| 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 | 43.5 | Very low | 51.2 | Low | 243 Ų | 243 | 115.5 Ų | 115.5 | 100% | 1.197 | 71% | 0.708 | S | S | * | * | 0 | 111 | 0 | -75.1 | 162 | 74.4 | 0 | 0 | 107 | S3 | M1-S3 PolarHBondContact O-N 3.27Š| |||
| 2 | A | 38.8 | Very low | 54.4 | Low | 107 Ų | 107 | 111.8 Ų | 111.8 | 88% | 0.884 | 69% | 0.685 | S | S | * | * | trans | -79.5 | 112.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | A4 | A2-A4 PolarHBondContact O-N 3.17Å; A2-A4 VanDerWaalsContact O-N 3.17Å | ||
| 3 | S | 41.1 | Very low | 57 | Low | 119 Ų | 119 | 106.5 Ų | 106.5 | 83% | 0.832 | 65% | 0.653 | S | S | * | * | trans | -62.3 | 114.9 | 171.1 | -58.9 | 0 | 0 | 0 | 0 | 108.1 | M1 | M1-S3 PolarHBondContact O-N 3.27Š| ||
| 4 | A | 41.6 | Very low | 59.4 | Low | 86 Ų | 86 | 109.6 Ų | 109.6 | 71% | 0.711 | 66% | 0.656 | S | S | * | * | trans | -55.8 | 137 | 169.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | A2 A6 | A2-A4 PolarHBondContact O-N 3.17Å; A2-A4 VanDerWaalsContact O-N 3.17Å; A4-A6 PolarHBondContact O-N 3.44Å; A4-A6 VanDerWaalsContact O-N 3.09Å | ||
| 5 | P | 40.9 | Very low | 61.4 | Low | 114 Ų | 114 | 108.1 Ų | 108.1 | 74% | 0.74 | 64% | 0.64 | S | S | * | * | trans | -58.2 | 121.9 | 170.6 | 24.1 | -30 | 0 | 0 | 0 | 106.9 | Q7 | P5-Q7 PolarHBondContact O-N 3.41Š| ||
| 6 | A | 47.4 | Very low | 63.2 | Low | 96 Ų | 96 | 101.4 Ų | 101.4 | 79% | 0.793 | 60% | 0.6 | S | S | * | * | trans | -54.1 | 104.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 107.2 | A4 Q8 | A4-A6 PolarHBondContact O-N 3.44Å; A4-A6 VanDerWaalsContact O-N 3.09Å; A6-Q8 PolarHBondContact O-N 3.18Å | ||
| 7 | Q | 45.8 | Very low | 64.9 | Low | 188 Ų | 188 | 101.6 Ų | 101.6 | 88% | 0.879 | 59% | 0.588 | S | S | * | * | trans | -59.4 | 112.4 | -178.8 | -71.4 | 175.4 | -60.7 | 0 | 0 | 106.5 | P5 | P5-Q7 PolarHBondContact O-N 3.41Š| ||
| 8 | Q | 53.4 | Low | 66.5 | Low | 140 Ų | 140 | 100 Ų | 100 | 65% | 0.654 | 58% | 0.58 | S | S | * | * | trans | -58.4 | 134.5 | 176.3 | -70.2 | 173.8 | -23.3 | 0 | 0 | 107.7 | A6 T10 | A6-Q8 PolarHBondContact O-N 3.18Å; Q8-T10 PolarHBondContact O-N 3.34Å; Q8-T10 PolarHBondContact O-OG1 3.04Å | ||
| 9 | P | 58.6 | Low | 67.9 | Low | 49 Ų | 49 | 94.7 Ų | 94.7 | 32% | 0.318 | 55% | 0.549 | S | S | . | . | trans | -63.9 | 104.6 | 172.5 | 14.3 | -15 | 0 | 0 | 0 | 108.4 | L11 F71 | P9-L11 PolarHBondContact O-N 3.26Å; P9-L11 VanDerWaalsContact O-N 3.16Å; P9-F71 HydrophobicContact CB-CE2 4.48Å; P9-F71 HydrophobicContact CG-CD2 4.35Å; P9-F71 HydrophobicContact CG-CE2 4.26Å; P9-F71 HydrophobicContact CG-CZ 4.38Å | ||
| 10 | T | 68.3 | Low | 69.1 | Low | 122 Ų | 122 | 90 Ų | 90 | 75% | 0.748 | 52% | 0.522 | S | S | * | . | trans | -82.1 | 86.1 | 172.8 | -16.8 | 0 | 0 | 0 | 0 | 107.2 | Q8 T12 | Q8-T10 PolarHBondContact O-N 3.34Å; Q8-T10 PolarHBondContact O-OG1 3.04Å; T10-T12 PolarHBondContact O-N 2.83Å | ||
| 11 | L | 83.9 | Confident | 70.3 | Confident | 6 Ų | 6 | 87.4 Ų | 87.4 | 3% | 0.031 | 51% | 0.508 | C | S | . | . | trans | -61.6 | 136.3 | 169.5 | -62.4 | 177.7 | 0 | 0 | 0 | 108.7 | P9 Q15 V19 Y69 F71 F81 L84 Y88 | P9-L11 PolarHBondContact O-N 3.26Å; P9-L11 VanDerWaalsContact O-N 3.16Å; L11-Q15 HydrophobicContact CB-CB 4.03Å; L11-Q15 HydrophobicContact CD2-CB 4.09Å; L11-V19 HydrophobicContact CD1-CB 4.47Å; L11-V19 HydrophobicContact CD1-CG2 3.94Å; L11-Y69 HydrophobicContact CD2-CD1 4.43Å; L11-F71 HydrophobicContact CD1-CE2 3.5Å; L11-F71 VanDerWaalsContact CD1-CE2 3.5Å; L11-F71 HydrophobicContact CD1-CZ 3.82Å; L11-F71 HydrophobicContact CD2-CE2 4.3Å; L11-F71 HydrophobicContact CG-CE2 3.8Å; L11-F71 HydrophobicContact CG-CZ 4.11Å; L11-F81 HydrophobicContact CD1-CD2 4.34Å; L11-F81 HydrophobicContact CD1-CE2 4.37Å; L11-L84 HydrophobicContact CB-CD1 3.92Å; L11-L84 HydrophobicContact CB-CD2 4.26Å; L11-L84 HydrophobicContact CD1-CD2 4.27Å; L11-L84 HydrophobicContact CG-CD1 4.36Å; L11-Y88 PolarHBondContact O-OH 3.23Å | ||
| 12 | T | 89.1 | Confident | 72.7 | Confident | 71 Ų | 71 | 79.8 Ų | 79.8 | 44% | 0.436 | 47% | 0.47 | S | S | . | . | trans | -69.9 | 167.2 | 169.2 | 63.7 | 0 | 0 | 0 | 0 | 110.8 | T10 E14 Q15 A16 | T10-T12 PolarHBondContact O-N 2.83Å; T12-E14 VanDerWaalsContact C-N 3.25Å; T12-E14 PolarHBondContact O-N 2.8Å; T12-Q15 PolarHBondContact O-N 3.15Å; T12-Q15 VanDerWaalsContact O-N 3.15Å; T12-Q15 WeakPolarHBondContact OG1-CG 3.46Å; T12-Q15 PolarHBondContact OG1-N 3.31Å; T12-A16 WeakPolarHBondContact O-CB 3.44Å; T12-A16 PolarHBondContact O-N 3.3Å | ||
| 13 | V | 88.8 | Confident | 75.4 | Confident | 43 Ų | 43 | 74.7 Ų | 74.7 | 26% | 0.261 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -52.4 | -46.6 | 174 | 179.1 | 0 | 0 | 0 | 0 | 110.7 | Q15 A16 R17 Y88 D92 I95 | V13-Q15 PolarHBondContact O-N 3.32Å; V13-A16 WeakPolarHBondContact O-CB 3.33Å; V13-A16 PolarHBondContact O-N 3.2Å; V13-R17 WeakPolarHBondContact O-CB 3.32Å; V13-R17 PolarHBondContact O-N 3.28Å; V13-Y88 HydrophobicContact CB-CD1 4.48Å; V13-Y88 HydrophobicContact CG2-CD1 3.54Å; V13-Y88 HydrophobicContact CG2-CE1 3.49Å; V13-Y88 VanDerWaalsContact CG2-CE1 3.49Å; V13-Y88 HydrophobicContact CG2-CG 4.26Å; V13-D92 HydrophobicContact CG1-CB 3.92Å; V13-I95 HydrophobicContact CG1-CD1 3.77Å |
| 14 | E | 90.2 | Very high | 77.9 | Confident | 151 Ų | 151 | 69.5 Ų | 69.5 | 71% | 0.706 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -62.3 | -43.9 | 179.1 | -62.4 | -176 | 94.3 | 0 | 0 | 111.9 | T12 R17 V18 | T12-E14 VanDerWaalsContact C-N 3.25Å; T12-E14 PolarHBondContact O-N 2.8Å; E14-R17 WeakPolarHBondContact O-CB 3.4Å; E14-R17 PolarHBondContact O-N 3.47Å; E14-V18 WeakPolarHBondContact O-CG2 3.12Å; E14-V18 PolarHBondContact O-N 3.27Å |
| 15 | Q | 90 | Very high | 80.4 | Confident | 87 Ų | 87 | 70.4 Ų | 70.4 | 41% | 0.407 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -65.4 | -43.2 | 175.9 | -73.9 | -174.6 | -31.3 | 0 | 0 | 111.7 | L11 T12 V13 R17 V18 V19 | L11-Q15 HydrophobicContact CB-CB 4.03Å; L11-Q15 HydrophobicContact CD2-CB 4.09Å; T12-Q15 PolarHBondContact O-N 3.15Å; T12-Q15 VanDerWaalsContact O-N 3.15Å; T12-Q15 WeakPolarHBondContact OG1-CG 3.46Å; T12-Q15 PolarHBondContact OG1-N 3.31Å; V13-Q15 PolarHBondContact O-N 3.32Å; Q15-R17 PolarHBondContact O-N 2.97Å; Q15-V18 PolarHBondContact O-N 3.48Å; Q15-V19 WeakPolarHBondContact O-CB 3.42Å; Q15-V19 WeakPolarHBondContact O-CG2 3.5Å; Q15-V19 PolarHBondContact O-N 3.16Å |
| 16 | A | 90.6 | Very high | 82.9 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -57.6 | -40.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | T12 V13 L20 L84 Y88 I95 | T12-A16 WeakPolarHBondContact O-CB 3.44Å; T12-A16 PolarHBondContact O-N 3.3Å; V13-A16 WeakPolarHBondContact O-CB 3.33Å; V13-A16 PolarHBondContact O-N 3.2Å; A16-L20 WeakPolarHBondContact O-CB 3.41Å; A16-L20 PolarHBondContact O-N 2.9Å; A16-L84 HydrophobicContact CB-CD2 3.6Å; A16-Y88 HydrophobicContact CB-CD2 3.58Å; A16-Y88 HydrophobicContact CB-CE2 3.9Å; A16-I95 HydrophobicContact CB-CD1 4.18Å |
| 17 | R | 91.9 | Very high | 85 | Confident | 106 Ų | 106 | 61.7 Ų | 61.7 | 40% | 0.4 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -63.3 | -47.1 | 175.6 | -162 | -174 | 92.7 | 169 | -0.1 | 112.2 | V13 E14 Q15 L20 S21 E94 I95 M98 | V13-R17 WeakPolarHBondContact O-CB 3.32Å; V13-R17 PolarHBondContact O-N 3.28Å; E14-R17 WeakPolarHBondContact O-CB 3.4Å; E14-R17 PolarHBondContact O-N 3.47Å; Q15-R17 PolarHBondContact O-N 2.97Å; R17-L20 PolarHBondContact O-N 3.18Å; R17-S21 WeakPolarHBondContact O-CB 3.36Å; R17-S21 PolarHBondContact O-N 2.98Å; R17-E94 WeakPolarHBondContact CD-OE1 3.48Å; R17-E94 IonicContact CZ-OE1 3.31Å; R17-E94 VanDerWaalsContact CZ-OE1 3.31Å; R17-E94 IonicContact NE-OE1 3.88Å; R17-E94 PolarHBondContact NE-OE1 2.8Å; R17-E94 VanDerWaalsContact NE-OE1 3.08Å; R17-E94 IonicContact NH1-OE1 3.41Å; R17-E94 PolarHBondContact NH1-OE1 3Å; R17-E94 IonicContact NH1-OE2 3.88Å; R17-I95 HydrophobicContact CB-CD1 4.27Å; R17-I95 HydrophobicContact CB-CG1 4.09Å; R17-I95 HydrophobicContact CG-CG1 4.2Å; R17-M98 HydrophobicContact CG-SD 4.3Å |
| 18 | V | 93.1 | Very high | 87.2 | Confident | 72 Ų | 72 | 57 Ų | 57 | 44% | 0.436 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61 | -51.1 | 176.3 | 173 | 0 | 0 | 0 | 0 | 110.4 | E14 Q15 L20 S21 E22 | E14-V18 WeakPolarHBondContact O-CG2 3.12Å; E14-V18 PolarHBondContact O-N 3.27Å; Q15-V18 PolarHBondContact O-N 3.48Å; V18-L20 VanDerWaalsContact C-N 3.3Å; V18-L20 PolarHBondContact O-N 2.85Å; V18-S21 VanDerWaalsContact O-CB 3.28Å; V18-S21 WeakPolarHBondContact O-CB 2.99Å; V18-S21 PolarHBondContact O-N 2.81Å; V18-S21 VanDerWaalsContact O-N 3.14Å; V18-E22 HydrophobicContact CG1-CG 4.39Å; V18-E22 WeakPolarHBondContact O-CG 3.38Å; V18-E22 PolarHBondContact O-N 3.08Å |
| 19 | V | 92.7 | Very high | 89.1 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 179.4 | 179.1 | 0 | 0 | 0 | 0 | 111.1 | L11 Q15 S21 E22 V23 I66 Y69 F81 | L11-V19 HydrophobicContact CD1-CB 4.47Å; L11-V19 HydrophobicContact CD1-CG2 3.94Å; Q15-V19 WeakPolarHBondContact O-CB 3.42Å; Q15-V19 WeakPolarHBondContact O-CG2 3.5Å; Q15-V19 PolarHBondContact O-N 3.16Å; V19-S21 VanDerWaalsContact C-N 3.34Å; V19-S21 PolarHBondContact O-N 3.09Å; V19-E22 PolarHBondContact O-N 3.15Å; V19-V23 HydrophobicContact CG1-CG2 4.47Å; V19-V23 WeakPolarHBondContact O-CB 3.44Å; V19-V23 VanDerWaalsContact O-CG2 3.28Å; V19-V23 WeakPolarHBondContact O-CG2 3.37Å; V19-V23 PolarHBondContact O-N 2.8Å; V19-I66 HydrophobicContact CG1-CG2 3.79Å; V19-Y69 HydrophobicContact CB-CE2 4.45Å; V19-Y69 HydrophobicContact CG1-CD2 4.23Å; V19-Y69 HydrophobicContact CG1-CE2 4.35Å; V19-Y69 HydrophobicContact CG2-CD1 3.43Å; V19-Y69 VanDerWaalsContact CG2-CD1 3.43Å; V19-Y69 HydrophobicContact CG2-CD2 3.7Å; V19-Y69 HydrophobicContact CG2-CE1 3.42Å; V19-Y69 VanDerWaalsContact CG2-CE1 3.42Å; V19-Y69 HydrophobicContact CG2-CE2 3.71Å; V19-Y69 HydrophobicContact CG2-CG 3.57Å; V19-F81 HydrophobicContact CB-CE2 3.92Å; V19-F81 HydrophobicContact CB-CZ 4.27Å; V19-F81 HydrophobicContact CG1-CD2 4.11Å; V19-F81 HydrophobicContact CG1-CE2 3.35Å; V19-F81 HydrophobicContact CG1-CZ 3.66Å |
