32-I61 HydrophobicContact CB-CD1 3.74Å; N32-I61 HydrophobicContact CB-CG1 4Å |
| 33 | A | 90.9 | Very high | 90.6 | Very high | 38 Ų | 38 | 65.1 Ų | 65.1 | 31% | 0.314 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.9 | -44.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | V29 R35 M36 D37 | V29-A33 WeakPolarHBondContact O-CB 3.42Å; V29-A33 PolarHBondContact O-N 2.7Å; A33-R35 PolarHBondContact O-N 2.7Å; A33-M36 PolarHBondContact O-N 3.13Å; A33-D37 WeakPolarHBondContact O-CB 3.46Å; A33-D37 PolarHBondContact O-N 2.95Å |
| 34 | A | 92.3 | Very high | 89.8 | Confident | 61 Ų | 61 | 69.8 Ų | 69.8 | 50% | 0.504 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | P30 M36 D37 E38 | P30-A34 VanDerWaalsContact O-CB 3.29Å; P30-A34 WeakPolarHBondContact O-CB 3.36Å; P30-A34 PolarHBondContact O-N 2.96Å; A34-M36 VanDerWaalsContact C-N 3.34Å; A34-M36 PolarHBondContact O-N 2.82Å; A34-D37 PolarHBondContact O-N 3.02Å; A34-E38 WeakPolarHBondContact O-CB 3.35Å; A34-E38 PolarHBondContact O-N 3.19Å |
| 35 | R | 91.7 | Very high | 88.9 | Confident | 96 Ų | 96 | 76.8 Ų | 76.8 | 36% | 0.362 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.2 | -40.1 | 176.3 | -67.9 | 174.2 | 71 | -176.5 | 2.9 | 112.7 | E31 N32 A33 A39 V57 | E31-R35 WeakPolarHBondContact O-CG 3.06Å; E31-R35 PolarHBondContact O-N 2.91Å; N32-R35 PolarHBondContact O-N 3.24Å; A33-R35 PolarHBondContact O-N 2.7Å; R35-A39 WeakPolarHBondContact O-CB 3.29Å; R35-A39 PolarHBondContact O-N 3.33Å; R35-A39 VanDerWaalsContact O-N 3.16Å; R35-V57 HydrophobicContact CB-CG1 3.8Å |
| 36 | M | 90.3 | Very high | 88.5 | Confident | 21 Ų | 21 | 75.1 Ų | 75.1 | 10% | 0.103 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -67.4 | -41.4 | 176.8 | -76.4 | -71.1 | -71.7 | 0 | 0 | 111.9 | F27 N32 A33 A34 R40 V54 V57 A58 I61 L106 | F27-M36 HydrophobicContact CD1-CE 3.96Å; F27-M36 HydrophobicContact CD1-CG 3.95Å; F27-M36 HydrophobicContact CD1-SD 4.13Å; F27-M36 HydrophobicContact CE1-CE 3.75Å; F27-M36 HydrophobicContact CE1-CG 4.13Å; F27-M36 HydrophobicContact CE1-SD 3.74Å; N32-M36 WeakPolarHBondContact O-CG 3.33Å; N32-M36 PolarHBondContact O-N 3.27Å; A33-M36 PolarHBondContact O-N 3.13Å; A34-M36 VanDerWaalsContact C-N 3.34Å; A34-M36 PolarHBondContact O-N 2.82Å; M36-R40 VanDerWaalsContact O-CB 3.26Å; M36-R40 WeakPolarHBondContact O-CB 3.45Å; M36-R40 PolarHBondContact O-N 2.86Å; M36-V54 HydrophobicContact CE-CG1 3.52Å; M36-V54 HydrophobicContact SD-CG1 3.93Å; M36-V57 HydrophobicContact CG-CG1 4.06Å; M36-V57 HydrophobicContact SD-CB 4.21Å; M36-V57 HydrophobicContact SD-CG1 3.8Å; M36-A58 HydrophobicContact CE-CB 4.34Å; M36-A58 HydrophobicContact SD-CB 4.06Å; M36-I61 HydrophobicContact CG-CD1 3.73Å; M36-I61 HydrophobicContact SD-CD1 4.14Å; M36-L106 HydrophobicContact CE-CD2 3.84Å |
| 37 | D | 89.4 | Confident | 87.8 | Confident | 83 Ų | 83 | 79.3 Ų | 79.3 | 44% | 0.444 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.1 | -47.7 | 179.3 | -158.9 | -121.8 | 0 | 0 | 0 | 111 | A33 A34 A39 R40 E41 | A33-D37 WeakPolarHBondContact O-CB 3.46Å; A33-D37 PolarHBondContact O-N 2.95Å; A34-D37 PolarHBondContact O-N 3.02Å; D37-A39 VanDerWaalsContact C-N 3.32Å; D37-A39 PolarHBondContact O-N 3.3Å; D37-R40 CarbonylContact O-C 3.56Å; D37-R40 WeakPolarHBondContact O-CA 3.49Å; D37-R40 WeakPolarHBondContact O-CB 3.27Å; D37-R40 PolarHBondContact O-N 3.47Å; D37-E41 WeakPolarHBondContact O-CG 3.35Å; D37-E41 PolarHBondContact O-N 3.34Å |
| 38 | E | 90.7 | Very high | 87.5 | Confident | 136 Ų | 136 | 80.3 Ų | 80.3 | 64% | 0.636 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -58.8 | -42.6 | 177 | -169.3 | -171.1 | 99.2 | 0 | 0 | 112 | A34 R40 S42 | A34-E38 WeakPolarHBondContact O-CB 3.35Å; A34-E38 PolarHBondContact O-N 3.19Å; E38-R40 VanDerWaalsContact C-N 3.31Å; E38-R40 PolarHBondContact O-N 3.38Å; E38-S42 VanDerWaalsContact O-CB 3.24Å; E38-S42 WeakPolarHBondContact O-CB 3.37Å; E38-S42 PolarHBondContact O-N 3.37Å; E38-S42 PolarHBondContact O-OG 3.21Å |
| 39 | A | 89.8 | Confident | 87.4 | Confident | 10 Ų | 10 | 81 Ų | 81 | 8% | 0.083 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -65 | -35.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R35 D37 A43 L53 V54 V57 | R35-A39 WeakPolarHBondContact O-CB 3.29Å; R35-A39 PolarHBondContact O-N 3.33Å; R35-A39 VanDerWaalsContact O-N 3.16Å; D37-A39 VanDerWaalsContact C-N 3.32Å; D37-A39 PolarHBondContact O-N 3.3Å; A39-A43 WeakPolarHBondContact O-CB 3.41Å; A39-A43 PolarHBondContact O-N 2.83Å; A39-L53 HydrophobicContact CB-CB 4.2Å; A39-V54 HydrophobicContact CB-CG2 4Å; A39-V57 HydrophobicContact CB-CG2 4.12Å |
| 40 | R | 85.8 | Confident | 87 | Confident | 136 Ų | 136 | 78.6 Ų | 78.6 | 51% | 0.513 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -74.9 | -41.6 | 179.4 | -172.6 | 176.6 | -176.5 | -145.6 | 1.2 | 111.9 | M36 D37 E38 A43 C44 M50 V54 | M36-R40 VanDerWaalsContact O-CB 3.26Å; M36-R40 WeakPolarHBondContact O-CB 3.45Å; M36-R40 PolarHBondContact O-N 2.86Å; D37-R40 CarbonylContact O-C 3.56Å; D37-R40 WeakPolarHBondContact O-CA 3.49Å; D37-R40 WeakPolarHBondContact O-CB 3.27Å; D37-R40 PolarHBondContact O-N 3.47Å; E38-R40 VanDerWaalsContact C-N 3.31Å; E38-R40 PolarHBondContact O-N 3.38Å; R40-A43 PolarHBondContact O-N 3.13Å; R40-C44 PolarHBondContact O-N 2.83Å; R40-M50 HydrophobicContact CG-CE 4.19Å; R40-V54 HydrophobicContact CB-CG2 4.11Å |
| 41 | E | 88.9 | Confident | 86.7 | Confident | 138 Ų | 138 | 77 Ų | 77 | 65% | 0.645 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -60.4 | -46.5 | 172 | -73 | -163.3 | 104.3 | 0 | 0 | 110.6 | D37 A43 C44 | D37-E41 WeakPolarHBondContact O-CG 3.35Å; D37-E41 PolarHBondContact O-N 3.34Å; E41-A43 VanDerWaalsContact C-N 3.25Å; E41-A43 PolarHBondContact O-N 3.1Å; E41-C44 PolarHBondContact O-N 3.44Å; E41-C44 VanDerWaalsContact O-N 3.07Å |
| 42 | S | 87.6 | Confident | 86.5 | Confident | 69 Ų | 69 | 77.3 Ų | 77.3 | 48% | 0.483 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.9 | -32 | 176.4 | -67.4 | 0 | 0 | 0 | 0 | 113.2 | E38 | E38-S42 VanDerWaalsContact O-CB 3.24Å; E38-S42 WeakPolarHBondContact O-CB 3.37Å; E38-S42 PolarHBondContact O-N 3.37Å; E38-S42 PolarHBondContact O-OG 3.21Å |
| 43 | A | 87.3 | Confident | 86.3 | Confident | 1 Ų | 1 | 79.6 Ų | 79.6 | 1% | 0.008 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -73.5 | -25.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A39 R40 E41 N45 D46 K49 M50 L53 | A39-A43 WeakPolarHBondContact O-CB 3.41Å; A39-A43 PolarHBondContact O-N 2.83Å; R40-A43 PolarHBondContact O-N 3.13Å; E41-A43 VanDerWaalsContact C-N 3.25Å; E41-A43 PolarHBondContact O-N 3.1Å; A43-N45 PolarHBondContact O-N 2.82Å; A43-D46 VanDerWaalsContact O-CB 3.24Å; A43-D46 WeakPolarHBondContact O-CB 3.35Å; A43-D46 PolarHBondContact O-N 3.01Å; A43-K49 HydrophobicContact CB-CB 3.77Å; A43-M50 HydrophobicContact CB-CB 4.21Å; A43-M50 HydrophobicContact CB-CG 3.44Å; A43-M50 VanDerWaalsContact CB-CG 3.44Å; A43-L53 HydrophobicContact CB-CD1 4.42Å |
