| 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 | 49.4 | Very low | 60.1 | Low | 210 Ų | 210 | 126 Ų | 126 | 100% | 1.034 | 61% | 0.608 | S | S | * | * | 0 | -32.4 | 0 | -83.9 | 169 | 168 | 0 | 0 | 113.2 | E3 I4 | M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.37Å; M1-I4 PolarHBondContact O-N 3.07Å | |||
| 2 | C | 53 | Low | 61.2 | Low | 107 Ų | 107 | 122 Ų | 122 | 72% | 0.723 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -57.6 | -33.8 | 178.5 | -77.2 | 0 | 0 | 0 | 0 | 116 | I4 E5 L6 | C2-I4 VanDerWaalsContact C-N 3.35Å; C2-I4 PolarHBondContact O-N 3.36Å; C2-E5 PolarHBondContact O-N 3.05Å; C2-L6 PolarHBondContact O-N 3Å |
| 3 | E | 61.2 | Low | 62.2 | Low | 147 Ų | 147 | 113.7 Ų | 113.7 | 69% | 0.687 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -67.3 | -37.2 | -176.4 | -58.7 | -156.1 | 163.7 | 0 | 0 | 112.6 | M1 E5 L6 Y7 | M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.37Å; E3-E5 VanDerWaalsContact C-N 3.31Å; E3-E5 PolarHBondContact O-N 3.24Å; E3-L6 WeakPolarHBondContact O-CB 3.38Å; E3-L6 PolarHBondContact O-N 3Å; E3-L6 VanDerWaalsContact O-N 3.13Å; E3-Y7 WeakPolarHBondContact O-CD2 3.35Å; E3-Y7 PolarHBondContact O-N 3.17Å; E3-Y7 VanDerWaalsContact O-N 3.08Å |
| 4 | I | 59 | Low | 63.3 | Low | 75 Ų | 75 | 112.7 Ų | 112.7 | 39% | 0.385 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68.4 | -34.5 | -178 | -39.4 | 172 | 0 | 0 | 0 | 110.6 | M1 C2 R8 V66 I67 | M1-I4 PolarHBondContact O-N 3.07Å; C2-I4 VanDerWaalsContact C-N 3.35Å; C2-I4 PolarHBondContact O-N 3.36Å; I4-R8 WeakPolarHBondContact O-CB 3.45Å; I4-R8 PolarHBondContact O-N 3.38Å; I4-R8 VanDerWaalsContact O-N 3.09Å; I4-V66 HydrophobicContact CG2-CG1 4.5Å; I4-I67 HydrophobicContact CG2-CG1 4.45Å |
| 5 | E | 59 | Low | 64.7 | Low | 143 Ų | 143 | 110.1 Ų | 110.1 | 67% | 0.668 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.9 | -39.4 | 171.9 | -80.7 | -161.5 | 145 | 0 | 0 | 112.2 | C2 E3 R8 K9 | C2-E5 PolarHBondContact O-N 3.05Å; E3-E5 VanDerWaalsContact C-N 3.31Å; E3-E5 PolarHBondContact O-N 3.24Å; E5-R8 PolarHBondContact O-N 2.99Å; E5-K9 WeakPolarHBondContact O-CB 3.36Å; E5-K9 PolarHBondContact O-N 3.04Å |
| 6 | L | 59 | Low | 65.8 | Low | 115 Ų | 115 | 106.1 Ų | 106.1 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.8 | -48 | 177.3 | -162.4 | 83.5 | 0 | 0 | 0 | 111 | C2 E3 R8 K9 T10 | C2-L6 PolarHBondContact O-N 3Å; E3-L6 WeakPolarHBondContact O-CB 3.38Å; E3-L6 PolarHBondContact O-N 3Å; E3-L6 VanDerWaalsContact O-N 3.13Å; L6-R8 PolarHBondContact O-N 3.49Å; L6-K9 PolarHBondContact O-N 3.24Å; L6-T10 WeakPolarHBondContact O-CB 3.36Å; L6-T10 PolarHBondContact O-N 3.42Å; L6-T10 PolarHBondContact O-OG1 3.1Å |
| 7 | Y | 59.5 | Low | 66.8 | Low | 62 Ų | 62 | 102.5 Ų | 102.5 | 24% | 0.243 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -57.7 | -46.6 | 174.9 | -80.3 | -77.8 | 0 | 0 | 0 | 111.5 | E3 K9 T10 K11 I12 V63 | E3-Y7 WeakPolarHBondContact O-CD2 3.35Å; E3-Y7 PolarHBondContact O-N 3.17Å; E3-Y7 VanDerWaalsContact O-N 3.08Å; Y7-K9 VanDerWaalsContact C-N 3.31Å; Y7-K9 PolarHBondContact O-N 3.17Å; Y7-T10 PolarHBondContact O-N 3.11Å; Y7-T10 PolarHBondContact O-OG1 3.2Å; Y7-K11 PolarHBondContact O-N 3.29Å; Y7-I12 HydrophobicContact CD1-CB 4.49Å; Y7-V63 HydrophobicContact CD1-CG1 4.22Å; Y7-V63 HydrophobicContact CG-CG1 4.25Å |
| 8 | R | 63.5 | Low | 67.9 | Low | 120 Ų | 120 | 99.4 Ų | 99.4 | 45% | 0.453 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -37.2 | 178.1 | -165 | 178.7 | -169.4 | -177.8 | 3.5 | 113 | I4 E5 L6 N71 | I4-R8 WeakPolarHBondContact O-CB 3.45Å; I4-R8 PolarHBondContact O-N 3.38Å; I4-R8 VanDerWaalsContact O-N 3.09Å; E5-R8 PolarHBondContact O-N 2.99Å; L6-R8 PolarHBondContact O-N 3.49Å; R8-N71 PolarHBondContact NH2-OD1 3.16Å |
| 9 | K | 61.6 | Low | 68.9 | Low | 192 Ų | 192 | 96.5 Ų | 96.5 | 84% | 0.835 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -78 | -35.1 | -177.2 | -143 | 172.3 | -168.9 | 174.7 | 0 | 112.3 | E5 L6 Y7 | E5-K9 WeakPolarHBondContact O-CB 3.36Å; E5-K9 PolarHBondContact O-N 3.04Å; L6-K9 PolarHBondContact O-N 3.24Å; Y7-K9 VanDerWaalsContact C-N 3.31Å; Y7-K9 PolarHBondContact O-N 3.17Å |
| 10 | T | 65.2 | Low | 69.8 | Low | 70 Ų | 70 | 91.7 Ų | 91.7 | 43% | 0.429 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -91.2 | -12.3 | -177.2 | 52.1 | 0 | 0 | 0 | 0 | 113.8 | L6 Y7 I12 | L6-T10 WeakPolarHBondContact O-CB 3.36Å; L6-T10 PolarHBondContact O-N 3.42Å; L6-T10 PolarHBondContact O-OG1 3.1Å; Y7-T10 PolarHBondContact O-N 3.11Å; Y7-T10 PolarHBondContact O-OG1 3.2Å; T10-I12 HydrophobicContact CG2-CD1 4.16Å; T10-I12 PolarHBondContact O-N 2.91Å; T10-I12 VanDerWaalsContact O-N 3.12Å; T10-I12 WeakPolarHBondContact OG1-CD1 3.42Å; T10-I12 WeakPolarHBondContact OG1-CG1 3.28Å |
| 11 | K | 70.5 | Confident | 70.6 | Confident | 145 Ų | 145 | 91.2 Ų | 91.2 | 63% | 0.63 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 29.5 | -177.6 | -66.8 | -175.8 | 176.4 | -179.1 | 0 | 113.2 | Y7 D13 P15 | Y7-K11 PolarHBondContact O-N 3.29Å; K11-D13 VanDerWaalsContact CA-OD1 3.26Å; K11-D13 WeakPolarHBondContact CA-OD1 3.36Å; K11-D13 PolarHBondContact O-N 3.28Å; K11-P15 WeakPolarHBondContact O-CD 3.48Å |
| 12 | I | 73.4 | Confident | 72.6 | Confident | 78 Ų | 78 | 86 Ų | 86 | 40% | 0.4 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.5 | -21 | -177.6 | -64 | 166 | 0 | 0 | 0 | 111 | Y7 T10 I14 P15 L16 | Y7-I12 HydrophobicContact CD1-CB 4.49Å; T10-I12 HydrophobicContact CG2-CD1 4.16Å; T10-I12 PolarHBondContact O-N 2.91Å; T10-I12 VanDerWaalsContact O-N 3.12Å; T10-I12 WeakPolarHBondContact OG1-CD1 3.42Å; T10-I12 WeakPolarHBondContact OG1-CG1 3.28Å; I12-I14 VanDerWaalsContact C-N 3.32Å; I12-I14 PolarHBondContact O-N 3.46Å; I12-P15 WeakPolarHBondContact O-CD 3.24Å; I12-P15 VanDerWaalsContact O-CG 3.26Å; I12-P15 WeakPolarHBondContact O-CG 3.48Å; I12-L16 WeakPolarHBondContact O-CB 2.93Å; I12-L16 PolarHBondContact O-N 3.28Å |
| 13 | D | 74.4 | Confident | 74.2 | Confident | 14 Ų | 14 | 83.7 Ų | 83.7 | 8% | 0.075 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -56.3 | -39.3 | 177.2 | 38.9 | -52.4 | 0 | 0 | 0 | 113.2 | K11 L17 V63 I67 | K11-D13 VanDerWaalsContact CA-OD1 3.26Å; K11-D13 WeakPolarHBondContact CA-OD1 3.36Å; K11-D13 PolarHBondContact O-N 3.28Å; D13-L17 VanDerWaalsContact O-CB 3.32Å; D13-L17 WeakPolarHBondContact O-CB 3.37Å; D13-L17 PolarHBondContact O-N 3.48Å; D13-V63 HydrophobicContact CB-CG1 4.25Å; D13-I67 HydrophobicContact CB-CD1 4.01Å |