| 20 | L | 92.7 | Very high | 90.8 | Very high | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 178.8 | -171 | 62.1 | 0 | 0 | 0 | 112 | A16 R17 V18 V23 I24 F81 V85 I95 M98 L102 | A16-L20 WeakPolarHBondContact O-CB 3.41Å; A16-L20 PolarHBondContact O-N 2.9Å; R17-L20 PolarHBondContact O-N 3.18Å; V18-L20 VanDerWaalsContact C-N 3.3Å; V18-L20 PolarHBondContact O-N 2.85Å; L20-V23 PolarHBondContact O-N 3.41Å; L20-I24 HydrophobicContact CG-CD1 4.36Å; L20-I24 WeakPolarHBondContact O-CD1 3.39Å; L20-I24 VanDerWaalsContact O-CG1 3.27Å; L20-I24 WeakPolarHBondContact O-CG1 3.39Å; L20-I24 PolarHBondContact O-N 3.37Å; L20-F81 HydrophobicContact CB-CZ 4.23Å; L20-F81 HydrophobicContact CD1-CE1 4.14Å; L20-F81 HydrophobicContact CD1-CZ 4.1Å; L20-V85 HydrophobicContact CD1-CG1 4.48Å; L20-V85 HydrophobicContact CD1-CG2 4.23Å; L20-V85 HydrophobicContact CD2-CG1 4.04Å; L20-I95 HydrophobicContact CD2-CG2 4.03Å; L20-M98 HydrophobicContact CB-SD 4.46Å; L20-M98 HydrophobicContact CD2-CB 3.36Å; L20-M98 HydrophobicContact CD2-CG 4.45Å; L20-M98 HydrophobicContact CD2-SD 4.34Å; L20-M98 HydrophobicContact CG-CB 3.79Å; L20-M98 HydrophobicContact CG-SD 4.39Å; L20-L102 HydrophobicContact CD1-CD2 3.69Å |
| 21 | S | 94 | Very high | 92 | Very high | 35 Ų | 35 | 57 Ų | 57 | 25% | 0.245 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.2 | -50 | 170.9 | -165.8 | 0 | 0 | 0 | 0 | 111.7 | R17 V18 V19 V23 I24 Q25 | R17-S21 WeakPolarHBondContact O-CB 3.36Å; R17-S21 PolarHBondContact O-N 2.98Å; V18-S21 VanDerWaalsContact O-CB 3.28Å; V18-S21 WeakPolarHBondContact O-CB 2.99Å; V18-S21 PolarHBondContact O-N 2.81Å; V18-S21 VanDerWaalsContact O-N 3.14Å; V19-S21 VanDerWaalsContact C-N 3.34Å; V19-S21 PolarHBondContact O-N 3.09Å; S21-V23 VanDerWaalsContact C-N 3.3Å; S21-V23 PolarHBondContact O-N 2.87Å; S21-I24 PolarHBondContact O-N 3.28Å; S21-I24 VanDerWaalsContact O-N 3.17Å; S21-Q25 WeakPolarHBondContact O-CG 3.28Å; S21-Q25 PolarHBondContact O-N 3.3Å; S21-Q25 PolarHBondContact OG-NE2 2.95Å |
| 22 | E | 94.7 | Very high | 92.5 | Very high | 83 Ų | 83 | 57.9 Ų | 57.9 | 39% | 0.388 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 179.1 | -68.8 | -71.2 | 96.2 | 0 | 0 | 111.1 | V18 V19 Q25 A26 V65 | V18-E22 HydrophobicContact CG1-CG 4.39Å; V18-E22 WeakPolarHBondContact O-CG 3.38Å; V18-E22 PolarHBondContact O-N 3.08Å; V19-E22 PolarHBondContact O-N 3.15Å; E22-Q25 PolarHBondContact O-N 2.92Å; E22-A26 WeakPolarHBondContact O-CB 3.47Å; E22-A26 PolarHBondContact O-N 3.5Å; E22-V65 HydrophobicContact CB-CG1 3.61Å |
| 23 | V | 93.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 56.3 Ų | 56.3 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.7 | -50.5 | 174.1 | 165.6 | 0 | 0 | 0 | 0 | 110.8 | V19 L20 S21 Q25 A26 F27 Q62 V65 I66 F81 L102 | V19-V23 HydrophobicContact CG1-CG2 4.47Å; V19-V23 WeakPolarHBondContact O-CB 3.44Å; V19-V23 VanDerWaalsContact O-CG2 3.28Å; V19-V23 WeakPolarHBondContact O-CG2 3.37Å; V19-V23 PolarHBondContact O-N 2.8Å; L20-V23 PolarHBondContact O-N 3.41Å; S21-V23 VanDerWaalsContact C-N 3.3Å; S21-V23 PolarHBondContact O-N 2.87Å; V23-Q25 VanDerWaalsContact C-N 3.3Å; V23-Q25 PolarHBondContact O-N 3.17Å; V23-A26 WeakPolarHBondContact O-CB 3.47Å; V23-A26 PolarHBondContact O-N 3.04Å; V23-A26 VanDerWaalsContact O-N 3.15Å; V23-F27 HydrophobicContact CG1-CD2 4.3Å; V23-F27 HydrophobicContact CG1-CE2 3.87Å; V23-F27 WeakPolarHBondContact O-CD2 3.27Å; V23-F27 PolarHBondContact O-N 3.35Å; V23-Q62 HydrophobicContact CG1-CG 3.72Å; V23-V65 HydrophobicContact CG2-CB 3.84Å; V23-V65 HydrophobicContact CG2-CG1 3.79Å; V23-V65 HydrophobicContact CG2-CG2 4.33Å; V23-I66 HydrophobicContact CG2-CG2 4.32Å; V23-F81 HydrophobicContact CG2-CE1 4.23Å; V23-F81 HydrophobicContact CG2-CZ 4.47Å; V23-L102 HydrophobicContact CG1-CD1 3.74Å; V23-L102 HydrophobicContact CG1-CD2 3.99Å |
| 24 | I | 93.4 | Very high | 92.9 | Very high | 10 Ų | 10 | 57 Ų | 57 | 5% | 0.051 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -62.2 | -39.7 | 179.8 | -68.5 | 164.2 | 0 | 0 | 0 | 111.1 | L20 S21 A26 F27 S28 M98 K101 L102 L105 | L20-I24 HydrophobicContact CG-CD1 4.36Å; L20-I24 WeakPolarHBondContact O-CD1 3.39Å; L20-I24 VanDerWaalsContact O-CG1 3.27Å; L20-I24 WeakPolarHBondContact O-CG1 3.39Å; L20-I24 PolarHBondContact O-N 3.37Å; S21-I24 PolarHBondContact O-N 3.28Å; S21-I24 VanDerWaalsContact O-N 3.17Å; I24-A26 VanDerWaalsContact C-N 3.35Å; I24-F27 PolarHBondContact O-N 3.47Å; I24-S28 PolarHBondContact O-OG 2.86Å; I24-M98 HydrophobicContact CD1-CB 3.78Å; I24-M98 HydrophobicContact CD1-CE 4.47Å; I24-M98 HydrophobicContact CD1-CG 4.13Å; I24-M98 WeakPolarHBondContact CD1-O 3.38Å; I24-K101 HydrophobicContact CD1-CD 4.47Å; I24-K101 HydrophobicContact CG2-CD 4.06Å; I24-L102 HydrophobicContact CG1-CB 4.24Å; I24-L102 HydrophobicContact CG1-CD1 4.41Å; I24-L105 HydrophobicContact CG2-CD1 4.31Å |
| 25 | Q | 94.1 | Very high | 93.1 | Very high | 106 Ų | 106 | 54 Ų | 54 | 50% | 0.495 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -66.3 | -37.2 | 175.4 | -72.1 | -177.9 | 55.5 | 0 | 0 | 111.9 | S21 E22 V23 F27 S28 V29 | S21-Q25 WeakPolarHBondContact O-CG 3.28Å; S21-Q25 PolarHBondContact O-N 3.3Å; S21-Q25 PolarHBondContact OG-NE2 2.95Å; E22-Q25 PolarHBondContact O-N 2.92Å; V23-Q25 VanDerWaalsContact C-N 3.3Å; V23-Q25 PolarHBondContact O-N 3.17Å; Q25-F27 PolarHBondContact O-N 3.14Å; Q25-S28 WeakPolarHBondContact O-CA 3.13Å; Q25-S28 WeakPolarHBondContact O-CB 3.5Å; Q25-S28 PolarHBondContact O-N 3.42Å; Q25-V29 PolarHBondContact O-N 2.63Å |
| 26 | A | 94.4 | Very high | 93.1 | Very high | 12 Ų | 12 | 50.4 Ų | 50.4 | 10% | 0.099 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60 | -34.6 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | E22 V23 I24 S28 V29 N32 I61 V65 | E22-A26 WeakPolarHBondContact O-CB 3.47Å; E22-A26 PolarHBondContact O-N 3.5Å; V23-A26 WeakPolarHBondContact O-CB 3.47Å; V23-A26 PolarHBondContact O-N 3.04Å; V23-A26 VanDerWaalsContact O-N 3.15Å; I24-A26 VanDerWaalsContact C-N 3.35Å; A26-S28 PolarHBondContact O-N 2.84Å; A26-V29 WeakPolarHBondContact O-CB 3.14Å; A26-V29 PolarHBondContact O-N 3.2Å; A26-N32 WeakPolarHBondContact O-CB 3.26Å; A26-N32 PolarHBondContact O-ND2 3.01Å; A26-I61 HydrophobicContact CB-CG2 3.66Å; A26-V65 HydrophobicContact CB-CG2 3.57Å |
| 27 | F | 92.5 | Very high | 93.2 | Very high | 14 Ų | 14 | 56.6 Ų | 56.6 | 6% | 0.061 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.6 | -20.6 | 171.9 | -77.3 | -82.7 | 0 | 0 | 0 | 113.9 | V23 I24 Q25 M36 A58 I61 Q62 L102 L105 L106 | V23-F27 HydrophobicContact CG1-CD2 4.3Å; V23-F27 HydrophobicContact CG1-CE2 3.87Å; V23-F27 WeakPolarHBondContact O-CD2 3.27Å; V23-F27 PolarHBondContact O-N 3.35Å; I24-F27 PolarHBondContact O-N 3.47Å; Q25-F27 PolarHBondContact O-N 3.14Å; F27-M36 HydrophobicContact CD1-CE 4.02Å; F27-M36 HydrophobicContact CD1-CG 4.02Å; F27-M36 HydrophobicContact CD1-SD 4.21Å; F27-M36 HydrophobicContact CE1-CE 3.77Å; F27-M36 HydrophobicContact CE1-CG 4.22Å; F27-M36 HydrophobicContact CE1-SD 3.83Å; F27-A58 HydrophobicContact CE1-CB 3.82Å; F27-A58 HydrophobicContact CZ-CB 3.88Å; F27-I61 HydrophobicContact CD1-CD1 3.88Å; F27-I61 HydrophobicContact CD1-CG2 4.41Å; F27-I61 HydrophobicContact CD2-CG2 4.16Å; F27-I61 HydrophobicContact CE1-CB 4.27Å; F27-I61 HydrophobicContact CE1-CD1 3.73Å; F27-I61 HydrophobicContact CE1-CG2 4.33Å; F27-I61 HydrophobicContact CE2-CB 4.49Å; F27-I61 HydrophobicContact CE2-CG2 4.02Å; F27-I61 HydrophobicContact CG-CG2 4.31Å; F27-I61 HydrophobicContact CZ-CB 4.1Å; F27-I61 HydrophobicContact CZ-CD1 4.42Å; F27-I61 HydrophobicContact CZ-CG2 4.1Å; F27-Q62 HydrophobicContact CE2-CG 3.96Å; F27-Q62 HydrophobicContact CZ-CG 4.08Å; F27-L102 HydrophobicContact CD2-CD1 3.93Å; F27-L102 HydrophobicContact CE2-CD1 3.54Å; F27-L102 HydrophobicContact CZ-CD1 4.34Å; F27-L105 HydrophobicContact CB-CD1 4.13Å; F27-L105 HydrophobicContact CG-CD1 4.38Å; F27-L106 HydrophobicContact CE1-CD2 3.7Å; F27-L106 HydrophobicContact CE2-CD2 4.32Å; F27-L106 HydrophobicContact CZ-CD2 3.5Å; F27-L106 VanDerWaalsContact CZ-CD2 3.5Å |
| 28 | S | 91.3 | Very high | 93.1 | Very high | 89 Ų | 89 | 58 Ų | 58 | 62% | 0.622 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | -7.7 | 179.3 | -49.8 | 0 | 0 | 0 | 0 | 112.9 | I24 Q25 A26 | I24-S28 PolarHBondContact O-OG 2.86Å; Q25-S28 WeakPolarHBondContact O-CA 3.13Å; Q25-S28 WeakPolarHBondContact O-CB 3.5Å; Q25-S28 PolarHBondContact O-N 3.42Å; A26-S28 PolarHBondContact O-N 2.84Å |
| 29 | V | 94.1 | Very high | 93.1 | Very high | 65 Ų | 65 | 55 Ų | 55 | 39% | 0.394 | 30% | 0.302 | S | S | . | . | S | Bend | trans | -64.2 | 132.8 | 173.5 | 173.5 | 0 | 0 | 0 | 0 | 108.4 | Q25 A26 E31 N32 A33 | Q25-V29 PolarHBondContact O-N 2.63Å; A26-V29 WeakPolarHBondContact O-CB 3.14Å; A26-V29 PolarHBondContact O-N 3.2Å; V29-E31 VanDerWaalsContact C-N 3.26Å; V29-E31 HydrophobicContact CG1-CB 4.39Å; V29-E31 PolarHBondContact O-N 3.4Å; V29-E31 VanDerWaalsContact O-N 3.14Å; V29-N32 HydrophobicContact CB-CB 4.35Å; V29-N32 PolarHBondContact O-N 3.43Å; V29-A33 WeakPolarHBondContact O-CB 3.28Å; V29-A33 PolarHBondContact O-N 3.35Å |
| 30 | P | 93 | Very high | 92.8 | Very high | 108 Ų | 108 | 58.3 Ų | 58.3 | 70% | 0.701 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -55.2 | -38.6 | -172.1 | 17.5 | -31.2 | 0 | 0 | 0 | 113.6 | A34 | P30-A34 VanDerWaalsContact O-CB 3.3Å; P30-A34 WeakPolarHBondContact O-CB 3.37Å; P30-A34 PolarHBondContact O-N 3.46Å |
