| 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 | 41.3 | Very low | 37.4 | Very low | 245 Ų | 245 | 142 Ų | 142 | 100% | 1.207 | 82% | 0.819 | S | S | * | * | 0 | 109 | 0 | -74.4 | -179.1 | 170 | 0 | 0 | 108.9 | |||||
| 2 | P | 35.2 | Very low | 38.2 | Very low | 127 Ų | 127 | 137.3 Ų | 137.3 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -112 | 134.1 | 158.2 | 23.9 | -6.9 | 0 | 0 | 0 | 110.3 | ||||
| 3 | G | 33.8 | Very low | 39.2 | Very low | 77 Ų | 77 | 135.4 Ų | 135.4 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | trans | -69.4 | 133.6 | -176 | 0 | 0 | 0 | 0 | 0 | 113.3 | N5 | G3-N5 PolarHBondContact O-N 3.45Å; G3-N5 VanDerWaalsContact O-N 3.14Å | ||
| 4 | H | 36.3 | Very low | 40.3 | Very low | 188 Ų | 188 | 133.8 Ų | 133.8 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | trans | -70.8 | 96.3 | 165.2 | -94.7 | -82.3 | 0 | 0 | 0 | 109.8 | A6 | H4-A6 VanDerWaalsContact C-N 3.28Å; H4-A6 PolarHBondContact O-N 3.22Å; H4-A6 VanDerWaalsContact O-N 3.11Å | ||
| 5 | N | 37.6 | Very low | 41.5 | Very low | 160 Ų | 160 | 133.1 Ų | 133.1 | 86% | 0.856 | 77% | 0.772 | S | S | * | * | trans | -78.3 | 83.5 | 158.7 | -88.2 | -10 | 0 | 0 | 0 | 108.7 | G3 S7 | G3-N5 PolarHBondContact O-N 3.45Å; G3-N5 VanDerWaalsContact O-N 3.14Å; N5-S7 VanDerWaalsContact C-N 3.3Å; N5-S7 PolarHBondContact O-N 2.67Å; N5-S7 VanDerWaalsContact O-N 3.14Å | ||
| 6 | A | 36.2 | Very low | 43 | Very low | 75 Ų | 75 | 126.9 Ų | 126.9 | 62% | 0.62 | 74% | 0.736 | S | S | * | * | trans | -79.9 | 83.1 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | H4 R8 | H4-A6 VanDerWaalsContact C-N 3.28Å; H4-A6 PolarHBondContact O-N 3.22Å; H4-A6 VanDerWaalsContact O-N 3.11Å; A6-R8 PolarHBondContact O-N 3.07Å | ||
| 7 | S | 37.7 | Very low | 45 | Very low | 105 Ų | 105 | 121 Ų | 121 | 73% | 0.734 | 70% | 0.702 | S | S | * | * | trans | -64.9 | 80.4 | 158.3 | 52.5 | 0 | 0 | 0 | 0 | 108.5 | N5 N9 | N5-S7 VanDerWaalsContact C-N 3.3Å; N5-S7 PolarHBondContact O-N 2.67Å; N5-S7 VanDerWaalsContact O-N 3.14Å; S7-N9 PolarHBondContact O-N 3.49Å | ||
| 8 | R | 35.4 | Very low | 47.1 | Very low | 232 Ų | 232 | 118.3 Ų | 118.3 | 88% | 0.875 | 69% | 0.691 | S | S | * | * | trans | -70.3 | 86.4 | 165.9 | -87.9 | -176 | -178.4 | 163 | 2.8 | 107.8 | A6 S10 | A6-R8 PolarHBondContact O-N 3.07Å; R8-S10 PolarHBondContact O-N 3.26Å | ||
| 9 | N | 35.4 | Very low | 49.2 | Very low | 143 Ų | 143 | 118.4 Ų | 118.4 | 77% | 0.765 | 68% | 0.684 | S | S | * | * | trans | -55 | 109.6 | 156.9 | -85.4 | -8.2 | 0 | 0 | 0 | 107.2 | S7 S11 | S7-N9 PolarHBondContact O-N 3.49Å; N9-S11 PolarHBondContact O-N 3.01Å | ||