| 44 | C | 76.4 | Confident | 86.2 | Confident | 97 Ų | 97 | 78 Ų | 78 | 66% | 0.655 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 45.7 | 57.9 | 172 | -171.9 | 0 | 0 | 0 | 0 | 114 | R40 E41 D46 | R40-C44 PolarHBondContact O-N 2.83Å; E41-C44 PolarHBondContact O-N 3.44Å; E41-C44 VanDerWaalsContact O-N 3.07Å; C44-D46 PolarHBondContact O-N 2.93Å |
| 45 | N | 71.8 | Confident | 86 | Confident | 160 Ų | 160 | 78.7 Ų | 78.7 | 86% | 0.856 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.4 | 0.7 | -176.6 | -78.8 | -73.5 | 0 | 0 | 0 | 116.6 | A43 M47 | A43-N45 PolarHBondContact O-N 2.82Å; N45-M47 PolarHBondContact O-N 3.4Å |
| 46 | D | 84.4 | Confident | 85.8 | Confident | 80 Ų | 80 | 76.7 Ų | 76.7 | 43% | 0.428 | 40% | 0.402 | S | S | . | . | trans | -77 | 111.3 | 173.6 | -170.3 | -77.5 | 0 | 0 | 0 | 109.4 | A43 C44 G48 K49 M50 | A43-D46 VanDerWaalsContact O-CB 3.24Å; A43-D46 WeakPolarHBondContact O-CB 3.35Å; A43-D46 PolarHBondContact O-N 3.01Å; C44-D46 PolarHBondContact O-N 2.93Å; D46-G48 PolarHBondContact O-N 3.21Å; D46-G48 VanDerWaalsContact OD1-CA 3.31Å; D46-G48 WeakPolarHBondContact OD1-CA 3.37Å; D46-G48 PolarHBondContact OD1-N 3.42Å; D46-K49 HydrophobicContact CB-CB 4.01Å; D46-K49 HydrophobicContact CB-CD 4.1Å; D46-K49 HydrophobicContact CB-CG 4.03Å; D46-K49 PolarHBondContact O-N 3.45Å; D46-K49 PolarHBondContact OD1-N 3.2Å; D46-M50 WeakPolarHBondContact O-CG 3.32Å; D46-M50 PolarHBondContact O-N 3.48Å | ||
| 47 | M | 78.1 | Confident | 85.9 | Confident | 100 Ų | 100 | 76.6 Ų | 76.6 | 49% | 0.493 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.7 | -33.1 | -178 | -169.7 | 172.7 | 178.8 | 0 | 0 | 111.9 | N45 M50 L51 P108 L110 | N45-M47 PolarHBondContact O-N 3.4Å; M47-M50 PolarHBondContact O-N 3.45Å; M47-L51 WeakPolarHBondContact O-CG 3.11Å; M47-L51 PolarHBondContact O-N 3.43Å; M47-P108 HydrophobicContact CG-CG 4.41Å; M47-L110 HydrophobicContact CE-CD2 3.8Å |
| 48 | G | 84.1 | Confident | 85.9 | Confident | 35 Ų | 35 | 72.6 Ų | 72.6 | 36% | 0.361 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.9 | -47.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | D46 L51 Q52 | D46-G48 PolarHBondContact O-N 3.21Å; D46-G48 VanDerWaalsContact OD1-CA 3.31Å; D46-G48 WeakPolarHBondContact OD1-CA 3.37Å; D46-G48 PolarHBondContact OD1-N 3.42Å; G48-L51 PolarHBondContact O-N 3.43Å; G48-Q52 VanDerWaalsContact O-CG 3.32Å; G48-Q52 WeakPolarHBondContact O-CG 3.35Å; G48-Q52 PolarHBondContact O-N 3.37Å |
| 49 | K | 86 | Confident | 85.8 | Confident | 102 Ų | 102 | 68 Ų | 68 | 44% | 0.443 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -67 | -35.7 | 175 | -67.4 | -175.4 | 178.1 | 178 | 0 | 112.8 | A43 D46 L51 Q52 L53 | A43-K49 HydrophobicContact CB-CB 3.77Å; D46-K49 HydrophobicContact CB-CB 4.01Å; D46-K49 HydrophobicContact CB-CD 4.1Å; D46-K49 HydrophobicContact CB-CG 4.03Å; D46-K49 PolarHBondContact O-N 3.45Å; D46-K49 PolarHBondContact OD1-N 3.2Å; K49-L51 VanDerWaalsContact C-N 3.31Å; K49-L51 PolarHBondContact O-N 3.35Å; K49-Q52 CarbonylContact O-C 3.54Å; K49-Q52 PolarHBondContact O-N 3.02Å; K49-Q52 VanDerWaalsContact O-N 3.09Å; K49-L53 HydrophobicContact CB-CD1 4.27Å; K49-L53 VanDerWaalsContact O-CB 3.27Å; K49-L53 WeakPolarHBondContact O-CB 3.12Å; K49-L53 WeakPolarHBondContact O-CG 3.23Å; K49-L53 PolarHBondContact O-N 3.28Å |
| 50 | M | 84.9 | Confident | 85.8 | Confident | 13 Ų | 13 | 71.5 Ų | 71.5 | 6% | 0.064 | 38% | 0.378 | C | S | . | . | I | π-helix | trans | -59.9 | -45.2 | 173.7 | -76 | -166 | 69.3 | 0 | 0 | 110.5 | R40 A43 D46 M47 Q52 V54 L55 P108 | R40-M50 HydrophobicContact CG-CE 4.19Å; A43-M50 HydrophobicContact CB-CB 4.21Å; A43-M50 HydrophobicContact CB-CG 3.44Å; A43-M50 VanDerWaalsContact CB-CG 3.44Å; D46-M50 WeakPolarHBondContact O-CG 3.32Å; D46-M50 PolarHBondContact O-N 3.48Å; M47-M50 PolarHBondContact O-N 3.45Å; M50-Q52 VanDerWaalsContact C-N 3.27Å; M50-Q52 PolarHBondContact O-N 2.92Å; M50-V54 HydrophobicContact CB-CG2 4.36Å; M50-V54 HydrophobicContact CE-CG2 4.34Å; M50-V54 HydrophobicContact CG-CG2 4.39Å; M50-V54 WeakPolarHBondContact O-CA 3.38Å; M50-V54 WeakPolarHBondContact O-CB 3.14Å; M50-V54 PolarHBondContact O-N 3.03Å; M50-L55 PolarHBondContact O-N 3.19Å; M50-P108 HydrophobicContact CE-CB 3.87Å; M50-P108 HydrophobicContact CE-CG 4.15Å; M50-P108 HydrophobicContact SD-CB 3.63Å; M50-P108 HydrophobicContact SD-CG 3.86Å |
| 51 | L | 85.3 | Confident | 86.1 | Confident | 75 Ų | 75 | 65.1 Ų | 65.1 | 39% | 0.393 | 35% | 0.354 | S | S | . | . | I | π-helix | trans | -68.9 | -23.2 | 175.3 | -66.4 | 174.9 | 0 | 0 | 0 | 113.4 | M47 G48 K49 L55 L107 | M47-L51 WeakPolarHBondContact O-CG 3.11Å; M47-L51 PolarHBondContact O-N 3.43Å; G48-L51 PolarHBondContact O-N 3.43Å; K49-L51 VanDerWaalsContact C-N 3.31Å; K49-L51 PolarHBondContact O-N 3.35Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L107 HydrophobicContact CD2-CD2 4.5Å |
| 52 | Q | 87.2 | Confident | 86.1 | Confident | 149 Ų | 149 | 59.5 Ų | 59.5 | 70% | 0.696 | 33% | 0.327 | S | S | * | . | I | π-helix | trans | -91.1 | -23.9 | 177.8 | -71.7 | -178.9 | 8.6 | 0 | 0 | 114.4 | G48 K49 M50 P56 | G48-Q52 VanDerWaalsContact O-CG 3.32Å; G48-Q52 WeakPolarHBondContact O-CG 3.35Å; G48-Q52 PolarHBondContact O-N 3.37Å; K49-Q52 CarbonylContact O-C 3.54Å; K49-Q52 PolarHBondContact O-N 3.02Å; K49-Q52 VanDerWaalsContact O-N 3.09Å; M50-Q52 VanDerWaalsContact C-N 3.27Å; M50-Q52 PolarHBondContact O-N 2.92Å; Q52-P56 WeakPolarHBondContact O-CD 3.36Å; Q52-P56 WeakPolarHBondContact O-CG 3.47Å |
| 53 | L | 89.6 | Confident | 86.2 | Confident | 72 Ų | 72 | 57.2 Ų | 57.2 | 38% | 0.377 | 31% | 0.309 | S | S | . | . | I | π-helix | trans | -111.3 | -51.2 | -175.9 | -61.5 | 175.6 | 0 | 0 | 0 | 111.6 | A39 A43 K49 P56 V57 | A39-L53 HydrophobicContact CB-CB 4.2Å; A43-L53 HydrophobicContact CB-CD1 4.42Å; K49-L53 HydrophobicContact CB-CD1 4.27Å; K49-L53 VanDerWaalsContact O-CB 3.27Å; K49-L53 WeakPolarHBondContact O-CB 3.12Å; K49-L53 WeakPolarHBondContact O-CG 3.23Å; K49-L53 PolarHBondContact O-N 3.28Å; L53-P56 WeakPolarHBondContact O-CD 3.25Å; L53-P56 WeakPolarHBondContact O-CG 3.44Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.45Å |
| 54 | V | 88.3 | Confident | 86.3 | Confident | 4 Ų | 4 | 62 Ų | 62 | 2% | 0.024 | 33% | 0.331 | C | S | . | . | I | π-helix | trans | -74.1 | -42.4 | -176.9 | -176.8 | 0 | 0 | 0 | 0 | 110.8 | M36 A39 R40 M50 V57 A58 | M36-V54 HydrophobicContact CE-CG1 3.52Å; M36-V54 HydrophobicContact SD-CG1 3.93Å; A39-V54 HydrophobicContact CB-CG2 4Å; R40-V54 HydrophobicContact CB-CG2 4.11Å; M50-V54 HydrophobicContact CB-CG2 4.36Å; M50-V54 HydrophobicContact CE-CG2 4.34Å; M50-V54 HydrophobicContact CG-CG2 4.39Å; M50-V54 WeakPolarHBondContact O-CA 3.38Å; M50-V54 WeakPolarHBondContact O-CB 3.14Å; M50-V54 PolarHBondContact O-N 3.03Å; V54-V57 PolarHBondContact O-N 3.35Å; V54-A58 WeakPolarHBondContact O-CB 3.34Å; V54-A58 PolarHBondContact O-N 2.92Å |
| 55 | L | 87.4 | Confident | 86.9 | Confident | 75 Ų | 75 | 58.2 Ų | 58.2 | 39% | 0.393 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60 | -46.6 | -179.1 | -170.1 | 67.6 | 0 | 0 | 0 | 113.8 | M50 L51 V57 A58 T59 | M50-L55 PolarHBondContact O-N 3.19Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L55-V57 VanDerWaalsContact C-N 3.34Å; L55-V57 PolarHBondContact O-N 2.79Å; L55-A58 WeakPolarHBondContact O-CB 3.49Å; L55-A58 PolarHBondContact O-N 2.85Å; L55-T59 WeakPolarHBondContact O-CB 3.37Å; L55-T59 PolarHBondContact O-N 3.36Å; L55-T59 PolarHBondContact O-OG1 2.92Å |