| 31 | E | 93.9 | Very high | 92.7 | Very high | 139 Ų | 139 | 65.2 Ų | 65.2 | 65% | 0.65 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62.3 | -47.2 | 175.9 | -175.4 | 177.4 | 90.3 | 0 | 0 | 112.3 | V29 R35 | V29-E31 VanDerWaalsContact C-N 3.26Å; V29-E31 HydrophobicContact CG1-CB 4.39Å; V29-E31 PolarHBondContact O-N 3.4Å; V29-E31 VanDerWaalsContact O-N 3.14Å; E31-R35 VanDerWaalsContact O-CG 3.29Å; E31-R35 WeakPolarHBondContact O-CG 3.31Å; E31-R35 PolarHBondContact O-N 2.95Å; E31-R35 VanDerWaalsContact O-N 3.15Å |
| 32 | N | 94.4 | Very high | 92.4 | Very high | 24 Ų | 24 | 66.8 Ų | 66.8 | 13% | 0.128 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -72.2 | -37.9 | -179.7 | -70.5 | -27.1 | 0 | 0 | 0 | 112.2 | A26 V29 R35 M36 I61 | A26-N32 WeakPolarHBondContact O-CB 3.26Å; A26-N32 PolarHBondContact O-ND2 3.01Å; V29-N32 HydrophobicContact CB-CB 4.35Å; V29-N32 PolarHBondContact O-N 3.43Å; N32-R35 PolarHBondContact O-N 2.93Å; N32-M36 WeakPolarHBondContact O-CB 3.48Å; N32-M36 WeakPolarHBondContact O-CG 3.47Å; N32-M36 PolarHBondContact O-N 3.28Å; N32-I61 HydrophobicContact CB-CD1 3.74Å; N32-I61 HydrophobicContact CB-CG1 3.99Å |
| 33 | A | 92.5 | Very high | 92.1 | Very high | 38 Ų | 38 | 62.9 Ų | 62.9 | 31% | 0.314 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | V29 R35 M36 E37 | V29-A33 WeakPolarHBondContact O-CB 3.28Å; V29-A33 PolarHBondContact O-N 3.35Å; A33-R35 PolarHBondContact O-N 3.46Å; A33-M36 PolarHBondContact O-N 2.86Å; A33-E37 WeakPolarHBondContact O-CB 3.36Å; A33-E37 PolarHBondContact O-N 2.85Å |
| 34 | A | 93.6 | Very high | 91.5 | Very high | 57 Ų | 57 | 67.8 Ų | 67.8 | 47% | 0.471 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -60.1 | -44.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | P30 M36 E37 E38 | P30-A34 VanDerWaalsContact O-CB 3.3Å; P30-A34 WeakPolarHBondContact O-CB 3.37Å; P30-A34 PolarHBondContact O-N 3.46Å; A34-M36 VanDerWaalsContact C-N 3.34Å; A34-M36 PolarHBondContact O-N 2.74Å; A34-E37 PolarHBondContact O-N 2.72Å; A34-E38 WeakPolarHBondContact O-CB 3.31Å; A34-E38 PolarHBondContact O-N 3.01Å |
| 35 | R | 93.6 | Very high | 90.6 | Very high | 89 Ų | 89 | 74.4 Ų | 74.4 | 34% | 0.336 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.9 | -40 | 176.1 | -68.8 | 173.8 | 70.4 | -174.3 | 3.4 | 112.5 | E31 N32 A33 A39 V57 | E31-R35 VanDerWaalsContact O-CG 3.29Å; E31-R35 WeakPolarHBondContact O-CG 3.31Å; E31-R35 PolarHBondContact O-N 2.95Å; E31-R35 VanDerWaalsContact O-N 3.15Å; N32-R35 PolarHBondContact O-N 2.93Å; A33-R35 PolarHBondContact O-N 3.46Å; R35-A39 WeakPolarHBondContact O-CB 3.28Å; R35-A39 PolarHBondContact O-N 2.99Å; R35-A39 VanDerWaalsContact O-N 3.17Å; R35-V57 HydrophobicContact CB-CG1 3.78Å |
| 36 | M | 91.9 | Very high | 90.1 | Very high | 12 Ų | 12 | 73.1 Ų | 73.1 | 6% | 0.059 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -68.2 | -40.1 | 177 | -76 | -70.4 | -69.7 | 0 | 0 | 111.8 | F27 N32 A33 A34 R40 V54 V57 A58 I61 L105 | F27-M36 HydrophobicContact CD1-CE 4.02Å; F27-M36 HydrophobicContact CD1-CG 4.02Å; F27-M36 HydrophobicContact CD1-SD 4.21Å; F27-M36 HydrophobicContact CE1-CE 3.77Å; F27-M36 HydrophobicContact CE1-CG 4.22Å; F27-M36 HydrophobicContact CE1-SD 3.83Å; N32-M36 WeakPolarHBondContact O-CB 3.48Å; N32-M36 WeakPolarHBondContact O-CG 3.47Å; N32-M36 PolarHBondContact O-N 3.28Å; A33-M36 PolarHBondContact O-N 2.86Å; A34-M36 VanDerWaalsContact C-N 3.34Å; A34-M36 PolarHBondContact O-N 2.74Å; M36-R40 WeakPolarHBondContact O-CB 3.5Å; M36-R40 WeakPolarHBondContact O-CD 3.47Å; M36-R40 WeakPolarHBondContact O-CG 3.46Å; M36-R40 PolarHBondContact O-N 2.63Å; M36-V54 HydrophobicContact CE-CG1 3.55Å; M36-V54 HydrophobicContact SD-CG1 4.05Å; M36-V57 HydrophobicContact CG-CG1 4.06Å; M36-V57 HydrophobicContact SD-CB 4.15Å; M36-V57 HydrophobicContact SD-CG1 3.76Å; M36-A58 HydrophobicContact CE-CB 4.24Å; M36-A58 HydrophobicContact SD-CB 4.01Å; M36-I61 HydrophobicContact CG-CD1 3.67Å; M36-I61 HydrophobicContact SD-CD1 4.07Å; M36-L105 VanDerWaalsContact CE-O 3.3Å; M36-L105 WeakPolarHBondContact CE-O 3.34Å |
| 37 | E | 90.7 | Very high | 89.4 | Confident | 129 Ų | 129 | 76.9 Ų | 76.9 | 60% | 0.603 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -66.1 | -49.3 | 177.4 | -173.6 | 155.8 | 79.1 | 0 | 0 | 111.3 | A33 A34 A39 R40 E41 | A33-E37 WeakPolarHBondContact O-CB 3.36Å; A33-E37 PolarHBondContact O-N 2.85Å; A34-E37 PolarHBondContact O-N 2.72Å; E37-A39 VanDerWaalsContact C-N 3.29Å; E37-A39 PolarHBondContact O-N 3.28Å; E37-R40 CarbonylContact O-C 3.56Å; E37-R40 WeakPolarHBondContact O-CA 3.47Å; E37-R40 WeakPolarHBondContact O-CB 3.46Å; E37-R40 PolarHBondContact O-N 3.14Å; E37-E41 HydrophobicContact CG-CG 4.4Å; E37-E41 WeakPolarHBondContact O-CG 3.3Å; E37-E41 PolarHBondContact O-N 2.96Å |
| 38 | E | 91.9 | Very high | 89.1 | Confident | 135 Ų | 135 | 77.7 Ų | 77.7 | 63% | 0.631 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -57.2 | -42.8 | 177.2 | -174.9 | -177.8 | 89.2 | 0 | 0 | 111.9 | A34 R40 S42 | A34-E38 WeakPolarHBondContact O-CB 3.31Å; A34-E38 PolarHBondContact O-N 3.01Å; E38-R40 VanDerWaalsContact C-N 3.34Å; E38-R40 PolarHBondContact O-N 2.82Å; E38-S42 VanDerWaalsContact O-CB 3.24Å; E38-S42 WeakPolarHBondContact O-CB 3.41Å; E38-S42 PolarHBondContact O-N 2.84Å; E38-S42 PolarHBondContact O-OG 3.3Å |
| 39 | A | 91 | Very high | 88.9 | Confident | 10 Ų | 10 | 78.3 Ų | 78.3 | 8% | 0.083 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.7 | -36.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | R35 E37 A43 L53 V54 V57 | R35-A39 WeakPolarHBondContact O-CB 3.28Å; R35-A39 PolarHBondContact O-N 2.99Å; R35-A39 VanDerWaalsContact O-N 3.17Å; E37-A39 VanDerWaalsContact C-N 3.29Å; E37-A39 PolarHBondContact O-N 3.28Å; A39-A43 WeakPolarHBondContact O-CB 2.96Å; A39-A43 PolarHBondContact O-N 3.28Å; A39-L53 HydrophobicContact CB-CB 4.28Å; A39-V54 HydrophobicContact CB-CG2 4.01Å; A39-V57 HydrophobicContact CB-CG2 4.11Å |
| 40 | R | 87.2 | Confident | 88.5 | Confident | 70 Ų | 70 | 75.7 Ų | 75.7 | 26% | 0.264 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -70.7 | -44.2 | 177.1 | -76.7 | 168 | 178.2 | -79.4 | -1.3 | 111.7 | M36 E37 E38 A43 C44 M50 V54 L105 | M36-R40 WeakPolarHBondContact O-CB 3.5Å; M36-R40 WeakPolarHBondContact O-CD 3.47Å; M36-R40 WeakPolarHBondContact O-CG 3.46Å; M36-R40 PolarHBondContact O-N 2.63Å; E37-R40 CarbonylContact O-C 3.56Å; E37-R40 WeakPolarHBondContact O-CA 3.47Å; E37-R40 WeakPolarHBondContact O-CB 3.46Å; E37-R40 PolarHBondContact O-N 3.14Å; E38-R40 VanDerWaalsContact C-N 3.34Å; E38-R40 PolarHBondContact O-N 2.82Å; R40-A43 PolarHBondContact O-N 3.41Å; R40-C44 PolarHBondContact O-N 3.28Å; R40-M50 HydrophobicContact CG-CE 4.41Å; R40-V54 HydrophobicContact CB-CG2 4.33Å; R40-V54 HydrophobicContact CG-CG1 4.12Å; R40-V54 HydrophobicContact CG-CG2 3.62Å; R40-L105 VanDerWaalsContact NH2-C 3.31Å; R40-L105 PolarHBondContact NH2-O 3.48Å |
| 41 | E | 90.1 | Very high | 88.2 | Confident | 145 Ų | 145 | 74.5 Ų | 74.5 | 68% | 0.678 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -61.1 | -45.8 | 174.9 | -71.8 | -167.2 | 101.4 | 0 | 0 | 110.8 | E37 A43 C44 | E37-E41 HydrophobicContact CG-CG 4.4Å; E37-E41 WeakPolarHBondContact O-CG 3.3Å; E37-E41 PolarHBondContact O-N 2.96Å; E41-A43 PolarHBondContact O-N 3.32Å; E41-C44 PolarHBondContact O-N 3.39Å |
| 42 | S | 89.1 | Confident | 88 | Confident | 68 Ų | 68 | 75 Ų | 75 | 48% | 0.476 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -61.4 | -31.5 | 175.8 | -63.1 | 0 | 0 | 0 | 0 | 113.2 | E38 | E38-S42 VanDerWaalsContact O-CB 3.24Å; E38-S42 WeakPolarHBondContact O-CB 3.41Å; E38-S42 PolarHBondContact O-N 2.84Å; E38-S42 PolarHBondContact O-OG 3.3Å |
| 43 | A | 88.2 | Confident | 87.8 | Confident | 0 Ų | 0 | 77.2 Ų | 77.2 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -74.1 | -25 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A39 R40 E41 N45 D46 K49 M50 L53 | A39-A43 WeakPolarHBondContact O-CB 2.96Å; A39-A43 PolarHBondContact O-N 3.28Å; R40-A43 PolarHBondContact O-N 3.41Å; E41-A43 PolarHBondContact O-N 3.32Å; A43-N45 PolarHBondContact O-N 3.15Å; A43-D46 VanDerWaalsContact O-CB 3.24Å; A43-D46 WeakPolarHBondContact O-CB 3.44Å; A43-D46 PolarHBondContact O-N 2.88Å; A43-K49 HydrophobicContact CB-CB 3.76Å; A43-M50 HydrophobicContact CB-CB 4.3Å; A43-M50 HydrophobicContact CB-CG 3.49Å; A43-M50 VanDerWaalsContact CB-CG 3.49Å; A43-L53 HydrophobicContact CB-CD1 4.47Å |
| 44 | C | 81.6 | Confident | 87.6 | Confident | 104 Ų | 104 | 75.4 Ų | 75.4 | 70% | 0.703 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.3 | 50 | 174.8 | -170.7 | 0 | 0 | 0 | 0 | 113.5 | R40 E41 D46 | R40-C44 PolarHBondContact O-N 3.28Å; E41-C44 PolarHBondContact O-N 3.39Å; C44-D46 PolarHBondContact O-N 2.83Å |
| 45 | N | 72.8 | Confident | 87.4 | Confident | 149 Ų | 149 | 76.2 Ų | 76.2 | 80% | 0.797 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.4 | 6.3 | -175.6 | -88 | -11.9 | 0 | 0 | 0 | 116.2 | A43 M47 | A43-N45 PolarHBondContact O-N 3.15Å; N45-M47 PolarHBondContact O-N 3.29Å |
| 46 | D | 85.3 | Confident | 87.2 | Confident | 79 Ų | 79 | 74.7 Ų | 74.7 | 42% | 0.422 | 39% | 0.392 | S | S | . | . | trans | -75.7 | 113.6 | 171.6 | -175.1 | -83 | 0 | 0 | 0 | 109.6 | A43 C44 G48 K49 M50 | A43-D46 VanDerWaalsContact O-CB 3.24Å; A43-D46 WeakPolarHBondContact O-CB 3.44Å; A43-D46 PolarHBondContact O-N 2.88Å; C44-D46 PolarHBondContact O-N 2.83Å; D46-G48 PolarHBondContact O-N 2.82Å; D46-G48 VanDerWaalsContact OD1-CA 3.28Å; D46-G48 WeakPolarHBondContact OD1-CA 3.36Å; D46-G48 PolarHBondContact OD1-N 3.48Å; D46-K49 HydrophobicContact CB-CB 4.03Å; D46-K49 HydrophobicContact CB-CD 4.09Å; D46-K49 HydrophobicContact CB-CG 4.05Å; D46-K49 PolarHBondContact O-N 3.23Å; D46-K49 PolarHBondContact OD1-N 2.84Å; D46-M50 WeakPolarHBondContact O-CG 3.13Å; D46-M50 PolarHBondContact O-N 3.47Å | ||