| 14 | I | 78.2 | Confident | 75.5 | Confident | 100 Ų | 100 | 77.9 Ų | 77.9 | 51% | 0.513 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -69 | -54.6 | 178.3 | -58.4 | 171.7 | 0 | 0 | 0 | 112.7 | I12 L16 L17 A18 | I12-I14 VanDerWaalsContact C-N 3.32Å; I12-I14 PolarHBondContact O-N 3.46Å; I14-L16 VanDerWaalsContact C-N 3.28Å; I14-L16 PolarHBondContact O-N 3.38Å; I14-L17 WeakPolarHBondContact O-CB 3.07Å; I14-L17 PolarHBondContact O-N 3.09Å; I14-A18 PolarHBondContact O-N 2.92Å |
| 15 | P | 83.8 | Confident | 77.1 | Confident | 74 Ų | 74 | 78.9 Ų | 78.9 | 48% | 0.481 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.6 | -31.7 | 178.2 | 24.9 | -33.1 | 0 | 0 | 0 | 112.2 | K11 I12 A18 A19 | K11-P15 WeakPolarHBondContact O-CD 3.48Å; I12-P15 WeakPolarHBondContact O-CD 3.24Å; I12-P15 VanDerWaalsContact O-CG 3.26Å; I12-P15 WeakPolarHBondContact O-CG 3.48Å; P15-A18 PolarHBondContact O-N 2.8Å; P15-A19 WeakPolarHBondContact O-CB 3.29Å; P15-A19 PolarHBondContact O-N 3.39Å |
| 16 | L | 82.5 | Confident | 78.6 | Confident | 46 Ų | 46 | 76.2 Ų | 76.2 | 24% | 0.241 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -66.4 | -39.2 | 175.2 | -162.4 | 72.7 | 0 | 0 | 0 | 111.5 | I12 I14 A19 G20 L56 F59 | I12-L16 WeakPolarHBondContact O-CB 2.93Å; I12-L16 PolarHBondContact O-N 3.28Å; I14-L16 VanDerWaalsContact C-N 3.28Å; I14-L16 PolarHBondContact O-N 3.38Å; L16-A19 PolarHBondContact O-N 2.95Å; L16-G20 PolarHBondContact O-N 3.01Å; L16-L56 HydrophobicContact CD1-CD2 4.07Å; L16-L56 HydrophobicContact CG-CD2 4.36Å; L16-F59 HydrophobicContact CD2-CD1 4.39Å |
| 17 | L | 83.3 | Confident | 80.1 | Confident | 44 Ų | 44 | 71 Ų | 71 | 23% | 0.23 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -64.3 | -44.6 | 173.9 | -167.4 | 85.3 | 0 | 0 | 0 | 111.1 | D13 I14 G20 M21 F57 S60 L61 | D13-L17 VanDerWaalsContact O-CB 3.32Å; D13-L17 WeakPolarHBondContact O-CB 3.37Å; D13-L17 PolarHBondContact O-N 3.48Å; I14-L17 WeakPolarHBondContact O-CB 3.07Å; I14-L17 PolarHBondContact O-N 3.09Å; L17-G20 PolarHBondContact O-N 3.35Å; L17-M21 WeakPolarHBondContact O-CB 3.4Å; L17-M21 WeakPolarHBondContact O-CG 3.48Å; L17-M21 PolarHBondContact O-N 2.95Å; L17-F57 HydrophobicContact CD1-CD2 4.48Å; L17-F57 HydrophobicContact CD1-CE2 3.99Å; L17-F57 HydrophobicContact CG-CE2 4.4Å; L17-S60 WeakPolarHBondContact CA-OG 3.22Å; L17-S60 WeakPolarHBondContact CB-OG 3.32Å; L17-S60 VanDerWaalsContact CD1-OG 3.24Å; L17-S60 WeakPolarHBondContact CD1-OG 3.23Å; L17-S60 PolarHBondContact N-OG 3.41Å; L17-L61 HydrophobicContact CD1-CB 4.31Å; L17-L61 HydrophobicContact CD1-CG 4.45Å |
| 18 | A | 86.1 | Confident | 81.6 | Confident | 47 Ų | 47 | 72 Ų | 72 | 39% | 0.388 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | I14 P15 G20 M21 I22 | I14-A18 PolarHBondContact O-N 2.92Å; P15-A18 PolarHBondContact O-N 2.8Å; A18-G20 PolarHBondContact O-N 3.46Å; A18-M21 PolarHBondContact O-N 3.46Å; A18-I22 WeakPolarHBondContact O-CB 3.31Å; A18-I22 WeakPolarHBondContact O-CD1 3.2Å; A18-I22 WeakPolarHBondContact O-CG1 3.44Å; A18-I22 PolarHBondContact O-N 2.95Å |
| 19 | A | 87.1 | Confident | 83 | Confident | 44 Ų | 44 | 70.9 Ų | 70.9 | 36% | 0.364 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -61.6 | -44.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P15 L16 M21 I22 L23 | P15-A19 WeakPolarHBondContact O-CB 3.29Å; P15-A19 PolarHBondContact O-N 3.39Å; L16-A19 PolarHBondContact O-N 2.95Å; A19-M21 PolarHBondContact O-N 3.49Å; A19-I22 PolarHBondContact O-N 3.5Å; A19-L23 WeakPolarHBondContact O-CB 3.36Å; A19-L23 WeakPolarHBondContact O-CG 3.36Å; A19-L23 PolarHBondContact O-N 2.85Å |
| 20 | G | 85.6 | Confident | 84.3 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.7 | -45.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L16 L17 A18 L23 C24 | L16-G20 PolarHBondContact O-N 3.01Å; L17-G20 PolarHBondContact O-N 3.35Å; A18-G20 PolarHBondContact O-N 3.46Å; G20-L23 PolarHBondContact O-N 2.95Å; G20-C24 PolarHBondContact O-N 3.33Å; G20-C24 PolarHBondContact O-SG 2.87Å |
| 21 | M | 87.5 | Confident | 85.5 | Confident | 83 Ų | 83 | 63.7 Ų | 63.7 | 41% | 0.409 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -60.2 | -46.5 | 175.5 | -78.4 | -64.6 | -66.4 | 0 | 0 | 112.3 | L17 A18 A19 L23 C24 I25 F57 | L17-M21 WeakPolarHBondContact O-CB 3.4Å; L17-M21 WeakPolarHBondContact O-CG 3.48Å; L17-M21 PolarHBondContact O-N 2.95Å; A18-M21 PolarHBondContact O-N 3.46Å; A19-M21 PolarHBondContact O-N 3.49Å; M21-L23 VanDerWaalsContact C-N 3.33Å; M21-L23 PolarHBondContact O-N 3.32Å; M21-C24 PolarHBondContact O-N 3.49Å; M21-I25 VanDerWaalsContact O-CG1 3.32Å; M21-I25 WeakPolarHBondContact O-CG1 3.23Å; M21-I25 PolarHBondContact O-N 3.43Å; M21-F57 HydrophobicContact CG-CD2 3.98Å; M21-F57 HydrophobicContact CG-CE2 3.44Å; M21-F57 VanDerWaalsContact CG-CE2 3.44Å; M21-F57 HydrophobicContact CG-CZ 4.21Å; M21-F57 HydrophobicContact SD-CD2 3.96Å; M21-F57 HydrophobicContact SD-CE1 4.24Å; M21-F57 HydrophobicContact SD-CE2 3.16Å; M21-F57 WeakPolarHBondContact SD-CE2 3.47Å; M21-F57 HydrophobicContact SD-CZ 3.31Å; M21-F57 WeakPolarHBondContact SD-CZ 3.5Å |
| 22 | I | 91.4 | Very high | 86.5 | Confident | 99 Ų | 99 | 59.8 Ų | 59.8 | 51% | 0.508 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.2 | -43.2 | -179.8 | -69.4 | 163.4 | 0 | 0 | 0 | 110.4 | A18 A19 I25 L26 | A18-I22 WeakPolarHBondContact O-CB 3.31Å; A18-I22 WeakPolarHBondContact O-CD1 3.2Å; A18-I22 WeakPolarHBondContact O-CG1 3.44Å; A18-I22 PolarHBondContact O-N 2.95Å; A19-I22 PolarHBondContact O-N 3.5Å; I22-I25 PolarHBondContact O-N 3.37Å; I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 HydrophobicContact CG2-CG 4.46Å; I22-L26 WeakPolarHBondContact O-CB 3.33Å; I22-L26 WeakPolarHBondContact O-CG 3.18Å; I22-L26 PolarHBondContact O-N 3.42Å |
| 23 | L | 87 | Confident | 87.4 | Confident | 60 Ų | 60 | 59.7 Ų | 59.7 | 31% | 0.314 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 176.6 | -75.4 | 166.8 | 0 | 0 | 0 | 112.2 | A19 G20 M21 I25 L26 S27 V49 | A19-L23 WeakPolarHBondContact O-CB 3.36Å; A19-L23 WeakPolarHBondContact O-CG 3.36Å; A19-L23 PolarHBondContact O-N 2.85Å; G20-L23 PolarHBondContact O-N 2.95Å; M21-L23 VanDerWaalsContact C-N 3.33Å; M21-L23 PolarHBondContact O-N 3.32Å; L23-I25 PolarHBondContact O-N 2.97Å; L23-L26 PolarHBondContact O-N 3.43Å; L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 2.83Å; L23-V49 HydrophobicContact CD2-CG1 4.26Å |
| 24 | C | 89.2 | Confident | 88.1 | Confident | 25 Ų | 25 | 59 Ų | 59 | 17% | 0.169 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.4 | -46.2 | 175.3 | -77.2 | 0 | 0 | 0 | 0 | 111.3 | G20 M21 S27 C28 | G20-C24 PolarHBondContact O-N 3.33Å; G20-C24 PolarHBondContact O-SG 2.87Å; M21-C24 PolarHBondContact O-N 3.49Å; C24-S27 PolarHBondContact O-N 2.89Å; C24-S27 PolarHBondContact O-OG 2.86Å; C24-C28 PolarHBondContact O-N 2.89Å; C24-C28 VanDerWaalsContact O-N 3.08Å |