| 10 | S | 44.2 | Very low | 51.2 | Low | 111 Ų | 111 | 113.2 Ų | 113.2 | 78% | 0.776 | 65% | 0.654 | S | S | * | * | trans | -74.4 | 62 | 174 | 56.9 | 0 | 0 | 0 | 0 | 109.9 | R8 C12 | R8-S10 PolarHBondContact O-N 3.26Å; S10-C12 PolarHBondContact O-N 3.09Å | ||
| 11 | S | 38.7 | Very low | 53.2 | Low | 99 Ų | 99 | 109.4 Ų | 109.4 | 69% | 0.692 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 118.5 | 162 | -62 | 0 | 0 | 0 | 0 | 106.6 | N9 D13 | N9-S11 PolarHBondContact O-N 3.01Å; S11-D13 PolarHBondContact O-N 3.34Å |
| 12 | C | 46.9 | Very low | 55.6 | Low | 85 Ų | 85 | 100.8 Ų | 100.8 | 57% | 0.574 | 60% | 0.595 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 133.7 | 168.3 | -69.8 | 0 | 0 | 0 | 0 | 108.5 | S10 | S10-C12 PolarHBondContact O-N 3.09Š|
| 13 | D | 50.4 | Low | 58.4 | Low | 113 Ų | 113 | 96 Ų | 96 | 60% | 0.604 | 56% | 0.562 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 128.7 | -177.2 | -71.8 | -52.4 | 0 | 0 | 0 | 110.9 | S11 L15 V16 T17 | S11-D13 PolarHBondContact O-N 3.34Å; D13-L15 PolarHBondContact O-N 3.23Å; D13-L15 VanDerWaalsContact O-N 3.14Å; D13-V16 HydrophobicContact CB-CB 4.25Å; D13-V16 HydrophobicContact CB-CG2 3.82Å; D13-V16 WeakPolarHBondContact O-CB 3.18Å; D13-V16 PolarHBondContact O-N 2.88Å; D13-T17 PolarHBondContact O-N 2.97Å |
| 14 | P | 55.9 | Low | 61.4 | Low | 113 Ų | 113 | 92.3 Ų | 92.3 | 73% | 0.734 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.9 | -27.8 | -176.3 | 20.4 | -31.2 | 0 | 0 | 0 | 113.4 | V16 S18 | P14-V16 PolarHBondContact O-N 2.81Å; P14-S18 PolarHBondContact O-N 3.42Å |
| 15 | L | 58.3 | Low | 64.2 | Low | 124 Ų | 124 | 87.8 Ų | 87.8 | 65% | 0.649 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.9 | -33.2 | 174.2 | -168.7 | 79.1 | 0 | 0 | 0 | 112.1 | D13 S18 H19 | D13-L15 PolarHBondContact O-N 3.23Å; D13-L15 VanDerWaalsContact O-N 3.14Å; L15-S18 WeakPolarHBondContact O-CB 3.44Å; L15-H19 PolarHBondContact O-CD2 3.44Å; L15-H19 PolarHBondContact O-N 2.97Å |
| 16 | V | 64.7 | Low | 67 | Low | 34 Ų | 34 | 84.9 Ų | 84.9 | 21% | 0.206 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -88 | -38.1 | -166.2 | 175.1 | 0 | 0 | 0 | 0 | 111.3 | D13 P14 S18 H19 L20 F264 | D13-V16 HydrophobicContact CB-CB 4.25Å; D13-V16 HydrophobicContact CB-CG2 3.82Å; D13-V16 WeakPolarHBondContact O-CB 3.18Å; D13-V16 PolarHBondContact O-N 2.88Å; P14-V16 PolarHBondContact O-N 2.81Å; V16-S18 PolarHBondContact O-N 3.34Å; V16-H19 PolarHBondContact O-N 3.17Å; V16-L20 PolarHBondContact O-N 3.18Å; V16-F264 HydrophobicContact CB-CZ 4.24Å; V16-F264 HydrophobicContact CG1-CD1 4.05Å; V16-F264 HydrophobicContact CG1-CD2 4.09Å; V16-F264 HydrophobicContact CG1-CE1 3.17Å; V16-F264 HydrophobicContact CG1-CE2 3.24Å; V16-F264 HydrophobicContact CG1-CG 4.46Å; V16-F264 HydrophobicContact CG1-CZ 2.76Å |
