| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.9 | Very low | 56.7 | Low | 244 Ų | 244 | 147.7 Ų | 147.7 | 100% | 1.202 | 73% | 0.733 | S | S | * | * | 0 | 105.9 | 0 | -66.4 | -174.7 | -125.9 | 0 | 0 | 107 | S3 | M1-S3 PolarHBondContact O-N 2.97Š| |||
| 2 | A | 44.4 | Very low | 58.9 | Low | 93 Ų | 93 | 138.9 Ų | 138.9 | 77% | 0.769 | 69% | 0.694 | S | S | * | * | trans | -63.8 | 132 | -176.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | N4 | A2-N4 PolarHBondContact O-N 3.45Š| ||
| 3 | S | 51.1 | Low | 61.2 | Low | 88 Ų | 88 | 135.5 Ų | 135.5 | 62% | 0.615 | 69% | 0.685 | S | S | * | * | trans | -58 | 105.7 | 166.4 | 42.9 | 0 | 0 | 0 | 0 | 107.9 | M1 F5 | M1-S3 PolarHBondContact O-N 2.97Å; S3-F5 PolarHBondContact O-N 3.28Å; S3-F5 WeakPolarHBondContact OG-CE2 3.43Å | ||
| 4 | N | 51.9 | Low | 63 | Low | 155 Ų | 155 | 133.2 Ų | 133.2 | 83% | 0.829 | 68% | 0.675 | S | S | * | * | trans | -65.3 | 87.6 | 164.5 | -95.2 | -82 | 0 | 0 | 0 | 106.7 | A2 R6 | A2-N4 PolarHBondContact O-N 3.45Å; N4-R6 VanDerWaalsContact C-N 3.32Å; N4-R6 PolarHBondContact O-N 3.3Å | ||
| 5 | F | 53.4 | Low | 64.6 | Low | 182 Ų | 182 | 128.3 Ų | 128.3 | 80% | 0.798 | 65% | 0.65 | S | S | * | * | trans | -57.1 | 105.7 | 159.7 | -76 | -80.4 | 0 | 0 | 0 | 105.4 | S3 S7 | S3-F5 PolarHBondContact O-N 3.28Å; S3-F5 WeakPolarHBondContact OG-CE2 3.43Å; F5-S7 PolarHBondContact O-N 3.33Å | ||
| 6 | R | 58.1 | Low | 66.2 | Low | 236 Ų | 236 | 126.7 Ų | 126.7 | 89% | 0.891 | 64% | 0.642 | S | S | * | * | trans | -56.2 | 105.3 | 177.6 | -168.4 | 161 | -175.9 | 163.2 | -0 | 106.3 | N4 Y8 | N4-R6 VanDerWaalsContact C-N 3.32Å; N4-R6 PolarHBondContact O-N 3.3Å; R6-Y8 PolarHBondContact O-N 3Å | ||
| 7 | S | 53.8 | Low | 67.7 | Low | 83 Ų | 83 | 123.6 Ų | 123.6 | 58% | 0.58 | 63% | 0.634 | S | S | * | * | trans | -55.2 | 135.7 | 174.3 | 66.4 | 0 | 0 | 0 | 0 | 106.5 | F5 I9 | F5-S7 PolarHBondContact O-N 3.33Å; S7-I9 PolarHBondContact O-N 2.97Å; S7-I9 WeakPolarHBondContact OG-CG1 3.43Å | ||
| 8 | Y | 58.2 | Low | 69 | Low | 146 Ų | 146 | 119.7 Ų | 119.7 | 57% | 0.573 | 61% | 0.613 | S | S | * | * | trans | -67.1 | 84.2 | 171.6 | -137.1 | -86.3 | 0 | 0 | 0 | 105.8 | R6 W10 R87 Q90 | R6-Y8 PolarHBondContact O-N 3Å; Y8-W10 VanDerWaalsContact C-N 3.27Å; Y8-W10 PolarHBondContact O-N 2.93Å; Y8-R87 PolarHBondContact OH-NH1 3.46Å; Y8-Q90 PolarHBondContact OH-NE2 3.29Å | ||
| 9 | I | 62 | Low | 70.2 | Confident | 139 Ų | 139 | 115.9 Ų | 115.9 | 71% | 0.713 | 59% | 0.593 | S | S | * | * | trans | -68.8 | 98.5 | 170.8 | -59.2 | 172.9 | 0 | 0 | 0 | 103.9 | S7 D11 | S7-I9 PolarHBondContact O-N 2.97Å; S7-I9 WeakPolarHBondContact OG-CG1 3.43Å; I9-D11 PolarHBondContact O-N 2.76Å | ||
| 10 | W | 66.4 | Low | 71.4 | Confident | 190 Ų | 190 | 114.1 Ų | 114.1 | 72% | 0.72 | 59% | 0.588 | S | S | * | * | trans | -63.4 | 103 | 179.2 | -176.9 | 81.3 | 0 | 0 | 0 | 107.8 | Y8 P12 | Y8-W10 VanDerWaalsContact C-N 3.27Å; Y8-W10 PolarHBondContact O-N 2.93Å; W10-P12 HydrophobicContact CD2-CB 4.38Å; W10-P12 HydrophobicContact CD2-CG 4.47Å; W10-P12 HydrophobicContact CE3-CB 4.17Å; W10-P12 HydrophobicContact CE3-CG 3.84Å; W10-P12 HydrophobicContact CH2-CB 3.48Å; W10-P12 VanDerWaalsContact CH2-CB 3.48Å; W10-P12 HydrophobicContact CH2-CG 3.73Å; W10-P12 HydrophobicContact CZ2-CB 3.69Å; W10-P12 HydrophobicContact CZ2-CG 4.35Å; W10-P12 HydrophobicContact CZ3-CB 3.73Å; W10-P12 HydrophobicContact CZ3-CG 3.43Å; W10-P12 VanDerWaalsContact CZ3-CG 3.43Å; W10-P12 VanDerWaalsContact O-CD 3.31Å; W10-P12 WeakPolarHBondContact O-CD 3.49Å | ||
| 11 | D | 81.7 | Confident | 72.4 | Confident | 69 Ų | 69 | 111.5 Ų | 111.5 | 37% | 0.369 | 58% | 0.575 | S | S | . | * | trans | -106.5 | 92 | 175.4 | -166.3 | -24.3 | 0 | 0 | 0 | 108.2 | I9 V13 L14 I15 | I9-D11 PolarHBondContact O-N 2.76Å; D11-V13 PolarHBondContact O-N 3.39Å; D11-V13 PolarHBondContact OD1-N 3.44Å; D11-L14 HydrophobicContact CB-CB 4.31Å; D11-L14 HydrophobicContact CB-CD1 3.87Å; D11-L14 HydrophobicContact CB-CG 4.12Å; D11-L14 PolarHBondContact O-N 3.32Å; D11-L14 WeakPolarHBondContact OD2-CD1 3.31Å; D11-I15 PolarHBondContact O-N 2.84Å | ||
| 12 | P | 83.1 | Confident | 74.8 | Confident | 42 Ų | 42 | 100 Ų | 100 | 27% | 0.273 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.8 | -28.1 | -175 | 26.5 | -33.8 | 0 | 0 | 0 | 111.9 | W10 L14 I15 I16 | W10-P12 HydrophobicContact CD2-CB 4.38Å; W10-P12 HydrophobicContact CD2-CG 4.47Å; W10-P12 HydrophobicContact CE3-CB 4.17Å; W10-P12 HydrophobicContact CE3-CG 3.84Å; W10-P12 HydrophobicContact CH2-CB 3.48Å; W10-P12 VanDerWaalsContact CH2-CB 3.48Å; W10-P12 HydrophobicContact CH2-CG 3.73Å; W10-P12 HydrophobicContact CZ2-CB 3.69Å; W10-P12 HydrophobicContact CZ2-CG 4.35Å; W10-P12 HydrophobicContact CZ3-CB 3.73Å; W10-P12 HydrophobicContact CZ3-CG 3.43Å; W10-P12 VanDerWaalsContact CZ3-CG 3.43Å; W10-P12 VanDerWaalsContact O-CD 3.31Å; W10-P12 WeakPolarHBondContact O-CD 3.49Å; P12-L14 VanDerWaalsContact C-N 3.34Å; P12-I15 PolarHBondContact O-N 3.23Å; P12-I16 VanDerWaalsContact O-CG1 3.3Å; P12-I16 WeakPolarHBondContact O-CG1 3.3Å; P12-I16 PolarHBondContact O-N 2.91Å |
| 13 | V | 88.4 | Confident | 77.1 | Confident | 94 Ų | 94 | 96.9 Ų | 96.9 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.1 | -42.6 | -179.1 | -178.3 | 0 | 0 | 0 | 0 | 109.5 | D11 I15 I16 C17 | D11-V13 PolarHBondContact O-N 3.39Å; D11-V13 PolarHBondContact OD1-N 3.44Å; V13-I15 PolarHBondContact O-N 2.93Å; V13-I16 PolarHBondContact O-N 2.81Å; V13-C17 WeakPolarHBondContact O-CB 3.28Å; V13-C17 PolarHBondContact O-N 3.05Å; V13-C17 PolarHBondContact O-SG 3.18Å |
| 14 | L | 86.8 | Confident | 79.2 | Confident | 104 Ų | 104 | 96 Ų | 96 | 55% | 0.545 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.2 | -41.4 | 176.6 | -69.9 | 177.7 | 0 | 0 | 0 | 112.4 | D11 P12 C17 Q18 | D11-L14 HydrophobicContact CB-CB 4.31Å; D11-L14 HydrophobicContact CB-CD1 3.87Å; D11-L14 HydrophobicContact CB-CG 4.12Å; D11-L14 PolarHBondContact O-N 3.32Å; D11-L14 WeakPolarHBondContact OD2-CD1 3.31Å; P12-L14 VanDerWaalsContact C-N 3.34Å; L14-C17 PolarHBondContact O-N 3.49Å; L14-Q18 WeakPolarHBondContact O-CB 3.35Å; L14-Q18 VanDerWaalsContact O-CG 3.28Å; L14-Q18 WeakPolarHBondContact O-CG 3.36Å; L14-Q18 PolarHBondContact O-N 2.93Å |
| 15 | I | 87.4 | Confident | 81.2 | Confident | 59 Ų | 59 | 89.6 Ų | 89.6 | 30% | 0.303 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.8 | -46.9 | 178.7 | -61.6 | 172.8 | 0 | 0 | 0 | 110.3 | D11 P12 V13 C17 Q18 I19 F94 | D11-I15 PolarHBondContact O-N 2.84Å; P12-I15 PolarHBondContact O-N 3.23Å; V13-I15 PolarHBondContact O-N 2.93Å; I15-C17 VanDerWaalsContact C-N 3.35Å; I15-C17 PolarHBondContact O-N 3.37Å; I15-Q18 WeakPolarHBondContact O-CB 3.48Å; I15-Q18 PolarHBondContact O-N 3.46Å; I15-I19 HydrophobicContact CG2-CD1 4.16Å; I15-I19 WeakPolarHBondContact O-CG1 3.37Å; I15-I19 PolarHBondContact O-N 3.31Å; I15-F94 HydrophobicContact CG2-CZ 4.43Å |
| 16 | I | 89.9 | Confident | 83.1 | Confident | 103 Ų | 103 | 81 Ų | 81 | 53% | 0.528 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 178.4 | -66.5 | 165.8 | 0 | 0 | 0 | 110.4 | P12 V13 Q18 I19 V20 | P12-I16 VanDerWaalsContact O-CG1 3.3Å; P12-I16 WeakPolarHBondContact O-CG1 3.3Å; P12-I16 PolarHBondContact O-N 2.91Å; V13-I16 PolarHBondContact O-N 2.81Å; I16-Q18 VanDerWaalsContact C-N 3.3Å; I16-Q18 PolarHBondContact O-N 3.44Å; I16-I19 PolarHBondContact O-N 2.91Å; I16-V20 HydrophobicContact CG2-CG2 4.35Å; I16-V20 WeakPolarHBondContact O-CG2 3.48Å; I16-V20 PolarHBondContact O-N 3.42Å |
| 17 | C | 90.7 | Very high | 84.6 | Confident | 75 Ų | 75 | 73.2 Ų | 73.2 | 51% | 0.507 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.7 | -40.9 | 175.7 | -73.5 | 0 | 0 | 0 | 0 | 112.1 | V13 L14 I15 V20 L21 | V13-C17 WeakPolarHBondContact O-CB 3.28Å; V13-C17 PolarHBondContact O-N 3.05Å; V13-C17 PolarHBondContact O-SG 3.18Å; L14-C17 PolarHBondContact O-N 3.49Å; I15-C17 VanDerWaalsContact C-N 3.35Å; I15-C17 PolarHBondContact O-N 3.37Å; C17-V20 PolarHBondContact O-N 3.25Å; C17-L21 WeakPolarHBondContact O-CB 3.16Å; C17-L21 PolarHBondContact O-N 2.79Å |
| 18 | Q | 91.4 | Very high | 86.5 | Confident | 53 Ų | 53 | 73.1 Ų | 73.1 | 25% | 0.248 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 175.8 | -75.5 | 174.9 | -18.9 | 0 | 0 | 112.2 | L14 I15 I16 L21 M22 F84 F94 | L14-Q18 WeakPolarHBondContact O-CB 3.35Å; L14-Q18 VanDerWaalsContact O-CG 3.28Å; L14-Q18 WeakPolarHBondContact O-CG 3.36Å; L14-Q18 PolarHBondContact O-N 2.93Å; I15-Q18 WeakPolarHBondContact O-CB 3.48Å; I15-Q18 PolarHBondContact O-N 3.46Å; I16-Q18 VanDerWaalsContact C-N 3.3Å; I16-Q18 PolarHBondContact O-N 3.44Å; Q18-L21 PolarHBondContact O-N 2.83Å; Q18-M22 WeakPolarHBondContact O-CB 3.34Å; Q18-M22 VanDerWaalsContact O-CG 3.32Å; Q18-M22 WeakPolarHBondContact O-CG 3.41Å; Q18-M22 PolarHBondContact O-N 2.98Å; Q18-F84 PolarHBondContact NE2-O 3.19Å; Q18-F94 HydrophobicContact CB-CE1 3.8Å; Q18-F94 HydrophobicContact CB-CZ 3.96Å |
| 19 | I | 91.9 | Very high | 88.1 | Confident | 47 Ų | 47 | 69.9 Ų | 69.9 | 24% | 0.241 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.6 | -53.2 | 175.2 | -64.9 | 170.9 | 0 | 0 | 0 | 109.4 | I15 I16 L21 M22 Q23 F94 F101 | I15-I19 HydrophobicContact CG2-CD1 4.16Å; I15-I19 WeakPolarHBondContact O-CG1 3.37Å; I15-I19 PolarHBondContact O-N 3.31Å; I16-I19 PolarHBondContact O-N 2.91Å; I19-L21 VanDerWaalsContact C-N 3.29Å; I19-L21 PolarHBondContact O-N 2.93Å; I19-M22 PolarHBondContact O-N 2.88Å; I19-M22 VanDerWaalsContact O-N 3.14Å; I19-Q23 HydrophobicContact CG2-CG 4.47Å; I19-Q23 WeakPolarHBondContact O-CG 3.32Å; I19-Q23 PolarHBondContact O-N 3.45Å; I19-F94 HydrophobicContact CG1-CD1 4.02Å; I19-F94 HydrophobicContact CG1-CE1 3.57Å; I19-F101 HydrophobicContact CG2-CE2 4.17Å |
| 20 | V | 93.8 | Very high | 89.5 | Confident | 80 Ų | 80 | 63.3 Ų | 63.3 | 49% | 0.485 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.3 | -43.1 | -179.5 | 173.4 | 0 | 0 | 0 | 0 | 111 | I16 C17 M22 Q23 C24 | I16-V20 HydrophobicContact CG2-CG2 4.35Å; I16-V20 WeakPolarHBondContact O-CG2 3.48Å; I16-V20 PolarHBondContact O-N 3.42Å; C17-V20 PolarHBondContact O-N 3.25Å; V20-M22 PolarHBondContact O-N 2.82Å; V20-Q23 WeakPolarHBondContact O-CB 3.28Å; V20-Q23 PolarHBondContact O-N 3.14Å; V20-C24 PolarHBondContact O-N 2.92Å; V20-C24 PolarHBondContact O-SG 3.41Å |
| 21 | L | 93.4 | Very high | 90.6 | Very high | 60 Ų | 60 | 55.6 Ų | 55.6 | 31% | 0.314 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61 | -45.6 | 177.1 | -178.7 | 69.8 | 0 | 0 | 0 | 112.1 | C17 Q18 I19 Q23 C24 I25 F84 | C17-L21 WeakPolarHBondContact O-CB 3.16Å; C17-L21 PolarHBondContact O-N 2.79Å; Q18-L21 PolarHBondContact O-N 2.83Å; I19-L21 VanDerWaalsContact C-N 3.29Å; I19-L21 PolarHBondContact O-N 2.93Å; L21-Q23 VanDerWaalsContact C-N 3.27Å; L21-Q23 PolarHBondContact O-N 3.33Å; L21-C24 PolarHBondContact O-N 3.23Å; L21-I25 HydrophobicContact CD1-CD1 4.44Å; L21-I25 HydrophobicContact CG-CD1 4.04Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.11Å; L21-I25 PolarHBondContact O-N 3.13Å; L21-F84 HydrophobicContact CD2-CB 4.21Å; L21-F84 HydrophobicContact CD2-CD1 3.35Å; L21-F84 HydrophobicContact CD2-CD2 3.73Å; L21-F84 HydrophobicContact CD2-CE1 3.5Å; L21-F84 VanDerWaalsContact CD2-CE1 3.5Å; L21-F84 HydrophobicContact CD2-CE2 3.88Å; L21-F84 HydrophobicContact CD2-CG 3.47Å; L21-F84 VanDerWaalsContact CD2-CG 3.47Å; L21-F84 HydrophobicContact CD2-CZ 3.76Å; L21-F84 HydrophobicContact CG-CD2 4.48Å; L21-F84 HydrophobicContact CG-CE2 4.43Å; L21-F84 HydrophobicContact CG-CZ 4.49Å |