| 25 | I | 91.7 | Very high | 88.6 | Confident | 95 Ų | 95 | 59.4 Ų | 59.4 | 49% | 0.487 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.3 | -46.8 | 178.8 | -67.2 | 166.6 | 0 | 0 | 0 | 110.8 | M21 I22 L23 S27 C28 L29 | M21-I25 VanDerWaalsContact O-CG1 3.32Å; M21-I25 WeakPolarHBondContact O-CG1 3.23Å; M21-I25 PolarHBondContact O-N 3.43Å; I22-I25 PolarHBondContact O-N 3.37Å; L23-I25 PolarHBondContact O-N 2.97Å; I25-S27 VanDerWaalsContact C-N 3.28Å; I25-S27 PolarHBondContact O-N 2.88Å; I25-C28 PolarHBondContact O-N 3.36Å; I25-L29 HydrophobicContact CG2-CD1 4.09Å; I25-L29 HydrophobicContact CG2-CG 4.44Å; I25-L29 WeakPolarHBondContact O-CG 3.39Å; I25-L29 PolarHBondContact O-N 3.29Å |
| 26 | L | 90.2 | Very high | 89 | Confident | 87 Ų | 87 | 59.8 Ų | 59.8 | 46% | 0.455 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -58.4 | -41.7 | 176.5 | -82.3 | 163.1 | 0 | 0 | 0 | 111.6 | I22 L23 L29 M30 | I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 HydrophobicContact CG2-CG 4.46Å; I22-L26 WeakPolarHBondContact O-CB 3.33Å; I22-L26 WeakPolarHBondContact O-CG 3.18Å; I22-L26 PolarHBondContact O-N 3.42Å; L23-L26 PolarHBondContact O-N 3.43Å; L26-L29 PolarHBondContact O-N 2.69Å; L26-M30 WeakPolarHBondContact O-CG 3.38Å; L26-M30 PolarHBondContact O-N 3.39Å |
| 27 | S | 90.1 | Very high | 89.3 | Confident | 6 Ų | 6 | 66.9 Ų | 66.9 | 4% | 0.042 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63 | -45.8 | 179 | 79.5 | 0 | 0 | 0 | 0 | 111.6 | L23 C24 I25 L29 M30 I31 | L23-S27 WeakPolarHBondContact O-CB 3.4Å; L23-S27 PolarHBondContact O-N 2.83Å; C24-S27 PolarHBondContact O-N 2.89Å; C24-S27 PolarHBondContact O-OG 2.86Å; I25-S27 VanDerWaalsContact C-N 3.28Å; I25-S27 PolarHBondContact O-N 2.88Å; S27-L29 VanDerWaalsContact C-N 3.32Å; S27-L29 PolarHBondContact O-N 3.28Å; S27-M30 PolarHBondContact O-N 3.34Å; S27-I31 WeakPolarHBondContact O-CD1 3.5Å; S27-I31 VanDerWaalsContact O-CG1 3.23Å; S27-I31 WeakPolarHBondContact O-CG1 3.37Å; S27-I31 PolarHBondContact O-N 3.23Å |
| 28 | C | 92.3 | Very high | 89.5 | Confident | 82 Ų | 82 | 71 Ų | 71 | 55% | 0.554 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -59.8 | -40.5 | 173.6 | -77.1 | 0 | 0 | 0 | 0 | 112.3 | C24 I25 I31 S32 | C24-C28 PolarHBondContact O-N 2.89Å; C24-C28 VanDerWaalsContact O-N 3.08Å; I25-C28 PolarHBondContact O-N 3.36Å; C28-I31 PolarHBondContact O-N 2.83Å; C28-S32 WeakPolarHBondContact O-CB 3.36Å; C28-S32 PolarHBondContact O-N 2.98Å; C28-S32 PolarHBondContact O-OG 3.08Å |
| 29 | L | 92.2 | Very high | 89.6 | Confident | 97 Ų | 97 | 76.7 Ų | 76.7 | 51% | 0.508 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.9 | -43.1 | 176.8 | -70.6 | 175.6 | 0 | 0 | 0 | 111.7 | I25 L26 S27 I31 S32 V33 | I25-L29 HydrophobicContact CG2-CD1 4.09Å; I25-L29 HydrophobicContact CG2-CG 4.44Å; I25-L29 WeakPolarHBondContact O-CG 3.39Å; I25-L29 PolarHBondContact O-N 3.29Å; L26-L29 PolarHBondContact O-N 2.69Å; S27-L29 VanDerWaalsContact C-N 3.32Å; S27-L29 PolarHBondContact O-N 3.28Å; L29-I31 PolarHBondContact O-N 3.26Å; L29-S32 WeakPolarHBondContact CA-OG 3.38Å; L29-S32 PolarHBondContact O-N 2.99Å; L29-S32 PolarHBondContact O-OG 3.3Å; L29-V33 VanDerWaalsContact O-CB 3.29Å; L29-V33 WeakPolarHBondContact O-CB 3.27Å; L29-V33 WeakPolarHBondContact O-CG2 3.37Å; L29-V33 PolarHBondContact O-N 2.9Å |
| 30 | M | 89.2 | Confident | 89.6 | Confident | 69 Ų | 69 | 80.9 Ų | 80.9 | 34% | 0.34 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.5 | -40.9 | 176.6 | -71.5 | -162.2 | 81.4 | 0 | 0 | 112.3 | L26 S27 G34 V42 A45 | L26-M30 WeakPolarHBondContact O-CG 3.38Å; L26-M30 PolarHBondContact O-N 3.39Å; S27-M30 PolarHBondContact O-N 3.34Å; M30-G34 PolarHBondContact O-N 2.95Å; M30-V42 HydrophobicContact CE-CG1 4.16Å; M30-A45 HydrophobicContact CE-CB 4.19Å |
| 31 | I | 91 | Very high | 89.8 | Confident | 43 Ų | 43 | 87.3 Ų | 87.3 | 22% | 0.221 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -63.2 | -50.5 | 177.2 | -65.7 | 164.2 | 0 | 0 | 0 | 110 | S27 C28 L29 V33 G34 I35 I47 | S27-I31 WeakPolarHBondContact O-CD1 3.5Å; S27-I31 VanDerWaalsContact O-CG1 3.23Å; S27-I31 WeakPolarHBondContact O-CG1 3.37Å; S27-I31 PolarHBondContact O-N 3.23Å; C28-I31 PolarHBondContact O-N 2.83Å; L29-I31 PolarHBondContact O-N 3.26Å; I31-V33 PolarHBondContact O-N 3.37Å; I31-G34 PolarHBondContact O-N 3.42Å; I31-I35 HydrophobicContact CG2-CD1 3.76Å; I31-I35 WeakPolarHBondContact O-CD1 3.38Å; I31-I35 VanDerWaalsContact O-CG1 3.24Å; I31-I35 WeakPolarHBondContact O-CG1 3.48Å; I31-I35 PolarHBondContact O-N 3.5Å; I31-I47 HydrophobicContact CD1-CG1 4.07Å; I31-I47 HydrophobicContact CG1-CG1 4.18Å |
| 32 | S | 91.6 | Very high | 89.9 | Confident | 62 Ų | 62 | 85.2 Ų | 85.2 | 43% | 0.434 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | -179.8 | 54.4 | 0 | 0 | 0 | 0 | 112.9 | C28 L29 A36 | C28-S32 WeakPolarHBondContact O-CB 3.36Å; C28-S32 PolarHBondContact O-N 2.98Å; C28-S32 PolarHBondContact O-OG 3.08Å; L29-S32 WeakPolarHBondContact CA-OG 3.38Å; L29-S32 PolarHBondContact O-N 2.99Å; L29-S32 PolarHBondContact O-OG 3.3Å; S32-A36 VanDerWaalsContact O-CB 3.31Å; S32-A36 WeakPolarHBondContact O-CB 3.38Å; S32-A36 PolarHBondContact O-N 2.89Å |
| 33 | V | 91.7 | Very high | 89.9 | Confident | 77 Ų | 77 | 84.7 Ų | 84.7 | 47% | 0.467 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66.9 | -40.5 | 176.3 | 171.4 | 0 | 0 | 0 | 0 | 111.4 | L29 I31 A36 R37 | L29-V33 VanDerWaalsContact O-CB 3.29Å; L29-V33 WeakPolarHBondContact O-CB 3.27Å; L29-V33 WeakPolarHBondContact O-CG2 3.37Å; L29-V33 PolarHBondContact O-N 2.9Å; I31-V33 PolarHBondContact O-N 3.37Å; V33-A36 PolarHBondContact O-N 3.22Å; V33-R37 HydrophobicContact CG1-CG 4.32Å; V33-R37 WeakPolarHBondContact O-CB 3.34Å; V33-R37 WeakPolarHBondContact O-CG 3.36Å; V33-R37 PolarHBondContact O-N 3.33Å |
| 34 | G | 88.1 | Confident | 90 | Very high | 0 Ų | 0 | 86.1 Ų | 86.1 | 0% | 0 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -65.1 | -39.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | M30 I31 V38 R39 | M30-G34 PolarHBondContact O-N 2.95Å; I31-G34 PolarHBondContact O-N 3.42Å; G34-V38 PolarHBondContact O-N 2.88Å; G34-V38 VanDerWaalsContact O-N 3.11Å; G34-R39 PolarHBondContact O-N 3.41Å |