| 17 | T | 76.8 | Confident | 69.8 | Low | 26 Ų | 26 | 81.3 Ų | 81.3 | 16% | 0.16 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -60.7 | -36.5 | 167.3 | -52.4 | 0 | 0 | 0 | 0 | 110.9 | D13 H19 L20 I21 L76 | D13-T17 PolarHBondContact O-N 2.97Å; T17-H19 PolarHBondContact O-N 3.14Å; T17-L20 PolarHBondContact O-N 2.96Å; T17-I21 HydrophobicContact CG2-CD1 3.91Å; T17-I21 HydrophobicContact CG2-CG1 4.41Å; T17-I21 VanDerWaalsContact O-CG1 3.29Å; T17-I21 WeakPolarHBondContact O-CG1 3.46Å; T17-I21 PolarHBondContact O-N 3.46Å; T17-L76 HydrophobicContact CG2-CD2 4.49Å; T17-L76 WeakPolarHBondContact CG2-O 3.24Å |
| 18 | S | 83.7 | Confident | 72.6 | Confident | 72 Ų | 72 | 77.8 Ų | 77.8 | 50% | 0.503 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -59.8 | -41.4 | 176.2 | -173 | 0 | 0 | 0 | 0 | 113 | P14 L15 V16 L20 I21 S22 | P14-S18 PolarHBondContact O-N 3.42Å; L15-S18 WeakPolarHBondContact O-CB 3.44Å; V16-S18 PolarHBondContact O-N 3.34Å; S18-L20 PolarHBondContact O-N 3.33Å; S18-I21 PolarHBondContact O-N 3.26Å; S18-S22 WeakPolarHBondContact O-CB 3.28Å; S18-S22 PolarHBondContact O-N 2.91Å |
| 19 | H | 86.3 | Confident | 75.6 | Confident | 120 Ų | 120 | 71.8 Ų | 71.8 | 56% | 0.556 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 176.5 | -72.8 | -64.9 | 0 | 0 | 0 | 113 | L15 V16 T17 S22 L23 | L15-H19 PolarHBondContact O-CD2 3.44Å; L15-H19 PolarHBondContact O-N 2.97Å; V16-H19 PolarHBondContact O-N 3.17Å; T17-H19 PolarHBondContact O-N 3.14Å; H19-S22 PolarHBondContact O-N 2.86Å; H19-L23 WeakPolarHBondContact O-CB 3.46Å; H19-L23 PolarHBondContact O-N 2.89Å |
| 20 | L | 89.5 | Confident | 78.4 | Confident | 14 Ų | 14 | 65.5 Ų | 65.5 | 7% | 0.073 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.1 | -43.7 | 176.8 | -74.3 | 170.6 | 0 | 0 | 0 | 111.4 | V16 T17 S18 S22 L23 Y24 L76 F264 I268 S271 | V16-L20 PolarHBondContact O-N 3.18Å; T17-L20 PolarHBondContact O-N 2.96Å; S18-L20 PolarHBondContact O-N 3.33Å; L20-S22 PolarHBondContact O-N 2.89Å; L20-L23 PolarHBondContact O-N 3.49Å; L20-Y24 HydrophobicContact CD2-CE2 4.45Å; L20-Y24 WeakPolarHBondContact O-CD2 3.4Å; L20-Y24 PolarHBondContact O-N 3.32Å; L20-L76 HydrophobicContact CB-CD1 4.15Å; L20-L76 HydrophobicContact CB-CD2 4.36Å; L20-L76 HydrophobicContact CD1-CD2 4.31Å; L20-F264 HydrophobicContact CD1-CE2 3.9Å; L20-F264 HydrophobicContact CD1-CZ 4.44Å; L20-I268 HydrophobicContact CD2-CG1 4.33Å; L20-S271 WeakPolarHBondContact CD2-OG 3.13Å |