| 47 | M | 79.6 | Confident | 87.3 | Confident | 90 Ų | 90 | 75.1 Ų | 75.1 | 44% | 0.443 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -56.3 | -39.1 | -179.3 | -168.3 | 84.2 | 174.7 | 0 | 0 | 111.9 | N45 M50 L51 P108 L110 | N45-M47 PolarHBondContact O-N 3.29Å; M47-M50 PolarHBondContact O-N 3.22Å; M47-L51 WeakPolarHBondContact O-CG 3.39Å; M47-L51 PolarHBondContact O-N 3.39Å; M47-P108 HydrophobicContact CE-CG 4.09Å; M47-P108 HydrophobicContact SD-CG 3.42Å; M47-P108 WeakPolarHBondContact SD-CG 3.41Å; M47-L110 HydrophobicContact CE-CD2 3.93Å |
| 48 | G | 85.3 | Confident | 87.3 | Confident | 31 Ų | 31 | 69 Ų | 69 | 32% | 0.32 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.7 | -45.6 | 179 | 0 | 0 | 0 | 0 | 0 | 111.6 | D46 L51 Q52 | D46-G48 PolarHBondContact O-N 2.82Å; D46-G48 VanDerWaalsContact OD1-CA 3.28Å; D46-G48 WeakPolarHBondContact OD1-CA 3.36Å; D46-G48 PolarHBondContact OD1-N 3.48Å; G48-L51 PolarHBondContact O-N 3.42Å; G48-Q52 VanDerWaalsContact O-CG 3.3Å; G48-Q52 WeakPolarHBondContact O-CG 3.29Å; G48-Q52 PolarHBondContact O-N 3.47Å |
| 49 | K | 86.8 | Confident | 87.2 | Confident | 102 Ų | 102 | 64.4 Ų | 64.4 | 44% | 0.443 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -68.1 | -35.1 | 174.6 | -67.6 | -176.1 | 178.2 | 178.4 | 0 | 112.4 | A43 D46 L51 Q52 L53 | A43-K49 HydrophobicContact CB-CB 3.76Å; D46-K49 HydrophobicContact CB-CB 4.03Å; D46-K49 HydrophobicContact CB-CD 4.09Å; D46-K49 HydrophobicContact CB-CG 4.05Å; D46-K49 PolarHBondContact O-N 3.23Å; D46-K49 PolarHBondContact OD1-N 2.84Å; K49-L51 VanDerWaalsContact C-N 3.3Å; K49-L51 PolarHBondContact O-N 3.35Å; K49-Q52 CarbonylContact O-C 3.54Å; K49-Q52 PolarHBondContact O-N 3.42Å; K49-Q52 VanDerWaalsContact O-N 3.09Å; K49-L53 HydrophobicContact CB-CD1 4.23Å; K49-L53 VanDerWaalsContact O-CB 3.24Å; K49-L53 WeakPolarHBondContact O-CB 3.15Å; K49-L53 WeakPolarHBondContact O-CG 3.44Å; K49-L53 PolarHBondContact O-N 2.9Å |
| 50 | M | 86.3 | Confident | 87.3 | Confident | 10 Ų | 10 | 68 Ų | 68 | 5% | 0.049 | 36% | 0.363 | C | S | . | . | I | π-helix | trans | -60.5 | -43.6 | 173.7 | -73.9 | -166.4 | 72.8 | 0 | 0 | 110.9 | R40 A43 D46 M47 Q52 V54 L55 P108 | R40-M50 HydrophobicContact CG-CE 4.41Å; A43-M50 HydrophobicContact CB-CB 4.3Å; A43-M50 HydrophobicContact CB-CG 3.49Å; A43-M50 VanDerWaalsContact CB-CG 3.49Å; D46-M50 WeakPolarHBondContact O-CG 3.13Å; D46-M50 PolarHBondContact O-N 3.47Å; M47-M50 PolarHBondContact O-N 3.22Å; M50-Q52 VanDerWaalsContact C-N 3.29Å; M50-Q52 PolarHBondContact O-N 3.01Å; M50-V54 HydrophobicContact CB-CG2 4.35Å; M50-V54 HydrophobicContact CE-CG2 4.34Å; M50-V54 HydrophobicContact CG-CG2 4.35Å; M50-V54 WeakPolarHBondContact O-CA 3.46Å; M50-V54 WeakPolarHBondContact O-CB 3.33Å; M50-V54 PolarHBondContact O-N 3.18Å; M50-L55 PolarHBondContact O-N 3.38Å; M50-L55 VanDerWaalsContact O-N 3.14Å; M50-P108 HydrophobicContact CE-CB 3.73Å; M50-P108 HydrophobicContact CE-CG 3.98Å; M50-P108 HydrophobicContact SD-CB 3.51Å; M50-P108 VanDerWaalsContact SD-CB 3.51Å; M50-P108 HydrophobicContact SD-CG 3.67Å |
| 51 | L | 86.6 | Confident | 87.5 | Confident | 84 Ų | 84 | 64.7 Ų | 64.7 | 44% | 0.44 | 35% | 0.351 | S | S | . | . | I | π-helix | trans | -69.7 | -23.5 | 174.8 | -64.3 | 175.4 | 0 | 0 | 0 | 113.4 | M47 G48 K49 L55 | M47-L51 WeakPolarHBondContact O-CG 3.39Å; M47-L51 PolarHBondContact O-N 3.39Å; G48-L51 PolarHBondContact O-N 3.42Å; K49-L51 VanDerWaalsContact C-N 3.3Å; K49-L51 PolarHBondContact O-N 3.35Å; L51-L55 HydrophobicContact CD2-CD2 4.37Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.45Å |
| 52 | Q | 88.9 | Confident | 87.6 | Confident | 148 Ų | 148 | 58.5 Ų | 58.5 | 69% | 0.692 | 32% | 0.322 | S | S | * | . | I | π-helix | trans | -92.4 | -23.2 | 178.5 | -71.2 | 180 | 42.9 | 0 | 0 | 114.5 | G48 K49 M50 P56 | G48-Q52 VanDerWaalsContact O-CG 3.3Å; G48-Q52 WeakPolarHBondContact O-CG 3.29Å; G48-Q52 PolarHBondContact O-N 3.47Å; K49-Q52 CarbonylContact O-C 3.54Å; K49-Q52 PolarHBondContact O-N 3.42Å; K49-Q52 VanDerWaalsContact O-N 3.09Å; M50-Q52 VanDerWaalsContact C-N 3.29Å; M50-Q52 PolarHBondContact O-N 3.01Å; Q52-P56 VanDerWaalsContact O-CG 3.29Å; Q52-P56 WeakPolarHBondContact O-CG 3.19Å |
| 53 | L | 90.5 | Very high | 87.7 | Confident | 71 Ų | 71 | 56.3 Ų | 56.3 | 37% | 0.372 | 30% | 0.304 | S | S | . | . | I | π-helix | trans | -113.8 | -48.8 | -174.9 | -60.3 | 178 | 0 | 0 | 0 | 111.8 | A39 A43 K49 V57 | A39-L53 HydrophobicContact CB-CB 4.28Å; A43-L53 HydrophobicContact CB-CD1 4.47Å; K49-L53 HydrophobicContact CB-CD1 4.23Å; K49-L53 VanDerWaalsContact O-CB 3.24Å; K49-L53 WeakPolarHBondContact O-CB 3.15Å; K49-L53 WeakPolarHBondContact O-CG 3.44Å; K49-L53 PolarHBondContact O-N 2.9Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å |
| 54 | V | 89.8 | Confident | 87.8 | Confident | 1 Ų | 1 | 61.1 Ų | 61.1 | 1% | 0.006 | 33% | 0.326 | C | S | . | . | I | π-helix | trans | -77.7 | -42.9 | -176.5 | -175.5 | 0 | 0 | 0 | 0 | 110.8 | M36 A39 R40 M50 V57 A58 | M36-V54 HydrophobicContact CE-CG1 3.55Å; M36-V54 HydrophobicContact SD-CG1 4.05Å; A39-V54 HydrophobicContact CB-CG2 4.01Å; R40-V54 HydrophobicContact CB-CG2 4.33Å; R40-V54 HydrophobicContact CG-CG1 4.12Å; R40-V54 HydrophobicContact CG-CG2 3.62Å; M50-V54 HydrophobicContact CB-CG2 4.35Å; M50-V54 HydrophobicContact CE-CG2 4.34Å; M50-V54 HydrophobicContact CG-CG2 4.35Å; M50-V54 WeakPolarHBondContact O-CA 3.46Å; M50-V54 WeakPolarHBondContact O-CB 3.33Å; M50-V54 PolarHBondContact O-N 3.18Å; V54-V57 PolarHBondContact O-N 3.44Å; V54-A58 WeakPolarHBondContact O-CB 3.36Å; V54-A58 PolarHBondContact O-N 3.44Å |
| 55 | L | 88.7 | Confident | 88.3 | Confident | 74 Ų | 74 | 57.2 Ų | 57.2 | 39% | 0.387 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62.1 | -42.8 | -177.8 | -175.6 | 67.4 | 0 | 0 | 0 | 113.2 | M50 L51 A58 T59 | M50-L55 PolarHBondContact O-N 3.38Å; M50-L55 VanDerWaalsContact O-N 3.14Å; L51-L55 HydrophobicContact CD2-CD2 4.37Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.45Å; L55-A58 PolarHBondContact O-N 3.27Å; L55-T59 WeakPolarHBondContact O-CB 3.41Å; L55-T59 PolarHBondContact O-N 3.21Å; L55-T59 PolarHBondContact O-OG1 3.26Å |
| 56 | P | 90.1 | Very high | 89.1 | Confident | 57 Ų | 57 | 50.1 Ų | 50.1 | 37% | 0.37 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.1 | -35.2 | 175.6 | -23.5 | 36 | 0 | 0 | 0 | 113.6 | Q52 T59 Q60 | Q52-P56 VanDerWaalsContact O-CG 3.29Å; Q52-P56 WeakPolarHBondContact O-CG 3.19Å; P56-T59 PolarHBondContact O-N 2.96Å; P56-Q60 WeakPolarHBondContact O-CG 3.35Å; P56-Q60 PolarHBondContact O-N 2.88Å; P56-Q60 PolarHBondContact O-NE2 2.94Å |
| 57 | V | 92.5 | Very high | 89.3 | Confident | 20 Ų | 20 | 51 Ų | 51 | 12% | 0.121 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.2 | -47.7 | 175.4 | 174.6 | 0 | 0 | 0 | 0 | 110 | R35 M36 A39 L53 V54 T59 Q60 I61 | R35-V57 HydrophobicContact CB-CG1 3.78Å; M36-V57 HydrophobicContact CG-CG1 4.06Å; M36-V57 HydrophobicContact SD-CB 4.15Å; M36-V57 HydrophobicContact SD-CG1 3.76Å; A39-V57 HydrophobicContact CB-CG2 4.11Å; L53-V57 VanDerWaalsContact O-CG2 3.3Å; L53-V57 WeakPolarHBondContact O-CG2 3.42Å; V54-V57 PolarHBondContact O-N 3.44Å; V57-T59 VanDerWaalsContact C-N 3.33Å; V57-T59 PolarHBondContact O-N 2.97Å; V57-Q60 WeakPolarHBondContact O-CB 3.38Å; V57-Q60 PolarHBondContact O-N 3.42Å; V57-I61 HydrophobicContact CG1-CD1 4.06Å; V57-I61 WeakPolarHBondContact O-CG1 3.16Å; V57-I61 PolarHBondContact O-N 2.89Å |
| 58 | A | 91.1 | Very high | 89.7 | Confident | 1 Ų | 1 | 50.7 Ų | 50.7 | 1% | 0.008 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -58.6 | -43.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | F27 M36 V54 L55 Q60 I61 Q62 L106 | F27-A58 HydrophobicContact CE1-CB 3.82Å; F27-A58 HydrophobicContact CZ-CB 3.88Å; M36-A58 HydrophobicContact CE-CB 4.24Å; M36-A58 HydrophobicContact SD-CB 4.01Å; V54-A58 WeakPolarHBondContact O-CB 3.36Å; V54-A58 PolarHBondContact O-N 3.44Å; L55-A58 PolarHBondContact O-N 3.27Å; A58-Q60 VanDerWaalsContact C-N 3.3Å; A58-Q60 PolarHBondContact O-N 3.03Å; A58-I61 PolarHBondContact O-N 3.01Å; A58-Q62 WeakPolarHBondContact O-CG 3.36Å; A58-Q62 PolarHBondContact O-N 3.47Å; A58-L106 HydrophobicContact CB-CD2 3.26Å; A58-L106 HydrophobicContact CB-CG 4.49Å |
| 59 | T | 90.9 | Very high | 89.7 | Confident | 39 Ų | 39 | 52.6 Ų | 52.6 | 24% | 0.239 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.4 | -42 | 178 | -58.4 | 0 | 0 | 0 | 0 | 110.3 | L55 P56 V57 Q62 Q63 V78 | L55-T59 WeakPolarHBondContact O-CB 3.41Å; L55-T59 PolarHBondContact O-N 3.21Å; L55-T59 PolarHBondContact O-OG1 3.26Å; P56-T59 PolarHBondContact O-N 2.96Å; V57-T59 VanDerWaalsContact C-N 3.33Å; V57-T59 PolarHBondContact O-N 2.97Å; T59-Q62 PolarHBondContact O-N 2.85Å; T59-Q63 WeakPolarHBondContact O-CB 3.5Å; T59-Q63 PolarHBondContact O-N 2.98Å; T59-V78 HydrophobicContact CG2-CB 4.15Å; T59-V78 HydrophobicContact CG2-CG1 4.25Å; T59-V78 HydrophobicContact CG2-CG2 3.87Å |
| 60 | Q | 91.5 | Very high | 89.5 | Confident | 84 Ų | 84 | 50.4 Ų | 50.4 | 39% | 0.393 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.9 | -45.6 | 174.8 | -75.2 | 171.7 | 78.2 | 0 | 0 | 112.2 | P56 V57 A58 Q62 Q63 E64 | P56-Q60 WeakPolarHBondContact O-CG 3.35Å; P56-Q60 PolarHBondContact O-N 2.88Å; P56-Q60 PolarHBondContact O-NE2 2.94Å; V57-Q60 WeakPolarHBondContact O-CB 3.38Å; V57-Q60 PolarHBondContact O-N 3.42Å; A58-Q60 VanDerWaalsContact C-N 3.3Å; A58-Q60 PolarHBondContact O-N 3.03Å; Q60-Q62 VanDerWaalsContact C-N 3.34Å; Q60-Q62 PolarHBondContact O-N 3.34Å; Q60-Q63 WeakPolarHBondContact O-CB 3.39Å; Q60-Q63 PolarHBondContact O-N 3.11Å; Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.43Å |