| 22 | M | 92.9 | Very high | 91.1 | Very high | 1 Ų | 1 | 57.6 Ų | 57.6 | 1% | 0.005 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.4 | -36.8 | 176.6 | -73.9 | -57.3 | -55.5 | 0 | 0 | 111.8 | Q18 I19 V20 I25 Y26 C77 L81 I85 V98 M130 | Q18-M22 WeakPolarHBondContact O-CB 3.34Å; Q18-M22 VanDerWaalsContact O-CG 3.32Å; Q18-M22 WeakPolarHBondContact O-CG 3.41Å; Q18-M22 PolarHBondContact O-N 2.98Å; I19-M22 PolarHBondContact O-N 2.88Å; I19-M22 VanDerWaalsContact O-N 3.14Å; V20-M22 PolarHBondContact O-N 2.82Å; M22-I25 PolarHBondContact O-N 3.48Å; M22-I25 HydrophobicContact SD-CD1 4.37Å; M22-Y26 WeakPolarHBondContact O-CB 3.31Å; M22-Y26 PolarHBondContact O-N 2.94Å; M22-C77 HydrophobicContact CE-CB 4.45Å; M22-L81 HydrophobicContact CE-CD2 3.55Å; M22-L81 HydrophobicContact CE-CG 3.79Å; M22-L81 HydrophobicContact SD-CD2 4.07Å; M22-I85 HydrophobicContact CG-CD1 4.38Å; M22-V98 HydrophobicContact CB-CG2 3.84Å; M22-M130 HydrophobicContact CE-CE 3.53Å |
| 23 | Q | 93.4 | Very high | 91.4 | Very high | 28 Ų | 28 | 59.8 Ų | 59.8 | 13% | 0.131 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.3 | -46.8 | 173.1 | -64.9 | -60.3 | 79 | 0 | 0 | 112 | I19 V20 L21 I25 Y26 Y27 V98 | I19-Q23 HydrophobicContact CG2-CG 4.47Å; I19-Q23 WeakPolarHBondContact O-CG 3.32Å; I19-Q23 PolarHBondContact O-N 3.45Å; V20-Q23 WeakPolarHBondContact O-CB 3.28Å; V20-Q23 PolarHBondContact O-N 3.14Å; L21-Q23 VanDerWaalsContact C-N 3.27Å; L21-Q23 PolarHBondContact O-N 3.33Å; Q23-I25 VanDerWaalsContact C-N 3.34Å; Q23-I25 PolarHBondContact O-N 2.96Å; Q23-Y26 PolarHBondContact O-N 3.29Å; Q23-Y27 VanDerWaalsContact O-CD2 3.28Å; Q23-Y27 WeakPolarHBondContact O-CD2 3.5Å; Q23-Y27 PolarHBondContact O-N 3.4Å; Q23-Y27 VanDerWaalsContact O-N 3.07Å; Q23-V98 VanDerWaalsContact OE1-CA 3.22Å; Q23-V98 VanDerWaalsContact OE1-CG2 3.25Å |
| 24 | C | 93.9 | Very high | 91.4 | Very high | 69 Ų | 69 | 55.6 Ų | 55.6 | 47% | 0.466 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 176.9 | -67.3 | 0 | 0 | 0 | 0 | 111.7 | V20 L21 S28 | V20-C24 PolarHBondContact O-N 2.92Å; V20-C24 PolarHBondContact O-SG 3.41Å; L21-C24 PolarHBondContact O-N 3.23Å; C24-S28 WeakPolarHBondContact O-CB 3.33Å; C24-S28 PolarHBondContact O-N 3.21Å; C24-S28 PolarHBondContact O-OG 2.98Å |
| 25 | I | 94.1 | Very high | 91.4 | Very high | 22 Ų | 22 | 52.4 Ų | 52.4 | 11% | 0.113 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.2 | -51.5 | 176.3 | -69.7 | 167.6 | 0 | 0 | 0 | 109.6 | L21 M22 Q23 Y27 S28 F29 F84 | L21-I25 HydrophobicContact CD1-CD1 4.44Å; L21-I25 HydrophobicContact CG-CD1 4.04Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.11Å; L21-I25 PolarHBondContact O-N 3.13Å; M22-I25 PolarHBondContact O-N 3.48Å; M22-I25 HydrophobicContact SD-CD1 4.37Å; Q23-I25 VanDerWaalsContact C-N 3.34Å; Q23-I25 PolarHBondContact O-N 2.96Å; I25-Y27 PolarHBondContact O-N 3.45Å; I25-S28 PolarHBondContact O-N 2.97Å; I25-F29 HydrophobicContact CB-CD2 4.44Å; I25-F29 HydrophobicContact CG2-CD2 3.71Å; I25-F29 HydrophobicContact CG2-CE2 4.05Å; I25-F29 WeakPolarHBondContact O-CB 3.28Å; I25-F29 VanDerWaalsContact O-CD2 3.32Å; I25-F29 WeakPolarHBondContact O-CD2 3.48Å; I25-F29 PolarHBondContact O-N 3.03Å; I25-F84 HydrophobicContact CD1-CD2 3.87Å; I25-F84 HydrophobicContact CD1-CE2 3.48Å; I25-F84 VanDerWaalsContact CD1-CE2 3.48Å; I25-F84 HydrophobicContact CD1-CZ 4.44Å |
| 26 | Y | 93.3 | Very high | 91.4 | Very high | 2 Ų | 2 | 51.2 Ų | 51.2 | 1% | 0.008 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -55.9 | -52.3 | -176.9 | -177.4 | -89 | 0 | 0 | 0 | 112.3 | M22 Q23 L30 N73 V98 H102 | M22-Y26 WeakPolarHBondContact O-CB 3.31Å; M22-Y26 PolarHBondContact O-N 2.94Å; Q23-Y26 PolarHBondContact O-N 3.29Å; Y26-L30 HydrophobicContact CE1-CD2 3.86Å; Y26-L30 WeakPolarHBondContact O-CB 3.42Å; Y26-L30 PolarHBondContact O-N 3.49Å; Y26-N73 VanDerWaalsContact CD2-ND2 3.26Å; Y26-N73 WeakPolarHBondContact CD2-ND2 3.2Å; Y26-N73 VanDerWaalsContact CE2-ND2 3.28Å; Y26-N73 WeakPolarHBondContact CE2-ND2 3.25Å; Y26-N73 PolarHBondContact O-ND2 2.95Å; Y26-N73 PolarHBondContact O-OD1 2.93Å; Y26-V98 HydrophobicContact CD1-CG1 4.37Å; Y26-V98 HydrophobicContact CD2-CG1 3.5Å; Y26-V98 VanDerWaalsContact CD2-CG1 3.5Å; Y26-V98 HydrophobicContact CE2-CG1 4.08Å; Y26-V98 HydrophobicContact CG-CG1 3.66Å; Y26-H102 HydrophobicContact CE1-CB 4.3Å; Y26-H102 AromaticContact CE1-ND1 3.98Å |
| 27 | Y | 91.1 | Very high | 91.2 | Very high | 72 Ų | 72 | 47.4 Ų | 47.4 | 28% | 0.282 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -72.7 | -35.7 | -177.8 | -73.7 | -71.8 | 0 | 0 | 0 | 113.3 | Q23 I25 G31 F51 H102 | Q23-Y27 VanDerWaalsContact O-CD2 3.28Å; Q23-Y27 WeakPolarHBondContact O-CD2 3.5Å; Q23-Y27 PolarHBondContact O-N 3.4Å; Q23-Y27 VanDerWaalsContact O-N 3.07Å; I25-Y27 PolarHBondContact O-N 3.45Å; Y27-G31 PolarHBondContact O-N 2.71Å; Y27-F51 HydrophobicContact CE1-CE1 4.14Å; Y27-F51 HydrophobicContact CE1-CZ 4.08Å; Y27-H102 WeakPolarHBondContact OH-CA 3.48Å |
| 28 | S | 93 | Very high | 90.9 | Very high | 80 Ų | 80 | 44.4 Ų | 44.4 | 56% | 0.559 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -69 | -44.9 | -179.2 | -54.4 | 0 | 0 | 0 | 0 | 111.3 | C24 I25 L32 | C24-S28 WeakPolarHBondContact O-CB 3.33Å; C24-S28 PolarHBondContact O-N 3.21Å; C24-S28 PolarHBondContact O-OG 2.98Å; I25-S28 PolarHBondContact O-N 2.97Å; S28-L32 WeakPolarHBondContact O-CB 3.13Å; S28-L32 PolarHBondContact O-N 2.67Å |
| 29 | F | 92.8 | Very high | 90.5 | Very high | 79 Ų | 79 | 45.5 Ų | 45.5 | 35% | 0.346 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -74.2 | -35.3 | 177.8 | -77.6 | -79 | 0 | 0 | 0 | 112.2 | I25 G31 L32 W33 N73 T76 | I25-F29 HydrophobicContact CB-CD2 4.44Å; I25-F29 HydrophobicContact CG2-CD2 3.71Å; I25-F29 HydrophobicContact CG2-CE2 4.05Å; I25-F29 WeakPolarHBondContact O-CB 3.28Å; I25-F29 VanDerWaalsContact O-CD2 3.32Å; I25-F29 WeakPolarHBondContact O-CD2 3.48Å; I25-F29 PolarHBondContact O-N 3.03Å; F29-G31 VanDerWaalsContact C-N 3.34Å; F29-G31 PolarHBondContact O-N 2.97Å; F29-L32 HydrophobicContact CD1-CD2 4.2Å; F29-L32 HydrophobicContact CE1-CD2 4.46Å; F29-L32 PolarHBondContact O-N 2.92Å; F29-W33 WeakPolarHBondContact O-CB 3.27Å; F29-W33 PolarHBondContact O-N 2.9Å; F29-N73 WeakPolarHBondContact CB-OD1 3.46Å; F29-T76 HydrophobicContact CB-CG2 4.13Å; F29-T76 HydrophobicContact CD1-CG2 3.57Å; F29-T76 HydrophobicContact CD2-CG2 3.88Å; F29-T76 HydrophobicContact CE1-CG2 3.83Å; F29-T76 HydrophobicContact CE2-CG2 4.13Å; F29-T76 HydrophobicContact CG-CG2 3.58Å; F29-T76 HydrophobicContact CZ-CG2 4.11Å |
| 30 | L | 90.9 | Very high | 90 | Very high | 1 Ų | 1 | 50.4 Ų | 50.4 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 173.2 | -177.6 | 62 | 0 | 0 | 0 | 111 | Y26 L32 W33 L34 I50 F70 N73 | Y26-L30 HydrophobicContact CE1-CD2 3.86Å; Y26-L30 WeakPolarHBondContact O-CB 3.42Å; Y26-L30 PolarHBondContact O-N 3.49Å; L30-L32 VanDerWaalsContact C-N 3.33Å; L30-L32 PolarHBondContact O-N 3.35Å; L30-W33 PolarHBondContact O-N 3.22Å; L30-L34 HydrophobicContact CD1-CD1 4.16Å; L30-L34 HydrophobicContact CD1-CG 4.4Å; L30-L34 HydrophobicContact CG-CD1 4.06Å; L30-L34 WeakPolarHBondContact O-CB 3.46Å; L30-L34 WeakPolarHBondContact O-CG 3.16Å; L30-L34 PolarHBondContact O-N 3.45Å; L30-I50 HydrophobicContact CD2-CG2 4.06Å; L30-F70 HydrophobicContact CD1-CD1 4.01Å; L30-F70 HydrophobicContact CD1-CD2 4.27Å; L30-F70 HydrophobicContact CD1-CE1 4.01Å; L30-F70 HydrophobicContact CD1-CE2 4.25Å; L30-F70 HydrophobicContact CD1-CG 4.14Å; L30-F70 HydrophobicContact CD1-CZ 4.13Å; L30-F70 HydrophobicContact CD2-CE1 3.88Å; L30-F70 HydrophobicContact CD2-CZ 4Å; L30-N73 HydrophobicContact CD1-CB 4.13Å; L30-N73 PolarHBondContact N-OD1 3.17Å |
| 31 | G | 89.1 | Confident | 89.2 | Confident | 27 Ų | 27 | 50.5 Ų | 50.5 | 28% | 0.278 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.7 | -41.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y27 F29 A35 | Y27-G31 PolarHBondContact O-N 2.71Å; F29-G31 VanDerWaalsContact C-N 3.34Å; F29-G31 PolarHBondContact O-N 2.97Å; G31-A35 WeakPolarHBondContact O-CB 3.38Å; G31-A35 PolarHBondContact O-N 3.41Å |
| 32 | L | 91.3 | Very high | 88.3 | Confident | 112 Ų | 112 | 56.6 Ų | 56.6 | 59% | 0.586 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -64.2 | -45.4 | 176.2 | -176.9 | 66.2 | 0 | 0 | 0 | 112.3 | S28 F29 L30 A35 G36 | S28-L32 WeakPolarHBondContact O-CB 3.13Å; S28-L32 PolarHBondContact O-N 2.67Å; F29-L32 HydrophobicContact CD1-CD2 4.2Å; F29-L32 HydrophobicContact CE1-CD2 4.46Å; F29-L32 PolarHBondContact O-N 2.92Å; L30-L32 VanDerWaalsContact C-N 3.33Å; L30-L32 PolarHBondContact O-N 3.35Å; L32-A35 PolarHBondContact O-N 3.35Å; L32-G36 PolarHBondContact O-N 3.46Å |
| 33 | W | 91.1 | Very high | 87.1 | Confident | 87 Ų | 87 | 58.2 Ų | 58.2 | 33% | 0.33 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64 | -45.1 | 178.8 | -77.1 | 123.4 | 0 | 0 | 0 | 111.4 | F29 L30 G36 V37 A69 L72 T76 | F29-W33 WeakPolarHBondContact O-CB 3.27Å; F29-W33 PolarHBondContact O-N 2.9Å; L30-W33 PolarHBondContact O-N 3.22Å; W33-G36 PolarHBondContact O-N 3.35Å; W33-V37 WeakPolarHBondContact O-CB 3.28Å; W33-V37 VanDerWaalsContact O-CG2 3.27Å; W33-V37 WeakPolarHBondContact O-CG2 3.37Å; W33-V37 PolarHBondContact O-N 3.27Å; W33-A69 HydrophobicContact CB-CB 3.96Å; W33-L72 HydrophobicContact CD2-CB 3.87Å; W33-L72 HydrophobicContact CD2-CD1 4.21Å; W33-L72 HydrophobicContact CE3-CB 4.26Å; W33-L72 HydrophobicContact CE3-CD1 3.74Å; W33-L72 HydrophobicContact CG-CB 4.24Å; W33-L72 HydrophobicContact CH2-CD1 4.29Å; W33-L72 HydrophobicContact CZ2-CB 4.13Å; W33-L72 HydrophobicContact CZ3-CD1 3.79Å; W33-T76 PolarHBondContact NE1-OG1 2.98Å; W33-T76 VanDerWaalsContact NE1-OG1 3.11Å |
| 34 | L | 87.8 | Confident | 85.9 | Confident | 7 Ų | 7 | 61.2 Ų | 61.2 | 4% | 0.037 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.2 | -46.1 | 175.8 | -71.9 | 170.3 | 0 | 0 | 0 | 111.6 | L30 G36 V37 D38 I50 A69 | L30-L34 HydrophobicContact CD1-CD1 4.16Å; L30-L34 HydrophobicContact CD1-CG 4.4Å; L30-L34 HydrophobicContact CG-CD1 4.06Å; L30-L34 WeakPolarHBondContact O-CB 3.46Å; L30-L34 WeakPolarHBondContact O-CG 3.16Å; L30-L34 PolarHBondContact O-N 3.45Å; L34-G36 VanDerWaalsContact C-N 3.27Å; L34-G36 PolarHBondContact O-N 3.34Å; L34-V37 PolarHBondContact O-N 3.3Å; L34-D38 WeakPolarHBondContact O-CB 3.36Å; L34-D38 VanDerWaalsContact O-CG 3.24Å; L34-D38 PolarHBondContact O-N 3.38Å; L34-I50 HydrophobicContact CD1-CB 4.45Å; L34-I50 HydrophobicContact CD1-CD1 4.24Å; L34-I50 HydrophobicContact CD1-CG1 3.35Å; L34-A69 HydrophobicContact CD2-CB 3.71Å; L34-A69 HydrophobicContact CG-CB 4.1Å |
| 35 | A | 87.1 | Confident | 84.4 | Confident | 37 Ų | 37 | 66.2 Ų | 66.2 | 31% | 0.306 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.4 | -36.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G31 L32 S39 | G31-A35 WeakPolarHBondContact O-CB 3.38Å; G31-A35 PolarHBondContact O-N 3.41Å; L32-A35 PolarHBondContact O-N 3.35Å; A35-S39 VanDerWaalsContact O-CB 3.28Å; A35-S39 WeakPolarHBondContact O-CB 3.34Å; A35-S39 PolarHBondContact O-N 2.89Å |
| 36 | G | 86.5 | Confident | 83.4 | Confident | 34 Ų | 34 | 67 Ų | 67 | 35% | 0.351 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -65.2 | -48.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L32 W33 L34 S39 L40 | L32-G36 PolarHBondContact O-N 3.46Å; W33-G36 PolarHBondContact O-N 3.35Å; L34-G36 VanDerWaalsContact C-N 3.27Å; L34-G36 PolarHBondContact O-N 3.34Å; G36-S39 PolarHBondContact O-N 3.31Å; G36-L40 WeakPolarHBondContact O-CG 3.47Å; G36-L40 PolarHBondContact O-N 3.07Å; G36-L40 VanDerWaalsContact O-N 3.17Å |
| 37 | V | 85.6 | Confident | 82.2 | Confident | 22 Ų | 22 | 72.3 Ų | 72.3 | 13% | 0.133 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -65.1 | -41.5 | 178.4 | 172.6 | 0 | 0 | 0 | 0 | 111.8 | W33 L34 S39 L40 V41 L65 A69 | W33-V37 WeakPolarHBondContact O-CB 3.28Å; W33-V37 VanDerWaalsContact O-CG2 3.27Å; W33-V37 WeakPolarHBondContact O-CG2 3.37Å; W33-V37 PolarHBondContact O-N 3.27Å; L34-V37 PolarHBondContact O-N 3.3Å; V37-S39 VanDerWaalsContact C-N 3.33Å; V37-S39 PolarHBondContact O-N 3.37Å; V37-L40 PolarHBondContact O-N 2.95Å; V37-V41 PolarHBondContact O-N 3.47Å; V37-L65 HydrophobicContact CG1-CB 3.58Å; V37-L65 HydrophobicContact CG1-CD1 4.18Å; V37-L65 HydrophobicContact CG1-CD2 3.96Å; V37-L65 HydrophobicContact CG1-CG 4.11Å; V37-A69 HydrophobicContact CG2-CB 4.46Å |