| 21 | I | 92.6 | Very high | 80.9 | Confident | 35 Ų | 35 | 60.2 Ų | 60.2 | 18% | 0.179 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -56.9 | -51.5 | 175.9 | -70.9 | 168.8 | 0 | 0 | 0 | 110.1 | T17 S18 L23 Y24 F25 L73 L76 I77 | T17-I21 HydrophobicContact CG2-CD1 3.91Å; T17-I21 HydrophobicContact CG2-CG1 4.41Å; T17-I21 VanDerWaalsContact O-CG1 3.29Å; T17-I21 WeakPolarHBondContact O-CG1 3.46Å; T17-I21 PolarHBondContact O-N 3.46Å; S18-I21 PolarHBondContact O-N 3.26Å; I21-L23 VanDerWaalsContact C-N 3.33Å; I21-L23 PolarHBondContact O-N 3.38Å; I21-Y24 PolarHBondContact O-N 3.22Å; I21-F25 HydrophobicContact CG2-CD2 3.58Å; I21-F25 HydrophobicContact CG2-CE2 3.49Å; I21-F25 VanDerWaalsContact CG2-CE2 3.49Å; I21-F25 VanDerWaalsContact O-CD2 3.26Å; I21-F25 WeakPolarHBondContact O-CD2 3.41Å; I21-F25 PolarHBondContact O-N 2.91Å; I21-L73 HydrophobicContact CG2-CD2 4.29Å; I21-L76 HydrophobicContact CD1-CB 4.28Å; I21-L76 HydrophobicContact CG1-CB 3.71Å; I21-L76 HydrophobicContact CG1-CD1 4.31Å; I21-I77 HydrophobicContact CD1-CG1 4.06Å; I21-I77 HydrophobicContact CG1-CG1 4.49Å |
| 22 | S | 93.1 | Very high | 83.6 | Confident | 63 Ų | 63 | 59.3 Ų | 59.3 | 44% | 0.441 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -56.8 | -46 | 178.3 | -177.6 | 0 | 0 | 0 | 0 | 111.9 | S18 H19 L20 Y24 F25 I26 | S18-S22 WeakPolarHBondContact O-CB 3.28Å; S18-S22 PolarHBondContact O-N 2.91Å; H19-S22 PolarHBondContact O-N 2.86Å; L20-S22 PolarHBondContact O-N 2.89Å; S22-Y24 PolarHBondContact O-N 3.13Å; S22-F25 PolarHBondContact O-N 2.85Å; S22-I26 WeakPolarHBondContact O-CG1 3.44Å; S22-I26 PolarHBondContact O-N 2.96Å |
| 23 | L | 94.1 | Very high | 85.9 | Confident | 26 Ų | 26 | 58.4 Ų | 58.4 | 14% | 0.136 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -59 | -49.9 | 177.4 | -172.5 | 157.8 | 0 | 0 | 0 | 111.6 | H19 L20 I21 F25 I26 V27 S271 V272 I275 | H19-L23 WeakPolarHBondContact O-CB 3.46Å; H19-L23 PolarHBondContact O-N 2.89Å; L20-L23 PolarHBondContact O-N 3.49Å; I21-L23 VanDerWaalsContact C-N 3.33Å; I21-L23 PolarHBondContact O-N 3.38Å; L23-F25 VanDerWaalsContact C-N 3.3Å; L23-F25 PolarHBondContact O-N 2.69Å; L23-I26 WeakPolarHBondContact O-CB 3.18Å; L23-I26 PolarHBondContact O-N 3.44Å; L23-V27 HydrophobicContact CD2-CG2 3.79Å; L23-V27 WeakPolarHBondContact O-CG2 3.35Å; L23-V27 PolarHBondContact O-N 3.01Å; L23-S271 WeakPolarHBondContact CD2-O 3.47Å; L23-V272 HydrophobicContact CD1-CG2 4.13Å; L23-I275 HydrophobicContact CD1-CD1 4.2Å; L23-I275 HydrophobicContact CD2-CG1 4.42Å; L23-I275 HydrophobicContact CG-CD1 4.41Å; L23-I275 HydrophobicContact CG-CG1 4.34Å |
| 24 | Y | 95.1 | Very high | 88 | Confident | 1 Ų | 1 | 53 Ų | 53 | 0% | 0.004 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.7 | -31 | -179 | -80.2 | -67.6 | 0 | 0 | 0 | 112.8 | L20 I21 S22 L28 F65 V69 R72 L76 L95 S271 A274 | L20-Y24 HydrophobicContact CD2-CE2 4.45Å; L20-Y24 WeakPolarHBondContact O-CD2 3.4Å; L20-Y24 PolarHBondContact O-N 3.32Å; I21-Y24 PolarHBondContact O-N 3.22Å; S22-Y24 PolarHBondContact O-N 3.13Å; Y24-L28 VanDerWaalsContact