| 56 | P | 88.8 | Confident | 87.7 | Confident | 54 Ų | 54 | 50.6 Ų | 50.6 | 35% | 0.351 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -68.9 | -30 | 177 | 21.1 | -29 | 0 | 0 | 0 | 113.4 | Q52 L53 Q60 | Q52-P56 WeakPolarHBondContact O-CD 3.36Å; Q52-P56 WeakPolarHBondContact O-CG 3.47Å; L53-P56 WeakPolarHBondContact O-CD 3.25Å; L53-P56 WeakPolarHBondContact O-CG 3.44Å; P56-Q60 WeakPolarHBondContact O-CG 3.17Å; P56-Q60 PolarHBondContact O-N 3.15Å; P56-Q60 PolarHBondContact O-NE2 2.99Å |
| 57 | V | 91.2 | Very high | 87.8 | Confident | 19 Ų | 19 | 51.5 Ų | 51.5 | 12% | 0.115 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.8 | -47 | 172.1 | 174.2 | 0 | 0 | 0 | 0 | 110 | R35 M36 A39 L53 V54 L55 T59 Q60 I61 | R35-V57 HydrophobicContact CB-CG1 3.8Å; M36-V57 HydrophobicContact CG-CG1 4.06Å; M36-V57 HydrophobicContact SD-CB 4.21Å; M36-V57 HydrophobicContact SD-CG1 3.8Å; A39-V57 HydrophobicContact CB-CG2 4.12Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.45Å; V54-V57 PolarHBondContact O-N 3.35Å; L55-V57 VanDerWaalsContact C-N 3.34Å; L55-V57 PolarHBondContact O-N 2.79Å; V57-T59 VanDerWaalsContact C-N 3.34Å; V57-T59 PolarHBondContact O-N 2.81Å; V57-Q60 WeakPolarHBondContact O-CB 3.35Å; V57-Q60 PolarHBondContact O-N 3.14Å; V57-I61 HydrophobicContact CG1-CD1 4.01Å; V57-I61 WeakPolarHBondContact O-CG1 3.31Å; V57-I61 PolarHBondContact O-N 3.48Å |
| 58 | A | 89.6 | Confident | 88.2 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.1 | -42.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | F27 M36 V54 L55 Q60 I61 Q62 L106 | F27-A58 HydrophobicContact CE1-CB 3.83Å; F27-A58 HydrophobicContact CZ-CB 3.83Å; M36-A58 HydrophobicContact CE-CB 4.34Å; M36-A58 HydrophobicContact SD-CB 4.06Å; V54-A58 WeakPolarHBondContact O-CB 3.34Å; V54-A58 PolarHBondContact O-N 2.92Å; L55-A58 WeakPolarHBondContact O-CB 3.49Å; L55-A58 PolarHBondContact O-N 2.85Å; A58-Q60 VanDerWaalsContact C-N 3.31Å; A58-Q60 PolarHBondContact O-N 2.82Å; A58-I61 PolarHBondContact O-N 2.86Å; A58-Q62 WeakPolarHBondContact O-CB 3.44Å; A58-Q62 WeakPolarHBondContact O-CG 3.39Å; A58-Q62 PolarHBondContact O-N 3.37Å; A58-L106 HydrophobicContact CB-CD1 4.02Å; A58-L106 HydrophobicContact CB-CD2 3.27Å; A58-L106 HydrophobicContact CB-CG 4.16Å |
| 59 | T | 89.6 | Confident | 88.2 | Confident | 40 Ų | 40 | 52.1 Ų | 52.1 | 25% | 0.245 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62 | -41.9 | 177.5 | -58.3 | 0 | 0 | 0 | 0 | 110.2 | L55 V57 Q62 Q63 V78 | L55-T59 WeakPolarHBondContact O-CB 3.37Å; L55-T59 PolarHBondContact O-N 3.36Å; L55-T59 PolarHBondContact O-OG1 2.92Å; V57-T59 VanDerWaalsContact C-N 3.34Å; V57-T59 PolarHBondContact O-N 2.81Å; T59-Q62 PolarHBondContact O-N 3.22Å; T59-Q63 WeakPolarHBondContact O-CB 3.29Å; T59-Q63 PolarHBondContact O-N 3.11Å; T59-V78 HydrophobicContact CG2-CB 4.11Å; T59-V78 HydrophobicContact CG2-CG1 4.21Å; T59-V78 HydrophobicContact CG2-CG2 3.84Å |
| 60 | Q | 89.8 | Confident | 87.9 | Confident | 83 Ų | 83 | 49.9 Ų | 49.9 | 39% | 0.388 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.5 | -46.4 | 174.5 | -79 | 169 | 75.9 | 0 | 0 | 112.2 | P56 V57 A58 Q62 Q63 E64 | P56-Q60 WeakPolarHBondContact O-CG 3.17Å; P56-Q60 PolarHBondContact O-N 3.15Å; P56-Q60 PolarHBondContact O-NE2 2.99Å; V57-Q60 WeakPolarHBondContact O-CB 3.35Å; V57-Q60 PolarHBondContact O-N 3.14Å; A58-Q60 VanDerWaalsContact C-N 3.31Å; A58-Q60 PolarHBondContact O-N 2.82Å; Q60-Q62 VanDerWaalsContact C-N 3.35Å; Q60-Q62 PolarHBondContact O-N 2.98Å; Q60-Q63 WeakPolarHBondContact O-CB 3.49Å; Q60-Q63 PolarHBondContact O-N 3.34Å; Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.35Å |
| 61 | I | 91.2 | Very high | 87.7 | Confident | 2 Ų | 2 | 49.8 Ų | 49.8 | 1% | 0.01 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.3 | -46.7 | 178.3 | -63.9 | 161.9 | 0 | 0 | 0 | 110.4 | A26 F27 N32 M36 V57 A58 Q63 E64 V65 | A26-I61 HydrophobicContact CB-CG2 3.66Å; F27-I61 HydrophobicContact CD1-CD1 3.81Å; F27-I61 HydrophobicContact CD1-CG2 4.37Å; F27-I61 HydrophobicContact CD2-CG2 4.13Å; F27-I61 HydrophobicContact CE1-CB 4.16Å; F27-I61 HydrophobicContact CE1-CD1 3.6Å; F27-I61 HydrophobicContact CE1-CG1 4.49Å; F27-I61 HydrophobicContact CE1-CG2 4.25Å; F27-I61 HydrophobicContact CE2-CB 4.37Å; F27-I61 HydrophobicContact CE2-CG2 3.95Å; F27-I61 HydrophobicContact CG-CG2 4.28Å; F27-I61 HydrophobicContact CZ-CB 3.95Å; F27-I61 HydrophobicContact CZ-CD1 4.28Å; F27-I61 HydrophobicContact CZ-CG2 4.01Å; N32-I61 HydrophobicContact CB-CD1 3.74Å; N32-I61 HydrophobicContact CB-CG1 4Å; M36-I61 HydrophobicContact CG-CD1 3.73Å; M36-I61 HydrophobicContact SD-CD1 4.14Å; V57-I61 HydrophobicContact CG1-CD1 4.01Å; V57-I61 WeakPolarHBondContact O-CG1 3.31Å; V57-I61 PolarHBondContact O-N 3.48Å; A58-I61 PolarHBondContact O-N 2.86Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 3.05Å; I61-E64 PolarHBondContact O-N 2.9Å; I61-V65 PolarHBondContact O-N 3.06Å |
| 62 | Q | 89.6 | Confident | 87 | Confident | 19 Ų | 19 | 51 Ų | 51 | 9% | 0.089 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.2 | -44.5 | 175.8 | -74 | 179.1 | -19.6 | 0 | 0 | 111.5 | V23 F27 A58 T59 Q60 E64 V65 I66 V78 | V23-Q62 HydrophobicContact CG1-CG 3.68Å; F27-Q62 HydrophobicContact CE2-CG 3.96Å; F27-Q62 HydrophobicContact CZ-CG 4.12Å; A58-Q62 WeakPolarHBondContact O-CB 3.44Å; A58-Q62 WeakPolarHBondContact O-CG 3.39Å; A58-Q62 PolarHBondContact O-N 3.37Å; T59-Q62 PolarHBondContact O-N 3.22Å; Q60-Q62 VanDerWaalsContact C-N 3.35Å; Q60-Q62 PolarHBondContact O-N 2.98Å; Q62-E64 PolarHBondContact O-N 3.08Å; Q62-V65 PolarHBondContact O-N 3.04Å; Q62-I66 WeakPolarHBondContact O-CG1 3.45Å; Q62-I66 WeakPolarHBondContact O-CG2 3.44Å; Q62-I66 PolarHBondContact O-N 3.39Å; Q62-V78 HydrophobicContact CB-CG1 4.17Å; Q62-V78 HydrophobicContact CB-CG2 4.11Å |
| 63 | Q | 89.3 | Confident | 85.8 | Confident | 21 Ų | 21 | 48.4 Ų | 48.4 | 10% | 0.098 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -62.6 | -40.6 | -179.2 | -168.3 | 165.8 | 35.8 | 0 | 0 | 112.6 | T59 Q60 I61 V65 I66 K67 N73 V78 | T59-Q63 WeakPolarHBondContact O-CB 3.29Å; T59-Q63 PolarHBondContact O-N 3.11Å; Q60-Q63 WeakPolarHBondContact O-CB 3.49Å; Q60-Q63 PolarHBondContact O-N 3.34Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 3.05Å; Q63-V65 VanDerWaalsContact C-N 3.25Å; Q63-V65 PolarHBondContact O-N 2.92Å; Q63-I66 PolarHBondContact O-N 3.46Å; Q63-K67 WeakPolarHBondContact O-CB 3.37Å; Q63-K67 PolarHBondContact O-N 3.39Å; Q63-N73 PolarHBondContact NE2-O 2.96Å; Q63-V78 HydrophobicContact CB-CG2 3.83Å; Q63-V78 HydrophobicContact CG-CG2 4.42Å |