| 35 | I | 89.9 | Confident | 90.1 | Very high | 108 Ų | 108 | 86.7 Ų | 86.7 | 55% | 0.554 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -65.1 | -47.2 | 172.6 | -64.5 | 163.9 | 0 | 0 | 0 | 110.2 | I31 R37 V38 W43 | I31-I35 HydrophobicContact CG2-CD1 3.76Å; I31-I35 WeakPolarHBondContact O-CD1 3.38Å; I31-I35 VanDerWaalsContact O-CG1 3.24Å; I31-I35 WeakPolarHBondContact O-CG1 3.48Å; I31-I35 PolarHBondContact O-N 3.5Å; I35-R37 VanDerWaalsContact C-N 3.27Å; I35-R37 PolarHBondContact O-N 3.03Å; I35-V38 PolarHBondContact O-N 3Å; I35-W43 HydrophobicContact CG1-CB 4.36Å; I35-W43 HydrophobicContact CG1-CG 4.47Å |
| 36 | A | 90.7 | Very high | 90 | Very high | 81 Ų | 81 | 82.2 Ų | 82.2 | 67% | 0.669 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -63.4 | -31 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | S32 V33 | S32-A36 VanDerWaalsContact O-CB 3.31Å; S32-A36 WeakPolarHBondContact O-CB 3.38Å; S32-A36 PolarHBondContact O-N 2.89Å; V33-A36 PolarHBondContact O-N 3.22Å |
| 37 | R | 89.4 | Confident | 90.1 | Very high | 196 Ų | 196 | 81.3 Ų | 81.3 | 74% | 0.74 | 43% | 0.428 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | 2.2 | 179.7 | -66.4 | -67.5 | -171.7 | 148.7 | 0.6 | 113.7 | V33 I35 R39 | V33-R37 HydrophobicContact CG1-CG 4.32Å; V33-R37 WeakPolarHBondContact O-CB 3.34Å; V33-R37 WeakPolarHBondContact O-CG 3.36Å; V33-R37 PolarHBondContact O-N 3.33Å; I35-R37 VanDerWaalsContact C-N 3.27Å; I35-R37 PolarHBondContact O-N 3.03Å; R37-R39 HydrophobicContact CB-CG 4.31Å; R37-R39 PolarHBondContact O-N 3.48Å; R37-R39 VanDerWaalsContact O-N 3.17Å |
| 38 | V | 88.3 | Confident | 90.2 | Very high | 131 Ų | 131 | 86.9 Ų | 86.9 | 79% | 0.794 | 46% | 0.456 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.5 | 40.8 | -175.3 | -163.1 | 0 | 0 | 0 | 0 | 111 | G34 I35 | G34-V38 PolarHBondContact O-N 2.88Å; G34-V38 VanDerWaalsContact O-N 3.11Å; I35-V38 PolarHBondContact O-N 3Å |
| 39 | R | 86.7 | Confident | 90.1 | Very high | 166 Ų | 166 | 85.2 Ų | 85.2 | 63% | 0.626 | 44% | 0.443 | S | S | * | . | trans | -109.8 | 101.9 | 178 | -79.6 | -170.5 | 168.3 | -163.9 | -4.1 | 108.8 | G34 R37 D41 V42 W43 | G34-R39 PolarHBondContact O-N 3.41Å; R37-R39 HydrophobicContact CB-CG 4.31Å; R37-R39 PolarHBondContact O-N 3.48Å; R37-R39 VanDerWaalsContact O-N 3.17Å; R39-D41 VanDerWaalsContact C-N 3.3Å; R39-D41 PolarHBondContact O-N 3.5Å; R39-V42 HydrophobicContact CB-CB 4.25Å; R39-V42 HydrophobicContact CB-CG2 3.85Å; R39-V42 PolarHBondContact O-N 2.88Å; R39-V42 VanDerWaalsContact O-N 3.16Å; R39-W43 VanDerWaalsContact O-CD1 3.31Å; R39-W43 PolarHBondContact O-N 3.45Å | ||
| 40 | E | 87.8 | Confident | 90 | Very high | 132 Ų | 132 | 81.7 Ų | 81.7 | 62% | 0.617 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -54.7 | -46.9 | -179 | -79.2 | -178 | 162.7 | 0 | 0 | 112.4 | V42 W43 I44 | E40-V42 PolarHBondContact O-N 3.48Å; E40-W43 PolarHBondContact O-N 2.92Å; E40-I44 HydrophobicContact CB-CD1 4.11Å; E40-I44 WeakPolarHBondContact O-CB 3.18Å; E40-I44 WeakPolarHBondContact O-CD1 3.2Å; E40-I44 WeakPolarHBondContact O-CG1 3.42Å; E40-I44 PolarHBondContact O-N 3.37Å |
| 41 | D | 89.8 | Confident | 90.1 | Very high | 135 Ų | 135 | 83.9 Ų | 83.9 | 72% | 0.722 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -54 | -34.9 | -179.2 | -52.8 | -33.2 | 0 | 0 | 0 | 113.2 | R39 A45 | R39-D41 VanDerWaalsContact C-N 3.3Å; R39-D41 PolarHBondContact O-N 3.5Å; D41-A45 VanDerWaalsContact O-CB 3.28Å; D41-A45 WeakPolarHBondContact O-CB 3.48Å; D41-A45 PolarHBondContact O-N 3.47Å; D41-A45 VanDerWaalsContact O-N 3.1Å |
| 42 | V | 88.6 | Confident | 90 | Very high | 38 Ų | 38 | 86.2 Ų | 86.2 | 23% | 0.23 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -80.3 | -46.3 | -172.9 | -178.3 | 0 | 0 | 0 | 0 | 111.7 | M30 R39 E40 I44 A45 G46 | M30-V42 HydrophobicContact CE-CG1 4.16Å; R39-V42 HydrophobicContact CB-CB 4.25Å; R39-V42 HydrophobicContact CB-CG2 3.85Å; R39-V42 PolarHBondContact O-N 2.88Å; R39-V42 VanDerWaalsContact O-N 3.16Å; E40-V42 PolarHBondContact O-N 3.48Å; V42-I44 VanDerWaalsContact C-N 3.34Å; V42-A45 PolarHBondContact O-N 3.33Å; V42-G46 PolarHBondContact O-N 2.93Å |
| 43 | W | 91.4 | Very high | 89.7 | Confident | 88 Ų | 88 | 83.3 Ų | 83.3 | 33% | 0.333 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -73.9 | -30 | -180 | 71 | -91.4 | 0 | 0 | 0 | 111.6 | I35 R39 E40 G46 I47 | I35-W43 HydrophobicContact CG1-CB 4.36Å; I35-W43 HydrophobicContact CG1-CG 4.47Å; R39-W43 VanDerWaalsContact O-CD1 3.31Å; R39-W43 PolarHBondContact O-N 3.45Å; E40-W43 PolarHBondContact O-N 2.92Å; W43-G46 PolarHBondContact O-N 3.5Å; W43-I47 HydrophobicContact CE3-CD1 3.4Å; W43-I47 HydrophobicContact CE3-CG1 4.36Å; W43-I47 HydrophobicContact CZ3-CD1 3.32Å; W43-I47 WeakPolarHBondContact O-CG1 3.33Å; W43-I47 PolarHBondContact O-N 3.38Å |
| 44 | I | 90.9 | Very high | 89.5 | Confident | 90 Ų | 90 | 84.4 Ų | 84.4 | 46% | 0.462 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -64.8 | -44.4 | 171.2 | -71.3 | 158.9 | 0 | 0 | 0 | 111 | E40 V42 G46 I47 L48 | E40-I44 HydrophobicContact CB-CD1 4.11Å; E40-I44 WeakPolarHBondContact O-CB 3.18Å; E40-I44 WeakPolarHBondContact O-CD1 3.2Å; E40-I44 WeakPolarHBondContact O-CG1 3.42Å; E40-I44 PolarHBondContact O-N 3.37Å; V42-I44 VanDerWaalsContact C-N 3.34Å; I44-G46 VanDerWaalsContact C-N 3.26Å; I44-G46 PolarHBondContact O-N 3.31Å; I44-I47 PolarHBondContact O-N 2.97Å; I44-I47 VanDerWaalsContact O-N 3.17Å; I44-L48 PolarHBondContact O-N 3.35Å |
| 45 | A | 90.5 | Very high | 89.5 | Confident | 38 Ų | 38 | 87.7 Ų | 87.7 | 31% | 0.314 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -59.5 | -39.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | M30 D41 V42 I47 L48 V49 | M30-A45 HydrophobicContact CE-CB 4.19Å; D41-A45 VanDerWaalsContact O-CB 3.28Å; D41-A45 WeakPolarHBondContact O-CB 3.48Å; D41-A45 PolarHBondContact O-N 3.47Å; D41-A45 VanDerWaalsContact O-N 3.1Å; V42-A45 PolarHBondContact O-N 3.33Å; A45-I47 PolarHBondContact O-N 2.9Å; A45-L48 WeakPolarHBondContact O-CB 3.29Å; A45-L48 PolarHBondContact O-N 2.97Å; A45-V49 WeakPolarHBondContact O-CG2 3.32Å; A45-V49 PolarHBondContact O-N 2.85Å |
| 46 | G | 89.9 | Confident | 89.4 | Confident | 0 Ų | 0 | 85.5 Ų | 85.5 | 0% | 0 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -58.9 | -43.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | V42 W43 I44 V49 A50 | V42-G46 PolarHBondContact O-N 2.93Å; W43-G46 PolarHBondContact O-N 3.5Å; I44-G46 VanDerWaalsContact C-N 3.26Å; I44-G46 PolarHBondContact O-N 3.31Å; G46-V49 PolarHBondContact O-N 3.23Å; G46-A50 PolarHBondContact O-N 3.3Å |