| 61 | I | 92.7 | Very high | 89.4 | Confident | 2 Ų | 2 | 50.6 Ų | 50.6 | 1% | 0.01 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -59.6 | -46.9 | 178.2 | -64.6 | 162.4 | 0 | 0 | 0 | 110.5 | A26 F27 N32 M36 V57 A58 Q63 E64 V65 | A26-I61 HydrophobicContact CB-CG2 3.66Å; F27-I61 HydrophobicContact CD1-CD1 3.88Å; F27-I61 HydrophobicContact CD1-CG2 4.41Å; F27-I61 HydrophobicContact CD2-CG2 4.16Å; F27-I61 HydrophobicContact CE1-CB 4.27Å; F27-I61 HydrophobicContact CE1-CD1 3.73Å; F27-I61 HydrophobicContact CE1-CG2 4.33Å; F27-I61 HydrophobicContact CE2-CB 4.49Å; F27-I61 HydrophobicContact CE2-CG2 4.02Å; F27-I61 HydrophobicContact CG-CG2 4.31Å; F27-I61 HydrophobicContact CZ-CB 4.1Å; F27-I61 HydrophobicContact CZ-CD1 4.42Å; F27-I61 HydrophobicContact CZ-CG2 4.1Å; N32-I61 HydrophobicContact CB-CD1 3.74Å; N32-I61 HydrophobicContact CB-CG1 3.99Å; M36-I61 HydrophobicContact CG-CD1 3.67Å; M36-I61 HydrophobicContact SD-CD1 4.07Å; V57-I61 HydrophobicContact CG1-CD1 4.06Å; V57-I61 WeakPolarHBondContact O-CG1 3.16Å; V57-I61 PolarHBondContact O-N 2.89Å; A58-I61 PolarHBondContact O-N 3.01Å; I61-Q63 VanDerWaalsContact C-N 3.32Å; I61-Q63 PolarHBondContact O-N 3.34Å; I61-E64 PolarHBondContact O-N 2.87Å; I61-V65 PolarHBondContact O-N 3.31Å |
| 62 | Q | 91.8 | Very high | 88.7 | Confident | 14 Ų | 14 | 50.9 Ų | 50.9 | 7% | 0.065 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.4 | -44.6 | 176.8 | -70.9 | -179.9 | 4.2 | 0 | 0 | 111.5 | V23 F27 A58 T59 Q60 E64 V65 I66 V78 L106 | V23-Q62 HydrophobicContact CG1-CG 3.72Å; F27-Q62 HydrophobicContact CE2-CG 3.96Å; F27-Q62 HydrophobicContact CZ-CG 4.08Å; A58-Q62 WeakPolarHBondContact O-CG 3.36Å; A58-Q62 PolarHBondContact O-N 3.47Å; T59-Q62 PolarHBondContact O-N 2.85Å; Q60-Q62 VanDerWaalsContact C-N 3.34Å; Q60-Q62 PolarHBondContact O-N 3.34Å; Q62-E64 VanDerWaalsContact C-N 3.35Å; Q62-E64 PolarHBondContact O-N 3.1Å; Q62-V65 PolarHBondContact O-N 2.98Å; Q62-I66 WeakPolarHBondContact O-CG1 3.39Å; Q62-I66 WeakPolarHBondContact O-CG2 3.45Å; Q62-I66 PolarHBondContact O-N 3.32Å; Q62-V78 HydrophobicContact CB-CG1 4.27Å; Q62-V78 HydrophobicContact CB-CG2 4.13Å; Q62-L106 VanDerWaalsContact NE2-CD1 3.33Å |
| 63 | Q | 91.1 | Very high | 87.6 | Confident | 23 Ų | 23 | 48 Ų | 48 | 11% | 0.107 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.4 | -41.5 | -179.7 | -176.6 | 167.5 | 50.3 | 0 | 0 | 113 | T59 Q60 I61 V65 I66 K67 N73 G75 V78 | T59-Q63 WeakPolarHBondContact O-CB 3.5Å; T59-Q63 PolarHBondContact O-N 2.98Å; Q60-Q63 WeakPolarHBondContact O-CB 3.39Å; Q60-Q63 PolarHBondContact O-N 3.11Å; I61-Q63 VanDerWaalsContact C-N 3.32Å; I61-Q63 PolarHBondContact O-N 3.34Å; Q63-V65 PolarHBondContact O-N 3.17Å; Q63-I66 PolarHBondContact O-N 3.08Å; Q63-K67 WeakPolarHBondContact O-CB 3.33Å; Q63-K67 PolarHBondContact O-N 3.48Å; Q63-N73 WeakPolarHBondContact CG-ND2 3.36Å; Q63-N73 PolarHBondContact NE2-O 2.91Å; Q63-G75 VanDerWaalsContact NE2-N 3.16Å; Q63-V78 HydrophobicContact CB-CG2 3.92Å |
| 64 | E | 90.9 | Very high | 86.5 | Confident | 100 Ų | 100 | 52.1 Ų | 52.1 | 47% | 0.467 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.6 | -29.1 | 177.7 | -74.2 | -66.2 | 94.5 | 0 | 0 | 113 | Q60 I61 Q62 K67 | Q60-E64 WeakPolarHBondContact O-CG 3.43Å; Q60-E64 PolarHBondContact O-N 3.43Å; I61-E64 PolarHBondContact O-N 2.87Å; Q62-E64 VanDerWaalsContact C-N 3.35Å; Q62-E64 PolarHBondContact O-N 3.1Å; E64-K67 VanDerWaalsContact O-CE 3.26Å; E64-K67 WeakPolarHBondContact O-CE 3.35Å; E64-K67 VanDerWaalsContact O-CG 3.31Å; E64-K67 WeakPolarHBondContact O-CG 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.44Å; E64-K67 IonicContact OE1-NZ 3.08Å; E64-K67 PolarHBondContact OE1-NZ 3.41Å; E64-K67 IonicContact OE2-NZ 2.93Å; E64-K67 PolarHBondContact OE2-NZ 3.4Å |
| 65 | V | 91.7 | Very high | 85.4 | Confident | 23 Ų | 23 | 53.2 Ų | 53.2 | 14% | 0.139 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -80.9 | -52.1 | 175 | 179.6 | 0 | 0 | 0 | 0 | 110.6 | E22 V23 A26 I61 Q62 Q63 K67 A68 Y69 | E22-V65 HydrophobicContact CB-CG1 3.61Å; V23-V65 HydrophobicContact CG2-CB 3.84Å; V23-V65 HydrophobicContact CG2-CG1 3.79Å; V23-V65 HydrophobicContact CG2-CG2 4.33Å; A26-V65 HydrophobicContact CB-CG2 3.57Å; I61-V65 PolarHBondContact O-N 3.31Å; Q62-V65 PolarHBondContact O-N 2.98Å; Q63-V65 PolarHBondContact O-N 3.17Å; V65-K67 VanDerWaalsContact C-N 3.26Å; V65-K67 PolarHBondContact O-N 3.17Å; V65-A68 WeakPolarHBondContact O-CB 3.35Å; V65-A68 PolarHBondContact O-N 2.97Å; V65-Y69 HydrophobicContact CG1-CE2 4.33Å; V65-Y69 WeakPolarHBondContact O-CD2 3.46Å |
| 66 | I | 89.9 | Confident | 85 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -70.2 | -20.7 | -172.8 | 66.9 | 178.8 | 0 | 0 | 0 | 113.3 | V19 V23 Q62 Q63 A68 Y69 F71 G77 V78 F81 | V19-I66 HydrophobicContact CG1-CG2 3.79Å; V23-I66 HydrophobicContact CG2-CG2 4.32Å; Q62-I66 WeakPolarHBondContact O-CG1 3.39Å; Q62-I66 WeakPolarHBondContact O-CG2 3.45Å; Q62-I66 PolarHBondContact O-N 3.32Å; Q63-I66 PolarHBondContact O-N 3.08Å; I66-A68 PolarHBondContact O-N 3.46Å; I66-Y69 PolarHBondContact O-N 3.19Å; I66-F71 HydrophobicContact CB-CB 3.92Å; I66-F71 HydrophobicContact CB-CD2 3.96Å; I66-F71 HydrophobicContact CB-CG 4.02Å; I66-F71 HydrophobicContact CD1-CB 3.8Å; I66-F71 HydrophobicContact CD1-CD1 4.43Å; I66-F71 HydrophobicContact CD1-CG 4.13Å; I66-F71 HydrophobicContact CG1-CB 3.71Å; I66-F71 HydrophobicContact CG1-CG 4.23Å; I66-F71 PolarHBondContact O-N 3.18Å; I66-G77 VanDerWaalsContact CD1-C 3.43Å; I66-G77 WeakPolarHBondContact CD1-O 3.48Å; I66-V78 HydrophobicContact CD1-CB 4.35Å; I66-V78 HydrophobicContact CD1-CG2 3.76Å; I66-F81 HydrophobicContact CD1-CB 4.09Å; I66-F81 HydrophobicContact CG2-CB 4.25Å; I66-F81 HydrophobicContact CG2-CD1 4Å; I66-F81 HydrophobicContact CG2-CD2 3.96Å; I66-F81 HydrophobicContact CG2-CE1 4.35Å; I66-F81 HydrophobicContact CG2-CE2 4.33Å; I66-F81 HydrophobicContact CG2-CG 3.79Å |
| 67 | K | 88.4 | Confident | 84.6 | Confident | 96 Ų | 96 | 52.5 Ų | 52.5 | 42% | 0.417 | 29% | 0.289 | S | S | . | . | G | 310 helix | trans | -60.2 | -32.7 | 174.7 | 72.5 | -177 | 178.7 | -177.9 | 0 | 112.3 | Q63 E64 V65 Y69 G70 | Q63-K67 WeakPolarHBondContact O-CB 3.33Å; Q63-K67 PolarHBondContact O-N 3.48Å; E64-K67 VanDerWaalsContact O-CE 3.26Å; E64-K67 WeakPolarHBondContact O-CE 3.35Å; E64-K67 VanDerWaalsContact O-CG 3.31Å; E64-K67 WeakPolarHBondContact O-CG 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.44Å; E64-K67 IonicContact OE1-NZ 3.08Å; E64-K67 PolarHBondContact OE1-NZ 3.41Å; E64-K67 IonicContact OE2-NZ 2.93Å; E64-K67 PolarHBondContact OE2-NZ 3.4Å; V65-K67 VanDerWaalsContact C-N 3.26Å; V65-K67 PolarHBondContact O-N 3.17Å; K67-Y69 PolarHBondContact O-N 2.67Å; K67-G70 PolarHBondContact O-N 2.84Å |
| 68 | A | 87.6 | Confident | 84.4 | Confident | 84 Ų | 84 | 52.1 Ų | 52.1 | 69% | 0.694 | 29% | 0.287 | S | S | * | . | G | 310 helix | trans | -65.7 | -17.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V65 I66 | V65-A68 WeakPolarHBondContact O-CB 3.35Å; V65-A68 PolarHBondContact O-N 2.97Å; I66-A68 PolarHBondContact O-N 3.46Å |
| 69 | Y | 86.3 | Confident | 84.3 | Confident | 71 Ų | 71 | 58.3 Ų | 58.3 | 28% | 0.278 | 32% | 0.319 | S | S | . | . | G | 310 helix | trans | -106.2 | 13.1 | -178.6 | -61 | -91.7 | 0 | 0 | 0 | 112.8 | L11 V19 V65 I66 K67 | L11-Y69 HydrophobicContact CD2-CD1 4.43Å; V19-Y69 HydrophobicContact CB-CE2 4.45Å; V19-Y69 HydrophobicContact CG1-CD2 4.23Å; V19-Y69 HydrophobicContact CG1-CE2 4.35Å; V19-Y69 HydrophobicContact CG2-CD1 3.43Å; V19-Y69 VanDerWaalsContact CG2-CD1 3.43Å; V19-Y69 HydrophobicContact CG2-CD2 3.7Å; V19-Y69 HydrophobicContact CG2-CE1 3.42Å; V19-Y69 VanDerWaalsContact CG2-CE1 3.42Å; V19-Y69 HydrophobicContact CG2-CE2 3.71Å; V19-Y69 HydrophobicContact CG2-CG 3.57Å; V65-Y69 HydrophobicContact CG1-CE2 4.33Å; V65-Y69 WeakPolarHBondContact O-CD2 3.46Å; I66-Y69 PolarHBondContact O-N 3.19Å; K67-Y69 PolarHBondContact O-N 2.67Å |
| 70 | G | 82.1 | Confident | 84.1 | Confident | 56 Ų | 56 | 60.2 Ų | 60.2 | 58% | 0.577 | 32% | 0.324 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 88.8 | 8.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | K67 | K67-G70 PolarHBondContact O-N 2.84Š|
| 71 | F | 83.6 | Confident | 84 | Confident | 14 Ų | 14 | 56.3 Ų | 56.3 | 6% | 0.061 | 31% | 0.306 | C | S | . | . | trans | -76.4 | 136.4 | 172.3 | -71.6 | -99.3 | 0 | 0 | 0 | 110.9 | P9 L11 I66 G77 K80 F81 | P9-F71 HydrophobicContact CB-CE2 4.48Å; P9-F71 HydrophobicContact CG-CD2 4.35Å; P9-F71 HydrophobicContact CG-CE2 4.26Å; P9-F71 HydrophobicContact CG-CZ 4.38Å; L11-F71 HydrophobicContact CD1-CE2 3.5Å; L11-F71 VanDerWaalsContact CD1-CE2 3.5Å; L11-F71 HydrophobicContact CD1-CZ 3.82Å; L11-F71 HydrophobicContact CD2-CE2 4.3Å; L11-F71 HydrophobicContact CG-CE2 3.8Å; L11-F71 HydrophobicContact CG-CZ 4.11Å; I66-F71 HydrophobicContact CB-CB 3.92Å; I66-F71 HydrophobicContact CB-CD2 3.96Å; I66-F71 HydrophobicContact CB-CG 4.02Å; I66-F71 HydrophobicContact CD1-CB 3.8Å; I66-F71 HydrophobicContact CD1-CD1 4.43Å; I66-F71 HydrophobicContact CD1-CG 4.13Å; I66-F71 HydrophobicContact CG1-CB 3.71Å; I66-F71 HydrophobicContact CG1-CG 4.23Å; I66-F71 PolarHBondContact O-N 3.18Å; F71-G77 VanDerWaalsContact CD1-O 3.31Å; F71-G77 WeakPolarHBondContact CD1-O 3.45Å; F71-K80 HydrophobicContact CD1-CB 4.18Å; F71-K80 HydrophobicContact CE1-CB 4Å; F71-F81 HydrophobicContact CD1-CB 4.24Å; F71-F81 HydrophobicContact CE1-CB 3.98Å; F71-F81 HydrophobicContact CZ-CB 4.4Å; F71-F81 HydrophobicContact CZ-CD2 4.34Å | ||