| 64 | E | 89.6 | Confident | 84.8 | Confident | 101 Ų | 101 | 52.4 Ų | 52.4 | 47% | 0.472 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -63.7 | -29.1 | 177.3 | -75.1 | -67.4 | 97.4 | 0 | 0 | 113.1 | Q60 I61 Q62 K67 | Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.35Å; I61-E64 PolarHBondContact O-N 2.9Å; Q62-E64 PolarHBondContact O-N 3.08Å; E64-K67 VanDerWaalsContact O-CE 3.26Å; E64-K67 WeakPolarHBondContact O-CE 3.32Å; E64-K67 VanDerWaalsContact O-CG 3.28Å; E64-K67 WeakPolarHBondContact O-CG 3.42Å; E64-K67 WeakPolarHBondContact OE1-CD 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.38Å; E64-K67 IonicContact OE1-NZ 3.01Å; E64-K67 PolarHBondContact OE1-NZ 2.89Å; E64-K67 WeakPolarHBondContact OE2-CE 3.49Å; E64-K67 IonicContact OE2-NZ 3.41Å; E64-K67 PolarHBondContact OE2-NZ 2.99Å |
| 65 | V | 90.1 | Very high | 83.5 | Confident | 18 Ų | 18 | 53.8 Ų | 53.8 | 11% | 0.109 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -80.8 | -52.5 | 174.7 | 179.3 | 0 | 0 | 0 | 0 | 110.4 | V19 E22 V23 A26 I61 Q62 Q63 K67 A68 Y69 | V19-V65 HydrophobicContact CG1-CG1 4.42Å; E22-V65 HydrophobicContact CB-CG1 3.63Å; V23-V65 HydrophobicContact CG2-CB 3.81Å; V23-V65 HydrophobicContact CG2-CG1 3.81Å; V23-V65 HydrophobicContact CG2-CG2 4.26Å; A26-V65 HydrophobicContact CB-CG2 3.59Å; I61-V65 PolarHBondContact O-N 3.06Å; Q62-V65 PolarHBondContact O-N 3.04Å; Q63-V65 VanDerWaalsContact C-N 3.25Å; Q63-V65 PolarHBondContact O-N 2.92Å; V65-K67 VanDerWaalsContact C-N 3.26Å; V65-K67 PolarHBondContact O-N 2.72Å; V65-A68 WeakPolarHBondContact O-CB 3.42Å; V65-A68 PolarHBondContact O-N 2.84Å; V65-Y69 HydrophobicContact CG1-CE2 4.27Å; V65-Y69 VanDerWaalsContact O-CD2 3.29Å; V65-Y69 WeakPolarHBondContact O-CD2 3.47Å |
| 66 | I | 88.2 | Confident | 83 | Confident | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -69.1 | -21.7 | -173.9 | 67.1 | 179.9 | 0 | 0 | 0 | 113.4 | V19 Q62 Q63 A68 Y69 F71 G77 V78 F81 | V19-I66 HydrophobicContact CG1-CG2 3.74Å; Q62-I66 WeakPolarHBondContact O-CG1 3.45Å; Q62-I66 WeakPolarHBondContact O-CG2 3.44Å; Q62-I66 PolarHBondContact O-N 3.39Å; Q63-I66 PolarHBondContact O-N 3.46Å; I66-A68 PolarHBondContact O-N 3.27Å; I66-Y69 PolarHBondContact O-N 3.48Å; I66-F71 HydrophobicContact CB-CB 3.92Å; I66-F71 HydrophobicContact CB-CD2 3.97Å; I66-F71 HydrophobicContact CB-CG 4.02Å; I66-F71 HydrophobicContact CD1-CB 3.84Å; I66-F71 HydrophobicContact CD1-CD1 4.45Å; I66-F71 HydrophobicContact CD1-CG 4.17Å; I66-F71 HydrophobicContact CG1-CB 3.72Å; I66-F71 HydrophobicContact CG1-CG 4.24Å; I66-F71 WeakPolarHBondContact O-CB 2.96Å; I66-F71 PolarHBondContact O-N 3.34Å; I66-G77 WeakPolarHBondContact CD1-O 3.41Å; I66-V78 HydrophobicContact CD1-CB 4.32Å; I66-V78 HydrophobicContact CD1-CG2 3.75Å; I66-F81 HydrophobicContact CD1-CB 4.17Å; I66-F81 HydrophobicContact CG2-CB 4.23Å; I66-F81 HydrophobicContact CG2-CD1 3.97Å; I66-F81 HydrophobicContact CG2-CD2 4.02Å; I66-F81 HydrophobicContact CG2-CE1 4.33Å; I66-F81 HydrophobicContact CG2-CE2 4.4Å; I66-F81 HydrophobicContact CG2-CG 3.8Å |
| 67 | K | 86.9 | Confident | 82.7 | Confident | 99 Ų | 99 | 53.2 Ų | 53.2 | 43% | 0.43 | 30% | 0.295 | S | S | . | . | G | 310 helix | trans | -60.2 | -32.6 | 174.7 | 71.9 | -179 | -179.8 | -179 | 0 | 112.1 | Q63 E64 V65 Y69 G70 F71 | Q63-K67 WeakPolarHBondContact O-CB 3.37Å; Q63-K67 PolarHBondContact O-N 3.39Å; E64-K67 VanDerWaalsContact O-CE 3.26Å; E64-K67 WeakPolarHBondContact O-CE 3.32Å; E64-K67 VanDerWaalsContact O-CG 3.28Å; E64-K67 WeakPolarHBondContact O-CG 3.42Å; E64-K67 WeakPolarHBondContact OE1-CD 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.38Å; E64-K67 IonicContact OE1-NZ 3.01Å; E64-K67 PolarHBondContact OE1-NZ 2.89Å; E64-K67 WeakPolarHBondContact OE2-CE 3.49Å; E64-K67 IonicContact OE2-NZ 3.41Å; E64-K67 PolarHBondContact OE2-NZ 2.99Å; V65-K67 VanDerWaalsContact C-N 3.26Å; V65-K67 PolarHBondContact O-N 2.72Å; K67-Y69 PolarHBondContact O-N 2.93Å; K67-G70 PolarHBondContact O-N 2.69Å; K67-F71 WeakPolarHBondContact CA-O 3.45Å |
| 68 | A | 85.9 | Confident | 82.4 | Confident | 85 Ų | 85 | 52.9 Ų | 52.9 | 70% | 0.702 | 29% | 0.293 | S | S | * | . | G | 310 helix | trans | -65.6 | -19.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | V65 I66 | V65-A68 WeakPolarHBondContact O-CB 3.42Å; V65-A68 PolarHBondContact O-N 2.84Å; I66-A68 PolarHBondContact O-N 3.27Å |
| 69 | Y | 83.9 | Confident | 82.2 | Confident | 64 Ų | 64 | 59 Ų | 59 | 25% | 0.251 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -102.5 | 10.7 | -179.1 | -61.6 | -94.3 | 0 | 0 | 0 | 112.9 | L11 V19 V65 I66 K67 | L11-Y69 HydrophobicContact CD2-CD1 4.38Å; V19-Y69 HydrophobicContact CB-CE2 4.49Å; V19-Y69 HydrophobicContact CG1-CD2 4.38Å; V19-Y69 HydrophobicContact CG1-CE2 4.44Å; V19-Y69 HydrophobicContact CG2-CD1 3.49Å; V19-Y69 VanDerWaalsContact CG2-CD1 3.49Å; V19-Y69 HydrophobicContact CG2-CD2 3.72Å; V19-Y69 HydrophobicContact CG2-CE1 3.42Å; V19-Y69 VanDerWaalsContact CG2-CE1 3.42Å; V19-Y69 HydrophobicContact CG2-CE2 3.68Å; V19-Y69 HydrophobicContact CG2-CG 3.64Å; V65-Y69 HydrophobicContact CG1-CE2 4.27Å; V65-Y69 VanDerWaalsContact O-CD2 3.29Å; V65-Y69 WeakPolarHBondContact O-CD2 3.47Å; I66-Y69 PolarHBondContact O-N 3.48Å; K67-Y69 PolarHBondContact O-N 2.93Å |
| 70 | G | 79 | Confident | 82 | Confident | 55 Ų | 55 | 61.1 Ų | 61.1 | 57% | 0.567 | 33% | 0.331 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 89.5 | 11 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | K67 | K67-G70 PolarHBondContact O-N 2.69Š|
| 71 | F | 81.6 | Confident | 81.9 | Confident | 10 Ų | 10 | 57.3 Ų | 57.3 | 4% | 0.044 | 31% | 0.313 | C | S | . | . | trans | -78.1 | 125.3 | 170.5 | -71.7 | -100.4 | 0 | 0 | 0 | 110.2 | P9 L11 I66 K67 G77 K80 F81 | P9-F71 HydrophobicContact CG-CE2 4.38Å; P9-F71 HydrophobicContact CG-CZ 4.39Å; L11-F71 HydrophobicContact CD1-CE2 3.48Å; L11-F71 VanDerWaalsContact CD1-CE2 3.48Å; L11-F71 HydrophobicContact CD1-CZ 3.82Å; L11-F71 HydrophobicContact CD2-CE2 4.28Å; L11-F71 HydrophobicContact CG-CE2 3.75Å; L11-F71 HydrophobicContact CG-CZ 4.06Å; I66-F71 HydrophobicContact CB-CB 3.92Å; I66-F71 HydrophobicContact CB-CD2 3.97Å; I66-F71 HydrophobicContact CB-CG 4.02Å; I66-F71 HydrophobicContact CD1-CB 3.84Å; I66-F71 HydrophobicContact CD1-CD1 4.45Å; I66-F71 HydrophobicContact CD1-CG 4.17Å; I66-F71 HydrophobicContact CG1-CB 3.72Å; I66-F71 HydrophobicContact CG1-CG 4.24Å; I66-F71 WeakPolarHBondContact O-CB 2.96Å; I66-F71 PolarHBondContact O-N 3.34Å; K67-F71 WeakPolarHBondContact CA-O 3.45Å; F71-G77 WeakPolarHBondContact CD1-O 3.3Å; F71-K80 HydrophobicContact CD1-CB 4.2Å; F71-K80 HydrophobicContact CE1-CB 4Å; F71-F81 HydrophobicContact CD1-CB 4.34Å; F71-F81 HydrophobicContact CE1-CB 4.05Å; F71-F81 HydrophobicContact CZ-CB 4.45Å; F71-F81 HydrophobicContact CZ-CD2 4.39Å | ||
| 72 | N | 69.8 | Low | 81.8 | Confident | 100 Ų | 100 | 59.8 Ų | 59.8 | 54% | 0.535 | 33% | 0.334 | S | S | . | . | trans | -68.6 | 150.3 | -176 | -166.3 | 20.5 | 0 | 0 | 0 | 112.9 | E74 | N72-E74 VanDerWaalsContact C-N 3.27Å; N72-E74 PolarHBondContact ND2-OE2 3.32Å; N72-E74 PolarHBondContact O-N 3.42Å | ||
| 73 | N | 63.5 | Low | 81.6 | Confident | 95 Ų | 95 | 67.8 Ų | 67.8 | 51% | 0.508 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 2.3 | -173.6 | -164.3 | -97.6 | 0 | 0 | 0 | 114.3 | Q63 G75 | Q63-N73 PolarHBondContact NE2-O 2.96Å; N73-G75 PolarHBondContact O-N 2.95Å |