| 47 | I | 92 | Very high | 89.2 | Confident | 69 Ų | 69 | 83.6 Ų | 83.6 | 35% | 0.354 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64 | -42.4 | 175.2 | -68.7 | 170.3 | 0 | 0 | 0 | 111.2 | I31 W43 I44 A45 V49 A50 I51 | I31-I47 HydrophobicContact CD1-CG1 4.07Å; I31-I47 HydrophobicContact CG1-CG1 4.18Å; W43-I47 HydrophobicContact CE3-CD1 3.4Å; W43-I47 HydrophobicContact CE3-CG1 4.36Å; W43-I47 HydrophobicContact CZ3-CD1 3.32Å; W43-I47 WeakPolarHBondContact O-CG1 3.33Å; W43-I47 PolarHBondContact O-N 3.38Å; I44-I47 PolarHBondContact O-N 2.97Å; I44-I47 VanDerWaalsContact O-N 3.17Å; A45-I47 PolarHBondContact O-N 2.9Å; I47-V49 VanDerWaalsContact C-N 3.29Å; I47-V49 PolarHBondContact O-N 3.44Å; I47-A50 WeakPolarHBondContact O-CB 3.42Å; I47-A50 PolarHBondContact O-N 3.29Å; I47-A50 VanDerWaalsContact O-N 3.09Å; I47-I51 HydrophobicContact CG2-CD1 4.01Å; I47-I51 HydrophobicContact CG2-CG1 4.43Å; I47-I51 WeakPolarHBondContact O-CG1 3.31Å; I47-I51 PolarHBondContact O-N 3.41Å |
| 48 | L | 91.2 | Very high | 89.1 | Confident | 123 Ų | 123 | 78.5 Ų | 78.5 | 64% | 0.644 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -58.8 | -43.7 | 177.3 | -164.2 | 85.3 | 0 | 0 | 0 | 111.1 | I44 A45 A50 I51 V52 | I44-L48 PolarHBondContact O-N 3.35Å; A45-L48 WeakPolarHBondContact O-CB 3.29Å; A45-L48 PolarHBondContact O-N 2.97Å; L48-A50 VanDerWaalsContact C-N 3.34Å; L48-I51 PolarHBondContact O-N 3.35Å; L48-V52 PolarHBondContact O-N 3.34Å |
| 49 | V | 90.7 | Very high | 89 | Confident | 47 Ų | 47 | 77.3 Ų | 77.3 | 29% | 0.285 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -65.1 | -38.9 | 175.2 | 177.3 | 0 | 0 | 0 | 0 | 111 | L23 A45 G46 I47 I51 V52 G53 | L23-V49 HydrophobicContact CD2-CG1 4.26Å; A45-V49 WeakPolarHBondContact O-CG2 3.32Å; A45-V49 PolarHBondContact O-N 2.85Å; G46-V49 PolarHBondContact O-N 3.23Å; I47-V49 VanDerWaalsContact C-N 3.29Å; I47-V49 PolarHBondContact O-N 3.44Å; V49-I51 PolarHBondContact O-N 2.87Å; V49-V52 PolarHBondContact O-N 2.82Å; V49-G53 PolarHBondContact O-N 2.84Å |
| 50 | A | 90.7 | Very high | 88.9 | Confident | 23 Ų | 23 | 69.4 Ų | 69.4 | 19% | 0.19 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.4 | -40.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | G46 I47 L48 V52 G53 L54 | G46-A50 PolarHBondContact O-N 3.3Å; I47-A50 WeakPolarHBondContact O-CB 3.42Å; I47-A50 PolarHBondContact O-N 3.29Å; I47-A50 VanDerWaalsContact O-N 3.09Å; L48-A50 VanDerWaalsContact C-N 3.34Å; A50-V52 PolarHBondContact O-N 3.41Å; A50-G53 PolarHBondContact O-N 3.19Å; A50-L54 WeakPolarHBondContact O-CB 3.19Å; A50-L54 PolarHBondContact O-N 3.08Å |
| 51 | I | 91.6 | Very high | 88.7 | Confident | 115 Ų | 115 | 66.2 Ų | 66.2 | 59% | 0.59 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -61.2 | -32.6 | 178.9 | -68.6 | 165.4 | 0 | 0 | 0 | 111.6 | I47 L48 V49 P55 | I47-I51 HydrophobicContact CG2-CD1 4.01Å; I47-I51 HydrophobicContact CG2-CG1 4.43Å; I47-I51 WeakPolarHBondContact O-CG1 3.31Å; I47-I51 PolarHBondContact O-N 3.41Å; L48-I51 PolarHBondContact O-N 3.35Å; V49-I51 PolarHBondContact O-N 2.87Å; I51-P55 WeakPolarHBondContact O-CD 3.24Å; I51-P55 WeakPolarHBondContact O-CG 3.36Å |
| 52 | V | 88.3 | Confident | 88.4 | Confident | 92 Ų | 92 | 64.8 Ų | 64.8 | 56% | 0.558 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -88.5 | -40.7 | 177.1 | -177.8 | 0 | 0 | 0 | 0 | 111.5 | L48 V49 A50 P55 L56 | L48-V52 PolarHBondContact O-N 3.34Å; V49-V52 PolarHBondContact O-N 2.82Å; A50-V52 PolarHBondContact O-N 3.41Å; V52-P55 WeakPolarHBondContact O-CD 2.96Å; V52-P55 WeakPolarHBondContact O-CG 3.2Å; V52-L56 WeakPolarHBondContact O-CB 3.16Å; V52-L56 PolarHBondContact O-N 3.35Å |
| 53 | G | 85.1 | Confident | 88.1 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -68.2 | -40.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | V49 A50 L56 F57 | V49-G53 PolarHBondContact O-N 2.84Å; A50-G53 PolarHBondContact O-N 3.19Å; G53-L56 PolarHBondContact O-N 3.04Å; G53-F57 WeakPolarHBondContact O-CB 3.4Å; G53-F57 PolarHBondContact O-N 3.43Å |
| 54 | L | 87.5 | Confident | 87.6 | Confident | 101 Ų | 101 | 63.1 Ų | 63.1 | 53% | 0.529 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.1 | -51.3 | -178.6 | -161.1 | 100.5 | 0 | 0 | 0 | 113.5 | A50 L56 F57 L58 | A50-L54 WeakPolarHBondContact O-CB 3.19Å; A50-L54 PolarHBondContact O-N 3.08Å; L54-L56 VanDerWaalsContact C-N 3.3Å; L54-L56 PolarHBondContact O-N 3.37Å; L54-F57 PolarHBondContact O-N 3.13Å; L54-L58 HydrophobicContact CD2-CD1 4.21Å; L54-L58 HydrophobicContact CG-CD1 4.4Å; L54-L58 WeakPolarHBondContact O-CB 3.48Å; L54-L58 WeakPolarHBondContact O-CG 3.36Å; L54-L58 PolarHBondContact O-N 3.42Å |
| 55 | P | 88.7 | Confident | 87.1 | Confident | 69 Ų | 69 | 61.7 Ų | 61.7 | 45% | 0.448 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66 | -33.5 | 177.2 | 24.4 | -33 | 0 | 0 | 0 | 112.2 | I51 V52 L58 F59 | I51-P55 WeakPolarHBondContact O-CD 3.24Å; I51-P55 WeakPolarHBondContact O-CG 3.36Å; V52-P55 WeakPolarHBondContact O-CD 2.96Å; V52-P55 WeakPolarHBondContact O-CG 3.2Å; P55-L58 PolarHBondContact O-N 3.35Å; P55-F59 VanDerWaalsContact O-CB 3.23Å; P55-F59 WeakPolarHBondContact O-CB 3.32Å; P55-F59 PolarHBondContact O-N 3.02Å |
| 56 | L | 87.1 | Confident | 86.5 | Confident | 61 Ų | 61 | 63.1 Ų | 63.1 | 32% | 0.319 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -67.5 | -40.3 | 177.3 | -154.6 | 142.7 | 0 | 0 | 0 | 111.1 | L16 V52 G53 L54 S60 | L16-L56 HydrophobicContact CD1-CD2 4.07Å; L16-L56 HydrophobicContact CG-CD2 4.36Å; V52-L56 WeakPolarHBondContact O-CB 3.16Å; V52-L56 PolarHBondContact O-N 3.35Å; G53-L56 PolarHBondContact O-N 3.04Å; L54-L56 VanDerWaalsContact C-N 3.3Å; L54-L56 PolarHBondContact O-N 3.37Å; L56-S60 WeakPolarHBondContact O-CB 3.11Å; L56-S60 PolarHBondContact O-N 2.98Å |
| 57 | F | 87.1 | Confident | 85.7 | Confident | 42 Ų | 42 | 64 Ų | 64 | 18% | 0.184 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.9 | -47.2 | 172.3 | 179.3 | -114.1 | 0 | 0 | 0 | 112.2 | L17 M21 G53 L54 F59 S60 L61 | L17-F57 HydrophobicContact CD1-CD2 4.48Å; L17-F57 HydrophobicContact CD1-CE2 3.99Å; L17-F57 HydrophobicContact CG-CE2 4.4Å; M21-F57 HydrophobicContact CG-CD2 3.98Å; M21-F57 HydrophobicContact CG-CE2 3.44Å; M21-F57 VanDerWaalsContact CG-CE2 3.44Å; M21-F57 HydrophobicContact CG-CZ 4.21Å; M21-F57 HydrophobicContact SD-CD2 3.96Å; M21-F57 HydrophobicContact SD-CE1 4.24Å; M21-F57 HydrophobicContact SD-CE2 3.16Å; M21-F57 WeakPolarHBondContact SD-CE2 3.47Å; M21-F57 HydrophobicContact SD-CZ 3.31Å; M21-F57 WeakPolarHBondContact SD-CZ 3.5Å; G53-F57 WeakPolarHBondContact O-CB 3.4Å; G53-F57 PolarHBondContact O-N 3.43Å; L54-F57 PolarHBondContact O-N 3.13Å; F57-F59 PolarHBondContact O-N 2.99Å; F57-S60 PolarHBondContact O-N 3.12Å; F57-L61 HydrophobicContact CE1-CD1 3.8Å; F57-L61 HydrophobicContact CE2-CD1 4.43Å; F57-L61 HydrophobicContact CZ-CD1 3.7Å; F57-L61 WeakPolarHBondContact O-CB 3.35Å; F57-L61 PolarHBondContact O-N 2.99Å |