| 38 | D | 84.2 | Confident | 81.4 | Confident | 12 Ų | 12 | 71.9 Ų | 71.9 | 6% | 0.064 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -65.2 | -36.9 | 175.6 | -70.6 | -28.3 | 0 | 0 | 0 | 111.9 | L34 L40 V41 Q42 S43 R45 Q49 | L34-D38 WeakPolarHBondContact O-CB 3.36Å; L34-D38 VanDerWaalsContact O-CG 3.24Å; L34-D38 PolarHBondContact O-N 3.38Å; D38-L40 VanDerWaalsContact C-N 3.26Å; D38-L40 PolarHBondContact O-N 3.08Å; D38-V41 PolarHBondContact O-N 3.1Å; D38-Q42 PolarHBondContact O-N 3.23Å; D38-S43 PolarHBondContact O-N 2.9Å; D38-R45 HydrophobicContact CB-CG 4.27Å; D38-Q49 PolarHBondContact OD1-NE2 3.16Å; D38-Q49 PolarHBondContact OD2-OE1 3.48Å |
| 39 | S | 82.7 | Confident | 80.4 | Confident | 77 Ų | 77 | 68.2 Ų | 68.2 | 54% | 0.538 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -65.3 | -30.3 | 175.8 | -170.5 | 0 | 0 | 0 | 0 | 112.6 | A35 G36 V37 V41 | A35-S39 VanDerWaalsContact O-CB 3.28Å; A35-S39 WeakPolarHBondContact O-CB 3.34Å; A35-S39 PolarHBondContact O-N 2.89Å; G36-S39 PolarHBondContact O-N 3.31Å; V37-S39 VanDerWaalsContact C-N 3.33Å; V37-S39 PolarHBondContact O-N 3.37Å; S39-V41 VanDerWaalsContact C-N 3.34Å |
| 40 | L | 81.6 | Confident | 79.6 | Confident | 149 Ų | 149 | 65.9 Ų | 65.9 | 78% | 0.78 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -75 | -26.4 | 176.7 | -67.7 | 172.2 | 0 | 0 | 0 | 112.3 | G36 V37 D38 | G36-L40 WeakPolarHBondContact O-CG 3.47Å; G36-L40 PolarHBondContact O-N 3.07Å; G36-L40 VanDerWaalsContact O-N 3.17Å; V37-L40 PolarHBondContact O-N 2.95Å; D38-L40 VanDerWaalsContact C-N 3.26Å; D38-L40 PolarHBondContact O-N 3.08Å |
| 41 | V | 78.1 | Confident | 78.8 | Confident | 82 Ų | 82 | 68 Ų | 68 | 50% | 0.497 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -109.7 | -0.2 | -172.5 | -178.1 | 0 | 0 | 0 | 0 | 112.9 | V37 D38 S39 S43 L65 | V37-V41 PolarHBondContact O-N 3.47Å; D38-V41 PolarHBondContact O-N 3.1Å; S39-V41 VanDerWaalsContact C-N 3.34Å; V41-S43 PolarHBondContact O-N 3.43Å; V41-L65 HydrophobicContact CB-CD1 4.38Å; V41-L65 HydrophobicContact CG1-CD1 4.28Å; V41-L65 HydrophobicContact CG2-CD1 3.66Å |
| 42 | Q | 74.7 | Confident | 78 | Confident | 188 Ų | 188 | 67.4 Ų | 67.4 | 88% | 0.879 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51 | 34.6 | -174.8 | -63 | -176.9 | -39.1 | 0 | 0 | 112.6 | D38 | D38-Q42 PolarHBondContact O-N 3.23Š|
| 43 | S | 67 | Low | 76.8 | Confident | 36 Ų | 36 | 63.2 Ų | 63.2 | 25% | 0.252 | 34% | 0.344 | S | S | . | . | trans | -81.3 | 153.6 | 179.9 | -166.6 | 0 | 0 | 0 | 0 | 111 | D38 V41 R45 | D38-S43 PolarHBondContact O-N 2.9Å; V41-S43 PolarHBondContact O-N 3.43Å; S43-R45 PolarHBondContact O-N 3.07Å | ||
| 44 | S | 67.6 | Low | 75.4 | Confident | 91 Ų | 91 | 66.4 Ų | 66.4 | 64% | 0.636 | 36% | 0.362 | S | S | * | . | trans | -67.6 | 119.8 | 172 | 52.9 | 0 | 0 | 0 | 0 | 109.8 | S46 | S44-S46 PolarHBondContact O-N 2.91Š| ||
| 45 | R | 63.2 | Low | 74.3 | Confident | 174 Ų | 174 | 67.6 Ų | 67.6 | 66% | 0.657 | 37% | 0.37 | S | S | * | . | trans | -67 | 115.9 | 175.1 | -63.6 | -177.6 | -179.1 | 94.5 | 2.9 | 109.1 | D38 S43 | D38-R45 HydrophobicContact CB-CG 4.27Å; S43-R45 PolarHBondContact O-N 3.07Å | ||
| 46 | S | 73.3 | Confident | 73.4 | Confident | 39 Ų | 39 | 66 Ų | 66 | 27% | 0.273 | 36% | 0.356 | S | S | . | . | trans | -128.1 | 144.8 | 173.4 | 68.7 | 0 | 0 | 0 | 0 | 111.4 | S44 D48 Q49 | S44-S46 PolarHBondContact O-N 2.91Å; S46-D48 PolarHBondContact O-N 3.11Å; S46-Q49 VanDerWaalsContact N-OE1 3.15Å; S46-Q49 PolarHBondContact O-N 3.39Å; S46-Q49 VanDerWaalsContact O-N 3.16Å; S46-Q49 PolarHBondContact O-OE1 2.71Å | ||
| 47 | L | 68.7 | Low | 72.6 | Confident | 112 Ų | 112 | 65.2 Ų | 65.2 | 59% | 0.586 | 35% | 0.349 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.9 | -19.3 | 173.3 | -68.1 | 173.6 | 0 | 0 | 0 | 111.8 | Q49 I50 F51 | L47-Q49 PolarHBondContact O-N 2.88Å; L47-I50 HydrophobicContact CD2-CD1 4.42Å; L47-I50 PolarHBondContact O-N 3.48Å; L47-F51 PolarHBondContact O-N 2.95Å; L47-F51 VanDerWaalsContact O-N 3.15Å |
| 48 | D | 73.9 | Confident | 72 | Confident | 64 Ų | 64 | 69.6 Ų | 69.6 | 34% | 0.342 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.1 | -28.9 | 174.6 | -55.1 | -43.1 | 0 | 0 | 0 | 112 | S46 I50 S52 V55 Y109 | S46-D48 PolarHBondContact O-N 3.11Å; D48-I50 PolarHBondContact O-N 3.23Å; D48-S52 WeakPolarHBondContact O-CA 3.38Å; D48-S52 WeakPolarHBondContact O-CB 3.32Å; D48-S52 PolarHBondContact O-N 3.33Å; D48-V55 HydrophobicContact CB-CG2 4.42Å; D48-Y109 WeakPolarHBondContact OD1-CE1 3.32Å; D48-Y109 PolarHBondContact OD1-OH 3.23Å |
| 49 | Q | 71.5 | Confident | 71.5 | Confident | 3 Ų | 3 | 73.5 Ų | 73.5 | 1% | 0.014 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -66.4 | -22 | 176.3 | -66.4 | 172 | -77.8 | 0 | 0 | 113.1 | D38 S46 L47 Q62 | D38-Q49 PolarHBondContact OD1-NE2 3.16Å; D38-Q49 PolarHBondContact OD2-OE1 3.48Å; S46-Q49 VanDerWaalsContact N-OE1 3.15Å; S46-Q49 PolarHBondContact O-N 3.39Å; S46-Q49 VanDerWaalsContact O-N 3.16Å; S46-Q49 PolarHBondContact O-OE1 2.71Å; L47-Q49 PolarHBondContact O-N 2.88Å; Q49-Q62 VanDerWaalsContact NE2-NE2 3.1Å |
| 50 | I | 76.4 | Confident | 71.4 | Confident | 30 Ų | 30 | 73.3 Ų | 73.3 | 15% | 0.154 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -92.1 | -45.7 | 179.1 | -61.7 | 169.1 | 0 | 0 | 0 | 110.4 | L30 L34 L47 D48 H102 | L30-I50 HydrophobicContact CD2-CG2 4.06Å; L34-I50 HydrophobicContact CD1-CB 4.45Å; L34-I50 HydrophobicContact CD1-CD1 4.24Å; L34-I50 HydrophobicContact CD1-CG1 3.35Å; L47-I50 HydrophobicContact CD2-CD1 4.42Å; L47-I50 PolarHBondContact O-N 3.48Å; D48-I50 PolarHBondContact O-N 3.23Å; I50-H102 PolarHBondContact O-CE1 2.87Å |
| 51 | F | 73.9 | Confident | 71.4 | Confident | 45 Ų | 45 | 72.7 Ų | 72.7 | 20% | 0.197 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -110.4 | -21 | -167.8 | -65.4 | -74.1 | 0 | 0 | 0 | 114.9 | Y27 L47 Y109 N110 | Y27-F51 HydrophobicContact CE1-CE1 4.14Å; Y27-F51 HydrophobicContact CE1-CZ 4.08Å; L47-F51 PolarHBondContact O-N 2.95Å; L47-F51 VanDerWaalsContact O-N 3.15Å; F51-Y109 HydrophobicContact CB-CD1 3.57Å; F51-Y109 HydrophobicContact CB-CD2 4.17Å; F51-Y109 HydrophobicContact CB-CE1 4.1Å; F51-Y109 HydrophobicContact CB-CG 3.59Å; F51-Y109 HydrophobicContact CG-CD2 4.47Å; F51-Y109 HydrophobicContact CG-CG 4.26Å; F51-N110 PolarHBondContact O-ND2 3.41Å |
| 52 | S | 71 | Confident | 71.5 | Confident | 14 Ų | 14 | 72 Ų | 72 | 10% | 0.098 | 38% | 0.382 | C | S | . | . | trans | -82.3 | 121.7 | 179.9 | -175.1 | 0 | 0 | 0 | 0 | 111.2 | D48 E54 | D48-S52 WeakPolarHBondContact O-CA 3.38Å; D48-S52 WeakPolarHBondContact O-CB 3.32Å; D48-S52 PolarHBondContact O-N 3.33Å; S52-E54 VanDerWaalsContact C-N 3.31Å | ||
| 53 | Y | 66.4 | Low | 71.8 | Confident | 25 Ų | 25 | 63 Ų | 63 | 10% | 0.098 | 34% | 0.34 | C | S | . | . | S | Bend | trans | -75.4 | -19.5 | 178.3 | 56.2 | -102.3 | 0 | 0 | 0 | 113 | V55 N110 P114 A116 | Y53-V55 VanDerWaalsContact C-N 3.32Å; Y53-N110 HydrophobicContact CD1-CB 4.09Å; Y53-N110 HydrophobicContact CE1-CB 3.44Å; Y53-N110 VanDerWaalsContact CE1-CB 3.44Å; Y53-N110 VanDerWaalsContact CE1-CG 3.48Å; Y53-P114 HydrophobicContact CD1-CB 4.3Å; Y53-P114 HydrophobicContact CG-CB 4.39Å; Y53-A116 HydrophobicContact CD2-CB 4Å |
| 54 | E | 62.4 | Low | 72.7 | Confident | 153 Ų | 153 | 65.8 Ų | 65.8 | 72% | 0.715 | 35% | 0.345 | S | S | * | . | S | Bend | trans | -72.8 | -27.4 | 179.6 | -65.9 | -170.1 | 163 | 0 | 0 | 112.3 | S52 L56 | S52-E54 VanDerWaalsContact C-N 3.31Å; E54-L56 VanDerWaalsContact C-N 3.33Å |
| 55 | V | 65.4 | Low | 73.5 | Confident | 33 Ų | 33 | 63.9 Ų | 63.9 | 20% | 0.2 | 33% | 0.327 | C | S | . | . | S | Bend | trans | -76 | -23.7 | -178.9 | -176 | 0 | 0 | 0 | 0 | 111.7 | D48 Y53 G57 G63 | D48-V55 HydrophobicContact CB-CG2 4.42Å; Y53-V55 VanDerWaalsContact C-N 3.32Å; V55-G57 PolarHBondContact O-N 3.01Å; V55-G63 WeakPolarHBondContact O-CA 3.44Å |
| 56 | L | 67.8 | Low | 74.6 | Confident | 2 Ų | 2 | 55.7 Ų | 55.7 | 1% | 0.01 | 30% | 0.297 | C | S | . | . | trans | -78.1 | 53.4 | 175.4 | -97.6 | 86.8 | 0 | 0 | 0 | 112.5 | E54 M67 F70 S118 V122 | E54-L56 VanDerWaalsContact C-N 3.33Å; L56-M67 HydrophobicContact CD2-CG 4.34Å; L56-M67 HydrophobicContact CG-CG 4.47Å; L56-F70 HydrophobicContact CD1-CE2 3.99Å; L56-F70 HydrophobicContact CD2-CD2 4.38Å; L56-F70 HydrophobicContact CD2-CE2 4.41Å; L56-S118 WeakPolarHBondContact O-CB 3.4Å; L56-S118 PolarHBondContact O-OG 3.36Å; L56-V122 HydrophobicContact CD2-CB 4.03Å; L56-V122 HydrophobicContact CD2-CG1 3.82Å; L56-V122 HydrophobicContact CD2-CG2 4.18Å | ||
| 57 | G | 69.4 | Low | 75.3 | Confident | 19 Ų | 19 | 54.7 Ų | 54.7 | 20% | 0.196 | 29% | 0.288 | C | S | . | . | trans | -94.1 | 141 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V55 A59 | V55-G57 PolarHBondContact O-N 3.01Å; G57-A59 PolarHBondContact O-N 3.28Å | ||
| 58 | F | 72.8 | Confident | 76.3 | Confident | 113 Ų | 113 | 54.8 Ų | 54.8 | 50% | 0.496 | 29% | 0.286 | S | S | . | . | S | Bend | trans | -67.2 | -24.7 | 172.5 | -64.2 | -77.1 | 0 | 0 | 0 | 113.1 | R64 M67 | F58-R64 PolarHBondContact O-NH1 3.5Å; F58-R64 VanDerWaalsContact O-NH1 3.17Å; F58-M67 HydrophobicContact CD1-CE 3.45Å; F58-M67 VanDerWaalsContact CD1-CE 3.45Å; F58-M67 HydrophobicContact CD1-SD 3.76Å; F58-M67 HydrophobicContact CE1-CE 3.75Å; F58-M67 HydrophobicContact CE1-SD 3.4Å; F58-M67 WeakPolarHBondContact CE1-SD 3.39Å; F58-M67 HydrophobicContact CG-CE 4.25Å; F58-M67 HydrophobicContact CZ-SD 4.04Å |
| 59 | A | 74.2 | Confident | 77.1 | Confident | 95 Ų | 95 | 51.7 Ų | 51.7 | 79% | 0.785 | 27% | 0.27 | S | S | * | . | S | Bend | trans | -70.9 | -36.5 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G57 R64 | G57-A59 PolarHBondContact O-N 3.28Å; A59-R64 PolarHBondContact O-NH1 3.41Å |
| 60 | T | 81 | Confident | 78 | Confident | 72 Ų | 72 | 51.7 Ų | 51.7 | 44% | 0.442 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -88.9 | 143.6 | -174.5 | 59.1 | 0 | 0 | 0 | 0 | 111.4 | Q62 G63 R64 | T60-Q62 VanDerWaalsContact C-N 3.28Å; T60-Q62 PolarHBondContact O-N 3.32Å; T60-G63 PolarHBondContact O-N 3.28Å; T60-G63 PolarHBondContact OG1-N 3.02Å; T60-R64 PolarHBondContact O-N 2.91Å |
| 61 | M | 79.9 | Confident | 78.7 | Confident | 137 Ų | 137 | 53.7 Ų | 53.7 | 68% | 0.675 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -58.8 | -43.5 | 174.4 | -67.1 | -80.6 | 159.5 | 0 | 0 | 110.6 | R64 L65 | M61-R64 PolarHBondContact O-N 3.46Å; M61-R64 PolarHBondContact SD-NH2 2.8Å; M61-L65 WeakPolarHBondContact O-CG 3.07Å; M61-L65 PolarHBondContact O-N 3.3Å; M61-L65 VanDerWaalsContact O-N 3.12Å |
| 62 | Q | 80.6 | Confident | 79.6 | Confident | 66 Ų | 66 | 54.5 Ų | 54.5 | 31% | 0.308 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 178 | -170.5 | 175.3 | 11.5 | 0 | 0 | 112.1 | Q49 T60 R64 L65 S66 | Q49-Q62 VanDerWaalsContact NE2-NE2 3.1Å; T60-Q62 VanDerWaalsContact C-N 3.28Å; T60-Q62 PolarHBondContact O-N 3.32Å; Q62-R64 VanDerWaalsContact C-N 3.34Å; Q62-R64 PolarHBondContact O-N 3.07Å; Q62-L65 PolarHBondContact O-N 3.4Å; Q62-S66 PolarHBondContact O-N 3Å; Q62-S66 PolarHBondContact O-OG 3.35Å |
| 63 | G | 82.3 | Confident | 80.7 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.3 | -39.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V55 T60 S66 M67 | V55-G63 WeakPolarHBondContact O-CA 3.44Å; T60-G63 PolarHBondContact O-N 3.28Å; T60-G63 PolarHBondContact OG1-N 3.02Å; G63-S66 PolarHBondContact O-N 3.36Å; G63-M67 WeakPolarHBondContact O-CG 3.46Å; G63-M67 PolarHBondContact O-N 3.44Å |
| 64 | R | 84.2 | Confident | 82 | Confident | 95 Ų | 95 | 52.7 Ų | 52.7 | 36% | 0.358 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -65.1 | -41.2 | 175.2 | -66.4 | -162.9 | -58.1 | -86.1 | 4.4 | 113.5 | F58 A59 T60 M61 Q62 M67 M68 | F58-R64 PolarHBondContact O-NH1 3.5Å; F58-R64 VanDerWaalsContact O-NH1 3.17Å; A59-R64 PolarHBondContact O-NH1 3.41Å; T60-R64 PolarHBondContact O-N 2.91Å; M61-R64 PolarHBondContact O-N 3.46Å; M61-R64 PolarHBondContact SD-NH2 2.8Å; Q62-R64 VanDerWaalsContact C-N 3.34Å; Q62-R64 PolarHBondContact O-N 3.07Å; R64-M67 HydrophobicContact CB-CE 4.17Å; R64-M67 HydrophobicContact CG-CE 3.79Å; R64-M67 PolarHBondContact O-N 3.42Å; R64-M68 WeakPolarHBondContact O-CG 3.33Å; R64-M68 PolarHBondContact O-N 3.23Å |