O-CB 3.28Å; Y24-L28 WeakPolarHBondContact O-CB 3.36Å; Y24-L28 PolarHBondContact O-N 2.85Å; Y24-F65 HydrophobicContact CE1-CZ 4.45Å; Y24-V69 HydrophobicContact CD1-CG1 3.93Å; Y24-V69 HydrophobicContact CD1-CG2 4.44Å; Y24-V69 HydrophobicContact CG-CG1 4.43Å; Y24-R72 HydrophobicContact CE2-CG 4.45Å; Y24-R72 PolarHBondContact OH-NE 3.43Å; Y24-R72 VanDerWaalsContact OH-NE 3.15Å; Y24-R72 PolarHBondContact OH-NH1 3.33Å; Y24-R72 PolarHBondContact OH-NH2 3.42Å; Y24-L76 HydrophobicContact CD2-CD1 3.66Å; Y24-L76 HydrophobicContact CE2-CD1 4.13Å; Y24-L95 VanDerWaalsContact OH-CD2 3.32Å; Y24-L95 WeakPolarHBondContact OH-CD2 3.27Å; Y24-S271 WeakPolarHBondContact OH-CB 3.37Å; Y24-S271 PolarHBondContact OH-OG 3.03Å; Y24-A274 HydrophobicContact CE1-CB 4.5Å |
| 25 | F | 95.9 | Very high | 89.8 | Confident | 92 Ų | 92 | 48.1 Ų | 48.1 | 40% | 0.404 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.4 | -45 | 170.1 | -87 | -66.4 | 0 | 0 | 0 | 112.3 | I21 S22 L23 V27 L28 I29 L73 | I21-F25 HydrophobicContact CG2-CD2 3.58Å; I21-F25 HydrophobicContact CG2-CE2 3.49Å; I21-F25 VanDerWaalsContact CG2-CE2 3.49Å; I21-F25 VanDerWaalsContact O-CD2 3.26Å; I21-F25 WeakPolarHBondContact O-CD2 3.41Å; I21-F25 PolarHBondContact O-N 2.91Å; S22-F25 PolarHBondContact O-N 2.85Å; L23-F25 VanDerWaalsContact C-N 3.3Å; L23-F25 PolarHBondContact O-N 2.69Å; F25-V27 VanDerWaalsContact C-N 3.3Å; F25-V27 PolarHBondContact O-N 3.24Å; F25-L28 PolarHBondContact O-N 3.37Å; F25-I29 WeakPolarHBondContact O-CG1 3.41Å; F25-I29 PolarHBondContact O-N 3.09Å; F25-L73 HydrophobicContact CD1-CD1 4.24Å; F25-L73 HydrophobicContact CD2-CD2 3.94Å; F25-L73 HydrophobicContact CE1-CD1 4.19Å; F25-L73 HydrophobicContact CE2-CD2 3.94Å; F25-L73 HydrophobicContact CG-CD1 4.47Å; F25-L73 HydrophobicContact CG-CD2 4.43Å; F25-L73 HydrophobicContact CZ-CD1 4.38Å; F25-L73 HydrophobicContact CZ-CD2 4.41Å |
| 26 | I | 95.4 | Very high | 91.5 | Very high | 100 Ų | 100 | 47.4 Ų | 47.4 | 51% | 0.513 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.2 | -45.3 | 175.4 | -69.1 | 165.8 | 0 | 0 | 0 | 110.3 | S22 L23 G30 | S22-I26 WeakPolarHBondContact O-CG1 3.44Å; S22-I26 PolarHBondContact O-N 2.96Å; L23-I26 WeakPolarHBondContact O-CB 3.18Å; L23-I26 PolarHBondContact O-N 3.44Å; I26-G30 WeakPolarHBondContact O-CA 3.14Å; I26-G30 PolarHBondContact O-N 2.85Å |
| 27 | V | 96.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.3 | -44.2 | 177.7 | 169.3 | 0 | 0 | 0 | 0 | 111.3 | L23 F25 G31 F65 L66 A274 I275 C277 | L23-V27 HydrophobicContact CD2-CG2 3.79Å; L23-V27 WeakPolarHBondContact O-CG2 3.35Å; L23-V27 PolarHBondContact O-N 3.01Å; F25-V27 VanDerWaalsContact C-N 3.3Å; F25-V27 PolarHBondContact O-N 3.24Å; V27-G31 WeakPolarHBondContact O-CA 3.09Å; V27-G31 PolarHBondContact O-N 2.98Å; V27-F65 HydrophobicContact CG1-CE1 3.87Å; V27-L66 HydrophobicContact CG1-CD2 4.18Å; V27-L66 WeakPolarHBondContact O-CD2 3.34Å; V27-A274 HydrophobicContact CG1-CB 4.14Å; V27-A274 HydrophobicContact CG2-CB 3.97Å; V27-I275 HydrophobicContact CG2-CG1 4.27Å; V27-C277 HydrophobicContact CG1-CB 4.15Å |