| 58 | L | 88 | Confident | 84.7 | Confident | 89 Ų | 89 | 67 Ų | 67 | 47% | 0.466 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.1 | -44.5 | 177.2 | -75.3 | 171 | 0 | 0 | 0 | 112 | L54 P55 L61 I62 | L54-L58 HydrophobicContact CD2-CD1 4.21Å; L54-L58 HydrophobicContact CG-CD1 4.4Å; L54-L58 WeakPolarHBondContact O-CB 3.48Å; L54-L58 WeakPolarHBondContact O-CG 3.36Å; L54-L58 PolarHBondContact O-N 3.42Å; P55-L58 PolarHBondContact O-N 3.35Å; L58-L61 PolarHBondContact O-N 3.26Å; L58-I62 VanDerWaalsContact O-CG1 3.27Å; L58-I62 WeakPolarHBondContact O-CG1 3.14Å; L58-I62 PolarHBondContact O-N 3.24Å |
| 59 | F | 86.4 | Confident | 83.5 | Confident | 106 Ų | 106 | 65.3 Ų | 65.3 | 47% | 0.465 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.2 | -47.6 | 177 | 179.7 | -99.1 | 0 | 0 | 0 | 111.2 | L16 P55 F57 L61 I62 V63 | L16-F59 HydrophobicContact CD2-CD1 4.39Å; P55-F59 VanDerWaalsContact O-CB 3.23Å; P55-F59 WeakPolarHBondContact O-CB 3.32Å; P55-F59 PolarHBondContact O-N 3.02Å; F57-F59 PolarHBondContact O-N 2.99Å; F59-L61 VanDerWaalsContact C-N 3.31Å; F59-L61 PolarHBondContact O-N 2.66Å; F59-I62 PolarHBondContact O-N 2.7Å; F59-V63 HydrophobicContact CD1-CG2 4.38Å; F59-V63 HydrophobicContact CE1-CG2 3.98Å; F59-V63 HydrophobicContact CE2-CG2 4.46Å; F59-V63 HydrophobicContact CZ-CG2 4.02Å; F59-V63 WeakPolarHBondContact O-CG2 3.17Å; F59-V63 PolarHBondContact O-N 3.45Å |
| 60 | S | 83.7 | Confident | 82.1 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -58.5 | -42.6 | 174.8 | 164.8 | 0 | 0 | 0 | 0 | 112.4 | L17 L56 F57 V63 F64 | L17-S60 WeakPolarHBondContact CA-OG 3.22Å; L17-S60 WeakPolarHBondContact CB-OG 3.32Å; L17-S60 VanDerWaalsContact CD1-OG 3.24Å; L17-S60 WeakPolarHBondContact CD1-OG 3.23Å; L17-S60 PolarHBondContact N-OG 3.41Å; L56-S60 WeakPolarHBondContact O-CB 3.11Å; L56-S60 PolarHBondContact O-N 2.98Å; F57-S60 PolarHBondContact O-N 3.12Å; S60-V63 PolarHBondContact O-N 3.46Å; S60-F64 WeakPolarHBondContact O-CB 3.26Å; S60-F64 PolarHBondContact O-N 3.44Å |
| 61 | L | 82.8 | Confident | 80.4 | Confident | 65 Ų | 65 | 68.8 Ų | 68.8 | 34% | 0.34 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -65.9 | -41.4 | -180 | -151.6 | 164.9 | 0 | 0 | 0 | 110.9 | L17 F57 L58 F59 F64 C65 | L17-L61 HydrophobicContact CD1-CB 4.31Å; L17-L61 HydrophobicContact CD1-CG 4.45Å; F57-L61 HydrophobicContact CE1-CD1 3.8Å; F57-L61 HydrophobicContact CE2-CD1 4.43Å; F57-L61 HydrophobicContact CZ-CD1 3.7Å; F57-L61 WeakPolarHBondContact O-CB 3.35Å; F57-L61 PolarHBondContact O-N 2.99Å; L58-L61 PolarHBondContact O-N 3.26Å; F59-L61 VanDerWaalsContact C-N 3.31Å; F59-L61 PolarHBondContact O-N 2.66Å; L61-F64 PolarHBondContact O-N 2.9Å; L61-C65 VanDerWaalsContact O-CB 3.32Å; L61-C65 WeakPolarHBondContact O-CB 3.5Å; L61-C65 PolarHBondContact O-N 3.27Å |
| 62 | I | 85.2 | Confident | 78.1 | Confident | 105 Ų | 105 | 68.6 Ų | 68.6 | 54% | 0.538 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.4 | -48.9 | 174.3 | -68.3 | 163.7 | 0 | 0 | 0 | 110.4 | L58 F59 F64 C65 V66 | L58-I62 VanDerWaalsContact O-CG1 3.27Å; L58-I62 WeakPolarHBondContact O-CG1 3.14Å; L58-I62 PolarHBondContact O-N 3.24Å; F59-I62 PolarHBondContact O-N 2.7Å; I62-F64 VanDerWaalsContact C-N 3.34Å; I62-F64 PolarHBondContact O-N 3.46Å; I62-C65 PolarHBondContact O-N 2.82Å; I62-V66 HydrophobicContact CG2-CG2 4.3Å; I62-V66 VanDerWaalsContact O-CG2 3.29Å; I62-V66 WeakPolarHBondContact O-CG2 3.46Å; I62-V66 PolarHBondContact O-N 2.92Å |
| 63 | V | 81.7 | Confident | 76.1 | Confident | 22 Ų | 22 | 68.2 Ų | 68.2 | 13% | 0.133 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -59.7 | -46.3 | 178.1 | 173.3 | 0 | 0 | 0 | 0 | 110.6 | Y7 D13 F59 S60 C65 V66 I67 | Y7-V63 HydrophobicContact CD1-CG1 4.22Å; Y7-V63 HydrophobicContact CG-CG1 4.25Å; D13-V63 HydrophobicContact CB-CG1 4.25Å; F59-V63 HydrophobicContact CD1-CG2 4.38Å; F59-V63 HydrophobicContact CE1-CG2 3.98Å; F59-V63 HydrophobicContact CE2-CG2 4.46Å; F59-V63 HydrophobicContact CZ-CG2 4.02Å; F59-V63 WeakPolarHBondContact O-CG2 3.17Å; F59-V63 PolarHBondContact O-N 3.45Å; S60-V63 PolarHBondContact O-N 3.46Å; V63-C65 PolarHBondContact O-N 3.46Å; V63-V66 PolarHBondContact O-N 3.32Å; V63-I67 HydrophobicContact CG1-CD1 3.67Å; V63-I67 HydrophobicContact CG1-CG1 4.37Å; V63-I67 WeakPolarHBondContact O-CB 3.26Å; V63-I67 VanDerWaalsContact O-CG1 3.28Å; V63-I67 WeakPolarHBondContact O-CG1 3.4Å; V63-I67 PolarHBondContact O-N 3.37Å |
| 64 | F | 80.4 | Confident | 74.2 | Confident | 68 Ų | 68 | 75.5 Ų | 75.5 | 30% | 0.298 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.3 | -45.4 | 176.5 | -175.8 | -99.6 | 0 | 0 | 0 | 111.8 | S60 L61 I62 I67 R68 | S60-F64 WeakPolarHBondContact O-CB 3.26Å; S60-F64 PolarHBondContact O-N 3.44Å; L61-F64 PolarHBondContact O-N 2.9Å; I62-F64 VanDerWaalsContact C-N 3.34Å; I62-F64 PolarHBondContact O-N 3.46Å; F64-I67 PolarHBondContact O-N 2.81Å; F64-R68 VanDerWaalsContact O-CB 3.31Å; F64-R68 WeakPolarHBondContact O-CB 3.28Å; F64-R68 PolarHBondContact O-N 3.09Å |
| 65 | C | 79.8 | Confident | 72.1 | Confident | 60 Ų | 60 | 75.7 Ų | 75.7 | 41% | 0.405 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62.8 | -41.6 | 176.2 | -84.4 | 0 | 0 | 0 | 0 | 112.8 | L61 I62 V63 R68 T69 | L61-C65 VanDerWaalsContact O-CB 3.32Å; L61-C65 WeakPolarHBondContact O-CB 3.5Å; L61-C65 PolarHBondContact O-N 3.27Å; I62-C65 PolarHBondContact O-N 2.82Å; V63-C65 PolarHBondContact O-N 3.46Å; C65-R68 PolarHBondContact O-N 3.29Å; C65-T69 WeakPolarHBondContact O-CB 3.46Å; C65-T69 PolarHBondContact O-N 3.46Å; C65-T69 PolarHBondContact O-OG1 2.93Å |
| 66 | V | 78.4 | Confident | 69.7 | Low | 68 Ų | 68 | 77.3 Ų | 77.3 | 41% | 0.412 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -65.8 | -46.1 | 178 | 170.4 | 0 | 0 | 0 | 0 | 110.6 | I4 I62 V63 R68 T69 N70 | I4-V66 HydrophobicContact CG2-CG1 4.5Å; I62-V66 HydrophobicContact CG2-CG2 4.3Å; I62-V66 VanDerWaalsContact O-CG2 3.29Å; I62-V66 WeakPolarHBondContact O-CG2 3.46Å; I62-V66 PolarHBondContact O-N 2.92Å; V63-V66 PolarHBondContact O-N 3.32Å; V66-R68 VanDerWaalsContact C-N 3.34Å; V66-R68 PolarHBondContact O-N 2.94Å; V66-T69 PolarHBondContact O-N 3.11Å; V66-N70 WeakPolarHBondContact O-CB 3.31Å; V66-N70 PolarHBondContact O-N 2.83Å |