| 65 | L | 86.1 | Confident | 83.5 | Confident | 51 Ų | 51 | 48.6 Ų | 48.6 | 27% | 0.267 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -65.2 | -43.2 | 176.5 | -75.9 | 177.4 | 0 | 0 | 0 | 111.9 | V37 V41 M61 Q62 M68 A69 | V37-L65 HydrophobicContact CG1-CB 3.58Å; V37-L65 HydrophobicContact CG1-CD1 4.18Å; V37-L65 HydrophobicContact CG1-CD2 3.96Å; V37-L65 HydrophobicContact CG1-CG 4.11Å; V41-L65 HydrophobicContact CB-CD1 4.38Å; V41-L65 HydrophobicContact CG1-CD1 4.28Å; V41-L65 HydrophobicContact CG2-CD1 3.66Å; M61-L65 WeakPolarHBondContact O-CG 3.07Å; M61-L65 PolarHBondContact O-N 3.3Å; M61-L65 VanDerWaalsContact O-N 3.12Å; Q62-L65 PolarHBondContact O-N 3.4Å; L65-M68 PolarHBondContact O-N 2.83Å; L65-A69 PolarHBondContact O-N 3.46Å |
| 66 | S | 86.1 | Confident | 84.9 | Confident | 2 Ų | 2 | 48.1 Ų | 48.1 | 1% | 0.014 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.5 | -44.4 | 171.4 | -66.1 | 0 | 0 | 0 | 0 | 111.5 | Q62 G63 M68 A69 F70 | Q62-S66 PolarHBondContact O-N 3Å; Q62-S66 PolarHBondContact O-OG 3.35Å; G63-S66 PolarHBondContact O-N 3.36Å; S66-M68 VanDerWaalsContact C-N 3.33Å; S66-M68 PolarHBondContact O-N 2.98Å; S66-A69 WeakPolarHBondContact O-CA 3.42Å; S66-A69 WeakPolarHBondContact O-CB 3.49Å; S66-A69 PolarHBondContact O-N 2.97Å; S66-F70 VanDerWaalsContact O-CD2 3.29Å; S66-F70 WeakPolarHBondContact O-CD2 3.49Å; S66-F70 PolarHBondContact O-N 3.06Å |
| 67 | M | 87.7 | Confident | 86.1 | Confident | 17 Ų | 17 | 48 Ų | 48 | 8% | 0.084 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.7 | -41.8 | 175.2 | -74.4 | -174.7 | -67.2 | 0 | 0 | 112.7 | L56 F58 G63 R64 A69 F70 I71 V122 | L56-M67 HydrophobicContact CD2-CG 4.34Å; L56-M67 HydrophobicContact CG-CG 4.47Å; F58-M67 HydrophobicContact CD1-CE 3.45Å; F58-M67 VanDerWaalsContact CD1-CE 3.45Å; F58-M67 HydrophobicContact CD1-SD 3.76Å; F58-M67 HydrophobicContact CE1-CE 3.75Å; F58-M67 HydrophobicContact CE1-SD 3.4Å; F58-M67 WeakPolarHBondContact CE1-SD 3.39Å; F58-M67 HydrophobicContact CG-CE 4.25Å; F58-M67 HydrophobicContact CZ-SD 4.04Å; G63-M67 WeakPolarHBondContact O-CG 3.46Å; G63-M67 PolarHBondContact O-N 3.44Å; R64-M67 HydrophobicContact CB-CE 4.17Å; R64-M67 HydrophobicContact CG-CE 3.79Å; R64-M67 PolarHBondContact O-N 3.42Å; M67-A69 VanDerWaalsContact C-N 3.31Å; M67-A69 PolarHBondContact O-N 2.96Å; M67-F70 PolarHBondContact O-N 3.24Å; M67-I71 WeakPolarHBondContact O-CG1 3.32Å; M67-I71 PolarHBondContact O-N 3.42Å; M67-V122 HydrophobicContact CG-CG1 4.38Å; M67-V122 HydrophobicContact CG-CG2 3.64Å; M67-V122 HydrophobicContact SD-CG2 3.5Å; M67-V122 WeakPolarHBondContact SD-CG2 3.48Å |
| 68 | M | 88.5 | Confident | 87.2 | Confident | 114 Ų | 114 | 47.1 Ų | 47.1 | 56% | 0.562 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -61.2 | -41 | 174.2 | -69.8 | 179.3 | 75.8 | 0 | 0 | 111.6 | R64 L65 S66 I71 L72 | R64-M68 WeakPolarHBondContact O-CG 3.33Å; R64-M68 PolarHBondContact O-N 3.23Å; L65-M68 PolarHBondContact O-N 2.83Å; S66-M68 VanDerWaalsContact C-N 3.33Å; S66-M68 PolarHBondContact O-N 2.98Å; M68-I71 PolarHBondContact O-N 2.88Å; M68-L72 WeakPolarHBondContact O-CG 3.44Å; M68-L72 PolarHBondContact O-N 3.09Å |
| 69 | A | 90.8 | Very high | 88.2 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62.4 | -41.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | W33 L34 V37 L65 S66 M67 L72 N73 | W33-A69 HydrophobicContact CB-CB 3.96Å; L34-A69 HydrophobicContact CD2-CB 3.71Å; L34-A69 HydrophobicContact CG-CB 4.1Å; V37-A69 HydrophobicContact CG2-CB 4.46Å; L65-A69 PolarHBondContact O-N 3.46Å; S66-A69 WeakPolarHBondContact O-CA 3.42Å; S66-A69 WeakPolarHBondContact O-CB 3.49Å; S66-A69 PolarHBondContact O-N 2.97Å; M67-A69 VanDerWaalsContact C-N 3.31Å; M67-A69 PolarHBondContact O-N 2.96Å; A69-L72 PolarHBondContact O-N 3.48Å; A69-N73 VanDerWaalsContact O-CB 3.26Å; A69-N73 WeakPolarHBondContact O-CB 3.28Å; A69-N73 PolarHBondContact O-N 3.34Å |
| 70 | F | 90.9 | Very high | 89 | Confident | 2 Ų | 2 | 41.9 Ų | 41.9 | 1% | 0.009 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.2 | -42.4 | 174.5 | -87.8 | -85 | 0 | 0 | 0 | 112.2 | L30 L56 S66 M67 N73 S74 H102 V122 | L30-F70 HydrophobicContact CD1-CD1 4.01Å; L30-F70 HydrophobicContact CD1-CD2 4.27Å; L30-F70 HydrophobicContact CD1-CE1 4.01Å; L30-F70 HydrophobicContact CD1-CE2 4.25Å; L30-F70 HydrophobicContact CD1-CG 4.14Å; L30-F70 HydrophobicContact CD1-CZ 4.13Å; L30-F70 HydrophobicContact CD2-CE1 3.88Å; L30-F70 HydrophobicContact CD2-CZ 4Å; L56-F70 HydrophobicContact CD1-CE2 3.99Å; L56-F70 HydrophobicContact CD2-CD2 4.38Å; L56-F70 HydrophobicContact CD2-CE2 4.41Å; S66-F70 VanDerWaalsContact O-CD2 3.29Å; S66-F70 WeakPolarHBondContact O-CD2 3.49Å; S66-F70 PolarHBondContact O-N 3.06Å; M67-F70 PolarHBondContact O-N 3.24Å; F70-N73 PolarHBondContact O-N 3.43Å; F70-S74 PolarHBondContact O-N 3.49Å; F70-H102 AromaticContact CE1-NE2 3.73Å; F70-V122 HydrophobicContact CB-CG1 4.19Å |
| 71 | I | 92.4 | Very high | 89.5 | Confident | 73 Ų | 73 | 38.5 Ų | 38.5 | 37% | 0.374 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -63.6 | -48.4 | 176.3 | -67.8 | 167 | 0 | 0 | 0 | 110.5 | M67 M68 N73 S74 L75 L129 | M67-I71 WeakPolarHBondContact O-CG1 3.32Å; M67-I71 PolarHBondContact O-N 3.42Å; M68-I71 PolarHBondContact O-N 2.88Å; I71-N73 VanDerWaalsContact C-N 3.28Å; I71-N73 PolarHBondContact O-N 3.16Å; I71-S74 WeakPolarHBondContact O-CB 3.47Å; I71-S74 PolarHBondContact O-N 2.98Å; I71-S74 VanDerWaalsContact O-N 3.12Å; I71-S74 PolarHBondContact O-OG 3.13Å; I71-L75 PolarHBondContact O-N 3.35Å; I71-L129 HydrophobicContact CG2-CD1 4.12Å |
| 72 | L | 92.9 | Very high | 90 | Very high | 61 Ų | 61 | 36.5 Ų | 36.5 | 32% | 0.319 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -60.1 | -40.5 | 176.4 | -70.1 | 171.9 | 0 | 0 | 0 | 111.6 | W33 M68 A69 S74 L75 T76 | W33-L72 HydrophobicContact CD2-CB 3.87Å; W33-L72 HydrophobicContact CD2-CD1 4.21Å; W33-L72 HydrophobicContact CE3-CB 4.26Å; W33-L72 HydrophobicContact CE3-CD1 3.74Å; W33-L72 HydrophobicContact CG-CB 4.24Å; W33-L72 HydrophobicContact CH2-CD1 4.29Å; W33-L72 HydrophobicContact CZ2-CB 4.13Å; W33-L72 HydrophobicContact CZ3-CD1 3.79Å; M68-L72 WeakPolarHBondContact O-CG 3.44Å; M68-L72 PolarHBondContact O-N 3.09Å; A69-L72 PolarHBondContact O-N 3.48Å; L72-S74 VanDerWaalsContact C-N 3.32Å; L72-S74 PolarHBondContact O-N 3.15Å; L72-L75 WeakPolarHBondContact O-CB 3.42Å; L72-L75 PolarHBondContact O-N 3.5Å; L72-T76 PolarHBondContact O-N 2.96Å; L72-T76 PolarHBondContact O-OG1 3.49Å; L72-T76 VanDerWaalsContact O-OG1 3.12Å |
| 73 | N | 94 | Very high | 90.4 | Very high | 0 Ų | 0 | 39.1 Ų | 39.1 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -62.2 | -39.4 | 175.2 | -170.4 | 57.4 | 0 | 0 | 0 | 112 | Y26 F29 L30 A69 F70 I71 L75 T76 C77 | Y26-N73 VanDerWaalsContact CD2-ND2 3.26Å; Y26-N73 WeakPolarHBondContact CD2-ND2 3.2Å; Y26-N73 VanDerWaalsContact CE2-ND2 3.28Å; Y26-N73 WeakPolarHBondContact CE2-ND2 3.25Å; Y26-N73 PolarHBondContact O-ND2 2.95Å; Y26-N73 PolarHBondContact O-OD1 2.93Å; F29-N73 WeakPolarHBondContact CB-OD1 3.46Å; L30-N73 HydrophobicContact CD1-CB 4.13Å; L30-N73 PolarHBondContact N-OD1 3.17Å; A69-N73 VanDerWaalsContact O-CB 3.26Å; A69-N73 WeakPolarHBondContact O-CB 3.28Å; A69-N73 PolarHBondContact O-N 3.34Å; F70-N73 PolarHBondContact O-N 3.43Å; I71-N73 VanDerWaalsContact C-N 3.28Å; I71-N73 PolarHBondContact O-N 3.16Å; N73-L75 VanDerWaalsContact C-N 3.27Å; N73-L75 PolarHBondContact O-N 3.39Å; N73-T76 PolarHBondContact O-N 3.04Å; N73-C77 WeakPolarHBondContact O-CB 3.39Å; N73-C77 PolarHBondContact O-N 3.38Å; N73-C77 PolarHBondContact O-SG 3.45Å |
| 74 | S | 93.4 | Very high | 90.6 | Very high | 1 Ų | 1 | 42.9 Ų | 42.9 | 1% | 0.007 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -60.5 | -37.4 | 175.5 | 80.1 | 0 | 0 | 0 | 0 | 112.1 | F70 I71 L72 C77 A78 | F70-S74 PolarHBondContact O-N 3.49Å; I71-S74 WeakPolarHBondContact O-CB 3.47Å; I71-S74 PolarHBondContact O-N 2.98Å; I71-S74 VanDerWaalsContact O-N 3.12Å; I71-S74 PolarHBondContact O-OG 3.13Å; L72-S74 VanDerWaalsContact C-N 3.32Å; L72-S74 PolarHBondContact O-N 3.15Å; S74-C77 PolarHBondContact O-N 2.9Å; S74-A78 WeakPolarHBondContact O-CB 3.46Å; S74-A78 PolarHBondContact O-N 3.2Å |
| 75 | L | 94.2 | Very high | 90.5 | Very high | 67 Ų | 67 | 38.9 Ų | 38.9 | 35% | 0.351 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -69 | -43.9 | 175.1 | -60 | 177.5 | 0 | 0 | 0 | 111.6 | I71 L72 N73 C77 A78 L79 I133 | I71-L75 PolarHBondContact O-N 3.35Å; L72-L75 WeakPolarHBondContact O-CB 3.42Å; L72-L75 PolarHBondContact O-N 3.5Å; N73-L75 VanDerWaalsContact C-N 3.27Å; N73-L75 PolarHBondContact O-N 3.39Å; L75-C77 VanDerWaalsContact C-N 3.31Å; L75-C77 PolarHBondContact O-N 2.92Å; L75-A78 WeakPolarHBondContact O-CB 3.49Å; L75-A78 PolarHBondContact O-N 2.89Å; L75-L79 PolarHBondContact O-N 3.33Å; L75-L79 VanDerWaalsContact O-N 3.16Å; L75-I133 HydrophobicContact CD2-CD1 3.3Å |
| 76 | T | 93.8 | Very high | 90 | Very high | 24 Ų | 24 | 44.4 Ų | 44.4 | 15% | 0.147 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.8 | -41.1 | 175.4 | -49.4 | 0 | 0 | 0 | 0 | 111.4 | F29 W33 L72 N73 L79 G80 | F29-T76 HydrophobicContact CB-CG2 4.13Å; F29-T76 HydrophobicContact CD1-CG2 3.57Å; F29-T76 HydrophobicContact CD2-CG2 3.88Å; F29-T76 HydrophobicContact CE1-CG2 3.83Å; F29-T76 HydrophobicContact CE2-CG2 4.13Å; F29-T76 HydrophobicContact CG-CG2 3.58Å; F29-T76 HydrophobicContact CZ-CG2 4.11Å; W33-T76 PolarHBondContact NE1-OG1 2.98Å; W33-T76 VanDerWaalsContact NE1-OG1 3.11Å; L72-T76 PolarHBondContact O-N 2.96Å; L72-T76 PolarHBondContact O-OG1 3.49Å; L72-T76 VanDerWaalsContact O-OG1 3.12Å; N73-T76 PolarHBondContact O-N 3.04Å; T76-L79 WeakPolarHBondContact O-CB 3.33Å; T76-L79 PolarHBondContact O-N 3.44Å; T76-G80 PolarHBondContact O-N 2.96Å |
| 77 | C | 92.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -68.1 | -34 | 176.5 | -67.8 | 0 | 0 | 0 | 0 | 112.3 | M22 N73 S74 L75 L79 G80 L81 M130 | M22-C77 HydrophobicContact CE-CB 4.45Å; N73-C77 WeakPolarHBondContact O-CB 3.39Å; N73-C77 PolarHBondContact O-N 3.38Å; N73-C77 PolarHBondContact O-SG 3.45Å; S74-C77 PolarHBondContact O-N 2.9Å; L75-C77 VanDerWaalsContact C-N 3.31Å; L75-C77 PolarHBondContact O-N 2.92Å; C77-L79 VanDerWaalsContact C-N 3.3Å; C77-L79 PolarHBondContact O-N 2.88Å; C77-G80 CarbonylContact O-C 3.6Å; C77-G80 WeakPolarHBondContact O-CA 3.46Å; C77-G80 PolarHBondContact O-N 3.11Å; C77-G80 VanDerWaalsContact O-N 3.09Å; C77-L81 WeakPolarHBondContact O-CG 3.23Å; C77-L81 PolarHBondContact O-N 3.31Å; C77-M130 HydrophobicContact CB-CE 3.64Å; C77-M130 HydrophobicContact CB-CG 4.2Å; C77-M130 HydrophobicContact CB-SD 3.45Å; C77-M130 WeakPolarHBondContact CB-SD 3.47Å |
| 78 | A | 93.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -61 | -38.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | S74 L75 G80 L81 W82 I133 | S74-A78 WeakPolarHBondContact O-CB 3.46Å; S74-A78 PolarHBondContact O-N 3.2Å; L75-A78 WeakPolarHBondContact O-CB 3.49Å; L75-A78 PolarHBondContact O-N 2.89Å; A78-G80 VanDerWaalsContact C-N 3.34Å; A78-L81 PolarHBondContact O-N 2.87Å; A78-W82 WeakPolarHBondContact O-CB 3.43Å; A78-W82 PolarHBondContact O-N 3.47Å; A78-I133 HydrophobicContact CB-CB 3.96Å; A78-I133 HydrophobicContact CB-CG2 3.78Å |
| 79 | L | 93.2 | Very high | 89.1 | Confident | 91 Ų | 91 | 52.4 Ų | 52.4 | 48% | 0.476 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -66.5 | -36.8 | 172.1 | -62.4 | 175.5 | 0 | 0 | 0 | 111.9 | L75 T76 C77 W82 F83 L137 | L75-L79 PolarHBondContact O-N 3.33Å; L75-L79 VanDerWaalsContact O-N 3.16Å; T76-L79 WeakPolarHBondContact O-CB 3.33Å; T76-L79 PolarHBondContact O-N 3.44Å; C77-L79 VanDerWaalsContact C-N 3.3Å; C77-L79 PolarHBondContact O-N 2.88Å; L79-W82 HydrophobicContact CD2-CE3 4.29Å; L79-W82 WeakPolarHBondContact O-CB 3.43Å; L79-W82 PolarHBondContact O-N 3.5Å; L79-F83 PolarHBondContact O-N 3.5Å; L79-L137 HydrophobicContact CD2-CD1 3.92Å |