| 28 | L | 96.9 | Very high | 93.3 | Very high | 31 Ų | 31 | 46.5 Ų | 46.5 | 16% | 0.162 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.2 | -52.9 | 179.7 | -176.8 | 61.9 | 0 | 0 | 0 | 111.1 | Y24 F25 L32 L66 V69 P70 L73 | Y24-L28 VanDerWaalsContact O-CB 3.28Å; Y24-L28 WeakPolarHBondContact O-CB 3.36Å; Y24-L28 PolarHBondContact O-N 2.85Å; F25-L28 PolarHBondContact O-N 3.37Å; L28-L32 HydrophobicContact CD1-CD1 3.82Å; L28-L32 HydrophobicContact CD1-CG 4.32Å; L28-L32 HydrophobicContact CG-CD1 4.06Å; L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.24Å; L28-L32 WeakPolarHBondContact O-CD1 3.42Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.43Å; L28-L66 HydrophobicContact CD1-CD2 4.42Å; L28-V69 HydrophobicContact CB-CG1 4.14Å; L28-V69 HydrophobicContact CD1-CB 4.45Å; L28-V69 HydrophobicContact CD1-CG1 4.47Å; L28-P70 HydrophobicContact CD1-CG 4.43Å; L28-L73 HydrophobicContact CD2-CD1 4.15Å |
| 29 | I | 96.8 | Very high | 93.5 | Very high | 106 Ų | 106 | 47 Ų | 47 | 54% | 0.544 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -68.4 | -53.2 | -177.2 | -63 | 171 | 0 | 0 | 0 | 110.3 | F25 G31 L32 V33 | F25-I29 WeakPolarHBondContact O-CG1 3.41Å; F25-I29 PolarHBondContact O-N 3.09Å; I29-G31 VanDerWaalsContact C-N 3.35Å; I29-G31 PolarHBondContact O-N 3.39Å; I29-L32 PolarHBondContact O-N 2.86Å; I29-V33 HydrophobicContact CG2-CG2 4.42Å; I29-V33 WeakPolarHBondContact O-CB 3.37Å; I29-V33 VanDerWaalsContact O-CG2 3.24Å; I29-V33 WeakPolarHBondContact O-CG2 3.24Å; I29-V33 PolarHBondContact O-N 3.33Å |
| 30 | G | 95.3 | Very high | 93.6 | Very high | 10 Ų | 10 | 48.2 Ų | 48.2 | 10% | 0.103 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.3 | -41.5 | -178 | 0 | 0 | 0 | 0 | 0 | 112.5 | I26 G34 | I26-G30 WeakPolarHBondContact O-CA 3.14Å; I26-G30 PolarHBondContact O-N 2.85Å; G30-G34 PolarHBondContact O-N 3.16Å |
| 31 | G | 95.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -65.8 | -45.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | V27 I29 G34 V35 L66 C277 | V27-G31 WeakPolarHBondContact O-CA 3.09Å; V27-G31 PolarHBondContact O-N 2.98Å; I29-G31 VanDerWaalsContact C-N 3.35Å; I29-G31 PolarHBondContact O-N 3.39Å; G31-G34 PolarHBondContact O-N 3.19Å; G31-V35 WeakPolarHBondContact O-CB 3.19Å; G31-V35 WeakPolarHBondContact O-CG2 3.25Å; G31-V35 PolarHBondContact O-N 3.32Å; G31-L66 VanDerWaalsContact C-CD1 3.5Å; G31-C277 WeakPolarHBondContact CA-O 3.47Å |