| 74 | E | 66.6 | Low | 81.6 | Confident | 157 Ų | 157 | 67.9 Ų | 67.9 | 73% | 0.734 | 36% | 0.364 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | 29.7 | -177.7 | -75 | 173.1 | 69.2 | 0 | 0 | 114.8 | N72 E76 | N72-E74 VanDerWaalsContact C-N 3.27Å; N72-E74 PolarHBondContact ND2-OE2 3.32Å; N72-E74 PolarHBondContact O-N 3.42Å; E74-E76 PolarHBondContact O-N 3.22Å |
| 75 | G | 62.6 | Low | 81.5 | Confident | 33 Ų | 33 | 63.3 Ų | 63.3 | 34% | 0.34 | 34% | 0.343 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.2 | -24.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | N73 G77 | N73-G75 PolarHBondContact O-N 2.95Å; G75-G77 VanDerWaalsContact C-N 3.27Å; G75-G77 PolarHBondContact O-N 3.28Å |
| 76 | E | 76.9 | Confident | 81.5 | Confident | 113 Ų | 113 | 68 Ų | 68 | 53% | 0.528 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -68.7 | -22.9 | 174 | -105.9 | -171.2 | 74 | 0 | 0 | 113.3 | E74 V78 L79 K80 | E74-E76 PolarHBondContact O-N 3.22Å; E76-V78 PolarHBondContact O-N 3.33Å; E76-L79 PolarHBondContact O-N 3.48Å; E76-K80 WeakPolarHBondContact O-CB 3.42Å; E76-K80 WeakPolarHBondContact O-CG 3.44Å; E76-K80 PolarHBondContact O-N 3.02Å; E76-K80 WeakPolarHBondContact OE1-CE 3.48Å; E76-K80 IonicContact OE1-NZ 2.63Å; E76-K80 PolarHBondContact OE1-NZ 3.27Å |
| 77 | G | 81.6 | Confident | 81.4 | Confident | 3 Ų | 3 | 74 Ų | 74 | 3% | 0.031 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -58.7 | -47.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I66 F71 G75 K80 F81 | I66-G77 WeakPolarHBondContact CD1-O 3.41Å; F71-G77 WeakPolarHBondContact CD1-O 3.3Å; G75-G77 VanDerWaalsContact C-N 3.27Å; G75-G77 PolarHBondContact O-N 3.28Å; G77-K80 PolarHBondContact O-N 2.96Å; G77-F81 WeakPolarHBondContact O-CB 3.36Å; G77-F81 PolarHBondContact O-N 3.15Å |
| 78 | V | 85.8 | Confident | 81.5 | Confident | 12 Ų | 12 | 71.2 Ų | 71.2 | 7% | 0.073 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -67.3 | -41.1 | -178.7 | 178.9 | 0 | 0 | 0 | 0 | 111.3 | T59 Q62 Q63 I66 E76 F81 A82 | T59-V78 HydrophobicContact CG2-CB 4.11Å; T59-V78 HydrophobicContact CG2-CG1 4.21Å; T59-V78 HydrophobicContact CG2-CG2 3.84Å; Q62-V78 HydrophobicContact CB-CG1 4.17Å; Q62-V78 HydrophobicContact CB-CG2 4.11Å; Q63-V78 HydrophobicContact CB-CG2 3.83Å; Q63-V78 HydrophobicContact CG-CG2 4.42Å; I66-V78 HydrophobicContact CD1-CB 4.32Å; I66-V78 HydrophobicContact CD1-CG2 3.75Å; E76-V78 PolarHBondContact O-N 3.33Å; V78-F81 PolarHBondContact O-N 3.47Å; V78-A82 VanDerWaalsContact O-CB 3.31Å; V78-A82 WeakPolarHBondContact O-CB 3.33Å; V78-A82 PolarHBondContact O-N 2.86Å |
| 79 | L | 85.4 | Confident | 81.6 | Confident | 128 Ų | 128 | 69.1 Ų | 69.1 | 67% | 0.67 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -62.5 | -42.6 | 175 | -84.4 | 148.7 | 0 | 0 | 0 | 112.3 | E76 A82 R83 | E76-L79 PolarHBondContact O-N 3.48Å; L79-A82 PolarHBondContact O-N 2.94Å; L79-R83 WeakPolarHBondContact O-CB 3.29Å; L79-R83 PolarHBondContact O-N 3.39Å |
| 80 | K | 85.4 | Confident | 81.6 | Confident | 85 Ų | 85 | 71.8 Ų | 71.8 | 37% | 0.37 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.7 | -45.5 | 175.4 | -76 | 172.1 | -179.8 | 158.1 | 0 | 111.3 | F71 E76 G77 R83 L84 | F71-K80 HydrophobicContact CD1-CB 4.2Å; F71-K80 HydrophobicContact CE1-CB 4Å; E76-K80 WeakPolarHBondContact O-CB 3.42Å; E76-K80 WeakPolarHBondContact O-CG 3.44Å; E76-K80 PolarHBondContact O-N 3.02Å; E76-K80 WeakPolarHBondContact OE1-CE 3.48Å; E76-K80 IonicContact OE1-NZ 2.63Å; E76-K80 PolarHBondContact OE1-NZ 3.27Å; G77-K80 PolarHBondContact O-N 2.96Å; K80-R83 PolarHBondContact O-N 3.22Å; K80-L84 WeakPolarHBondContact O-CB 3.43Å; K80-L84 PolarHBondContact O-N 3.26Å |
| 81 | F | 87.6 | Confident | 81.9 | Confident | 4 Ų | 4 | 75.4 Ų | 75.4 | 2% | 0.018 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -61.8 | -46.6 | 176 | 179 | -109 | 0 | 0 | 0 | 111.7 | L11 T16 V19 L20 V23 I66 F71 G77 V78 R83 L84 V85 | L11-F81 HydrophobicContact CD1-CD2 4.17Å; L11-F81 HydrophobicContact CD1-CE2 4.17Å; T16-F81 HydrophobicContact CG2-CE2 4.28Å; V19-F81 HydrophobicContact CB-CE2 3.86Å; V19-F81 HydrophobicContact CB-CZ 4.07Å; V19-F81 HydrophobicContact CG1-CD2 4.14Å; V19-F81 HydrophobicContact CG1-CE1 4.36Å; V19-F81 HydrophobicContact CG1-CE2 3.35Å; V19-F81 HydrophobicContact CG1-CZ 3.48Å; V19-F81 VanDerWaalsContact CG1-CZ 3.48Å; L20-F81 HydrophobicContact CB-CZ 4.43Å; L20-F81 HydrophobicContact CD1-CE1 3.68Å; L20-F81 HydrophobicContact CD1-CZ 3.64Å; V23-F81 HydrophobicContact CG2-CE1 4.37Å; I66-F81 HydrophobicContact CD1-CB 4.17Å; I66-F81 HydrophobicContact CG2-CB 4.23Å; I66-F81 HydrophobicContact CG2-CD1 3.97Å; I66-F81 HydrophobicContact CG2-CD2 4.02Å; I66-F81 HydrophobicContact CG2-CE1 4.33Å; I66-F81 HydrophobicContact CG2-CE2 4.4Å; I66-F81 HydrophobicContact CG2-CG 3.8Å; F71-F81 HydrophobicContact CD1-CB 4.34Å; F71-F81 HydrophobicContact CE1-CB 4.05Å; F71-F81 HydrophobicContact CZ-CB 4.45Å; F71-F81 HydrophobicContact CZ-CD2 4.39Å; G77-F81 WeakPolarHBondContact O-CB 3.36Å; G77-F81 PolarHBondContact O-N 3.15Å; V78-F81 PolarHBondContact O-N 3.47Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 3.43Å; F81-L84 WeakPolarHBondContact O-CB 3.39Å; F81-L84 PolarHBondContact O-N 3.24Å; F81-V85 HydrophobicContact CD1-CG2 4.15Å; F81-V85 HydrophobicContact CD2-CG2 4.34Å; F81-V85 HydrophobicContact CE1-CG2 3.73Å; F81-V85 HydrophobicContact CE2-CG2 3.92Å; F81-V85 HydrophobicContact CG-CG2 4.44Å; F81-V85 HydrophobicContact CZ-CG2 3.6Å; F81-V85 WeakPolarHBondContact O-CG2 3.44Å; F81-V85 PolarHBondContact O-N 3.48Å |
| 82 | A | 87.8 | Confident | 82.2 | Confident | 53 Ų | 53 | 76.7 Ų | 76.7 | 44% | 0.438 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -59.4 | -40.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | V78 L79 L84 K86 | V78-A82 VanDerWaalsContact O-CB 3.31Å; V78-A82 WeakPolarHBondContact O-CB 3.33Å; V78-A82 PolarHBondContact O-N 2.86Å; L79-A82 PolarHBondContact O-N 2.94Å; A82-L84 VanDerWaalsContact C-N 3.35Å; A82-K86 WeakPolarHBondContact O-CB 3.33Å; A82-K86 PolarHBondContact O-N 3.41Å |
| 83 | R | 87 | Confident | 83.1 | Confident | 187 Ų | 187 | 77 Ų | 77 | 71% | 0.706 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.1 | -42 | 173.5 | -177.8 | -179 | -68.5 | -168.9 | -1 | 111.6 | L79 K80 F81 K86 M87 | L79-R83 WeakPolarHBondContact O-CB 3.29Å; L79-R83 PolarHBondContact O-N 3.39Å; K80-R83 PolarHBondContact O-N 3.22Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 3.43Å; R83-K86 VanDerWaalsContact O-CB 3.29Å; R83-K86 WeakPolarHBondContact O-CB 3.39Å; R83-K86 PolarHBondContact O-N 3.14Å; R83-M87 WeakPolarHBondContact O-CG 3.45Å; R83-M87 PolarHBondContact O-N 3.5Å |