| 80 | G | 90.8 | Very high | 88.8 | Confident | 7 Ų | 7 | 54.5 Ų | 54.5 | 7% | 0.072 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.3 | -49 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T76 C77 A78 W82 F83 F84 | T76-G80 PolarHBondContact O-N 2.96Å; C77-G80 CarbonylContact O-C 3.6Å; C77-G80 WeakPolarHBondContact O-CA 3.46Å; C77-G80 PolarHBondContact O-N 3.11Å; C77-G80 VanDerWaalsContact O-N 3.09Å; A78-G80 VanDerWaalsContact C-N 3.34Å; G80-W82 VanDerWaalsContact C-N 3.28Å; G80-W82 PolarHBondContact O-N 3.41Å; G80-F83 PolarHBondContact O-N 2.98Å; G80-F84 VanDerWaalsContact O-CD2 3.25Å; G80-F84 WeakPolarHBondContact O-CD2 3.37Å; G80-F84 PolarHBondContact O-N 3.3Å |
| 81 | L | 90.7 | Very high | 88.7 | Confident | 0 Ų | 0 | 54.4 Ų | 54.4 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -55.7 | -46.3 | 175 | -66.4 | 174.6 | 0 | 0 | 0 | 111 | M22 C77 A78 F83 I85 R86 C91 F94 T95 M130 | M22-L81 HydrophobicContact CE-CD2 3.55Å; M22-L81 HydrophobicContact CE-CG 3.79Å; M22-L81 HydrophobicContact SD-CD2 4.07Å; C77-L81 WeakPolarHBondContact O-CG 3.23Å; C77-L81 PolarHBondContact O-N 3.31Å; A78-L81 PolarHBondContact O-N 2.87Å; L81-F83 PolarHBondContact O-N 2.82Å; L81-I85 HydrophobicContact CB-CD1 4.44Å; L81-I85 HydrophobicContact CD2-CD1 3.31Å; L81-I85 HydrophobicContact CG-CD1 4.45Å; L81-I85 WeakPolarHBondContact O-CB 3.48Å; L81-I85 PolarHBondContact O-N 3.47Å; L81-R86 PolarHBondContact O-N 3.46Å; L81-C91 HydrophobicContact CD1-CB 4.28Å; L81-F94 HydrophobicContact CD2-CB 3.74Å; L81-T95 WeakPolarHBondContact CD1-OG1 3.5Å; L81-M130 HydrophobicContact CD1-CE 3.63Å; L81-M130 HydrophobicContact CD1-CG 3.74Å; L81-M130 HydrophobicContact CD2-CE 3.85Å; L81-M130 HydrophobicContact CG-CE 3.7Å |
| 82 | W | 91.5 | Very high | 88.6 | Confident | 96 Ų | 96 | 55.3 Ų | 55.3 | 36% | 0.364 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -59.5 | -44.4 | 179 | 173.6 | 52.3 | 0 | 0 | 0 | 113 | A78 L79 G80 R86 L137 T141 | A78-W82 WeakPolarHBondContact O-CB 3.43Å; A78-W82 PolarHBondContact O-N 3.47Å; L79-W82 HydrophobicContact CD2-CE3 4.29Å; L79-W82 WeakPolarHBondContact O-CB 3.43Å; L79-W82 PolarHBondContact O-N 3.5Å; G80-W82 VanDerWaalsContact C-N 3.28Å; G80-W82 PolarHBondContact O-N 3.41Å; W82-R86 WeakPolarHBondContact O-CG 3.28Å; W82-L137 HydrophobicContact CB-CB 3.95Å; W82-L137 HydrophobicContact CB-CD1 4.23Å; W82-L137 HydrophobicContact CD2-CB 4.41Å; W82-L137 HydrophobicContact CG-CB 3.73Å; W82-L137 HydrophobicContact CG-CD1 4.38Å; W82-T141 HydrophobicContact CZ2-CG2 3.93Å; W82-T141 PolarHBondContact NE1-OG1 2.99Å |
| 83 | F | 88.1 | Confident | 88.5 | Confident | 120 Ų | 120 | 57 Ų | 57 | 53% | 0.526 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -73.7 | -42.8 | -176.3 | -170 | -100.8 | 0 | 0 | 0 | 113 | L79 G80 L81 R86 | L79-F83 PolarHBondContact O-N 3.5Å; G80-F83 PolarHBondContact O-N 2.98Å; L81-F83 PolarHBondContact O-N 2.82Å; F83-R86 PolarHBondContact O-NE 2.6Å |
| 84 | F | 86.2 | Confident | 88.4 | Confident | 79 Ų | 79 | 57.6 Ų | 57.6 | 35% | 0.346 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -95.7 | -40.1 | -169.9 | -65.7 | -68.6 | 0 | 0 | 0 | 114.8 | Q18 L21 I25 G80 | Q18-F84 PolarHBondContact NE2-O 3.19Å; L21-F84 HydrophobicContact CD2-CB 4.21Å; L21-F84 HydrophobicContact CD2-CD1 3.35Å; L21-F84 HydrophobicContact CD2-CD2 3.73Å; L21-F84 HydrophobicContact CD2-CE1 3.5Å; L21-F84 VanDerWaalsContact CD2-CE1 3.5Å; L21-F84 HydrophobicContact CD2-CE2 3.88Å; L21-F84 HydrophobicContact CD2-CG 3.47Å; L21-F84 VanDerWaalsContact CD2-CG 3.47Å; L21-F84 HydrophobicContact CD2-CZ 3.76Å; L21-F84 HydrophobicContact CG-CD2 4.48Å; L21-F84 HydrophobicContact CG-CE2 4.43Å; L21-F84 HydrophobicContact CG-CZ 4.49Å; I25-F84 HydrophobicContact CD1-CD2 3.87Å; I25-F84 HydrophobicContact CD1-CE2 3.48Å; I25-F84 VanDerWaalsContact CD1-CE2 3.48Å; I25-F84 HydrophobicContact CD1-CZ 4.44Å; G80-F84 VanDerWaalsContact O-CD2 3.25Å; G80-F84 WeakPolarHBondContact O-CD2 3.37Å; G80-F84 PolarHBondContact O-N 3.3Å |
| 85 | I | 82.4 | Confident | 88.4 | Confident | 12 Ų | 12 | 57.5 Ų | 57.5 | 6% | 0.062 | 26% | 0.262 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | -37.7 | -174.7 | -69.5 | 153.8 | 0 | 0 | 0 | 111.1 | M22 L81 R87 Q90 F94 | M22-I85 HydrophobicContact CG-CD1 4.38Å; L81-I85 HydrophobicContact CB-CD1 4.44Å; L81-I85 HydrophobicContact CD2-CD1 3.31Å; L81-I85 HydrophobicContact CG-CD1 4.45Å; L81-I85 WeakPolarHBondContact O-CB 3.48Å; L81-I85 PolarHBondContact O-N 3.47Å; I85-R87 HydrophobicContact CG2-CB 4.43Å; I85-R87 PolarHBondContact O-N 3.34Å; I85-Q90 HydrophobicContact CG2-CB 4.12Å; I85-F94 HydrophobicContact CD1-CB 3.64Å; I85-F94 HydrophobicContact CD1-CD1 3.85Å; I85-F94 HydrophobicContact CD1-CD2 3.29Å; I85-F94 HydrophobicContact CD1-CE1 4.28Å; I85-F94 HydrophobicContact CD1-CE2 3.81Å; I85-F94 HydrophobicContact CD1-CG 3.32Å; I85-F94 HydrophobicContact CD1-CZ 4.27Å; I85-F94 HydrophobicContact CG1-CD2 3.84Å; I85-F94 HydrophobicContact CG1-CE2 3.83Å; I85-F94 HydrophobicContact CG1-CG 4.24Å; I85-F94 HydrophobicContact CG1-CZ 4.2Å; I85-F94 HydrophobicContact CG2-CD2 4.16Å; I85-F94 HydrophobicContact CG2-CE2 4.14Å |
| 86 | R | 77.3 | Confident | 88.4 | Confident | 167 Ų | 167 | 57.5 Ų | 57.5 | 63% | 0.63 | 27% | 0.265 | S | S | * | . | trans | 54.7 | -8 | 176.7 | -61.6 | -175.5 | 179.2 | -164.3 | -1 | 116.7 | L81 W82 F83 | L81-R86 PolarHBondContact O-N 3.46Å; W82-R86 WeakPolarHBondContact O-CG 3.28Å; F83-R86 PolarHBondContact O-NE 2.6Å | ||
| 87 | R | 80.2 | Confident | 88.4 | Confident | 116 Ų | 116 | 58.7 Ų | 58.7 | 44% | 0.438 | 27% | 0.272 | S | S | . | . | trans | -105.5 | 112.9 | 175.8 | -89.7 | -179.2 | 172.4 | 172.9 | -1.8 | 109.8 | Y8 I85 K89 Q90 C91 | Y8-R87 PolarHBondContact OH-NH1 3.46Å; I85-R87 HydrophobicContact CG2-CB 4.43Å; I85-R87 PolarHBondContact O-N 3.34Å; R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 3.34Å; R87-Q90 PolarHBondContact O-N 3.3Å; R87-C91 PolarHBondContact O-SG 3.46Å; R87-C91 VanDerWaalsContact O-SG 3.4Å | ||
| 88 | G | 79.4 | Confident | 88.4 | Confident | 5 Ų | 5 | 58.7 Ų | 58.7 | 5% | 0.052 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.9 | -42.3 | -178 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q90 C91 | G88-Q90 PolarHBondContact O-N 2.84Å; G88-C91 WeakPolarHBondContact O-CB 3.26Å; G88-C91 PolarHBondContact O-N 3.18Å |
| 89 | K | 81.9 | Confident | 88.4 | Confident | 179 Ų | 179 | 59.1 Ų | 59.1 | 78% | 0.778 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -59.9 | -20.6 | -176.8 | -61.4 | -166.8 | 176.5 | 98.7 | 0 | 115.1 | R87 | R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 3.34Å |
| 90 | Q | 85.1 | Confident | 88.4 | Confident | 44 Ų | 44 | 60 Ų | 60 | 21% | 0.206 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -100.4 | -9.3 | -179 | -62.2 | 179.3 | -77.8 | 0 | 0 | 112.4 | Y8 I85 R87 G88 L92 D93 F94 | Y8-Q90 PolarHBondContact OH-NE2 3.29Å; I85-Q90 HydrophobicContact CG2-CB 4.12Å; R87-Q90 PolarHBondContact O-N 3.3Å; G88-Q90 PolarHBondContact O-N 2.84Å; Q90-L92 VanDerWaalsContact C-N 3.31Å; Q90-L92 PolarHBondContact O-N 3.04Å; Q90-D93 PolarHBondContact O-N 3.28Å; Q90-F94 HydrophobicContact CB-CD2 4.17Å; Q90-F94 HydrophobicContact CB-CE2 4.17Å; Q90-F94 VanDerWaalsContact O-CD2 3.28Å; Q90-F94 WeakPolarHBondContact O-CD2 3.45Å; Q90-F94 PolarHBondContact O-N 3.49Å; Q90-F94 VanDerWaalsContact O-N 3.16Å |
| 91 | C | 88.3 | Confident | 88.4 | Confident | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.5 | -37 | -173.8 | -72.7 | 0 | 0 | 0 | 0 | 112.6 | L81 R87 G88 T95 E135 C138 | L81-C91 HydrophobicContact CD1-CB 4.28Å; R87-C91 PolarHBondContact O-SG 3.46Å; R87-C91 VanDerWaalsContact O-SG 3.4Å; G88-C91 WeakPolarHBondContact O-CB 3.26Å; G88-C91 PolarHBondContact O-N 3.18Å; C91-T95 WeakPolarHBondContact O-CB 3.45Å; C91-T95 PolarHBondContact O-N 2.83Å; C91-T95 PolarHBondContact O-OG1 2.88Å; C91-E135 HydrophobicContact CB-CB 4.45Å; C91-C138 PolarHBondContact SG-SG 3.15Å |
| 92 | L | 90.9 | Very high | 88.4 | Confident | 92 Ų | 92 | 64.2 Ų | 64.2 | 48% | 0.482 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.4 | -47.7 | 176.6 | -172.5 | 154.2 | 0 | 0 | 0 | 110.9 | Q90 F94 T95 V96 | Q90-L92 VanDerWaalsContact C-N 3.31Å; Q90-L92 PolarHBondContact O-N 3.04Å; L92-F94 VanDerWaalsContact C-N 3.34Å; L92-F94 PolarHBondContact O-N 2.92Å; L92-T95 WeakPolarHBondContact O-CB 3.18Å; L92-T95 PolarHBondContact O-N 2.93Å; L92-T95 VanDerWaalsContact O-N 3.11Å; L92-V96 HydrophobicContact CD2-CG2 3.84Å; L92-V96 HydrophobicContact CG-CG2 4.44Å; L92-V96 WeakPolarHBondContact O-CG2 3.2Å; L92-V96 PolarHBondContact O-N 2.93Å |
| 93 | D | 92.1 | Very high | 88.2 | Confident | 97 Ų | 97 | 62 Ų | 62 | 52% | 0.519 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -58.9 | -45.4 | -179.9 | -59.2 | -27.1 | 0 | 0 | 0 | 111.5 | Q90 V96 T97 | Q90-D93 PolarHBondContact O-N 3.28Å; D93-V96 PolarHBondContact O-N 2.87Å; D93-T97 WeakPolarHBondContact O-CB 3.16Å; D93-T97 VanDerWaalsContact O-CG2 3.28Å; D93-T97 WeakPolarHBondContact O-CG2 3.16Å; D93-T97 PolarHBondContact O-N 2.94Å; D93-T97 PolarHBondContact O-OG1 3.47Å |
| 94 | F | 91.9 | Very high | 88.2 | Confident | 12 Ų | 12 | 58.7 Ų | 58.7 | 5% | 0.053 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -65.8 | -37.8 | 175.9 | -80.4 | -79 | 0 | 0 | 0 | 112.7 | I15 Q18 I19 L81 I85 Q90 L92 T97 V98 | I15-F94 HydrophobicContact CG2-CZ 4.43Å; Q18-F94 HydrophobicContact CB-CE1 3.8Å; Q18-F94 HydrophobicContact CB-CZ 3.96Å; I19-F94 HydrophobicContact CG1-CD1 4.02Å; I19-F94 HydrophobicContact CG1-CE1 3.57Å; L81-F94 HydrophobicContact CD2-CB 3.74Å; I85-F94 HydrophobicContact CD1-CB 3.64Å; I85-F94 HydrophobicContact CD1-CD1 3.85Å; I85-F94 HydrophobicContact CD1-CD2 3.29Å; I85-F94 HydrophobicContact CD1-CE1 4.28Å; I85-F94 HydrophobicContact CD1-CE2 3.81Å; I85-F94 HydrophobicContact CD1-CG 3.32Å; I85-F94 HydrophobicContact CD1-CZ 4.27Å; I85-F94 HydrophobicContact CG1-CD2 3.84Å; I85-F94 HydrophobicContact CG1-CE2 3.83Å; I85-F94 HydrophobicContact CG1-CG 4.24Å; I85-F94 HydrophobicContact CG1-CZ 4.2Å; I85-F94 HydrophobicContact CG2-CD2 4.16Å; I85-F94 HydrophobicContact CG2-CE2 4.14Å; Q90-F94 HydrophobicContact CB-CD2 4.17Å; Q90-F94 HydrophobicContact CB-CE2 4.17Å; Q90-F94 VanDerWaalsContact O-CD2 3.28Å; Q90-F94 WeakPolarHBondContact O-CD2 3.45Å; Q90-F94 PolarHBondContact O-N 3.49Å; Q90-F94 VanDerWaalsContact O-N 3.16Å; L92-F94 VanDerWaalsContact C-N 3.34Å; L92-F94 PolarHBondContact O-N 2.92Å; F94-T97 VanDerWaalsContact CA-OG1 3.27Å; F94-T97 WeakPolarHBondContact CA-OG1 3.36Å; F94-T97 PolarHBondContact O-OG1 3.05Å; F94-V98 WeakPolarHBondContact O-CG2 3.43Å; F94-V98 PolarHBondContact O-N 3.37Å; F94-V98 VanDerWaalsContact O-N 3.07Å |
| 95 | T | 93.4 | Very high | 88.2 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.8 | -46.5 | 177.3 | -58.4 | 0 | 0 | 0 | 0 | 111.4 | L81 C91 L92 V98 H99 I127 M130 A131 | L81-T95 WeakPolarHBondContact CD1-OG1 3.5Å; C91-T95 WeakPolarHBondContact O-CB 3.45Å; C91-T95 PolarHBondContact O-N 2.83Å; C91-T95 PolarHBondContact O-OG1 2.88Å; L92-T95 WeakPolarHBondContact O-CB 3.18Å; L92-T95 PolarHBondContact O-N 2.93Å; L92-T95 VanDerWaalsContact O-N 3.11Å; T95-V98 PolarHBondContact O-N 3.19Å; T95-H99 PolarHBondContact O-N 3.12Å; T95-H99 PolarHBondContact O-ND1 2.89Å; T95-I127 HydrophobicContact CG2-CB 4.32Å; T95-I127 HydrophobicContact CG2-CG1 4.46Å; T95-I127 HydrophobicContact CG2-CG2 4.06Å; T95-M130 HydrophobicContact CG2-CB 3.81Å; T95-M130 HydrophobicContact CG2-CE 4.33Å; T95-M130 HydrophobicContact CG2-CG 3.75Å; T95-M130 HydrophobicContact CG2-SD 3.77Å; T95-A131 HydrophobicContact CG2-CB 4.27Å |
| 96 | V | 93.3 | Very high | 88.3 | Confident | 67 Ų | 67 | 55.2 Ų | 55.2 | 41% | 0.406 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | -179.9 | 172.7 | 0 | 0 | 0 | 0 | 110.4 | L92 D93 V98 H99 F100 I127 | L92-V96 HydrophobicContact CD2-CG2 3.84Å; L92-V96 HydrophobicContact CG-CG2 4.44Å; L92-V96 WeakPolarHBondContact O-CG2 3.2Å; L92-V96 PolarHBondContact O-N 2.93Å; D93-V96 PolarHBondContact O-N 2.87Å; V96-V98 PolarHBondContact O-N 3.46Å; V96-H99 PolarHBondContact O-N 3.47Å; V96-F100 VanDerWaalsContact O-CB 3.23Å; V96-F100 WeakPolarHBondContact O-CB 3.26Å; V96-F100 PolarHBondContact O-N 3.44Å; V96-I127 HydrophobicContact CG2-CG2 4.4Å |