| 32 | L | 96.4 | Very high | 92.9 | Very high | 80 Ų | 80 | 50.9 Ų | 50.9 | 42% | 0.419 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.8 | -47.8 | 176.9 | -76.4 | 170.7 | 0 | 0 | 0 | 111.5 | L28 I29 G34 V35 I36 L66 | L28-L32 HydrophobicContact CD1-CD1 3.82Å; L28-L32 HydrophobicContact CD1-CG 4.32Å; L28-L32 HydrophobicContact CG-CD1 4.06Å; L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.24Å; L28-L32 WeakPolarHBondContact O-CD1 3.42Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.43Å; I29-L32 PolarHBondContact O-N 2.86Å; L32-G34 VanDerWaalsContact C-N 3.31Å; L32-G34 PolarHBondContact O-N 3.3Å; L32-V35 PolarHBondContact O-N 2.96Å; L32-I36 WeakPolarHBondContact O-CB 3.27Å; L32-I36 WeakPolarHBondContact O-CD1 3.18Å; L32-I36 VanDerWaalsContact O-CG1 3.23Å; L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.01Å; L32-L66 HydrophobicContact CD2-CD1 4.45Å; L32-L66 HydrophobicContact CG-CD1 4.48Å |
| 33 | V | 96 | Very high | 92.3 | Very high | 67 Ų | 67 | 54.1 Ų | 54.1 | 41% | 0.406 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 178.1 | 177.3 | 0 | 0 | 0 | 0 | 110.8 | I29 S37 L281 | I29-V33 HydrophobicContact CG2-CG2 4.42Å; I29-V33 WeakPolarHBondContact O-CB 3.37Å; I29-V33 VanDerWaalsContact O-CG2 3.24Å; I29-V33 WeakPolarHBondContact O-CG2 3.24Å; I29-V33 PolarHBondContact O-N 3.33Å; V33-S37 WeakPolarHBondContact O-CB 3.44Å; V33-S37 PolarHBondContact O-N 3.42Å; V33-S37 PolarHBondContact O-OG 2.96Å; V33-L281 HydrophobicContact CB-CD1 4.4Å; V33-L281 HydrophobicContact CG1-CD1 3.7Å; V33-L281 HydrophobicContact CG1-CD2 4.48Å |
| 34 | G | 93.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 60.9 Ų | 60.9 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -62.2 | -48.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.1 | G30 G31 L32 S37 I38 | G30-G34 PolarHBondContact O-N 3.16Å; G31-G34 PolarHBondContact O-N 3.19Å; L32-G34 VanDerWaalsContact C-N 3.31Å; L32-G34 PolarHBondContact O-N 3.3Å; G34-S37 PolarHBondContact O-N 3.26Å; G34-I38 PolarHBondContact O-N 3.27Å |
| 35 | V | 94.4 | Very high | 90.3 | Very high | 9 Ų | 9 | 65.6 Ų | 65.6 | 6% | 0.055 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.1 | -49.4 | 176.8 | 163.4 | 0 | 0 | 0 | 0 | 111.1 | G31 L32 S37 I38 L39 V59 H62 L66 L280 | G31-V35 WeakPolarHBondContact O-CB 3.19Å; G31-V35 WeakPolarHBondContact O-CG2 3.25Å; G31-V35 PolarHBondContact O-N 3.32Å; L32-V35 PolarHBondContact O-N 2.96Å; V35-S37 VanDerWaalsContact C-N 3.34Å; V35-S37 PolarHBondContact O-N 3.46Å; V35-I38 PolarHBondContact O-N 3.14Å; V35-L39 HydrophobicContact CG1-CD1 3.78Å; V35-L39 HydrophobicContact CG1-CG 4.47Å; V35-L39 WeakPolarHBondContact O-CB 3.31Å; V35-L39 VanDerWaalsContact O-CG 3.32Å; V35-L39 WeakPolarHBondContact O-CG 3.33Å; V35-L39 PolarHBondContact O-N 3.43Å; V35-V59 HydrophobicContact CG1-CG1 3.99Å; V35-H62 HydrophobicContact CG2-CB 4.01Å; V35-L66 HydrophobicContact CG2-CD1 4.21Å; V35-L280 HydrophobicContact CG2-CD1 4.01Å |