| 67 | I | 73.4 | Confident | 67.6 | Low | 18 Ų | 18 | 79.2 Ų | 79.2 | 9% | 0.092 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61.9 | -44.2 | 177.3 | -67.4 | 169.2 | 0 | 0 | 0 | 110.2 | I4 D13 V63 F64 N71 | I4-I67 HydrophobicContact CG2-CG1 4.45Å; D13-I67 HydrophobicContact CB-CD1 4.01Å; V63-I67 HydrophobicContact CG1-CD1 3.67Å; V63-I67 HydrophobicContact CG1-CG1 4.37Å; V63-I67 WeakPolarHBondContact O-CB 3.26Å; V63-I67 VanDerWaalsContact O-CG1 3.28Å; V63-I67 WeakPolarHBondContact O-CG1 3.4Å; V63-I67 PolarHBondContact O-N 3.37Å; F64-I67 PolarHBondContact O-N 2.81Å; I67-N71 PolarHBondContact O-N 3.27Å; I67-N71 PolarHBondContact O-ND2 3.06Å |
| 68 | R | 70 | Confident | 65.4 | Low | 134 Ų | 134 | 86 Ų | 86 | 51% | 0.506 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -68 | -42.8 | 179.5 | -145.7 | -168.2 | -179.5 | -175.5 | 4.5 | 111.7 | F64 C65 V66 N70 N71 Y72 | F64-R68 VanDerWaalsContact O-CB 3.31Å; F64-R68 WeakPolarHBondContact O-CB 3.28Å; F64-R68 PolarHBondContact O-N 3.09Å; C65-R68 PolarHBondContact O-N 3.29Å; V66-R68 VanDerWaalsContact C-N 3.34Å; V66-R68 PolarHBondContact O-N 2.94Å; R68-N70 VanDerWaalsContact C-N 3.31Å; R68-N70 PolarHBondContact O-N 3.06Å; R68-N71 WeakPolarHBondContact O-CA 3.48Å; R68-N71 WeakPolarHBondContact O-CB 3.42Å; R68-N71 PolarHBondContact O-N 3.35Å; R68-Y72 HydrophobicContact CB-CE2 4.26Å; R68-Y72 HydrophobicContact CG-CD2 4.29Å; R68-Y72 HydrophobicContact CG-CE2 3.54Å; R68-Y72 VanDerWaalsContact CZ-OH 3.26Å; R68-Y72 PolarHBondContact NE-OH 3.4Å; R68-Y72 PolarHBondContact NH2-OH 3.01Å; R68-Y72 WeakPolarHBondContact O-CD2 3.5Å; R68-Y72 PolarHBondContact O-N 2.74Å; R68-Y72 VanDerWaalsContact O-N 3.13Å |
| 69 | T | 66.9 | Low | 63.3 | Low | 86 Ų | 86 | 90.3 Ų | 90.3 | 53% | 0.528 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 177.5 | -60.7 | 0 | 0 | 0 | 0 | 111.6 | C65 V66 N71 Y72 T73 | C65-T69 WeakPolarHBondContact O-CB 3.46Å; C65-T69 PolarHBondContact O-N 3.46Å; C65-T69 PolarHBondContact O-OG1 2.93Å; V66-T69 PolarHBondContact O-N 3.11Å; T69-N71 VanDerWaalsContact C-N 3.27Å; T69-N71 PolarHBondContact O-N 2.97Å; T69-Y72 PolarHBondContact O-N 3.38Å; T69-T73 PolarHBondContact O-N 3.4Å; T69-T73 VanDerWaalsContact O-N 3.11Å |
| 70 | N | 62.1 | Low | 61.1 | Low | 80 Ų | 80 | 95.1 Ų | 95.1 | 43% | 0.428 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.2 | -31.3 | 176.3 | -161.4 | -3.7 | 0 | 0 | 0 | 112.3 | V66 R68 Y72 T73 | V66-N70 WeakPolarHBondContact O-CB 3.31Å; V66-N70 PolarHBondContact O-N 2.83Å; R68-N70 VanDerWaalsContact C-N 3.31Å; R68-N70 PolarHBondContact O-N 3.06Å; N70-Y72 VanDerWaalsContact C-N 3.32Å; N70-T73 WeakPolarHBondContact CA-OG1 2.99Å; N70-T73 PolarHBondContact O-OG1 3.03Å |
| 71 | N | 53.2 | Low | 59.2 | Low | 63 Ų | 63 | 100 Ų | 100 | 34% | 0.337 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -71.3 | -25.3 | 170.6 | -71.4 | -70.2 | 0 | 0 | 0 | 112.8 | R8 I67 R68 T69 | R8-N71 PolarHBondContact NH2-OD1 3.16Å; I67-N71 PolarHBondContact O-N 3.27Å; I67-N71 PolarHBondContact O-ND2 3.06Å; R68-N71 WeakPolarHBondContact O-CA 3.48Å; R68-N71 WeakPolarHBondContact O-CB 3.42Å; R68-N71 PolarHBondContact O-N 3.35Å; T69-N71 VanDerWaalsContact C-N 3.27Å; T69-N71 PolarHBondContact O-N 2.97Å |
| 72 | Y | 45 | Very low | 57.4 | Low | 112 Ų | 112 | 105.6 Ų | 105.6 | 44% | 0.439 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -82.4 | -24.2 | 177.7 | -70.6 | -67.7 | 0 | 0 | 0 | 114 | R68 T69 N70 E74 V75 L76 | R68-Y72 HydrophobicContact CB-CE2 4.26Å; R68-Y72 HydrophobicContact CG-CD2 4.29Å; R68-Y72 HydrophobicContact CG-CE2 3.54Å; R68-Y72 VanDerWaalsContact CZ-OH 3.26Å; R68-Y72 PolarHBondContact NE-OH 3.4Å; R68-Y72 PolarHBondContact NH2-OH 3.01Å; R68-Y72 WeakPolarHBondContact O-CD2 3.5Å; R68-Y72 PolarHBondContact O-N 2.74Å; R68-Y72 VanDerWaalsContact O-N 3.13Å; T69-Y72 PolarHBondContact O-N 3.38Å; N70-Y72 VanDerWaalsContact C-N 3.32Å; Y72-E74 PolarHBondContact O-N 3.13Å; Y72-E74 VanDerWaalsContact O-N 3.16Å; Y72-V75 PolarHBondContact O-N 3.16Å; Y72-L76 PolarHBondContact O-N 3.21Å |
| 73 | T | 45.7 | Very low | 55.3 | Low | 83 Ų | 83 | 103.9 Ų | 103.9 | 51% | 0.509 | 54% | 0.542 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.3 | -15 | 171.7 | 33.4 | 0 | 0 | 0 | 0 | 113.3 | T69 N70 P77 | T69-T73 PolarHBondContact O-N 3.4Å; T69-T73 VanDerWaalsContact O-N 3.11Å; N70-T73 WeakPolarHBondContact CA-OG1 2.99Å; N70-T73 PolarHBondContact O-OG1 3.03Å; T73-P77 WeakPolarHBondContact O-CD 3.26Å; T73-P77 VanDerWaalsContact O-CG 3.26Å; T73-P77 WeakPolarHBondContact O-CG 3.18Å |
| 74 | E | 44.3 | Very low | 53.4 | Low | 153 Ų | 153 | 111.7 Ų | 111.7 | 72% | 0.715 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.9 | -19.7 | 171.4 | -66.2 | -172.4 | 173.4 | 0 | 0 | 113.4 | Y72 | Y72-E74 PolarHBondContact O-N 3.13Å; Y72-E74 VanDerWaalsContact O-N 3.16Å |
| 75 | V | 44.9 | Very low | 52.1 | Low | 105 Ų | 105 | 115.9 Ų | 115.9 | 64% | 0.636 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -18.9 | -174.6 | -170.3 | 0 | 0 | 0 | 0 | 112.8 | Y72 | Y72-V75 PolarHBondContact O-N 3.16Š|
| 76 | L | 37.6 | Very low | 50.8 | Low | 104 Ų | 104 | 118 Ų | 118 | 55% | 0.545 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -135.7 | 19.7 | -173.6 | -94.8 | 123.3 | 0 | 0 | 0 | 120.7 | Y72 K78 Y80 | Y72-L76 PolarHBondContact O-N 3.21Å; L76-K78 PolarHBondContact O-N 3.3Å; L76-Y80 HydrophobicContact CD2-CE2 4.41Å |
| 77 | P | 42.8 | Very low | 49.5 | Very low | 101 Ų | 101 | 120 Ų | 120 | 66% | 0.656 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -84.1 | 15.1 | 169.3 | 36 | -34.8 | 0 | 0 | 0 | 113.7 | T73 | T73-P77 WeakPolarHBondContact O-CD 3.26Å; T73-P77 VanDerWaalsContact O-CG 3.26Å; T73-P77 WeakPolarHBondContact O-CG 3.18Å |
| 78 | K | 42.1 | Very low | 48.5 | Very low | 184 Ų | 184 | 123.4 Ų | 123.4 | 80% | 0.8 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -112.6 | -0.5 | -168.1 | -102.4 | -164.2 | -178.1 | -179.5 | 0 | 119.5 | L76 | L76-K78 PolarHBondContact O-N 3.3Š|
| 79 | Q | 42 | Very low | 47.4 | Very low | 179 Ų | 179 | 123.1 Ų | 123.1 | 84% | 0.836 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -138.7 | 9.8 | -173.8 | -69.1 | -166.1 | -24.8 | 0 | 0 | 118.8 | V81 | Q79-V81 VanDerWaalsContact C-N 3.28Å; Q79-V81 PolarHBondContact O-N 3.33Å |
| 80 | Y | 41.4 | Very low | 46.4 | Very low | 208 Ų | 208 | 126.3 Ų | 126.3 | 82% | 0.816 | 67% | 0.668 | S | S | * | * | trans | -96.9 | 43.8 | 162.1 | -51.4 | -76 | 0 | 0 | 0 | 111.5 | L76 L82 | L76-Y80 HydrophobicContact CD2-CE2 4.41Å; Y80-L82 VanDerWaalsContact C-N 3.34Å; Y80-L82 PolarHBondContact O-N 3.45Å | ||
| 81 | V | 43.9 | Very low | 45.6 | Very low | 102 Ų | 102 | 128 Ų | 128 | 62% | 0.618 | 68% | 0.682 | S | S | * | * | trans | -86.9 | 90.4 | 157.1 | -174.5 | 0 | 0 | 0 | 0 | 106 | Q79 G83 | Q79-V81 VanDerWaalsContact C-N 3.28Å; Q79-V81 PolarHBondContact O-N 3.33Å; V81-G83 PolarHBondContact O-N 2.83Å | ||