| 84 | L | 87.6 | Confident | 84.3 | Confident | 24 Ų | 24 | 76.1 Ų | 76.1 | 13% | 0.126 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -66.9 | -43.5 | -179.5 | -173.2 | 143.9 | 0 | 0 | 0 | 111.2 | L11 T16 K80 F81 A82 K86 M87 Y88 | L11-L84 HydrophobicContact CB-CD1 4.36Å; L11-L84 HydrophobicContact CB-CD2 4.09Å; L11-L84 HydrophobicContact CD1-CD2 4.44Å; T16-L84 HydrophobicContact CG2-CD2 3.73Å; T16-L84 WeakPolarHBondContact OG1-CD2 3.32Å; K80-L84 WeakPolarHBondContact O-CB 3.43Å; K80-L84 PolarHBondContact O-N 3.26Å; F81-L84 WeakPolarHBondContact O-CB 3.39Å; F81-L84 PolarHBondContact O-N 3.24Å; A82-L84 VanDerWaalsContact C-N 3.35Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 2.82Å; L84-M87 PolarHBondContact O-N 2.83Å; L84-M87 VanDerWaalsContact O-N 3.11Å; L84-Y88 HydrophobicContact CD1-CE2 4.44Å; L84-Y88 HydrophobicContact CD2-CD2 3.63Å; L84-Y88 HydrophobicContact CD2-CE2 3.5Å; L84-Y88 HydrophobicContact CG-CD2 4.03Å; L84-Y88 HydrophobicContact CG-CE2 3.7Å; L84-Y88 VanDerWaalsContact O-CD2 3.27Å; L84-Y88 WeakPolarHBondContact O-CD2 3.26Å; L84-Y88 PolarHBondContact O-N 3.47Å; L84-Y88 VanDerWaalsContact O-N 3.08Å |
| 85 | V | 89.1 | Confident | 85.5 | Confident | 5 Ų | 5 | 68.7 Ų | 68.7 | 3% | 0.03 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -57.2 | -42.2 | 169.8 | 174.7 | 0 | 0 | 0 | 0 | 111.2 | T16 L20 F81 M87 Y88 E89 I95 | T16-V85 HydrophobicContact CG2-CG2 3.78Å; L20-V85 HydrophobicContact CD1-CG1 4.1Å; L20-V85 HydrophobicContact CD1-CG2 3.63Å; L20-V85 HydrophobicContact CD2-CG1 4.14Å; F81-V85 HydrophobicContact CD1-CG2 4.15Å; F81-V85 HydrophobicContact CD2-CG2 4.34Å; F81-V85 HydrophobicContact CE1-CG2 3.73Å; F81-V85 HydrophobicContact CE2-CG2 3.92Å; F81-V85 HydrophobicContact CG-CG2 4.44Å; F81-V85 HydrophobicContact CZ-CG2 3.6Å; F81-V85 WeakPolarHBondContact O-CG2 3.44Å; F81-V85 PolarHBondContact O-N 3.48Å; V85-M87 VanDerWaalsContact C-N 3.27Å; V85-M87 PolarHBondContact O-N 3.37Å; V85-Y88 PolarHBondContact O-N 2.88Å; V85-Y88 VanDerWaalsContact O-N 3.15Å; V85-E89 WeakPolarHBondContact O-CB 3.45Å; V85-E89 PolarHBondContact O-N 2.93Å; V85-I95 HydrophobicContact CG1-CG2 3.96Å |
| 86 | K | 88.3 | Confident | 86.8 | Confident | 117 Ų | 117 | 68.7 Ų | 68.7 | 51% | 0.509 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.9 | -32.3 | 176.9 | -164 | 86.8 | -175 | 139.2 | 0 | 113.1 | A82 R83 L84 E89 | A82-K86 WeakPolarHBondContact O-CB 3.33Å; A82-K86 PolarHBondContact O-N 3.41Å; R83-K86 VanDerWaalsContact O-CB 3.29Å; R83-K86 WeakPolarHBondContact O-CB 3.39Å; R83-K86 PolarHBondContact O-N 3.14Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 2.82Å; K86-E89 IonicContact NZ-OE2 2.82Å; K86-E89 PolarHBondContact NZ-OE2 3.44Å; K86-E89 VanDerWaalsContact O-CG 3.29Å; K86-E89 WeakPolarHBondContact O-CG 3.34Å |
| 87 | M | 87.8 | Confident | 87.5 | Confident | 124 Ų | 124 | 66.4 Ų | 66.4 | 61% | 0.611 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -79 | -28.6 | 176.6 | -67.6 | -179.7 | 97.7 | 0 | 0 | 112.2 | R83 L84 V85 T90 Q91 | R83-M87 WeakPolarHBondContact O-CG 3.45Å; R83-M87 PolarHBondContact O-N 3.5Å; L84-M87 PolarHBondContact O-N 2.83Å; L84-M87 VanDerWaalsContact O-N 3.11Å; V85-M87 VanDerWaalsContact C-N 3.27Å; V85-M87 PolarHBondContact O-N 3.37Å; M87-T90 PolarHBondContact O-OG1 3.07Å; M87-Q91 PolarHBondContact O-NE2 3.31Å |
| 88 | Y | 88.6 | Confident | 87.9 | Confident | 42 Ų | 42 | 67.8 Ų | 67.8 | 17% | 0.165 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -91.1 | -23.9 | 179.1 | -69 | -52 | 0 | 0 | 0 | 113.9 | L11 V13 T16 L84 V85 T90 Q91 D92 I95 | L11-Y88 WeakPolarHBondContact O-CE2 3.32Å; L11-Y88 PolarHBondContact O-OH 3.35Å; V13-Y88 HydrophobicContact CB-CD1 4.43Å; V13-Y88 HydrophobicContact CG2-CD1 3.48Å; V13-Y88 VanDerWaalsContact CG2-CD1 3.48Å; V13-Y88 HydrophobicContact CG2-CE1 3.44Å; V13-Y88 VanDerWaalsContact CG2-CE1 3.44Å; V13-Y88 HydrophobicContact CG2-CG 4.28Å; T16-Y88 HydrophobicContact CG2-CD2 4.04Å; T16-Y88 WeakPolarHBondContact OG1-CD2 3.45Å; T16-Y88 WeakPolarHBondContact OG1-CE2 3.45Å; L84-Y88 HydrophobicContact CD1-CE2 4.44Å; L84-Y88 HydrophobicContact CD2-CD2 3.63Å; L84-Y88 HydrophobicContact CD2-CE2 3.5Å; L84-Y88 HydrophobicContact CG-CD2 4.03Å; L84-Y88 HydrophobicContact CG-CE2 3.7Å; L84-Y88 VanDerWaalsContact O-CD2 3.27Å; L84-Y88 WeakPolarHBondContact O-CD2 3.26Å; L84-Y88 PolarHBondContact O-N 3.47Å; L84-Y88 VanDerWaalsContact O-N 3.08Å; V85-Y88 PolarHBondContact O-N 2.88Å; V85-Y88 VanDerWaalsContact O-N 3.15Å; Y88-T90 PolarHBondContact O-N 2.91Å; Y88-T90 VanDerWaalsContact O-N 3.14Å; Y88-Q91 PolarHBondContact O-N 3.03Å; Y88-D92 PolarHBondContact O-N 2.77Å; Y88-I95 HydrophobicContact CG-CD1 4.42Å |
| 89 | E | 87.1 | Confident | 88.1 | Confident | 41 Ų | 41 | 67.6 Ų | 67.6 | 19% | 0.192 | 36% | 0.355 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -22 | 174.2 | 66.1 | -176.6 | 55.2 | 0 | 0 | 112.8 | V85 K86 I95 A96 S99 K103 | V85-E89 WeakPolarHBondContact O-CB 3.45Å; V85-E89 PolarHBondContact O-N 2.93Å; K86-E89 IonicContact NZ-OE2 2.82Å; K86-E89 PolarHBondContact NZ-OE2 3.44Å; K86-E89 VanDerWaalsContact O-CG 3.29Å; K86-E89 WeakPolarHBondContact O-CG 3.34Å; E89-I95 HydrophobicContact CB-CG2 4.41Å; E89-A96 HydrophobicContact CB-CB 3.87Å; E89-S99 PolarHBondContact OE1-OG 3.22Å; E89-S99 VanDerWaalsContact OE1-OG 3.14Å; E89-K103 IonicContact OE1-NZ 2.7Å; E89-K103 PolarHBondContact OE1-NZ 3.33Å |
| 90 | T | 83.8 | Confident | 88.2 | Confident | 119 Ų | 119 | 64.1 Ų | 64.1 | 73% | 0.73 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -18.1 | 173.3 | 56.7 | 0 | 0 | 0 | 0 | 113.6 | M87 Y88 | M87-T90 PolarHBondContact O-OG1 3.07Å; Y88-T90 PolarHBondContact O-N 2.91Å; Y88-T90 VanDerWaalsContact O-N 3.14Å |
| 91 | Q | 85.9 | Confident | 88.3 | Confident | 131 Ų | 131 | 66.1 Ų | 66.1 | 61% | 0.612 | 35% | 0.354 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.9 | -32.5 | -178.5 | -67 | 176.3 | 78.1 | 0 | 0 | 111.8 | M87 Y88 | M87-Q91 PolarHBondContact O-NE2 3.31Å; Y88-Q91 PolarHBondContact O-N 3.03Å |
| 92 | D | 88.6 | Confident | 88.3 | Confident | 37 Ų | 37 | 66.6 Ų | 66.6 | 20% | 0.198 | 36% | 0.356 | C | S | . | . | trans | -130.5 | 117.1 | -175.6 | -174.1 | -82.5 | 0 | 0 | 0 | 110.9 | V13 Y88 E94 I95 A96 | V13-D92 HydrophobicContact CG1-CB 3.99Å; Y88-D92 PolarHBondContact O-N 2.77Å; D92-E94 PolarHBondContact O-N 3.01Å; D92-E94 VanDerWaalsContact OD1-CA 3.27Å; D92-E94 WeakPolarHBondContact OD1-CA 3.44Å; D92-E94 WeakPolarHBondContact OD1-CB 3.43Å; D92-E94 PolarHBondContact OD1-N 2.98Å; D92-I95 HydrophobicContact CB-CB 4.26Å; D92-I95 HydrophobicContact CB-CD1 4.01Å; D92-I95 HydrophobicContact CB-CG1 4.14Å; D92-I95 PolarHBondContact O-N 2.93Å; D92-I95 PolarHBondContact OD1-N 3.32Å; D92-A96 PolarHBondContact O-N 2.73Å | ||
| 93 | P | 87.8 | Confident | 88.1 | Confident | 107 Ų | 107 | 68.2 Ų | 68.2 | 70% | 0.695 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -69.4 | -21.2 | -178.6 | 28 | -34.2 | 0 | 0 | 0 | 113.1 | A96 A97 | P93-A96 WeakPolarHBondContact O-CB 3.3Å; P93-A96 PolarHBondContact O-N 3.22Å; P93-A97 PolarHBondContact O-N 3.16Å |