| 72 | N | 72.7 | Confident | 83.8 | Confident | 90 Ų | 90 | 58.7 Ų | 58.7 | 48% | 0.481 | 33% | 0.326 | S | S | . | . | trans | -68.5 | 148.7 | -176.7 | -164.7 | 21.9 | 0 | 0 | 0 | 112.8 | E74 | N72-E74 VanDerWaalsContact C-N 3.27Å; N72-E74 PolarHBondContact ND2-OE2 3Å; N72-E74 PolarHBondContact O-N 3.24Å | ||
| 73 | N | 66.3 | Low | 83.7 | Confident | 87 Ų | 87 | 66.6 Ų | 66.6 | 47% | 0.465 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | 14 | -175.2 | -162.5 | -101.1 | 0 | 0 | 0 | 114.1 | Q63 G75 | Q63-N73 WeakPolarHBondContact CG-ND2 3.36Å; Q63-N73 PolarHBondContact NE2-O 2.91Å; N73-G75 PolarHBondContact O-N 3.34Å |
| 74 | E | 67.4 | Low | 83.6 | Confident | 158 Ų | 158 | 66.5 Ų | 66.5 | 74% | 0.738 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.6 | 28.2 | -176.2 | -70.6 | 177.1 | 81.9 | 0 | 0 | 114.5 | N72 E76 | N72-E74 VanDerWaalsContact C-N 3.27Å; N72-E74 PolarHBondContact ND2-OE2 3Å; N72-E74 PolarHBondContact O-N 3.24Å; E74-E76 PolarHBondContact O-N 2.88Å |
| 75 | G | 65.8 | Low | 83.5 | Confident | 25 Ų | 25 | 62 Ų | 62 | 26% | 0.258 | 34% | 0.335 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.7 | -31.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q63 N73 G77 V78 | Q63-G75 VanDerWaalsContact NE2-N 3.16Å; N73-G75 PolarHBondContact O-N 3.34Å; G75-G77 PolarHBondContact O-N 3.46Å; G75-V78 PolarHBondContact O-N 3.36Å |
| 76 | E | 79.9 | Confident | 83.4 | Confident | 114 Ų | 114 | 66.9 Ų | 66.9 | 53% | 0.533 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.8 | -27.5 | 173.7 | -153.8 | -175.2 | 99.5 | 0 | 0 | 112.2 | E74 V78 L79 K80 | E74-E76 PolarHBondContact O-N 2.88Å; E76-V78 VanDerWaalsContact C-N 3.35Å; E76-V78 PolarHBondContact O-N 3.25Å; E76-L79 PolarHBondContact O-N 2.94Å; E76-K80 WeakPolarHBondContact O-CG 3.29Å; E76-K80 PolarHBondContact O-N 3.23Å; E76-K80 WeakPolarHBondContact OE1-CE 3.3Å; E76-K80 IonicContact OE1-NZ 2.63Å; E76-K80 PolarHBondContact OE1-NZ 3.38Å |
| 77 | G | 83.8 | Confident | 83.4 | Confident | 2 Ų | 2 | 72.5 Ų | 72.5 | 2% | 0.021 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.5 | -42.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | I66 F71 G75 K80 F81 | I66-G77 VanDerWaalsContact CD1-C 3.43Å; I66-G77 WeakPolarHBondContact CD1-O 3.48Å; F71-G77 VanDerWaalsContact CD1-O 3.31Å; F71-G77 WeakPolarHBondContact CD1-O 3.45Å; G75-G77 PolarHBondContact O-N 3.46Å; G77-K80 PolarHBondContact O-N 2.94Å; G77-F81 WeakPolarHBondContact O-CB 3.46Å; G77-F81 PolarHBondContact O-N 3.43Å |
| 78 | V | 88.1 | Confident | 83.5 | Confident | 11 Ų | 11 | 69.6 Ų | 69.6 | 7% | 0.067 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -68.4 | -41.7 | -179.8 | 176.5 | 0 | 0 | 0 | 0 | 111 | T59 Q62 Q63 I66 G75 E76 K80 F81 A82 | T59-V78 HydrophobicContact CG2-CB 4.15Å; T59-V78 HydrophobicContact CG2-CG1 4.25Å; T59-V78 HydrophobicContact CG2-CG2 3.87Å; Q62-V78 HydrophobicContact CB-CG1 4.27Å; Q62-V78 HydrophobicContact CB-CG2 4.13Å; Q63-V78 HydrophobicContact CB-CG2 3.92Å; I66-V78 HydrophobicContact CD1-CB 4.35Å; I66-V78 HydrophobicContact CD1-CG2 3.76Å; G75-V78 PolarHBondContact O-N 3.36Å; E76-V78 VanDerWaalsContact C-N 3.35Å; E76-V78 PolarHBondContact O-N 3.25Å; V78-K80 VanDerWaalsContact C-N 3.35Å; V78-K80 PolarHBondContact O-N 2.94Å; V78-F81 PolarHBondContact O-N 3.29Å; V78-A82 WeakPolarHBondContact O-CB 3.28Å; V78-A82 PolarHBondContact O-N 3.18Å |
| 79 | L | 87.4 | Confident | 83.6 | Confident | 131 Ų | 131 | 67 Ų | 67 | 69% | 0.686 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -62.7 | -41 | 174.4 | -86.9 | 92.2 | 0 | 0 | 0 | 112.2 | E76 A82 R83 | E76-L79 PolarHBondContact O-N 2.94Å; L79-A82 PolarHBondContact O-N 3.18Å; L79-R83 PolarHBondContact O-N 3Å |
| 80 | K | 87.2 | Confident | 83.5 | Confident | 79 Ų | 79 | 69.6 Ų | 69.6 | 34% | 0.343 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 176 | -75.1 | 175.4 | -177.6 | 166.2 | 0 | 111.3 | F71 E76 G77 V78 R83 L84 | F71-K80 HydrophobicContact CD1-CB 4.18Å; F71-K80 HydrophobicContact CE1-CB 4Å; E76-K80 WeakPolarHBondContact O-CG 3.29Å; E76-K80 PolarHBondContact O-N 3.23Å; E76-K80 WeakPolarHBondContact OE1-CE 3.3Å; E76-K80 IonicContact OE1-NZ 2.63Å; E76-K80 PolarHBondContact OE1-NZ 3.38Å; G77-K80 PolarHBondContact O-N 2.94Å; V78-K80 VanDerWaalsContact C-N 3.35Å; V78-K80 PolarHBondContact O-N 2.94Å; K80-R83 PolarHBondContact O-N 3.25Å; K80-L84 WeakPolarHBondContact O-CB 3.24Å; K80-L84 PolarHBondContact O-N 3.02Å |
| 81 | F | 89.3 | Confident | 83.8 | Confident | 2 Ų | 2 | 73 Ų | 73 | 1% | 0.009 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 175.2 | 177.8 | -108.7 | 0 | 0 | 0 | 111.6 | L11 V19 L20 V23 I66 F71 G77 V78 R83 L84 V85 | L11-F81 HydrophobicContact CD1-CD2 4.34Å; L11-F81 HydrophobicContact CD1-CE2 4.37Å; V19-F81 HydrophobicContact CB-CE2 3.92Å; V19-F81 HydrophobicContact CB-CZ 4.27Å; V19-F81 HydrophobicContact CG1-CD2 4.11Å; V19-F81 HydrophobicContact CG1-CE2 3.35Å; V19-F81 HydrophobicContact CG1-CZ 3.66Å; L20-F81 HydrophobicContact CB-CZ 4.23Å; L20-F81 HydrophobicContact CD1-CE1 4.14Å; L20-F81 HydrophobicContact CD1-CZ 4.1Å; V23-F81 HydrophobicContact CG2-CE1 4.23Å; V23-F81 HydrophobicContact CG2-CZ 4.47Å; I66-F81 HydrophobicContact CD1-CB 4.09Å; I66-F81 HydrophobicContact CG2-CB 4.25Å; I66-F81 HydrophobicContact CG2-CD1 4Å; I66-F81 HydrophobicContact CG2-CD2 3.96Å; I66-F81 HydrophobicContact CG2-CE1 4.35Å; I66-F81 HydrophobicContact CG2-CE2 4.33Å; I66-F81 HydrophobicContact CG2-CG 3.79Å; F71-F81 HydrophobicContact CD1-CB 4.24Å; F71-F81 HydrophobicContact CE1-CB 3.98Å; F71-F81 HydrophobicContact CZ-CB 4.4Å; F71-F81 HydrophobicContact CZ-CD2 4.34Å; G77-F81 WeakPolarHBondContact O-CB 3.46Å; G77-F81 PolarHBondContact O-N 3.43Å; V78-F81 PolarHBondContact O-N 3.29Å; F81-R83 VanDerWaalsContact C-N 3.3Å; F81-R83 PolarHBondContact O-N 2.97Å; F81-L84 WeakPolarHBondContact O-CB 3.5Å; F81-L84 PolarHBondContact O-N 3.43Å; F81-L84 VanDerWaalsContact O-N 3.1Å; F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CD2-CG2 4.31Å; F81-V85 HydrophobicContact CE1-CG2 3.78Å; F81-V85 HydrophobicContact CE2-CG2 3.83Å; F81-V85 HydrophobicContact CG-CG2 4.49Å; F81-V85 HydrophobicContact CZ-CG2 3.55Å; F81-V85 WeakPolarHBondContact O-CG2 3.36Å; F81-V85 PolarHBondContact O-N 3.32Å |
| 82 | A | 89.3 | Confident | 84.1 | Confident | 53 Ų | 53 | 74 Ų | 74 | 44% | 0.438 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -59.4 | -39.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.5 | V78 L79 K86 | V78-A82 WeakPolarHBondContact O-CB 3.28Å; V78-A82 PolarHBondContact O-N 3.18Å; L79-A82 PolarHBondContact O-N 3.18Å; A82-K86 WeakPolarHBondContact O-CB 3.39Å; A82-K86 PolarHBondContact O-N 3.46Å |
| 83 | R | 88.6 | Confident | 84.9 | Confident | 180 Ų | 180 | 75 Ų | 75 | 68% | 0.679 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -64.1 | -42.8 | 174.2 | -177 | -177.1 | -66.7 | -174.3 | -0.5 | 111.8 | L79 K80 F81 K86 M87 | L79-R83 PolarHBondContact O-N 3Å; K80-R83 PolarHBondContact O-N 3.25Å; F81-R83 VanDerWaalsContact C-N 3.3Å; F81-R83 PolarHBondContact O-N 2.97Å; R83-K86 WeakPolarHBondContact O-CB 3.14Å; R83-K86 PolarHBondContact O-N 2.92Å; R83-M87 HydrophobicContact CG-CE 4.46Å; R83-M87 WeakPolarHBondContact O-CG 3.45Å; R83-M87 PolarHBondContact O-N 3.39Å; R83-M87 VanDerWaalsContact O-N 3.08Å |
| 84 | L | 88.9 | Confident | 86.1 | Confident | 21 Ų | 21 | 75.1 Ų | 75.1 | 11% | 0.11 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63.6 | -46.5 | 178.3 | 178.7 | 146.6 | 0 | 0 | 0 | 111.2 | L11 A16 K80 F81 K86 M87 Y88 | L11-L84 HydrophobicContact CB-CD1 3.92Å; L11-L84 HydrophobicContact CB-CD2 4.26Å; L11-L84 HydrophobicContact CD1-CD2 4.27Å; L11-L84 HydrophobicContact CG-CD1 4.36Å; A16-L84 HydrophobicContact CB-CD2 3.6Å; K80-L84 WeakPolarHBondContact O-CB 3.24Å; K80-L84 PolarHBondContact O-N 3.02Å; F81-L84 WeakPolarHBondContact O-CB 3.5Å; F81-L84 PolarHBondContact O-N 3.43Å; F81-L84 VanDerWaalsContact O-N 3.1Å; L84-K86 VanDerWaalsContact C-N 3.32Å; L84-K86 PolarHBondContact O-N 3.43Å; L84-M87 PolarHBondContact O-N 3.22Å; L84-Y88 HydrophobicContact CD1-CE2 4.21Å; L84-Y88 HydrophobicContact CD2-CD2 3.59Å; L84-Y88 HydrophobicContact CD2-CE2 3.49Å; L84-Y88 VanDerWaalsContact CD2-CE2 3.49Å; L84-Y88 HydrophobicContact CG-CD2 3.98Å; L84-Y88 HydrophobicContact CG-CE2 3.6Å; L84-Y88 WeakPolarHBondContact O-CD2 3.4Å; L84-Y88 PolarHBondContact O-N 3.41Å; L84-Y88 VanDerWaalsContact O-N 3.17Å |
| 85 | V | 90.2 | Very high | 87.3 | Confident | 6 Ų | 6 | 67.6 Ų | 67.6 | 4% | 0.036 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -56.6 | -47.6 | 173.4 | 172.1 | 0 | 0 | 0 | 0 | 110.2 | L20 F81 M87 Y88 E89 I95 | L20-V85 HydrophobicContact CD1-CG1 4.48Å; L20-V85 HydrophobicContact CD1-CG2 4.23Å; L20-V85 HydrophobicContact CD2-CG1 4.04Å; F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CD2-CG2 4.31Å; F81-V85 HydrophobicContact CE1-CG2 3.78Å; F81-V85 HydrophobicContact CE2-CG2 3.83Å; F81-V85 HydrophobicContact CG-CG2 4.49Å; F81-V85 HydrophobicContact CZ-CG2 3.55Å; F81-V85 WeakPolarHBondContact O-CG2 3.36Å; F81-V85 PolarHBondContact O-N 3.32Å; V85-M87 VanDerWaalsContact C-N 3.27Å; V85-M87 PolarHBondContact O-N 3.26Å; V85-Y88 CarbonylContact O-C 3.54Å; V85-Y88 WeakPolarHBondContact O-CA 3.43Å; V85-Y88 PolarHBondContact O-N 2.85Å; V85-E89 HydrophobicContact CG1-CG 4.36Å; V85-E89 WeakPolarHBondContact O-CG 3.45Å; V85-E89 PolarHBondContact O-N 3.44Å; V85-I95 HydrophobicContact CG1-CG2 3.94Å |