| 97 | T | 94.1 | Very high | 88.7 | Confident | 48 Ų | 48 | 53.4 Ų | 53.4 | 29% | 0.294 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 177.2 | 48.3 | 0 | 0 | 0 | 0 | 112.2 | D93 F94 H99 F100 F101 | D93-T97 WeakPolarHBondContact O-CB 3.16Å; D93-T97 VanDerWaalsContact O-CG2 3.28Å; D93-T97 WeakPolarHBondContact O-CG2 3.16Å; D93-T97 PolarHBondContact O-N 2.94Å; D93-T97 PolarHBondContact O-OG1 3.47Å; F94-T97 VanDerWaalsContact CA-OG1 3.27Å; F94-T97 WeakPolarHBondContact CA-OG1 3.36Å; F94-T97 PolarHBondContact O-OG1 3.05Å; T97-H99 PolarHBondContact O-N 3.36Å; T97-F100 WeakPolarHBondContact O-CB 3.43Å; T97-F100 PolarHBondContact O-N 3.23Å; T97-F101 WeakPolarHBondContact O-CD2 3.48Å; T97-F101 PolarHBondContact O-N 2.84Å |
| 98 | V | 93.6 | Very high | 88.9 | Confident | 1 Ų | 1 | 53.9 Ų | 53.9 | 1% | 0.006 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -57.4 | -50.6 | 175.7 | 167.4 | 0 | 0 | 0 | 0 | 111.5 | M22 Q23 Y26 F94 T95 V96 F100 F101 H102 | M22-V98 HydrophobicContact CB-CG2 3.84Å; Q23-V98 VanDerWaalsContact OE1-CA 3.22Å; Q23-V98 VanDerWaalsContact OE1-CG2 3.25Å; Y26-V98 HydrophobicContact CD1-CG1 4.37Å; Y26-V98 HydrophobicContact CD2-CG1 3.5Å; Y26-V98 VanDerWaalsContact CD2-CG1 3.5Å; Y26-V98 HydrophobicContact CE2-CG1 4.08Å; Y26-V98 HydrophobicContact CG-CG1 3.66Å; F94-V98 WeakPolarHBondContact O-CG2 3.43Å; F94-V98 PolarHBondContact O-N 3.37Å; F94-V98 VanDerWaalsContact O-N 3.07Å; T95-V98 PolarHBondContact O-N 3.19Å; V96-V98 PolarHBondContact O-N 3.46Å; V98-F100 VanDerWaalsContact C-N 3.33Å; V98-F100 PolarHBondContact O-N 3.38Å; V98-F101 PolarHBondContact O-N 3.24Å; V98-H102 PolarHBondContact O-N 3.18Å; V98-H102 VanDerWaalsContact O-N 3.08Å |
| 99 | H | 92.3 | Very high | 89 | Confident | 8 Ų | 8 | 58.5 Ų | 58.5 | 4% | 0.037 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -71.3 | -28.8 | -179.1 | -69.8 | 81.7 | 0 | 0 | 0 | 112.7 | T95 V96 T97 H102 M103 I127 | T95-H99 PolarHBondContact O-N 3.12Å; T95-H99 PolarHBondContact O-ND1 2.89Å; V96-H99 PolarHBondContact O-N 3.47Å; T97-H99 PolarHBondContact O-N 3.36Å; H99-H102 PolarHBondContact O-N 3.4Å; H99-M103 WeakPolarHBondContact O-CB 3.24Å; H99-M103 PolarHBondContact O-N 3.36Å; H99-I127 HydrophobicContact CB-CD1 3.78Å; H99-I127 HydrophobicContact CB-CG1 3.77Å |
| 100 | F | 92.6 | Very high | 88.9 | Confident | 111 Ų | 111 | 51.4 Ų | 51.4 | 49% | 0.487 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64.1 | -44.6 | 173.5 | 179.3 | -103.5 | 0 | 0 | 0 | 111.7 | V96 T97 V98 H102 M103 I104 | V96-F100 VanDerWaalsContact O-CB 3.23Å; V96-F100 WeakPolarHBondContact O-CB 3.26Å; V96-F100 PolarHBondContact O-N 3.44Å; T97-F100 WeakPolarHBondContact O-CB 3.43Å; T97-F100 PolarHBondContact O-N 3.23Å; V98-F100 VanDerWaalsContact C-N 3.33Å; V98-F100 PolarHBondContact O-N 3.38Å; F100-H102 VanDerWaalsContact C-N 3.33Å; F100-H102 PolarHBondContact O-N 3.33Å; F100-M103 HydrophobicContact CD2-CE 3.64Å; F100-M103 HydrophobicContact CE2-CE 3.72Å; F100-M103 WeakPolarHBondContact O-CB 3.25Å; F100-M103 PolarHBondContact O-N 3.32Å; F100-I104 HydrophobicContact CD1-CD1 3.77Å; F100-I104 HydrophobicContact CE1-CD1 3.33Å; F100-I104 HydrophobicContact CE1-CG1 4.34Å; F100-I104 HydrophobicContact CZ-CD1 3.78Å; F100-I104 HydrophobicContact CZ-CG1 4.44Å; F100-I104 WeakPolarHBondContact O-CG1 3.32Å; F100-I104 PolarHBondContact O-N 3.45Å |
| 101 | F | 91.8 | Very high | 88.6 | Confident | 94 Ų | 94 | 53.7 Ų | 53.7 | 41% | 0.412 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65.3 | -36.9 | 173 | -78.9 | -66.7 | 0 | 0 | 0 | 112.5 | I19 T97 V98 M103 I104 G105 | I19-F101 HydrophobicContact CG2-CE2 4.17Å; T97-F101 WeakPolarHBondContact O-CD2 3.48Å; T97-F101 PolarHBondContact O-N 2.84Å; V98-F101 PolarHBondContact O-N 3.24Å; F101-M103 VanDerWaalsContact C-N 3.35Å; F101-I104 PolarHBondContact O-N 2.92Å; F101-G105 PolarHBondContact O-N 2.96Å |
| 102 | H | 89.8 | Confident | 88.1 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.1 | -45.2 | 173.6 | -177.4 | 60.2 | 0 | 0 | 0 | 111.4 | Y26 Y27 I50 F70 V98 H99 F100 I104 G105 C106 | Y26-H102 HydrophobicContact CE1-CB 4.3Å; Y26-H102 AromaticContact CE1-ND1 3.98Å; Y27-H102 WeakPolarHBondContact OH-CA 3.48Å; I50-H102 PolarHBondContact O-CE1 2.87Å; F70-H102 AromaticContact CE1-NE2 3.73Å; V98-H102 PolarHBondContact O-N 3.18Å; V98-H102 VanDerWaalsContact O-N 3.08Å; H99-H102 PolarHBondContact O-N 3.4Å; F100-H102 VanDerWaalsContact C-N 3.33Å; F100-H102 PolarHBondContact O-N 3.33Å; H102-I104 VanDerWaalsContact C-N 3.34Å; H102-I104 PolarHBondContact O-N 2.86Å; H102-G105 WeakPolarHBondContact O-CA 3.17Å; H102-G105 PolarHBondContact O-N 2.81Å; H102-G105 VanDerWaalsContact O-N 3.11Å; H102-C106 PolarHBondContact O-N 3.12Å; H102-C106 PolarHBondContact O-SG 3.01Å; H102-C106 VanDerWaalsContact O-SG 3.34Å |
| 103 | M | 88.3 | Confident | 87.1 | Confident | 49 Ų | 49 | 60.7 Ų | 60.7 | 24% | 0.241 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -57.8 | -44 | 173.8 | -177 | -174.6 | 72.3 | 0 | 0 | 112.1 | H99 F100 F101 G105 C106 W107 W119 W120 | H99-M103 WeakPolarHBondContact O-CB 3.24Å; H99-M103 PolarHBondContact O-N 3.36Å; F100-M103 HydrophobicContact CD2-CE 3.64Å; F100-M103 HydrophobicContact CE2-CE 3.72Å; F100-M103 WeakPolarHBondContact O-CB 3.25Å; F100-M103 PolarHBondContact O-N 3.32Å; F101-M103 VanDerWaalsContact C-N 3.35Å; M103-G105 VanDerWaalsContact C-N 3.34Å; M103-G105 PolarHBondContact O-N 3.21Å; M103-C106 PolarHBondContact O-N 3Å; M103-W107 WeakPolarHBondContact O-CB 3.43Å; M103-W107 PolarHBondContact O-N 3.05Å; M103-W119 HydrophobicContact CB-CH2 3.94Å; M103-W119 HydrophobicContact CG-CH2 3.87Å; M103-W120 HydrophobicContact SD-CH2 3.9Å; M103-W120 HydrophobicContact SD-CZ3 4.38Å |
| 104 | I | 88.5 | Confident | 86.1 | Confident | 51 Ų | 51 | 56.3 Ų | 56.3 | 26% | 0.262 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -60.7 | -44.2 | 174.4 | -69.4 | 167 | 0 | 0 | 0 | 110.8 | F100 F101 H102 C106 W107 I108 | F100-I104 HydrophobicContact CD1-CD1 3.77Å; F100-I104 HydrophobicContact CE1-CD1 3.33Å; F100-I104 HydrophobicContact CE1-CG1 4.34Å; F100-I104 HydrophobicContact CZ-CD1 3.78Å; F100-I104 HydrophobicContact CZ-CG1 4.44Å; F100-I104 WeakPolarHBondContact O-CG1 3.32Å; F100-I104 PolarHBondContact O-N 3.45Å; F101-I104 PolarHBondContact O-N 2.92Å; H102-I104 VanDerWaalsContact C-N 3.34Å; H102-I104 PolarHBondContact O-N 2.86Å; I104-C106 PolarHBondContact O-N 2.96Å; I104-W107 PolarHBondContact O-N 2.81Å; I104-I108 HydrophobicContact CG2-CD1 3.69Å; I104-I108 HydrophobicContact CG2-CG1 4.3Å; I104-I108 WeakPolarHBondContact O-CG1 3.28Å; I104-I108 PolarHBondContact O-N 2.82Å |
| 105 | G | 84.5 | Confident | 85.1 | Confident | 18 Ų | 18 | 60.6 Ų | 60.6 | 19% | 0.186 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -58.2 | -46.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F101 H102 M103 W107 I108 Y109 | F101-G105 PolarHBondContact O-N 2.96Å; H102-G105 WeakPolarHBondContact O-CA 3.17Å; H102-G105 PolarHBondContact O-N 2.81Å; H102-G105 VanDerWaalsContact O-N 3.11Å; M103-G105 VanDerWaalsContact C-N 3.34Å; M103-G105 PolarHBondContact O-N 3.21Å; G105-W107 VanDerWaalsContact C-N 3.33Å; G105-W107 PolarHBondContact O-N 3.11Å; G105-I108 PolarHBondContact O-N 3.38Å; G105-Y109 WeakPolarHBondContact O-CB 3.44Å; G105-Y109 PolarHBondContact O-N 2.84Å |
| 106 | C | 85.3 | Confident | 84.5 | Confident | 0 Ų | 0 | 61.7 Ų | 61.7 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.3 | -38.1 | 175.7 | -64.4 | 0 | 0 | 0 | 0 | 112.3 | H102 M103 I104 Y109 N110 W119 | H102-C106 PolarHBondContact O-N 3.12Å; H102-C106 PolarHBondContact O-SG 3.01Å; H102-C106 VanDerWaalsContact O-SG 3.34Å; M103-C106 PolarHBondContact O-N 3Å; I104-C106 PolarHBondContact O-N 2.96Å; C106-Y109 PolarHBondContact O-N 3.45Å; C106-N110 PolarHBondContact O-N 2.92Å; C106-N110 PolarHBondContact O-ND2 2.81Å; C106-W119 HydrophobicContact CB-CZ2 4.36Å |
| 107 | W | 85 | Confident | 83.9 | Confident | 129 Ų | 129 | 64.8 Ų | 64.8 | 49% | 0.489 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.5 | -46.4 | 176.5 | -178.7 | 18.1 | 0 | 0 | 0 | 111.7 | M103 I104 G105 Y109 S111 L113 | M103-W107 WeakPolarHBondContact O-CB 3.43Å; M103-W107 PolarHBondContact O-N 3.05Å; I104-W107 PolarHBondContact O-N 2.81Å; G105-W107 VanDerWaalsContact C-N 3.33Å; G105-W107 PolarHBondContact O-N 3.11Å; W107-Y109 VanDerWaalsContact C-N 3.32Å; W107-Y109 PolarHBondContact O-N 2.84Å; W107-S111 WeakPolarHBondContact O-CA 3.43Å; W107-S111 PolarHBondContact O-N 2.78Å; W107-L113 HydrophobicContact CD2-CD2 3.85Å; W107-L113 HydrophobicContact CE3-CD2 4.31Å; W107-L113 HydrophobicContact CG-CD2 3.99Å |
| 108 | I | 84.8 | Confident | 83.4 | Confident | 126 Ų | 126 | 63.5 Ų | 63.5 | 65% | 0.646 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.3 | -41.5 | 177.6 | -66.1 | 168.2 | 0 | 0 | 0 | 110.6 | I104 G105 | I104-I108 HydrophobicContact CG2-CD1 3.69Å; I104-I108 HydrophobicContact CG2-CG1 4.3Å; I104-I108 WeakPolarHBondContact O-CG1 3.28Å; I104-I108 PolarHBondContact O-N 2.82Å; G105-I108 PolarHBondContact O-N 3.38Å |
| 109 | Y | 82.5 | Confident | 83 | Confident | 102 Ų | 102 | 63.7 Ų | 63.7 | 40% | 0.4 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -66.6 | -46.5 | -178.2 | -171.5 | -98.7 | 0 | 0 | 0 | 112.8 | D48 F51 G105 C106 W107 | D48-Y109 WeakPolarHBondContact OD1-CE1 3.32Å; D48-Y109 PolarHBondContact OD1-OH 3.23Å; F51-Y109 HydrophobicContact CB-CD1 3.57Å; F51-Y109 HydrophobicContact CB-CD2 4.17Å; F51-Y109 HydrophobicContact CB-CE1 4.1Å; F51-Y109 HydrophobicContact CB-CG 3.59Å; F51-Y109 HydrophobicContact CG-CD2 4.47Å; F51-Y109 HydrophobicContact CG-CG 4.26Å; G105-Y109 WeakPolarHBondContact O-CB 3.44Å; G105-Y109 PolarHBondContact O-N 2.84Å; C106-Y109 PolarHBondContact O-N 3.45Å; W107-Y109 VanDerWaalsContact C-N 3.32Å; W107-Y109 PolarHBondContact O-N 2.84Å |
| 110 | N | 79.3 | Confident | 82.8 | Confident | 31 Ų | 31 | 68.6 Ų | 68.6 | 17% | 0.166 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -91.3 | -5.3 | -175.6 | -60.6 | -85.9 | 0 | 0 | 0 | 113.2 | F51 Y53 C106 H112 | F51-N110 PolarHBondContact O-ND2 3.41Å; Y53-N110 HydrophobicContact CD1-CB 4.09Å; Y53-N110 HydrophobicContact CE1-CB 3.44Å; Y53-N110 VanDerWaalsContact CE1-CB 3.44Å; Y53-N110 VanDerWaalsContact CE1-CG 3.48Å; C106-N110 PolarHBondContact O-N 2.92Å; C106-N110 PolarHBondContact O-ND2 2.81Å; N110-H112 PolarHBondContact O-CD2 3.23Å; N110-H112 PolarHBondContact O-N 3.22Å |
| 111 | S | 79.4 | Confident | 82.7 | Confident | 91 Ų | 91 | 67.8 Ų | 67.8 | 64% | 0.636 | 35% | 0.349 | S | S | * | . | S | Bend | trans | 55.9 | -2.2 | -173.5 | -60.1 | 0 | 0 | 0 | 0 | 115.9 | W107 | W107-S111 WeakPolarHBondContact O-CA 3.43Å; W107-S111 PolarHBondContact O-N 2.78Å |
| 112 | H | 76.1 | Confident | 82.5 | Confident | 128 Ų | 128 | 63.9 Ų | 63.9 | 59% | 0.593 | 33% | 0.332 | S | S | * | . | S | Bend | trans | -123.2 | 150.8 | 178.3 | -69.1 | -78.1 | 0 | 0 | 0 | 109.7 | N110 | N110-H112 PolarHBondContact O-CD2 3.23Å; N110-H112 PolarHBondContact O-N 3.22Å |
| 113 | L | 70.4 | Confident | 82.6 | Confident | 111 Ų | 111 | 64.1 Ų | 64.1 | 58% | 0.581 | 33% | 0.334 | S | S | * | . | trans | -67.6 | 141.7 | 173.2 | -73.7 | 171.4 | 0 | 0 | 0 | 109.8 | W107 S115 | W107-L113 HydrophobicContact CD2-CD2 3.85Å; W107-L113 HydrophobicContact CE3-CD2 4.31Å; W107-L113 HydrophobicContact CG-CD2 3.99Å; L113-S115 PolarHBondContact O-N 3.16Å | ||