| 94 | E | 90.1 | Very high | 88 | Confident | 77 Ų | 77 | 63 Ų | 63 | 36% | 0.36 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -71.4 | -44.2 | 176.9 | -151 | -172.2 | 102.6 | 0 | 0 | 110.4 | R17 D92 A96 A97 M98 | R17-E94 WeakPolarHBondContact CD-OE1 3.35Å; R17-E94 WeakPolarHBondContact CG-OE1 3.48Å; R17-E94 IonicContact CZ-OE1 2.93Å; R17-E94 IonicContact CZ-OE2 3.5Å; R17-E94 IonicContact NE-OE1 2.69Å; R17-E94 PolarHBondContact NE-OE1 3.43Å; R17-E94 IonicContact NH1-OE1 3.02Å; R17-E94 PolarHBondContact NH1-OE1 3.02Å; R17-E94 IonicContact NH1-OE2 2.78Å; R17-E94 PolarHBondContact NH1-OE2 3.2Å; R17-E94 IonicContact NH2-OE1 3.57Å; D92-E94 PolarHBondContact O-N 3.01Å; D92-E94 VanDerWaalsContact OD1-CA 3.27Å; D92-E94 WeakPolarHBondContact OD1-CA 3.44Å; D92-E94 WeakPolarHBondContact OD1-CB 3.43Å; D92-E94 PolarHBondContact OD1-N 2.98Å; E94-A96 VanDerWaalsContact C-N 3.28Å; E94-A96 PolarHBondContact O-N 2.86Å; E94-A97 PolarHBondContact O-N 3.2Å; E94-M98 HydrophobicContact CG-CE 4.11Å; E94-M98 WeakPolarHBondContact O-CG 3.36Å; E94-M98 PolarHBondContact O-N 3.46Å; E94-M98 VanDerWaalsContact OE1-CE 3.26Å; E94-M98 WeakPolarHBondContact OE1-CE 3.1Å |
| 95 | I | 90.8 | Very high | 87.7 | Confident | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -60.6 | -40 | 172.2 | -67 | 176.8 | 0 | 0 | 0 | 110.6 | V13 T16 R17 L20 V85 Y88 E89 D92 M98 S99 | V13-I95 HydrophobicContact CG1-CD1 3.69Å; T16-I95 HydrophobicContact CG2-CD1 4.26Å; R17-I95 HydrophobicContact CB-CD1 4.38Å; R17-I95 HydrophobicContact CB-CG1 4.14Å; R17-I95 HydrophobicContact CG-CG1 4.24Å; L20-I95 HydrophobicContact CD2-CG2 4.13Å; V85-I95 HydrophobicContact CG1-CG2 3.96Å; Y88-I95 HydrophobicContact CG-CD1 4.42Å; E89-I95 HydrophobicContact CB-CG2 4.41Å; D92-I95 HydrophobicContact CB-CB 4.26Å; D92-I95 HydrophobicContact CB-CD1 4.01Å; D92-I95 HydrophobicContact CB-CG1 4.14Å; D92-I95 PolarHBondContact O-N 2.93Å; D92-I95 PolarHBondContact OD1-N 3.32Å; I95-M98 PolarHBondContact O-N 3.27Å; I95-S99 WeakPolarHBondContact O-CB 3.18Å; I95-S99 PolarHBondContact O-N 2.84Å |
| 96 | A | 90.6 | Very high | 87.1 | Confident | 34 Ų | 34 | 66.6 Ų | 66.6 | 28% | 0.281 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | E89 D92 P93 E94 S99 A100 | E89-A96 HydrophobicContact CB-CB 3.87Å; D92-A96 PolarHBondContact O-N 2.73Å; P93-A96 WeakPolarHBondContact O-CB 3.3Å; P93-A96 PolarHBondContact O-N 3.22Å; E94-A96 VanDerWaalsContact C-N 3.28Å; E94-A96 PolarHBondContact O-N 2.86Å; A96-S99 PolarHBondContact O-N 3.3Å; A96-A100 WeakPolarHBondContact O-CB 3.39Å; A96-A100 PolarHBondContact O-N 2.68Å |
| 97 | A | 91.1 | Very high | 86.3 | Confident | 64 Ų | 64 | 64.3 Ų | 64.3 | 53% | 0.529 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.5 | -43.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | P93 E94 A100 K101 | P93-A97 PolarHBondContact O-N 3.16Å; E94-A97 PolarHBondContact O-N 3.2Å; A97-A100 PolarHBondContact O-N 2.88Å; A97-K101 PolarHBondContact O-N 2.92Å |
| 98 | M | 90.3 | Very high | 85.1 | Confident | 32 Ų | 32 | 59.5 Ų | 59.5 | 16% | 0.158 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -65.7 | -41.1 | 176.2 | -72.3 | -178.6 | -173.8 | 0 | 0 | 112.1 | R17 L20 S21 I24 E94 I95 A100 K101 L102 | R17-M98 HydrophobicContact CG-CE 3.96Å; R17-M98 HydrophobicContact CG-SD 4.02Å; L20-M98 HydrophobicContact CB-SD 4.29Å; L20-M98 HydrophobicContact CD2-CB 3.29Å; L20-M98 HydrophobicContact CD2-CG 4.41Å; L20-M98 HydrophobicContact CD2-SD 4.33Å; L20-M98 HydrophobicContact CG-CB 3.95Å; S21-M98 WeakPolarHBondContact OG-CE 3.45Å; S21-M98 PolarHBondContact OG-SD 3.35Å; I24-M98 HydrophobicContact CD1-CB 3.86Å; I24-M98 HydrophobicContact CD1-CG 4.22Å; E94-M98 HydrophobicContact CG-CE 4.11Å; E94-M98 WeakPolarHBondContact O-CG 3.36Å; E94-M98 PolarHBondContact O-N 3.46Å; E94-M98 VanDerWaalsContact OE1-CE 3.26Å; E94-M98 WeakPolarHBondContact OE1-CE 3.1Å; I95-M98 PolarHBondContact O-N 3.27Å; M98-A100 VanDerWaalsContact C-N 3.34Å; M98-A100 PolarHBondContact O-N 3.06Å; M98-K101 PolarHBondContact O-N 2.75Å; M98-L102 WeakPolarHBondContact O-CB 3.46Å; M98-L102 PolarHBondContact O-N 3.06Å |
| 99 | S | 88.6 | Confident | 83.5 | Confident | 8 Ų | 8 | 62.5 Ų | 62.5 | 6% | 0.056 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -62 | -42.3 | 176.3 | 175.2 | 0 | 0 | 0 | 0 | 110.8 | E89 I95 A96 L102 K103 | E89-S99 PolarHBondContact OE1-OG 3.22Å; E89-S99 VanDerWaalsContact OE1-OG 3.14Å; I95-S99 WeakPolarHBondContact O-CB 3.18Å; I95-S99 PolarHBondContact O-N 2.84Å; A96-S99 PolarHBondContact O-N 3.3Å; S99-L102 PolarHBondContact O-N 3.31Å; S99-K103 WeakPolarHBondContact O-CB 3.11Å; S99-K103 VanDerWaalsContact O-CG 3.3Å; S99-K103 WeakPolarHBondContact O-CG 3.24Å; S99-K103 PolarHBondContact O-N 2.95Å; S99-K103 PolarHBondContact OG-NZ 3.03Å |
| 100 | A | 88.3 | Confident | 81.6 | Confident | 56 Ų | 56 | 65.4 Ų | 65.4 | 46% | 0.463 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -63.5 | -44.6 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | A96 A97 M98 L102 K103 A104 | A96-A100 WeakPolarHBondContact O-CB 3.39Å; A96-A100 PolarHBondContact O-N 2.68Å; A97-A100 PolarHBondContact O-N 2.88Å; M98-A100 VanDerWaalsContact C-N 3.34Å; M98-A100 PolarHBondContact O-N 3.06Å; A100-L102 PolarHBondContact O-N 3.37Å; A100-K103 PolarHBondContact O-N 2.77Å; A100-A104 WeakPolarHBondContact O-CB 3.32Å; A100-A104 PolarHBondContact O-N 3.07Å |
| 101 | K | 88.4 | Confident | 79.5 | Confident | 127 Ų | 127 | 65 Ų | 65 | 55% | 0.552 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -60.1 | -45.7 | 176.3 | -174.9 | 176.1 | 179.4 | -178.4 | 0 | 111.6 | I24 A97 M98 A104 L105 | I24-K101 HydrophobicContact CG2-CD 4.22Å; A97-K101 PolarHBondContact O-N 2.92Å; M98-K101 PolarHBondContact O-N 2.75Å; K101-A104 PolarHBondContact O-N 3.09Å; K101-L105 WeakPolarHBondContact O-CG 3.27Å; K101-L105 PolarHBondContact O-N 3.44Å; K101-L105 VanDerWaalsContact O-N 3.15Å |
| 102 | L | 86.9 | Confident | 77.3 | Confident | 13 Ų | 13 | 64.2 Ų | 64.2 | 7% | 0.068 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -60 | -50.1 | 176.3 | -177.6 | 58.7 | 0 | 0 | 0 | 111 | L20 V23 I24 F27 M98 S99 A100 A104 L105 L106 | L20-L102 HydrophobicContact CD1-CD2 3.94Å; V23-L102 HydrophobicContact CG1-CD1 3.67Å; V23-L102 HydrophobicContact CG1-CD2 3.88Å; V23-L102 HydrophobicContact CG1-CG 4.44Å; I24-L102 HydrophobicContact CG1-CB 4.24Å; I24-L102 HydrophobicContact CG1-CD1 4.36Å; F27-L102 HydrophobicContact CD2-CD1 3.77Å; F27-L102 HydrophobicContact CE2-CD1 3.49Å; F27-L102 VanDerWaalsContact CE2-CD1 3.49Å; F27-L102 HydrophobicContact CZ-CD1 4.34Å; M98-L102 WeakPolarHBondContact O-CB 3.46Å; M98-L102 PolarHBondContact O-N 3.06Å; S99-L102 PolarHBondContact O-N 3.31Å; A100-L102 PolarHBondContact O-N 3.37Å; L102-A104 VanDerWaalsContact C-N 3.26Å; L102-A104 PolarHBondContact O-N 3.46Å; L102-L105 WeakPolarHBondContact O-CB 3.24Å; L102-L105 PolarHBondContact O-N 2.82Å; L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 2.98Å |
| 103 | K | 84.1 | Confident | 74.9 | Confident | 88 Ų | 88 | 67.3 Ų | 67.3 | 38% | 0.383 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -57 | -38.7 | 176.3 | -74.3 | 167 | 179.6 | 140.1 | 0 | 112.5 | E89 S99 A100 L105 L106 L107 | E89-K103 IonicContact OE1-NZ 2.7Å; E89-K103 PolarHBondContact OE1-NZ 3.33Å; S99-K103 WeakPolarHBondContact O-CB 3.11Å; S99-K103 VanDerWaalsContact O-CG 3.3Å; S99-K103 WeakPolarHBondContact O-CG 3.24Å; S99-K103 PolarHBondContact O-N 2.95Å; S99-K103 PolarHBondContact OG-NZ 3.03Å; A100-K103 PolarHBondContact O-N 2.77Å; K103-L105 VanDerWaalsContact C-N 3.28Å; K103-L105 PolarHBondContact O-N 2.94Å; K103-L106 PolarHBondContact O-N 3.25Å; K103-L107 HydrophobicContact CB-CD1 4.46Å; K103-L107 WeakPolarHBondContact O-CB 3.27Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.81Å |