| 86 | K | 89.8 | Confident | 88.6 | Confident | 124 Ų | 124 | 67.5 Ų | 67.5 | 54% | 0.539 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -54.5 | -40.5 | 177.8 | -164.7 | 91.2 | -162 | 126.7 | 0 | 112.9 | A82 R83 L84 Y88 E89 | A82-K86 WeakPolarHBondContact O-CB 3.39Å; A82-K86 PolarHBondContact O-N 3.46Å; R83-K86 WeakPolarHBondContact O-CB 3.14Å; R83-K86 PolarHBondContact O-N 2.92Å; L84-K86 VanDerWaalsContact C-N 3.32Å; L84-K86 PolarHBondContact O-N 3.43Å; K86-Y88 VanDerWaalsContact C-N 3.31Å; K86-E89 WeakPolarHBondContact CA-OE2 3.38Å; K86-E89 VanDerWaalsContact CD-OE2 3.24Å; K86-E89 WeakPolarHBondContact CD-OE2 3.38Å; K86-E89 WeakPolarHBondContact CE-OE2 3.13Å; K86-E89 IonicContact NZ-OE2 2.75Å; K86-E89 PolarHBondContact NZ-OE2 2.51Å |
| 87 | M | 89.2 | Confident | 89.2 | Confident | 118 Ų | 118 | 65 Ų | 65 | 58% | 0.581 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -69.2 | -30.4 | 177.5 | -73.1 | -179.3 | 168.2 | 0 | 0 | 112.7 | R83 L84 V85 T90 Q91 | R83-M87 HydrophobicContact CG-CE 4.46Å; R83-M87 WeakPolarHBondContact O-CG 3.45Å; R83-M87 PolarHBondContact O-N 3.39Å; R83-M87 VanDerWaalsContact O-N 3.08Å; L84-M87 PolarHBondContact O-N 3.22Å; V85-M87 VanDerWaalsContact C-N 3.27Å; V85-M87 PolarHBondContact O-N 3.26Å; M87-T90 PolarHBondContact O-OG1 2.98Å; M87-Q91 PolarHBondContact O-NE2 3.18Å |
| 88 | Y | 90.5 | Very high | 89.6 | Confident | 36 Ų | 36 | 66.6 Ų | 66.6 | 14% | 0.141 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -88.2 | -20 | 178.7 | -66.7 | -44.9 | 0 | 0 | 0 | 113.9 | L11 V13 A16 L84 V85 K86 T90 Q91 D92 I95 | L11-Y88 PolarHBondContact O-OH 3.23Å; V13-Y88 HydrophobicContact CB-CD1 4.48Å; V13-Y88 HydrophobicContact CG2-CD1 3.54Å; V13-Y88 HydrophobicContact CG2-CE1 3.49Å; V13-Y88 VanDerWaalsContact CG2-CE1 3.49Å; V13-Y88 HydrophobicContact CG2-CG 4.26Å; A16-Y88 HydrophobicContact CB-CD2 3.58Å; A16-Y88 HydrophobicContact CB-CE2 3.9Å; L84-Y88 HydrophobicContact CD1-CE2 4.21Å; L84-Y88 HydrophobicContact CD2-CD2 3.59Å; L84-Y88 HydrophobicContact CD2-CE2 3.49Å; L84-Y88 VanDerWaalsContact CD2-CE2 3.49Å; L84-Y88 HydrophobicContact CG-CD2 3.98Å; L84-Y88 HydrophobicContact CG-CE2 3.6Å; L84-Y88 WeakPolarHBondContact O-CD2 3.4Å; L84-Y88 PolarHBondContact O-N 3.41Å; L84-Y88 VanDerWaalsContact O-N 3.17Å; V85-Y88 CarbonylContact O-C 3.54Å; V85-Y88 WeakPolarHBondContact O-CA 3.43Å; V85-Y88 PolarHBondContact O-N 2.85Å; K86-Y88 VanDerWaalsContact C-N 3.31Å; Y88-T90 PolarHBondContact O-N 2.75Å; Y88-T90 VanDerWaalsContact O-N 3.11Å; Y88-Q91 PolarHBondContact O-N 2.93Å; Y88-D92 PolarHBondContact O-N 2.73Å; Y88-I95 HydrophobicContact CG-CD1 4.37Å |
| 89 | E | 89.4 | Confident | 89.7 | Confident | 30 Ų | 30 | 66.3 Ų | 66.3 | 14% | 0.14 | 35% | 0.347 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -54 | -31.1 | 173.3 | -67.3 | -179 | 126.4 | 0 | 0 | 112.5 | V85 K86 A96 S99 K103 | V85-E89 HydrophobicContact CG1-CG 4.36Å; V85-E89 WeakPolarHBondContact O-CG 3.45Å; V85-E89 PolarHBondContact O-N 3.44Å; K86-E89 WeakPolarHBondContact CA-OE2 3.38Å; K86-E89 VanDerWaalsContact CD-OE2 3.24Å; K86-E89 WeakPolarHBondContact CD-OE2 3.38Å; K86-E89 WeakPolarHBondContact CE-OE2 3.13Å; K86-E89 IonicContact NZ-OE2 2.75Å; K86-E89 PolarHBondContact NZ-OE2 2.51Å; E89-A96 HydrophobicContact CB-CB 4.15Å; E89-A96 HydrophobicContact CG-CB 4.47Å; E89-S99 WeakPolarHBondContact OE1-CB 3.47Å; E89-S99 PolarHBondContact OE1-OG 3.28Å; E89-K103 IonicContact OE1-NZ 2.63Å; E89-K103 PolarHBondContact OE1-NZ 3.28Å; E89-K103 IonicContact OE2-NZ 2.72Å |
| 90 | T | 84.9 | Confident | 89.8 | Confident | 125 Ų | 125 | 65 Ų | 65 | 77% | 0.767 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.5 | -15.5 | 178.6 | 58.2 | 0 | 0 | 0 | 0 | 113.7 | M87 Y88 | M87-T90 PolarHBondContact O-OG1 2.98Å; Y88-T90 PolarHBondContact O-N 2.75Å; Y88-T90 VanDerWaalsContact O-N 3.11Å |
| 91 | Q | 87.4 | Confident | 90 | Very high | 128 Ų | 128 | 67.1 Ų | 67.1 | 60% | 0.598 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.9 | -31.3 | -176.7 | -66.2 | 175.7 | 75 | 0 | 0 | 111.6 | M87 Y88 | M87-Q91 PolarHBondContact O-NE2 3.18Å; Y88-Q91 PolarHBondContact O-N 2.93Å |
| 92 | D | 90.5 | Very high | 90 | Very high | 35 Ų | 35 | 67.8 Ų | 67.8 | 19% | 0.187 | 35% | 0.352 | C | S | . | . | trans | -133.9 | 116.1 | -175.7 | -173.5 | -72.6 | 0 | 0 | 0 | 110.9 | V13 Y88 E94 I95 A96 | V13-D92 HydrophobicContact CG1-CB 3.92Å; Y88-D92 PolarHBondContact O-N 2.73Å; D92-E94 VanDerWaalsContact C-N 3.27Å; D92-E94 PolarHBondContact O-N 3.28Å; D92-E94 VanDerWaalsContact OD1-CA 3.28Å; D92-E94 WeakPolarHBondContact OD1-CA 3.35Å; D92-E94 WeakPolarHBondContact OD1-CB 3.3Å; D92-E94 PolarHBondContact OD1-N 2.9Å; D92-I95 HydrophobicContact CB-CB 4.19Å; D92-I95 HydrophobicContact CB-CD1 3.96Å; D92-I95 HydrophobicContact CB-CG1 4.07Å; D92-I95 PolarHBondContact O-N 2.98Å; D92-I95 PolarHBondContact OD1-N 3.29Å; D92-A96 PolarHBondContact O-N 3.02Å | ||
| 93 | P | 89.5 | Confident | 89.8 | Confident | 109 Ų | 109 | 69.1 Ų | 69.1 | 71% | 0.708 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -70 | -21.7 | -178.4 | 28.1 | -34.2 | 0 | 0 | 0 | 113.3 | A96 A97 | P93-A96 PolarHBondContact O-N 2.63Å; P93-A97 PolarHBondContact O-N 2.89Å |
| 94 | E | 91.9 | Very high | 89.7 | Confident | 91 Ų | 91 | 64.5 Ų | 64.5 | 43% | 0.425 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -71.6 | -43.4 | 175.9 | -164.5 | 176.4 | 111.8 | 0 | 0 | 110.1 | R17 D92 A96 A97 M98 | R17-E94 WeakPolarHBondContact CD-OE1 3.48Å; R17-E94 IonicContact CZ-OE1 3.31Å; R17-E94 VanDerWaalsContact CZ-OE1 3.31Å; R17-E94 IonicContact NE-OE1 3.88Å; R17-E94 PolarHBondContact NE-OE1 2.8Å; R17-E94 VanDerWaalsContact NE-OE1 3.08Å; R17-E94 IonicContact NH1-OE1 3.41Å; R17-E94 PolarHBondContact NH1-OE1 3Å; R17-E94 IonicContact NH1-OE2 3.88Å; D92-E94 VanDerWaalsContact C-N 3.27Å; D92-E94 PolarHBondContact O-N 3.28Å; D92-E94 VanDerWaalsContact OD1-CA 3.28Å; D92-E94 WeakPolarHBondContact OD1-CA 3.35Å; D92-E94 WeakPolarHBondContact OD1-CB 3.3Å; D92-E94 PolarHBondContact OD1-N 2.9Å; E94-A96 VanDerWaalsContact C-N 3.29Å; E94-A96 PolarHBondContact O-N 3.17Å; E94-A97 PolarHBondContact O-N 3.08Å; E94-M98 WeakPolarHBondContact O-CB 3.2Å; E94-M98 WeakPolarHBondContact O-CG 3.28Å; E94-M98 PolarHBondContact O-N 3.37Å |
| 95 | I | 92.5 | Very high | 89.4 | Confident | 0 Ų | 0 | 66.3 Ų | 66.3 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 172 | -67.1 | 178 | 0 | 0 | 0 | 110.8 | V13 A16 R17 L20 V85 Y88 D92 M98 S99 | V13-I95 HydrophobicContact CG1-CD1 3.77Å; A16-I95 HydrophobicContact CB-CD1 4.18Å; R17-I95 HydrophobicContact CB-CD1 4.27Å; R17-I95 HydrophobicContact CB-CG1 4.09Å; R17-I95 HydrophobicContact CG-CG1 4.2Å; L20-I95 HydrophobicContact CD2-CG2 4.03Å; V85-I95 HydrophobicContact CG1-CG2 3.94Å; Y88-I95 HydrophobicContact CG-CD1 4.37Å; D92-I95 HydrophobicContact CB-CB 4.19Å; D92-I95 HydrophobicContact CB-CD1 3.96Å; D92-I95 HydrophobicContact CB-CG1 4.07Å; D92-I95 PolarHBondContact O-N 2.98Å; D92-I95 PolarHBondContact OD1-N 3.29Å; I95-M98 PolarHBondContact O-N 2.89Å; I95-S99 WeakPolarHBondContact O-CB 3.45Å; I95-S99 PolarHBondContact O-N 3.21Å |
| 96 | A | 92.2 | Very high | 88.9 | Confident | 22 Ų | 22 | 67.6 Ų | 67.6 | 18% | 0.182 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.7 | -48.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | E89 D92 P93 E94 M98 S99 I100 | E89-A96 HydrophobicContact CB-CB 4.15Å; E89-A96 HydrophobicContact CG-CB 4.47Å; D92-A96 PolarHBondContact O-N 3.02Å; P93-A96 PolarHBondContact O-N 2.63Å; E94-A96 VanDerWaalsContact C-N 3.29Å; E94-A96 PolarHBondContact O-N 3.17Å; A96-M98 PolarHBondContact O-N 3.14Å; A96-S99 PolarHBondContact O-N 3.07Å; A96-I100 VanDerWaalsContact O-CG1 3.28Å; A96-I100 WeakPolarHBondContact O-CG1 3.4Å; A96-I100 PolarHBondContact O-N 3.22Å |
| 97 | A | 92.6 | Very high | 88.1 | Confident | 61 Ų | 61 | 64.9 Ų | 64.9 | 50% | 0.504 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | P93 E94 I100 K101 | P93-A97 PolarHBondContact O-N 2.89Å; E94-A97 PolarHBondContact O-N 3.08Å; A97-I100 PolarHBondContact O-N 2.75Å; A97-K101 PolarHBondContact O-N 3.43Å |
| 98 | M | 92.4 | Very high | 86.9 | Confident | 36 Ų | 36 | 60 Ų | 60 | 18% | 0.177 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.5 | -40.6 | 177.1 | -73.5 | -173.4 | 131.1 | 0 | 0 | 112.6 | R17 L20 I24 E94 I95 A96 I100 K101 L102 | R17-M98 HydrophobicContact CG-SD 4.3Å; L20-M98 HydrophobicContact CB-SD 4.46Å; L20-M98 HydrophobicContact CD2-CB 3.36Å; L20-M98 HydrophobicContact CD2-CG 4.45Å; L20-M98 HydrophobicContact CD2-SD 4.34Å; L20-M98 HydrophobicContact CG-CB 3.79Å; L20-M98 HydrophobicContact CG-SD 4.39Å; I24-M98 HydrophobicContact CD1-CB 3.78Å; I24-M98 HydrophobicContact CD1-CE 4.47Å; I24-M98 HydrophobicContact CD1-CG 4.13Å; I24-M98 WeakPolarHBondContact CD1-O 3.38Å; E94-M98 WeakPolarHBondContact O-CB 3.2Å; E94-M98 WeakPolarHBondContact O-CG 3.28Å; E94-M98 PolarHBondContact O-N 3.37Å; I95-M98 PolarHBondContact O-N 2.89Å; A96-M98 PolarHBondContact O-N 3.14Å; M98-I100 VanDerWaalsContact C-N 3.34Å; M98-I100 PolarHBondContact O-N 2.78Å; M98-K101 WeakPolarHBondContact O-CB 3.38Å; M98-K101 PolarHBondContact O-N 2.92Å; M98-L102 WeakPolarHBondContact O-CB 3.29Å; M98-L102 PolarHBondContact O-N 3.49Å |
| 99 | S | 90.1 | Very high | 85.3 | Confident | 6 Ų | 6 | 63.7 Ų | 63.7 | 4% | 0.042 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 176.4 | 170.9 | 0 | 0 | 0 | 0 | 111.7 | E89 I95 A96 L102 K103 | E89-S99 WeakPolarHBondContact OE1-CB 3.47Å; E89-S99 PolarHBondContact OE1-OG 3.28Å; I95-S99 WeakPolarHBondContact O-CB 3.45Å; I95-S99 PolarHBondContact O-N 3.21Å; A96-S99 PolarHBondContact O-N 3.07Å; S99-L102 PolarHBondContact O-N 3.42Å; S99-K103 VanDerWaalsContact O-CG 3.29Å; S99-K103 WeakPolarHBondContact O-CG 3.24Å; S99-K103 PolarHBondContact O-N 3.06Å; S99-K103 PolarHBondContact OG-NZ 2.91Å |