| 114 | P | 70.6 | Confident | 82.8 | Confident | 6 Ų | 6 | 66 Ų | 66 | 4% | 0.039 | 35% | 0.348 | C | S | . | . | trans | -58.8 | 106.1 | 177.7 | -19.4 | 30 | 0 | 0 | 0 | 110.1 | Y53 W119 W120 | Y53-P114 HydrophobicContact CD1-CB 4.3Å; Y53-P114 HydrophobicContact CG-CB 4.39Å; P114-W119 HydrophobicContact CB-CD2 3.96Å; P114-W119 HydrophobicContact CB-CE3 3.64Å; P114-W119 HydrophobicContact CB-CZ3 4Å; P114-W119 HydrophobicContact CG-CD2 4.38Å; P114-W119 HydrophobicContact CG-CE3 4.08Å; P114-W119 HydrophobicContact CG-CH2 4.14Å; P114-W119 HydrophobicContact CG-CZ2 4.4Å; P114-W119 HydrophobicContact CG-CZ3 3.96Å; P114-W120 PolarHBondContact O-NE1 3.13Å | ||
| 115 | S | 72.7 | Confident | 83.1 | Confident | 101 Ų | 101 | 65.7 Ų | 65.7 | 71% | 0.706 | 35% | 0.353 | S | S | * | . | trans | -90.5 | -14.4 | 178 | 59.4 | 0 | 0 | 0 | 0 | 112.4 | L113 L117 | L113-S115 PolarHBondContact O-N 3.16Å; S115-L117 PolarHBondContact O-N 2.87Å | ||
| 116 | A | 80.1 | Confident | 83.5 | Confident | 24 Ų | 24 | 64.9 Ų | 64.9 | 20% | 0.198 | 35% | 0.345 | C | S | . | . | trans | -72.5 | 115.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y53 S118 W119 W120 | Y53-A116 HydrophobicContact CD2-CB 4Å; A116-S118 VanDerWaalsContact C-N 3.26Å; A116-S118 PolarHBondContact O-N 3.46Å; A116-W119 HydrophobicContact CB-CB 4.29Å; A116-W119 WeakPolarHBondContact O-CB 3.08Å; A116-W119 PolarHBondContact O-N 2.88Å; A116-W120 VanDerWaalsContact O-CD1 3.28Å; A116-W120 PolarHBondContact O-N 3.49Å | ||
| 117 | L | 81.3 | Confident | 83.9 | Confident | 131 Ų | 131 | 67.1 Ų | 67.1 | 69% | 0.686 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -58.3 | -36.9 | 177.8 | -168.6 | 95.8 | 0 | 0 | 0 | 112.5 | S115 W119 W120 L121 | S115-L117 PolarHBondContact O-N 2.87Å; L117-W119 VanDerWaalsContact C-N 3.29Å; L117-W119 PolarHBondContact O-N 3.27Å; L117-W120 PolarHBondContact O-N 2.93Å; L117-L121 HydrophobicContact CD2-CD1 3.95Å; L117-L121 HydrophobicContact CG-CD1 4.33Å; L117-L121 HydrophobicContact CG-CG 4.43Å; L117-L121 WeakPolarHBondContact O-CG 3.35Å; L117-L121 PolarHBondContact O-N 3.27Å |
| 118 | S | 82.3 | Confident | 84.4 | Confident | 21 Ų | 21 | 63.3 Ų | 63.3 | 15% | 0.147 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -60 | -39.4 | 179.2 | 52.2 | 0 | 0 | 0 | 0 | 112.2 | L56 A116 L121 V122 | L56-S118 WeakPolarHBondContact O-CB 3.4Å; L56-S118 PolarHBondContact O-OG 3.36Å; A116-S118 VanDerWaalsContact C-N 3.26Å; A116-S118 PolarHBondContact O-N 3.46Å; S118-L121 PolarHBondContact O-N 3.49Å; S118-V122 VanDerWaalsContact O-CG2 3.23Å; S118-V122 WeakPolarHBondContact O-CG2 3.48Å; S118-V122 PolarHBondContact O-N 2.9Å |
| 119 | W | 86.1 | Confident | 84.9 | Confident | 6 Ų | 6 | 60.5 Ų | 60.5 | 2% | 0.023 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -62.4 | -44.5 | 176.1 | -176.5 | 90.4 | 0 | 0 | 0 | 111.3 | M103 C106 P114 A116 L117 V122 N123 | M103-W119 HydrophobicContact CB-CH2 3.94Å; M103-W119 HydrophobicContact CG-CH2 3.87Å; C106-W119 HydrophobicContact CB-CZ2 4.36Å; P114-W119 HydrophobicContact CB-CD2 3.96Å; P114-W119 HydrophobicContact CB-CE3 3.64Å; P114-W119 HydrophobicContact CB-CZ3 4Å; P114-W119 HydrophobicContact CG-CD2 4.38Å; P114-W119 HydrophobicContact CG-CE3 4.08Å; P114-W119 HydrophobicContact CG-CH2 4.14Å; P114-W119 HydrophobicContact CG-CZ2 4.4Å; P114-W119 HydrophobicContact CG-CZ3 3.96Å; A116-W119 HydrophobicContact CB-CB 4.29Å; A116-W119 WeakPolarHBondContact O-CB 3.08Å; A116-W119 PolarHBondContact O-N 2.88Å; L117-W119 VanDerWaalsContact C-N 3.29Å; L117-W119 PolarHBondContact O-N 3.27Å; W119-V122 PolarHBondContact O-N 3.44Å; W119-N123 VanDerWaalsContact CD2-ND2 3.3Å; W119-N123 WeakPolarHBondContact CZ2-ND2 3.44Å; W119-N123 PolarHBondContact NE1-ND2 2.83Å; W119-N123 WeakPolarHBondContact O-CB 3.39Å; W119-N123 PolarHBondContact O-N 3.16Å; W119-N123 PolarHBondContact O-ND2 3.32Å |
| 120 | W | 87.5 | Confident | 85.5 | Confident | 110 Ų | 110 | 55.6 Ų | 55.6 | 42% | 0.417 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 176.4 | -72.4 | 100.7 | 0 | 0 | 0 | 112.1 | M103 P114 A116 L117 V122 N123 V124 | M103-W120 HydrophobicContact SD-CH2 3.9Å; M103-W120 HydrophobicContact SD-CZ3 4.38Å; P114-W120 PolarHBondContact O-NE1 3.13Å; A116-W120 VanDerWaalsContact O-CD1 3.28Å; A116-W120 PolarHBondContact O-N 3.49Å; L117-W120 PolarHBondContact O-N 2.93Å; W120-V122 VanDerWaalsContact C-N 3.34Å; W120-V122 PolarHBondContact O-N 3.37Å; W120-N123 PolarHBondContact O-N 3.07Å; W120-V124 WeakPolarHBondContact O-CB 3.28Å; W120-V124 VanDerWaalsContact O-CG2 3.28Å; W120-V124 WeakPolarHBondContact O-CG2 3.2Å; W120-V124 PolarHBondContact O-N 3.32Å |
| 121 | L | 89.5 | Confident | 86.2 | Confident | 94 Ų | 94 | 54.5 Ų | 54.5 | 49% | 0.492 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 178.7 | -69.8 | 175.3 | 0 | 0 | 0 | 111.8 | L117 S118 A125 | L117-L121 HydrophobicContact CD2-CD1 3.95Å; L117-L121 HydrophobicContact CG-CD1 4.33Å; L117-L121 HydrophobicContact CG-CG 4.43Å; L117-L121 WeakPolarHBondContact O-CG 3.35Å; L117-L121 PolarHBondContact O-N 3.27Å; S118-L121 PolarHBondContact O-N 3.49Å; L121-A125 VanDerWaalsContact O-CB 3.27Å; L121-A125 WeakPolarHBondContact O-CB 3.25Å; L121-A125 PolarHBondContact O-N 3.41Å |
| 122 | V | 89.6 | Confident | 86.9 | Confident | 12 Ų | 12 | 54.8 Ų | 54.8 | 7% | 0.073 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -65.3 | -44.8 | 178.9 | 172.7 | 0 | 0 | 0 | 0 | 111 | L56 M67 F70 S118 W119 W120 A125 C126 | L56-V122 HydrophobicContact CD2-CB 4.03Å; L56-V122 HydrophobicContact CD2-CG1 3.82Å; L56-V122 HydrophobicContact CD2-CG2 4.18Å; M67-V122 HydrophobicContact CG-CG1 4.38Å; M67-V122 HydrophobicContact CG-CG2 3.64Å; M67-V122 HydrophobicContact SD-CG2 3.5Å; M67-V122 WeakPolarHBondContact SD-CG2 3.48Å; F70-V122 HydrophobicContact CB-CG1 4.19Å; S118-V122 VanDerWaalsContact O-CG2 3.23Å; S118-V122 WeakPolarHBondContact O-CG2 3.48Å; S118-V122 PolarHBondContact O-N 2.9Å; W119-V122 PolarHBondContact O-N 3.44Å; W120-V122 VanDerWaalsContact C-N 3.34Å; W120-V122 PolarHBondContact O-N 3.37Å; V122-A125 PolarHBondContact O-N 2.94Å; V122-C126 WeakPolarHBondContact O-CB 3.49Å; V122-C126 PolarHBondContact O-N 3.02Å; V122-C126 PolarHBondContact O-SG 3.4Å |
| 123 | N | 91.1 | Very high | 87.8 | Confident | 5 Ų | 5 | 51.1 Ų | 51.1 | 3% | 0.027 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.4 | -43.9 | 178.4 | -82.5 | -86.8 | 0 | 0 | 0 | 112.2 | W119 W120 A125 C126 I127 | W119-N123 VanDerWaalsContact CD2-ND2 3.3Å; W119-N123 WeakPolarHBondContact CZ2-ND2 3.44Å; W119-N123 PolarHBondContact NE1-ND2 2.83Å; W119-N123 WeakPolarHBondContact O-CB 3.39Å; W119-N123 PolarHBondContact O-N 3.16Å; W119-N123 PolarHBondContact O-ND2 3.32Å; W120-N123 PolarHBondContact O-N 3.07Å; N123-A125 VanDerWaalsContact C-N 3.32Å; N123-A125 PolarHBondContact O-N 2.61Å; N123-C126 PolarHBondContact O-N 2.91Å; N123-I127 WeakPolarHBondContact O-CB 3.29Å; N123-I127 VanDerWaalsContact O-CG1 3.25Å; N123-I127 WeakPolarHBondContact O-CG1 3.42Å; N123-I127 PolarHBondContact O-N 2.98Å |
| 124 | V | 92.7 | Very high | 88.9 | Confident | 88 Ų | 88 | 45.9 Ų | 45.9 | 53% | 0.533 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 175.6 | 170.3 | 0 | 0 | 0 | 0 | 110.9 | W120 I127 A128 | W120-V124 WeakPolarHBondContact O-CB 3.28Å; W120-V124 VanDerWaalsContact O-CG2 3.28Å; W120-V124 WeakPolarHBondContact O-CG2 3.2Å; W120-V124 PolarHBondContact O-N 3.32Å; V124-I127 PolarHBondContact O-N 2.8Å; V124-A128 WeakPolarHBondContact O-CB 3.4Å; V124-A128 PolarHBondContact O-N 3.21Å |
| 125 | A | 93.7 | Very high | 90 | Very high | 45 Ų | 45 | 49.6 Ų | 49.6 | 37% | 0.372 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | L121 V122 N123 A128 L129 | L121-A125 VanDerWaalsContact O-CB 3.27Å; L121-A125 WeakPolarHBondContact O-CB 3.25Å; L121-A125 PolarHBondContact O-N 3.41Å; V122-A125 PolarHBondContact O-N 2.94Å; N123-A125 VanDerWaalsContact C-N 3.32Å; N123-A125 PolarHBondContact O-N 2.61Å; A125-A128 PolarHBondContact O-N 3.21Å; A125-L129 WeakPolarHBondContact O-CB 3.28Å; A125-L129 VanDerWaalsContact O-CG 3.28Å; A125-L129 WeakPolarHBondContact O-CG 3.36Å; A125-L129 PolarHBondContact O-N 3.17Å |
| 126 | C | 93.4 | Very high | 90.9 | Very high | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.014 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 177.2 | -68.1 | 0 | 0 | 0 | 0 | 112.2 | V122 N123 L129 M130 | V122-C126 WeakPolarHBondContact O-CB 3.49Å; V122-C126 PolarHBondContact O-N 3.02Å; V122-C126 PolarHBondContact O-SG 3.4Å; N123-C126 PolarHBondContact O-N 2.91Å; C126-L129 PolarHBondContact O-N 3.46Å; C126-M130 WeakPolarHBondContact O-CB 3.38Å; C126-M130 PolarHBondContact O-N 3.22Å |
| 127 | I | 94.5 | Very high | 91.4 | Very high | 46 Ų | 46 | 51.7 Ų | 51.7 | 24% | 0.236 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -59.7 | -50 | 173.8 | -70.8 | 164.3 | 0 | 0 | 0 | 109.9 | T95 V96 H99 N123 V124 L129 M130 A131 | T95-I127 HydrophobicContact CG2-CB 4.32Å; T95-I127 HydrophobicContact CG2-CG1 4.46Å; T95-I127 HydrophobicContact CG2-CG2 4.06Å; V96-I127 HydrophobicContact CG2-CG2 4.4Å; H99-I127 HydrophobicContact CB-CD1 3.78Å; H99-I127 HydrophobicContact CB-CG1 3.77Å; N123-I127 WeakPolarHBondContact O-CB 3.29Å; N123-I127 VanDerWaalsContact O-CG1 3.25Å; N123-I127 WeakPolarHBondContact O-CG1 3.42Å; N123-I127 PolarHBondContact O-N 2.98Å; V124-I127 PolarHBondContact O-N 2.8Å; I127-L129 PolarHBondContact O-N 3.29Å; I127-M130 PolarHBondContact O-N 3.26Å; I127-A131 WeakPolarHBondContact O-CB 3.32Å; I127-A131 PolarHBondContact O-N 3.29Å |
| 128 | A | 95.4 | Very high | 91.7 | Very high | 50 Ų | 50 | 45.5 Ų | 45.5 | 41% | 0.413 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.3 | -47 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | V124 A125 V132 | V124-A128 WeakPolarHBondContact O-CB 3.4Å; V124-A128 PolarHBondContact O-N 3.21Å; A125-A128 PolarHBondContact O-N 3.21Å; A128-V132 VanDerWaalsContact O-CB 3.28Å; A128-V132 WeakPolarHBondContact O-CB 3.23Å; A128-V132 WeakPolarHBondContact O-CG2 3.4Å; A128-V132 PolarHBondContact O-N 2.81Å |
| 129 | L | 95.3 | Very high | 92.1 | Very high | 66 Ų | 66 | 49.2 Ų | 49.2 | 35% | 0.346 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.5 | -50.6 | 177.9 | -73.8 | 173 | 0 | 0 | 0 | 111.7 | I71 A125 C126 I127 A131 I133 | I71-L129 HydrophobicContact CG2-CD1 4.12Å; A125-L129 WeakPolarHBondContact O-CB 3.28Å; A125-L129 VanDerWaalsContact O-CG 3.28Å; A125-L129 WeakPolarHBondContact O-CG 3.36Å; A125-L129 PolarHBondContact O-N 3.17Å; C126-L129 PolarHBondContact O-N 3.46Å; I127-L129 PolarHBondContact O-N 3.29Å; L129-A131 PolarHBondContact O-N 3.34Å; L129-I133 HydrophobicContact CD2-CD1 4.47Å; L129-I133 VanDerWaalsContact O-CB 3.25Å; L129-I133 WeakPolarHBondContact O-CB 3.27Å; L129-I133 VanDerWaalsContact O-CG1 3.23Å; L129-I133 WeakPolarHBondContact O-CG1 3.23Å; L129-I133 PolarHBondContact O-N 2.98Å |
| 130 | M | 94.5 | Very high | 92.1 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -62.5 | -44.5 | -179.2 | 178.3 | 174.5 | 166.4 | 0 | 0 | 111.7 | M22 C77 L81 T95 C126 I127 G134 | M22-M130 HydrophobicContact CE-CE 3.53Å; C77-M130 HydrophobicContact CB-CE 3.64Å; C77-M130 HydrophobicContact CB-CG 4.2Å; C77-M130 HydrophobicContact CB-SD 3.45Å; C77-M130 WeakPolarHBondContact CB-SD 3.47Å; L81-M130 HydrophobicContact CD1-CE 3.63Å; L81-M130 HydrophobicContact CD1-CG 3.74Å; L81-M130 HydrophobicContact CD2-CE 3.85Å; L81-M130 HydrophobicContact CG-CE 3.7Å; T95-M130 HydrophobicContact CG2-CB 3.81Å; T95-M130 HydrophobicContact CG2-CE 4.33Å; T95-M130 HydrophobicContact CG2-CG 3.75Å; T95-M130 HydrophobicContact CG2-SD 3.77Å; C126-M130 WeakPolarHBondContact O-CB 3.38Å; C126-M130 PolarHBondContact O-N 3.22Å; I127-M130 PolarHBondContact O-N 3.26Å; M130-G134 WeakPolarHBondContact O-CA 3.27Å; M130-G134 PolarHBondContact O-N 2.91Å |
| 131 | A | 94.1 | Very high | 92 | Very high | 8 Ų | 8 | 51.7 Ų | 51.7 | 7% | 0.066 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -67.3 | -50.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | T95 I127 L129 G134 E135 | T95-A131 HydrophobicContact CG2-CB 4.27Å; I127-A131 WeakPolarHBondContact O-CB 3.32Å; I127-A131 PolarHBondContact O-N 3.29Å; L129-A131 PolarHBondContact O-N 3.34Å; A131-G134 PolarHBondContact O-N 2.91Å; A131-E135 WeakPolarHBondContact O-CB 3.38Å; A131-E135 PolarHBondContact O-N 2.88Å |