| 104 | A | 84.1 | Confident | 72.7 | Confident | 77 Ų | 77 | 67.7 Ų | 67.7 | 64% | 0.636 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -68.3 | -24.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | A100 K101 L102 | A100-A104 WeakPolarHBondContact O-CB 3.32Å; A100-A104 PolarHBondContact O-N 3.07Å; K101-A104 PolarHBondContact O-N 3.09Å; L102-A104 VanDerWaalsContact C-N 3.26Å; L102-A104 PolarHBondContact O-N 3.46Å |
| 105 | L | 81.5 | Confident | 71 | Confident | 81 Ų | 81 | 72.1 Ų | 72.1 | 42% | 0.424 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -77 | -29.7 | 172.1 | -67.1 | 170.7 | 0 | 0 | 0 | 112.2 | I24 F27 K101 L102 K103 | I24-L105 HydrophobicContact CG2-CD1 4.46Å; F27-L105 HydrophobicContact CB-CD1 4.22Å; K101-L105 WeakPolarHBondContact O-CG 3.27Å; K101-L105 PolarHBondContact O-N 3.44Å; K101-L105 VanDerWaalsContact O-N 3.15Å; L102-L105 WeakPolarHBondContact O-CB 3.24Å; L102-L105 PolarHBondContact O-N 2.82Å; K103-L105 VanDerWaalsContact C-N 3.28Å; K103-L105 PolarHBondContact O-N 2.94Å |
| 106 | L | 76.5 | Confident | 68.8 | Low | 24 Ų | 24 | 75.4 Ų | 75.4 | 13% | 0.126 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -92.1 | -36.6 | -175 | -55.9 | -167.5 | 0 | 0 | 0 | 113.5 | F27 M36 A58 L102 K103 | F27-L106 HydrophobicContact CD1-CD2 4.32Å; F27-L106 HydrophobicContact CE1-CD2 3.49Å; F27-L106 VanDerWaalsContact CE1-CD2 3.49Å; F27-L106 HydrophobicContact CE2-CD2 4.32Å; F27-L106 HydrophobicContact CZ-CD2 3.52Å; M36-L106 HydrophobicContact CE-CD2 3.84Å; A58-L106 HydrophobicContact CB-CD1 4.02Å; A58-L106 HydrophobicContact CB-CD2 3.27Å; A58-L106 HydrophobicContact CB-CG 4.16Å; L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 2.98Å; K103-L106 PolarHBondContact O-N 3.25Å |
| 107 | L | 70.9 | Confident | 66.6 | Low | 68 Ų | 68 | 76.9 Ų | 76.9 | 36% | 0.356 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -91.3 | 141.9 | -178.8 | -61.6 | 174.5 | 0 | 0 | 0 | 109.1 | L51 K103 | L51-L107 HydrophobicContact CD2-CD2 4.5Å; K103-L107 HydrophobicContact CB-CD1 4.46Å; K103-L107 WeakPolarHBondContact O-CB 3.27Å; K103-L107 WeakPolarHBondContact O-CG 3.37Å; K103-L107 PolarHBondContact O-N 2.81Å |
| 108 | P | 63.2 | Low | 64.3 | Low | 24 Ų | 24 | 78.3 Ų | 78.3 | 16% | 0.156 | 50% | 0.5 | C | S | . | . | trans | -53.2 | 156.6 | 164.4 | 19.8 | -26.6 | 0 | 0 | 0 | 109.6 | M47 M50 L110 | M47-P108 HydrophobicContact CG-CG 4.41Å; M50-P108 HydrophobicContact CE-CB 3.87Å; M50-P108 HydrophobicContact CE-CG 4.15Å; M50-P108 HydrophobicContact SD-CB 3.63Å; M50-P108 HydrophobicContact SD-CG 3.86Å; P108-L110 PolarHBondContact O-N 3.19Å | ||
| 109 | P | 54.9 | Low | 62.4 | Low | 105 Ų | 105 | 84.8 Ų | 84.8 | 68% | 0.682 | 53% | 0.533 | S | S | * | . | trans | -55.7 | 99.6 | 167.5 | 25.6 | -32.5 | 0 | 0 | 0 | 106.9 | S111 | P109-S111 VanDerWaalsContact C-N 3.32Å; P109-S111 PolarHBondContact O-N 3Å | ||
| 110 | L | 47.3 | Very low | 60.8 | Low | 101 Ų | 101 | 89.7 Ų | 89.7 | 53% | 0.529 | 57% | 0.565 | S | S | . | * | trans | -63.5 | 108.9 | 166.5 | -65.9 | 176.6 | 0 | 0 | 0 | 102.4 | M47 P108 T112 | M47-L110 HydrophobicContact CE-CD2 3.8Å; P108-L110 PolarHBondContact O-N 3.19Å; L110-T112 VanDerWaalsContact C-N 3.26Å; L110-T112 PolarHBondContact O-N 3.3Å | ||
| 111 | S | 39.1 | Very low | 59.2 | Low | 110 Ų | 110 | 92 Ų | 92 | 77% | 0.769 | 58% | 0.584 | S | S | * | * | trans | -44.8 | 106.8 | 162.3 | -55.8 | 0 | 0 | 0 | 0 | 104.6 | P109 P113 | P109-S111 VanDerWaalsContact C-N 3.32Å; P109-S111 PolarHBondContact O-N 3Å; S111-P113 VanDerWaalsContact O-CD 3.27Å; S111-P113 WeakPolarHBondContact O-CD 3.31Å | ||
| 112 | T | 39.8 | Very low | 57.9 | Low | 115 Ų | 115 | 94.8 Ų | 94.8 | 71% | 0.706 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -49 | 119.1 | 169.5 | 45.5 | 0 | 0 | 0 | 0 | 103.7 | L110 P114 | L110-T112 VanDerWaalsContact C-N 3.26Å; L110-T112 PolarHBondContact O-N 3.3Å; T112-P114 VanDerWaalsContact O-N 3.17Å |
| 113 | P | 38.9 | Very low | 56.5 | Low | 103 Ų | 103 | 98.9 Ų | 98.9 | 67% | 0.669 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 134.5 | 165.1 | 21 | -28.8 | 0 | 0 | 0 | 104.8 | S111 I115 | S111-P113 VanDerWaalsContact O-CD 3.27Å; S111-P113 WeakPolarHBondContact O-CD 3.31Å; P113-I115 PolarHBondContact O-N 2.64Å |
| 114 | P | 41.2 | Very low | 55 | Low | 115 Ų | 115 | 99.5 Ų | 99.5 | 75% | 0.747 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -51 | 122.9 | 175.7 | 24.5 | -31.2 | 0 | 0 | 0 | 104.2 | T112 G116 | T112-P114 VanDerWaalsContact O-N 3.17Å; P114-G116 WeakPolarHBondContact O-CA 3.42Å; P114-G116 PolarHBondContact O-N 2.91Å |
| 115 | I | 54.4 | Low | 53.4 | Low | 170 Ų | 170 | 100.7 Ų | 100.7 | 87% | 0.872 | 66% | 0.663 | S | S | * | * | trans | -58.6 | 95.4 | 172.5 | -62.6 | 166.7 | 0 | 0 | 0 | 102.8 | P113 G117 | P113-I115 PolarHBondContact O-N 2.64Å; I115-G117 PolarHBondContact O-N 3.21Å | ||
| 116 | G | 45.5 | Very low | 51.8 | Low | 68 Ų | 68 | 101.9 Ų | 101.9 | 70% | 0.701 | 68% | 0.677 | S | S | * | * | trans | -72.1 | 103.2 | -164.9 | 0 | 0 | 0 | 0 | 0 | 106.1 | P114 | P114-G116 WeakPolarHBondContact O-CA 3.42Å; P114-G116 PolarHBondContact O-N 2.91Å | ||
| 117 | G | 43.9 | Very low | 50.2 | Low | 65 Ų | 65 | 106.8 Ų | 106.8 | 67% | 0.67 | 71% | 0.711 | S | S | * | * | trans | 55.6 | 106.3 | 150.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | I115 I119 | I115-G117 PolarHBondContact O-N 3.21Å; G117-I119 PolarHBondContact O-N 2.95Å | ||
| 118 | A | 43.4 | Very low | 48.9 | Very low | 94 Ų | 94 | 109.3 Ų | 109.3 | 78% | 0.777 | 74% | 0.735 | S | S | * | * | trans | -25.3 | 124.2 | 146.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | P120 | A118-P120 WeakPolarHBondContact O-CD 3.17Š| ||
| 119 | I | 50 | Low | 47.8 | Very low | 168 Ų | 168 | 115.4 Ų | 115.4 | 86% | 0.862 | 78% | 0.776 | S | S | * | * | trans | -47.8 | 124.9 | 148.6 | 37 | 156.5 | 0 | 0 | 0 | 109.8 | G117 | G117-I119 PolarHBondContact O-N 2.95Š| ||
| 120 | P | 54.9 | Low | 47.3 | Very low | 111 Ų | 111 | 116.2 Ų | 116.2 | 72% | 0.721 | 78% | 0.784 | S | S | * | * | trans | -108.2 | 110.3 | 141.7 | 32 | -19.5 | 0 | 0 | 0 | 106.9 | A118 S122 | A118-P120 WeakPolarHBondContact O-CD 3.17Å; P120-S122 PolarHBondContact O-N 3.47Å | ||
| 121 | A | 54.4 | Low | 47.3 | Very low | 104 Ų | 104 | 117.5 Ų | 117.5 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -62.6 | 130.3 | 158.7 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 122 | S | 61.8 | Low | 48 | Very low | 187 Ų | 187 | 118.2 Ų | 118.2 | 100% | 1.308 | 81% | 0.808 | S | S | * | * | trans | -138.4 | 0 | 164.3 | -65 | 0 | 0 | 0 | 0 | 107.9 | P120 | P120-S122 PolarHBondContact O-N 3.47Š|
Retrieved 122 of 122 residues in 23.9 ms
(Link to these results)