| 100 | I | 90 | Very high | 83.4 | Confident | 102 Ų | 102 | 67.6 Ų | 67.6 | 52% | 0.523 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.9 | -48.5 | 172.6 | -67 | 163.6 | 0 | 0 | 0 | 110 | A96 A97 M98 L102 K103 S104 | A96-I100 VanDerWaalsContact O-CG1 3.28Å; A96-I100 WeakPolarHBondContact O-CG1 3.4Å; A96-I100 PolarHBondContact O-N 3.22Å; A97-I100 PolarHBondContact O-N 2.75Å; M98-I100 VanDerWaalsContact C-N 3.34Å; M98-I100 PolarHBondContact O-N 2.78Å; I100-L102 VanDerWaalsContact C-N 3.32Å; I100-L102 PolarHBondContact O-N 3.37Å; I100-K103 PolarHBondContact O-N 3.29Å; I100-S104 PolarHBondContact O-N 2.73Å; I100-S104 PolarHBondContact O-OG 3.09Å |
| 101 | K | 90.3 | Very high | 81.3 | Confident | 124 Ų | 124 | 67 Ų | 67 | 54% | 0.539 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -57.2 | -45.5 | 177.2 | -176.2 | 176.4 | 179.1 | -178.3 | 0 | 111.7 | I24 A97 M98 S104 L105 | I24-K101 HydrophobicContact CD1-CD 4.47Å; I24-K101 HydrophobicContact CG2-CD 4.06Å; A97-K101 PolarHBondContact O-N 3.43Å; M98-K101 WeakPolarHBondContact O-CB 3.38Å; M98-K101 PolarHBondContact O-N 2.92Å; K101-S104 PolarHBondContact O-N 3.06Å; K101-L105 WeakPolarHBondContact O-CG 3.24Å; K101-L105 PolarHBondContact O-N 3.34Å |
| 102 | L | 89.3 | Confident | 79.2 | Confident | 16 Ų | 16 | 66.4 Ų | 66.4 | 8% | 0.084 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -59.5 | -50 | 176 | -178.8 | 59.9 | 0 | 0 | 0 | 110.7 | L20 V23 I24 F27 M98 S99 I100 S104 L105 L106 | L20-L102 HydrophobicContact CD1-CD2 3.69Å; V23-L102 HydrophobicContact CG1-CD1 3.74Å; V23-L102 HydrophobicContact CG1-CD2 3.99Å; I24-L102 HydrophobicContact CG1-CB 4.24Å; I24-L102 HydrophobicContact CG1-CD1 4.41Å; F27-L102 HydrophobicContact CD2-CD1 3.93Å; F27-L102 HydrophobicContact CE2-CD1 3.54Å; F27-L102 HydrophobicContact CZ-CD1 4.34Å; M98-L102 WeakPolarHBondContact O-CB 3.29Å; M98-L102 PolarHBondContact O-N 3.49Å; S99-L102 PolarHBondContact O-N 3.42Å; I100-L102 VanDerWaalsContact C-N 3.32Å; I100-L102 PolarHBondContact O-N 3.37Å; L102-S104 VanDerWaalsContact C-N 3.28Å; L102-S104 PolarHBondContact O-N 2.82Å; L102-L105 WeakPolarHBondContact O-CA 3.24Å; L102-L105 WeakPolarHBondContact O-CB 3.37Å; L102-L105 PolarHBondContact O-N 3.01Å; L102-L106 HydrophobicContact CG-CD1 4.38Å; L102-L106 WeakPolarHBondContact O-CG 3.4Å; L102-L106 PolarHBondContact O-N 3.05Å |
| 103 | K | 86.1 | Confident | 76.8 | Confident | 81 Ų | 81 | 69.7 Ų | 69.7 | 35% | 0.352 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -57.2 | -39.9 | 178.1 | -73 | 163.8 | -178.7 | 146.8 | 0 | 112.5 | E89 S99 I100 L105 L106 L107 | E89-K103 IonicContact OE1-NZ 2.63Å; E89-K103 PolarHBondContact OE1-NZ 3.28Å; E89-K103 IonicContact OE2-NZ 2.72Å; S99-K103 VanDerWaalsContact O-CG 3.29Å; S99-K103 WeakPolarHBondContact O-CG 3.24Å; S99-K103 PolarHBondContact O-N 3.06Å; S99-K103 PolarHBondContact OG-NZ 2.91Å; I100-K103 PolarHBondContact O-N 3.29Å; K103-L105 VanDerWaalsContact C-N 3.25Å; K103-L105 PolarHBondContact O-N 2.78Å; K103-L106 PolarHBondContact O-N 2.92Å; K103-L106 VanDerWaalsContact O-N 3.08Å; K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 WeakPolarHBondContact O-CG 3.3Å; K103-L107 PolarHBondContact O-N 2.75Å |
| 104 | S | 85.8 | Confident | 74.5 | Confident | 84 Ų | 84 | 70.1 Ų | 70.1 | 59% | 0.587 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -64.6 | -27.2 | 175 | -62.4 | 0 | 0 | 0 | 0 | 113.5 | I100 K101 L102 L106 | I100-S104 PolarHBondContact O-N 2.73Å; I100-S104 PolarHBondContact O-OG 3.09Å; K101-S104 PolarHBondContact O-N 3.06Å; L102-S104 VanDerWaalsContact C-N 3.28Å; L102-S104 PolarHBondContact O-N 2.82Å; S104-L106 VanDerWaalsContact C-N 3.33Å |
| 105 | L | 83.8 | Confident | 72.8 | Confident | 59 Ų | 59 | 74.1 Ų | 74.1 | 31% | 0.309 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -79.2 | -14.1 | 173.1 | -65.9 | 171.9 | 0 | 0 | 0 | 113.4 | I24 F27 M36 R40 K101 L102 K103 | I24-L105 HydrophobicContact CG2-CD1 4.31Å; F27-L105 HydrophobicContact CB-CD1 4.13Å; F27-L105 HydrophobicContact CG-CD1 4.38Å; M36-L105 VanDerWaalsContact CE-O 3.3Å; M36-L105 WeakPolarHBondContact CE-O 3.34Å; R40-L105 VanDerWaalsContact NH2-C 3.31Å; R40-L105 PolarHBondContact NH2-O 3.48Å; K101-L105 WeakPolarHBondContact O-CG 3.24Å; K101-L105 PolarHBondContact O-N 3.34Å; L102-L105 WeakPolarHBondContact O-CA 3.24Å; L102-L105 WeakPolarHBondContact O-CB 3.37Å; L102-L105 PolarHBondContact O-N 3.01Å; K103-L105 VanDerWaalsContact C-N 3.25Å; K103-L105 PolarHBondContact O-N 2.78Å |
| 106 | L | 78.6 | Confident | 70.6 | Confident | 32 Ų | 32 | 77.3 Ų | 77.3 | 17% | 0.168 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -104 | -40.7 | -178.4 | -57.1 | -174.4 | 0 | 0 | 0 | 112.5 | F27 A58 Q62 L102 K103 S104 | F27-L106 HydrophobicContact CE1-CD2 3.7Å; F27-L106 HydrophobicContact CE2-CD2 4.32Å; F27-L106 HydrophobicContact CZ-CD2 3.5Å; F27-L106 VanDerWaalsContact CZ-CD2 3.5Å; A58-L106 HydrophobicContact CB-CD2 3.26Å; A58-L106 HydrophobicContact CB-CG 4.49Å; Q62-L106 VanDerWaalsContact NE2-CD1 3.33Å; L102-L106 HydrophobicContact CG-CD1 4.38Å; L102-L106 WeakPolarHBondContact O-CG 3.4Å; L102-L106 PolarHBondContact O-N 3.05Å; K103-L106 PolarHBondContact O-N 2.92Å; K103-L106 VanDerWaalsContact O-N 3.08Å; S104-L106 VanDerWaalsContact C-N 3.33Å |
| 107 | L | 72.8 | Confident | 68.3 | Low | 68 Ų | 68 | 79.3 Ų | 79.3 | 36% | 0.356 | 49% | 0.488 | S | S | . | . | S | Bend | trans | -87.5 | 147.2 | -176.4 | -60.1 | 175.8 | 0 | 0 | 0 | 109.7 | K103 | K103-L107 WeakPolarHBondContact O-CB 3.42Å; K103-L107 WeakPolarHBondContact O-CG 3.3Å; K103-L107 PolarHBondContact O-N 2.75Å |
| 108 | P | 65 | Low | 66 | Low | 16 Ų | 16 | 80.3 Ų | 80.3 | 10% | 0.104 | 50% | 0.496 | C | S | . | . | trans | -53.9 | 158.1 | 161.6 | 14 | -19.7 | 0 | 0 | 0 | 110.2 | M47 M50 L110 | M47-P108 HydrophobicContact CE-CG 4.09Å; M47-P108 HydrophobicContact SD-CG 3.42Å; M47-P108 WeakPolarHBondContact SD-CG 3.41Å; M50-P108 HydrophobicContact CE-CB 3.73Å; M50-P108 HydrophobicContact CE-CG 3.98Å; M50-P108 HydrophobicContact SD-CB 3.51Å; M50-P108 VanDerWaalsContact SD-CB 3.51Å; M50-P108 HydrophobicContact SD-CG 3.67Å; P108-L110 VanDerWaalsContact C-N 3.27Å; P108-L110 PolarHBondContact O-N 2.95Å | ||
| 109 | P | 57 | Low | 63.9 | Low | 112 Ų | 112 | 86.7 Ų | 86.7 | 73% | 0.727 | 53% | 0.529 | S | S | * | . | trans | -54.4 | 103.3 | 161.4 | 25.3 | -31.5 | 0 | 0 | 0 | 106.6 | S111 | P109-S111 VanDerWaalsContact C-N 3.31Å; P109-S111 PolarHBondContact O-N 3.18Å | ||
| 110 | L | 49.1 | Very low | 61.9 | Low | 112 Ų | 112 | 91.9 Ų | 91.9 | 59% | 0.586 | 56% | 0.561 | S | S | * | * | trans | -62.7 | 107.8 | 167 | -63.9 | 176.9 | 0 | 0 | 0 | 103 | M47 P108 T112 | M47-L110 HydrophobicContact CE-CD2 3.93Å; P108-L110 VanDerWaalsContact C-N 3.27Å; P108-L110 PolarHBondContact O-N 2.95Å; L110-T112 VanDerWaalsContact C-N 3.26Å; L110-T112 PolarHBondContact O-N 3.26Å | ||
| 111 | S | 41.5 | Very low | 60 | Low | 113 Ų | 113 | 92.2 Ų | 92.2 | 79% | 0.79 | 58% | 0.579 | S | S | * | * | trans | -46.6 | 107.2 | 161.4 | -56.9 | 0 | 0 | 0 | 0 | 104.3 | P109 P113 | P109-S111 VanDerWaalsContact C-N 3.31Å; P109-S111 PolarHBondContact O-N 3.18Å; S111-P113 WeakPolarHBondContact O-CD 3.28Å | ||
| 112 | T | 41.8 | Very low | 58.6 | Low | 116 Ų | 116 | 95 Ų | 95 | 71% | 0.712 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -47.3 | 120.3 | 168.6 | 44.1 | 0 | 0 | 0 | 0 | 104 | L110 | L110-T112 VanDerWaalsContact C-N 3.26Å; L110-T112 PolarHBondContact O-N 3.26Å |
| 113 | P | 40.9 | Very low | 57.1 | Low | 104 Ų | 104 | 98.9 Ų | 98.9 | 68% | 0.675 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 136.1 | 168.1 | 21 | -29.8 | 0 | 0 | 0 | 105.1 | S111 I115 | S111-P113 WeakPolarHBondContact O-CD 3.28Å; P113-I115 PolarHBondContact O-N 3.28Å |
| 114 | P | 41.6 | Very low | 55.5 | Low | 117 Ų | 117 | 99.8 Ų | 99.8 | 76% | 0.76 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 121.4 | 173.4 | 24.5 | -30.2 | 0 | 0 | 0 | 104 | G116 | P114-G116 PolarHBondContact O-N 2.87Š|
| 115 | I | 55.6 | Low | 53.9 | Low | 175 Ų | 175 | 100.7 Ų | 100.7 | 90% | 0.897 | 66% | 0.659 | S | S | * | * | trans | -64.8 | 83.9 | 168.5 | -61.7 | 168.1 | 0 | 0 | 0 | 102.7 | P113 G117 | P113-I115 PolarHBondContact O-N 3.28Å; I115-G117 PolarHBondContact O-N 2.64Å | ||
| 116 | G | 45.4 | Very low | 52.1 | Low | 67 Ų | 67 | 103.2 Ų | 103.2 | 69% | 0.691 | 68% | 0.68 | S | S | * | * | trans | -79.9 | 108.2 | -169.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | P114 | P114-G116 PolarHBondContact O-N 2.87Š| ||
| 117 | G | 44.2 | Very low | 50.4 | Low | 64 Ų | 64 | 107.6 Ų | 107.6 | 66% | 0.66 | 71% | 0.712 | S | S | * | * | trans | 72.5 | 100.6 | 153.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | I115 | I115-G117 PolarHBondContact O-N 2.64Š| ||
| 118 | A | 44 | Very low | 48.9 | Very low | 83 Ų | 83 | 110.3 Ų | 110.3 | 69% | 0.686 | 74% | 0.736 | S | S | * | * | 63 | 99 | 92.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | T120 | A118-T120 PolarHBondContact O-N 3.28Š| |||
| 119 | I | 48.6 | Very low | 47.8 | Very low | 169 Ų | 169 | 117 Ų | 117 | 87% | 0.867 | 78% | 0.781 | S | S | * | * | trans | -11.6 | 115.3 | 131.9 | 55.5 | 112.8 | 0 | 0 | 0 | 113.1 | ||||
| 120 | T | 48.8 | Very low | 47.1 | Very low | 115 Ų | 115 | 117.4 Ų | 117.4 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | -152.8 | 84.7 | 152.2 | 146.5 | 0 | 0 | 0 | 0 | 106.2 | A118 | A118-T120 PolarHBondContact O-N 3.28Š| ||
| 121 | A | 49.2 | Very low | 46.9 | Very low | 109 Ų | 109 | 117.8 Ų | 117.8 | 90% | 0.901 | 80% | 0.801 | S | S | * | * | trans | -77.7 | 119.4 | 154.6 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 122 | S | 61.5 | Low | 47.4 | Very low | 182 Ų | 182 | 118.3 Ų | 118.3 | 100% | 1.273 | 80% | 0.802 | S | S | * | * | trans | -107.5 | 0 | 162 | -61.6 | 0 | 0 | 0 | 0 | 108.3 |
Retrieved 122 of 122 residues in 65.2 ms
(Link to these results)