| 132 | V | 94.9 | Very high | 91.7 | Very high | 96 Ų | 96 | 51.9 Ų | 51.9 | 58% | 0.582 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -64.7 | -45.8 | -177.2 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | A128 Y136 | A128-V132 VanDerWaalsContact O-CB 3.28Å; A128-V132 WeakPolarHBondContact O-CB 3.23Å; A128-V132 WeakPolarHBondContact O-CG2 3.4Å; A128-V132 PolarHBondContact O-N 2.81Å; V132-Y136 WeakPolarHBondContact O-CB 3.28Å; V132-Y136 PolarHBondContact O-N 3.18Å |
| 133 | I | 94.5 | Very high | 91.3 | Very high | 52 Ų | 52 | 56.4 Ų | 56.4 | 27% | 0.267 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -69.4 | -44 | -179.7 | -63.8 | 170.4 | 0 | 0 | 0 | 110.2 | L75 A78 L129 Y136 L137 | L75-I133 HydrophobicContact CD2-CD1 3.3Å; A78-I133 HydrophobicContact CB-CB 3.96Å; A78-I133 HydrophobicContact CB-CG2 3.78Å; L129-I133 HydrophobicContact CD2-CD1 4.47Å; L129-I133 VanDerWaalsContact O-CB 3.25Å; L129-I133 WeakPolarHBondContact O-CB 3.27Å; L129-I133 VanDerWaalsContact O-CG1 3.23Å; L129-I133 WeakPolarHBondContact O-CG1 3.23Å; L129-I133 PolarHBondContact O-N 2.98Å; I133-Y136 PolarHBondContact O-N 3.42Å; I133-L137 HydrophobicContact CG2-CD1 3.85Å; I133-L137 HydrophobicContact CG2-CG 4.3Å; I133-L137 WeakPolarHBondContact O-CB 3.35Å; I133-L137 VanDerWaalsContact O-CG 3.24Å; I133-L137 WeakPolarHBondContact O-CG 3.21Å; I133-L137 PolarHBondContact O-N 3.37Å |
| 134 | G | 92.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.6 | -46.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | M130 A131 L137 C138 | M130-G134 WeakPolarHBondContact O-CA 3.27Å; M130-G134 PolarHBondContact O-N 2.91Å; A131-G134 PolarHBondContact O-N 2.91Å; G134-L137 PolarHBondContact O-N 3Å; G134-C138 WeakPolarHBondContact O-CB 3.43Å; G134-C138 PolarHBondContact O-N 3.38Å; G134-C138 PolarHBondContact O-SG 2.89Å |
| 135 | E | 93.4 | Very high | 89 | Confident | 85 Ų | 85 | 64.1 Ų | 64.1 | 40% | 0.397 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.2 | -47.4 | 176.7 | -175.4 | 177.3 | -178.7 | 0 | 0 | 111.4 | C91 A131 L137 C138 M139 | C91-E135 HydrophobicContact CB-CB 4.45Å; A131-E135 WeakPolarHBondContact O-CB 3.38Å; A131-E135 PolarHBondContact O-N 2.88Å; E135-L137 PolarHBondContact O-N 3.34Å; E135-C138 PolarHBondContact O-N 3.44Å; E135-M139 VanDerWaalsContact O-CB 3.32Å; E135-M139 WeakPolarHBondContact O-CB 3.5Å; E135-M139 PolarHBondContact O-N 2.93Å |
| 136 | Y | 91.6 | Very high | 87.5 | Confident | 129 Ų | 129 | 67.4 Ų | 67.4 | 51% | 0.506 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -57.8 | -46.5 | 178.4 | 175.4 | -99.9 | 0 | 0 | 0 | 112.1 | V132 I133 M139 R140 | V132-Y136 WeakPolarHBondContact O-CB 3.28Å; V132-Y136 PolarHBondContact O-N 3.18Å; I133-Y136 PolarHBondContact O-N 3.42Å; Y136-M139 PolarHBondContact O-N 3.36Å; Y136-R140 VanDerWaalsContact O-CB 3.32Å; Y136-R140 WeakPolarHBondContact O-CB 3.33Å; Y136-R140 PolarHBondContact O-N 3.25Å |
| 137 | L | 90.6 | Very high | 85.8 | Confident | 40 Ų | 40 | 72.7 Ų | 72.7 | 21% | 0.209 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -66.2 | -42.6 | 179.1 | -69.6 | 174.4 | 0 | 0 | 0 | 112 | L79 W82 I133 G134 E135 T141 | L79-L137 HydrophobicContact CD2-CD1 3.92Å; W82-L137 HydrophobicContact CB-CB 3.95Å; W82-L137 HydrophobicContact CB-CD1 4.23Å; W82-L137 HydrophobicContact CD2-CB 4.41Å; W82-L137 HydrophobicContact CG-CB 3.73Å; W82-L137 HydrophobicContact CG-CD1 4.38Å; I133-L137 HydrophobicContact CG2-CD1 3.85Å; I133-L137 HydrophobicContact CG2-CG 4.3Å; I133-L137 WeakPolarHBondContact O-CB 3.35Å; I133-L137 VanDerWaalsContact O-CG 3.24Å; I133-L137 WeakPolarHBondContact O-CG 3.21Å; I133-L137 PolarHBondContact O-N 3.37Å; G134-L137 PolarHBondContact O-N 3Å; E135-L137 PolarHBondContact O-N 3.34Å; L137-T141 PolarHBondContact O-N 3.44Å; L137-T141 VanDerWaalsContact O-N 3.13Å; L137-T141 PolarHBondContact O-OG1 3.26Å |
| 138 | C | 89.3 | Confident | 84.3 | Confident | 0 Ų | 0 | 76.4 Ų | 76.4 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62.8 | -48.3 | 175.1 | -70.4 | 0 | 0 | 0 | 0 | 111.6 | C91 G134 E135 R140 T141 E142 | C91-C138 PolarHBondContact SG-SG 3.15Å; G134-C138 WeakPolarHBondContact O-CB 3.43Å; G134-C138 PolarHBondContact O-N 3.38Å; G134-C138 PolarHBondContact O-SG 2.89Å; E135-C138 PolarHBondContact O-N 3.44Å; C138-R140 VanDerWaalsContact C-N 3.33Å; C138-R140 PolarHBondContact O-N 2.97Å; C138-T141 PolarHBondContact O-N 2.91Å; C138-T141 VanDerWaalsContact O-N 3.15Å; C138-T141 PolarHBondContact O-OG1 3.46Å; C138-E142 WeakPolarHBondContact O-CB 3.35Å; C138-E142 PolarHBondContact O-N 3.32Å |
| 139 | M | 88.9 | Confident | 82.5 | Confident | 99 Ų | 99 | 81 Ų | 81 | 49% | 0.488 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 180 | -169.3 | 179.9 | 98.6 | 0 | 0 | 111.3 | E135 Y136 T141 E142 L143 | E135-M139 VanDerWaalsContact O-CB 3.32Å; E135-M139 WeakPolarHBondContact O-CB 3.5Å; E135-M139 PolarHBondContact O-N 2.93Å; Y136-M139 PolarHBondContact O-N 3.36Å; M139-T141 VanDerWaalsContact C-N 3.27Å; M139-T141 PolarHBondContact O-N 2.91Å; M139-E142 PolarHBondContact O-N 3.12Å; M139-L143 HydrophobicContact CE-CD1 4.06Å; M139-L143 HydrophobicContact CG-CD1 4.09Å; M139-L143 HydrophobicContact CG-CG 4.48Å; M139-L143 WeakPolarHBondContact O-CB 3.44Å; M139-L143 VanDerWaalsContact O-CG 3.28Å; M139-L143 WeakPolarHBondContact O-CG 3.18Å; M139-L143 PolarHBondContact O-N 3.29Å |
| 140 | R | 87.4 | Confident | 81 | Confident | 121 Ų | 121 | 83.5 Ų | 83.5 | 46% | 0.457 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.7 | -34.6 | 177.6 | -169.4 | 175.8 | -172.1 | -169.6 | 2.8 | 112.5 | Y136 C138 R144 | Y136-R140 VanDerWaalsContact O-CB 3.32Å; Y136-R140 WeakPolarHBondContact O-CB 3.33Å; Y136-R140 PolarHBondContact O-N 3.25Å; C138-R140 VanDerWaalsContact C-N 3.33Å; C138-R140 PolarHBondContact O-N 2.97Å; R140-R144 WeakPolarHBondContact O-CG 3.4Å; R140-R144 PolarHBondContact O-N 3.19Å |
| 141 | T | 84.8 | Confident | 79.5 | Confident | 48 Ų | 48 | 85.6 Ų | 85.6 | 29% | 0.294 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -79 | -36.3 | 177.5 | 43.5 | 0 | 0 | 0 | 0 | 112.9 | W82 L137 C138 M139 R144 A145 | W82-T141 HydrophobicContact CZ2-CG2 3.93Å; W82-T141 PolarHBondContact NE1-OG1 2.99Å; L137-T141 PolarHBondContact O-N 3.44Å; L137-T141 VanDerWaalsContact O-N 3.13Å; L137-T141 PolarHBondContact O-OG1 3.26Å; C138-T141 PolarHBondContact O-N 2.91Å; C138-T141 VanDerWaalsContact O-N 3.15Å; C138-T141 PolarHBondContact O-OG1 3.46Å; M139-T141 VanDerWaalsContact C-N 3.27Å; M139-T141 PolarHBondContact O-N 2.91Å; T141-R144 PolarHBondContact O-N 3.41Å; T141-A145 PolarHBondContact O-N 3.27Å |
| 142 | E | 84.4 | Confident | 77.8 | Confident | 98 Ų | 98 | 91.3 Ų | 91.3 | 46% | 0.458 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.8 | -44.6 | 172.7 | -170.2 | 175.6 | 170.9 | 0 | 0 | 111.4 | C138 M139 R144 A145 | C138-E142 WeakPolarHBondContact O-CB 3.35Å; C138-E142 PolarHBondContact O-N 3.32Å; M139-E142 PolarHBondContact O-N 3.12Å; E142-R144 VanDerWaalsContact C-N 3.34Å; E142-R144 PolarHBondContact O-N 3.18Å; E142-A145 PolarHBondContact O-N 3.34Å |
| 143 | L | 79.7 | Confident | 76 | Confident | 106 Ų | 106 | 95.5 Ų | 95.5 | 56% | 0.555 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.5 | -31.3 | 178.7 | -70.2 | 171.2 | 0 | 0 | 0 | 113.6 | M139 A145 | M139-L143 HydrophobicContact CE-CD1 4.06Å; M139-L143 HydrophobicContact CG-CD1 4.09Å; M139-L143 HydrophobicContact CG-CG 4.48Å; M139-L143 WeakPolarHBondContact O-CB 3.44Å; M139-L143 VanDerWaalsContact O-CG 3.28Å; M139-L143 WeakPolarHBondContact O-CG 3.18Å; M139-L143 PolarHBondContact O-N 3.29Å; L143-A145 VanDerWaalsContact C-N 3.3Å; L143-A145 PolarHBondContact O-N 3.48Å |
| 144 | R | 73.5 | Confident | 74.4 | Confident | 178 Ų | 178 | 98 Ų | 98 | 67% | 0.672 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -71.9 | -22 | 178 | -79.5 | 177.4 | 175.7 | -169.2 | -1.6 | 113.6 | R140 T141 E142 I146 | R140-R144 WeakPolarHBondContact O-CG 3.4Å; R140-R144 PolarHBondContact O-N 3.19Å; T141-R144 PolarHBondContact O-N 3.41Å; E142-R144 VanDerWaalsContact C-N 3.34Å; E142-R144 PolarHBondContact O-N 3.18Å; R144-I146 PolarHBondContact O-N 2.7Å |
| 145 | A | 62.3 | Low | 72.7 | Confident | 78 Ų | 78 | 105.3 Ų | 105.3 | 65% | 0.645 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -6.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T141 E142 L143 P147 | T141-A145 PolarHBondContact O-N 3.27Å; E142-A145 PolarHBondContact O-N 3.34Å; L143-A145 VanDerWaalsContact C-N 3.3Å; L143-A145 PolarHBondContact O-N 3.48Å; A145-P147 WeakPolarHBondContact O-CD 3.4Å |
| 146 | I | 62.6 | Low | 71 | Confident | 114 Ų | 114 | 112.5 Ų | 112.5 | 59% | 0.585 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -94.5 | 100.7 | 176.1 | -53.4 | 171.8 | 0 | 0 | 0 | 108.2 | R144 V148 | R144-I146 PolarHBondContact O-N 2.7Å; I146-V148 PolarHBondContact O-N 3.37Å; I146-V148 VanDerWaalsContact O-N 3.1Å |
| 147 | P | 58.2 | Low | 70 | Confident | 113 Ų | 113 | 111.7 Ų | 111.7 | 73% | 0.734 | 61% | 0.612 | S | S | * | * | trans | -65.1 | 114.8 | 166.9 | 26.7 | -31.3 | 0 | 0 | 0 | 107.7 | A145 N149 | A145-P147 WeakPolarHBondContact O-CD 3.4Å; P147-N149 PolarHBondContact O-N 3.44Å | ||
| 148 | V | 61.9 | Low | 68.9 | Low | 124 Ų | 124 | 115.5 Ų | 115.5 | 75% | 0.752 | 63% | 0.633 | S | S | * | * | trans | -69.2 | 84.3 | 164 | -173.5 | 0 | 0 | 0 | 0 | 105.6 | I146 T150 | I146-V148 PolarHBondContact O-N 3.37Å; I146-V148 VanDerWaalsContact O-N 3.1Å; V148-T150 HydrophobicContact CG1-CG2 4.18Å; V148-T150 PolarHBondContact O-N 3.17Å | ||
| 149 | N | 59.1 | Low | 67.8 | Low | 145 Ų | 145 | 121.9 Ų | 121.9 | 78% | 0.775 | 67% | 0.668 | S | S | * | * | trans | -65.5 | 91.9 | 168.3 | -169.2 | 25.9 | 0 | 0 | 0 | 106.1 | P147 G151 | P147-N149 PolarHBondContact O-N 3.44Å; N149-G151 PolarHBondContact O-N 3.21Å | ||
| 150 | T | 62.4 | Low | 66.6 | Low | 119 Ų | 119 | 123.2 Ų | 123.2 | 73% | 0.73 | 68% | 0.679 | S | S | * | * | trans | -64.2 | 85.8 | 166.3 | 48.5 | 0 | 0 | 0 | 0 | 106.3 | V148 | V148-T150 HydrophobicContact CG1-CG2 4.18Å; V148-T150 PolarHBondContact O-N 3.17Å | ||
| 151 | G | 63.3 | Low | 65.3 | Low | 44 Ų | 44 | 123.4 Ų | 123.4 | 45% | 0.454 | 69% | 0.692 | S | S | . | * | trans | -52.3 | 144.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.2 | N149 K153 | N149-G151 PolarHBondContact O-N 3.21Å; G151-K153 PolarHBondContact O-N 3.32Å; G151-K153 VanDerWaalsContact O-N 3.13Å | ||
| 152 | P | 58.9 | Low | 64 | Low | 129 Ų | 129 | 128.4 Ų | 128.4 | 84% | 0.838 | 72% | 0.719 | S | S | * | * | trans | -53.8 | 124.7 | -174.5 | 20.6 | -31.5 | 0 | 0 | 0 | 109.5 | S154 | P152-S154 PolarHBondContact O-N 3.17Š| ||
| 153 | K | 56.8 | Low | 62.5 | Low | 184 Ų | 184 | 130.6 Ų | 130.6 | 80% | 0.8 | 74% | 0.738 | S | S | * | * | trans | -57.3 | 110.6 | 171.8 | -67.7 | -173.5 | -179.6 | 178.5 | 0 | 106.9 | G151 N155 | G151-K153 PolarHBondContact O-N 3.32Å; G151-K153 VanDerWaalsContact O-N 3.13Å; K153-N155 VanDerWaalsContact C-N 3.32Å; K153-N155 PolarHBondContact O-N 3.34Å; K153-N155 PolarHBondContact O-ND2 3.46Å | ||
| 154 | S | 59.9 | Low | 61.2 | Low | 105 Ų | 105 | 132.5 Ų | 132.5 | 73% | 0.734 | 75% | 0.752 | S | S | * | * | trans | -65.3 | 98.7 | 167.5 | 53.8 | 0 | 0 | 0 | 0 | 106.9 | P152 L156 | P152-S154 PolarHBondContact O-N 3.17Å; S154-L156 PolarHBondContact O-N 2.88Å | ||
| 155 | N | 58.4 | Low | 60.1 | Low | 152 Ų | 152 | 128.7 Ų | 128.7 | 81% | 0.813 | 76% | 0.758 | S | S | * | * | trans | -68.8 | 111.2 | 166.5 | -62.7 | -70 | 0 | 0 | 0 | 106.4 | K153 | K153-N155 VanDerWaalsContact C-N 3.32Å; K153-N155 PolarHBondContact O-N 3.34Å; K153-N155 PolarHBondContact O-ND2 3.46Å | ||
| 156 | L | 57.8 | Low | 59.9 | Low | 237 Ų | 237 | 133.3 Ų | 133.3 | 100% | 1.241 | 77% | 0.769 | S | S | * | * | trans | -91.5 | 0 | 161.5 | -93.9 | 133.9 | 0 | 0 | 0 | 108.1 | S154 | S154-L156 PolarHBondContact O-N 2.88Š|
Retrieved 156 of 156 residues in 256.5 ms
(Link to these results)