| 82 | L | 44.1 | Very low | 45.2 | Very low | 182 Ų | 182 | 130.3 Ų | 130.3 | 95% | 0.953 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.6 | 90.8 | 158.9 | -138.8 | 81.6 | 0 | 0 | 0 | 106.9 | Y80 | Y80-L82 VanDerWaalsContact C-N 3.34Å; Y80-L82 PolarHBondContact O-N 3.45Å |
| 83 | G | 42.1 | Very low | 45.4 | Very low | 69 Ų | 69 | 129.8 Ų | 129.8 | 71% | 0.711 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 145.5 | -1.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 120.2 | V81 | V81-G83 PolarHBondContact O-N 2.83Š|
| 84 | K | 41.5 | Very low | 45.3 | Very low | 186 Ų | 186 | 130.4 Ų | 130.4 | 81% | 0.809 | 71% | 0.712 | S | S | * | * | trans | -159.5 | 78.1 | 171.7 | -101.3 | -179.3 | -169.8 | 172.7 | 0 | 111.9 | P86 | K84-P86 VanDerWaalsContact O-CD 3.29Å; K84-P86 WeakPolarHBondContact O-CD 3.29Å | ||
| 85 | I | 53.9 | Low | 45.8 | Very low | 157 Ų | 157 | 129.4 Ų | 129.4 | 81% | 0.805 | 72% | 0.722 | S | S | * | * | trans | -82 | 110.8 | 159.1 | -67 | 161.6 | 0 | 0 | 0 | 105.8 | ||||
| 86 | P | 51.1 | Low | 46.1 | Very low | 103 Ų | 103 | 128.5 Ų | 128.5 | 67% | 0.669 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 140.1 | 166.5 | 27 | -31 | 0 | 0 | 0 | 108.1 | K84 | K84-P86 VanDerWaalsContact O-CD 3.29Å; K84-P86 WeakPolarHBondContact O-CD 3.29Å |
| 87 | P | 52.1 | Low | 46.7 | Very low | 112 Ų | 112 | 128.2 Ų | 128.2 | 73% | 0.727 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -57 | 141.3 | -177.8 | 24 | -32.7 | 0 | 0 | 0 | 109.7 | T89 | P87-T89 PolarHBondContact O-N 2.87Å; P87-T89 VanDerWaalsContact O-N 3.09Å |
| 88 | P | 51.4 | Low | 47 | Very low | 89 Ų | 89 | 125.9 Ų | 125.9 | 58% | 0.578 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -57 | 121.5 | 178.2 | 23.8 | -32.5 | 0 | 0 | 0 | 108.8 | F90 | P88-F90 VanDerWaalsContact C-N 3.27Å; P88-F90 HydrophobicContact CB-CE2 4.43Å; P88-F90 HydrophobicContact CG-CD2 4.31Å; P88-F90 HydrophobicContact CG-CE2 3.73Å; P88-F90 HydrophobicContact CG-CZ 4.14Å; P88-F90 WeakPolarHBondContact O-CD2 3.34Å; P88-F90 PolarHBondContact O-N 3.09Å |
| 89 | T | 47.6 | Very low | 47.6 | Very low | 127 Ų | 127 | 121.8 Ų | 121.8 | 78% | 0.779 | 71% | 0.713 | S | S | * | * | trans | -66.5 | 94.2 | 170 | -21 | 0 | 0 | 0 | 0 | 106.8 | P87 T91 | P87-T89 PolarHBondContact O-N 2.87Å; P87-T89 VanDerWaalsContact O-N 3.09Å; T89-T91 PolarHBondContact O-N 2.86Å | ||
| 90 | F | 45.5 | Very low | 48.2 | Very low | 153 Ų | 153 | 118.7 Ų | 118.7 | 67% | 0.671 | 70% | 0.701 | S | S | * | * | trans | -66.8 | 86.2 | 169 | -73.2 | -82.1 | 0 | 0 | 0 | 108.4 | P88 S92 I93 | P88-F90 VanDerWaalsContact C-N 3.27Å; P88-F90 HydrophobicContact CB-CE2 4.43Å; P88-F90 HydrophobicContact CG-CD2 4.31Å; P88-F90 HydrophobicContact CG-CE2 3.73Å; P88-F90 HydrophobicContact CG-CZ 4.14Å; P88-F90 WeakPolarHBondContact O-CD2 3.34Å; P88-F90 PolarHBondContact O-N 3.09Å; F90-S92 PolarHBondContact O-N 3.38Å; F90-I93 HydrophobicContact CB-CD1 3.88Å; F90-I93 HydrophobicContact CB-CG1 3.97Å; F90-I93 HydrophobicContact CD1-CD1 4.46Å; F90-I93 HydrophobicContact CD1-CG1 4.22Å; F90-I93 HydrophobicContact CG-CD1 4.09Å; F90-I93 HydrophobicContact CG-CG1 4.24Å | ||
| 91 | T | 46.5 | Very low | 48.5 | Very low | 117 Ų | 117 | 118.4 Ų | 118.4 | 72% | 0.718 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -75.3 | 113.8 | 160.5 | 54.3 | 0 | 0 | 0 | 0 | 106.8 | T89 | T89-T91 PolarHBondContact O-N 2.86Š|
| 92 | S | 44.2 | Very low | 48.6 | Very low | 111 Ų | 111 | 122.1 Ų | 122.1 | 78% | 0.776 | 71% | 0.71 | S | S | * | * | trans | 68.4 | 76.6 | -178.7 | 68.7 | 0 | 0 | 0 | 0 | 117 | F90 | F90-S92 PolarHBondContact O-N 3.38Š| ||
| 93 | I | 49.5 | Very low | 48.6 | Very low | 101 Ų | 101 | 121 Ų | 121 | 52% | 0.518 | 73% | 0.727 | S | S | . | * | trans | -73.5 | 121.3 | 144.6 | -65.1 | 158 | 0 | 0 | 0 | 106 | F90 S95 | F90-I93 HydrophobicContact CB-CD1 3.88Å; F90-I93 HydrophobicContact CB-CG1 3.97Å; F90-I93 HydrophobicContact CD1-CD1 4.46Å; F90-I93 HydrophobicContact CD1-CG1 4.22Å; F90-I93 HydrophobicContact CG-CD1 4.09Å; F90-I93 HydrophobicContact CG-CG1 4.24Å; I93-S95 PolarHBondContact O-N 3.28Å | ||
| 94 | P | 43.9 | Very low | 48.9 | Very low | 95 Ų | 95 | 123.6 Ų | 123.6 | 62% | 0.617 | 73% | 0.728 | S | S | * | * | trans | -61.6 | 127.6 | 168.1 | 24.9 | -29.4 | 0 | 0 | 0 | 107.6 | A96 L97 | P94-A96 PolarHBondContact O-N 3.26Å; P94-L97 PolarHBondContact O-N 2.72Å | ||
| 95 | S | 53.2 | Low | 49.3 | Very low | 133 Ų | 133 | 120.3 Ų | 120.3 | 93% | 0.93 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | 15.7 | -173.7 | 28 | 0 | 0 | 0 | 0 | 115.7 | I93 | I93-S95 PolarHBondContact O-N 3.28Š|
| 96 | A | 52.3 | Low | 49 | Very low | 85 Ų | 85 | 118.3 Ų | 118.3 | 70% | 0.702 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.1 | -10 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | P94 | P94-A96 PolarHBondContact O-N 3.26Š|
| 97 | L | 49.4 | Very low | 48.9 | Very low | 98 Ų | 98 | 119.2 Ų | 119.2 | 51% | 0.513 | 72% | 0.722 | S | S | . | * | S | Bend | trans | -114.6 | 17.3 | -173.8 | -132.7 | 77.7 | 0 | 0 | 0 | 114.6 | P94 I100 | P94-L97 PolarHBondContact O-N 2.72Å; L97-I100 HydrophobicContact CD1-CD1 4.1Å; L97-I100 HydrophobicContact CG-CD1 4.18Å |
| 98 | G | 48.5 | Very low | 48.7 | Very low | 53 Ų | 53 | 119.6 Ų | 119.6 | 55% | 0.546 | 72% | 0.722 | S | S | . | * | S | Bend | trans | -81.5 | -16.9 | -179 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 99 | S | 54.9 | Low | 48.5 | Very low | 98 Ų | 98 | 121.7 Ų | 121.7 | 69% | 0.685 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -87.2 | -10.6 | -175.4 | 62.8 | 0 | 0 | 0 | 0 | 114.8 | ||
| 100 | I | 56.3 | Low | 48.6 | Very low | 114 Ų | 114 | 121.3 Ų | 121.3 | 59% | 0.585 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -88.4 | -16.8 | -173.2 | -47.6 | 179.2 | 0 | 0 | 0 | 112 | L97 | L97-I100 HydrophobicContact CD1-CD1 4.1Å; L97-I100 HydrophobicContact CG-CD1 4.18Å |
| 101 | Y | 46.5 | Very low | 48.8 | Very low | 201 Ų | 201 | 118.8 Ų | 118.8 | 79% | 0.788 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -103.4 | 6.3 | -177.6 | -73 | -80.7 | 0 | 0 | 0 | 114.4 | ||
| 102 | H | 46.8 | Very low | 49 | Very low | 181 Ų | 181 | 119 Ų | 119 | 84% | 0.838 | 73% | 0.734 | S | S | * | * | trans | -122.6 | 16.9 | -176.9 | -105 | -64.4 | 0 | 0 | 0 | 114.9 | ||||
| 103 | A | 42.8 | Very low | 49.4 | Very low | 158 Ų | 158 | 119.7 Ų | 119.7 | 100% | 1.306 | 73% | 0.73 | S | S | * | * | trans | -119.3 | 0 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111 |
Retrieved 103 of 103 residues in 103.6 ms
(Link to these results)