| 36 | I | 93.4 | Very high | 88.5 | Confident | 109 Ų | 109 | 69.2 Ų | 69.2 | 56% | 0.559 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -62 | -44.3 | -179.8 | -68 | 166 | 0 | 0 | 0 | 110.6 | L32 L39 F40 | L32-I36 WeakPolarHBondContact O-CB 3.27Å; L32-I36 WeakPolarHBondContact O-CD1 3.18Å; L32-I36 VanDerWaalsContact O-CG1 3.23Å; L32-I36 WeakPolarHBondContact O-CG1 3.37Å; L32-I36 PolarHBondContact O-N 3.01Å; I36-L39 PolarHBondContact O-N 3.39Å; I36-F40 PolarHBondContact O-N 3.49Å |
| 37 | S | 90 | Very high | 86.7 | Confident | 37 Ų | 37 | 68.5 Ų | 68.5 | 26% | 0.259 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | -179.6 | -66 | 0 | 0 | 0 | 0 | 111.9 | V33 G34 V35 F40 L41 | V33-S37 WeakPolarHBondContact O-CB 3.44Å; V33-S37 PolarHBondContact O-N 3.42Å; V33-S37 PolarHBondContact O-OG 2.96Å; G34-S37 PolarHBondContact O-N 3.26Å; V35-S37 VanDerWaalsContact C-N 3.34Å; V35-S37 PolarHBondContact O-N 3.46Å; S37-F40 PolarHBondContact O-N 2.94Å; S37-L41 WeakPolarHBondContact O-CG 3.24Å; S37-L41 PolarHBondContact O-N 3.44Å; S37-L41 VanDerWaalsContact O-N 3.13Å |
| 38 | I | 89.3 | Confident | 85.2 | Confident | 5 Ų | 5 | 77.2 Ų | 77.2 | 3% | 0.026 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.2 | -42.7 | 176 | -76.9 | -69 | 0 | 0 | 0 | 111.6 | G34 V35 F40 L41 L42 V55 V59 L280 F283 V284 | G34-I38 PolarHBondContact O-N 3.27Å; V35-I38 PolarHBondContact O-N 3.14Å; I38-F40 VanDerWaalsContact C-N 3.3Å; I38-F40 PolarHBondContact O-N 3.24Å; I38-L41 HydrophobicContact CD1-CD1 4.48Å; I38-L41 PolarHBondContact O-N 3.5Å; I38-L42 HydrophobicContact CG2-CD1 3.65Å; I38-L42 HydrophobicContact CG2-CG 4.04Å; I38-L42 WeakPolarHBondContact O-CB 3.28Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.28Å; I38-L42 PolarHBondContact O-N 2.94Å; I38-V55 HydrophobicContact CG2-CG1 3.69Å; I38-V59 HydrophobicContact CB-CG2 4.4Å; I38-V59 HydrophobicContact CG2-CG2 3.61Å; I38-L280 HydrophobicContact CG1-CB 3.87Å; I38-L280 HydrophobicContact CG1-CD1 4.44Å; I38-L280 HydrophobicContact CG1-CD2 4.21Å; I38-L280 HydrophobicContact CG1-CG 4.39Å; I38-F283 HydrophobicContact CD1-CD1 3.96Å; I38-F283 HydrophobicContact CD1-CE1 4.48Å; I38-V284 HydrophobicContact CD1-CG2 3.42Å; I38-V284 VanDerWaalsContact CD1-CG2 3.42Å; I38-V284 HydrophobicContact CG1-CG2 3.72Å |
| 39 | L | 89.1 | Confident | 83.8 | Confident | 81 Ų | 81 | 77.7 Ų | 77.7 | 42% | 0.424 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -58.4 | -43.9 | 176.8 | -77 | 168.9 | 0 | 0 | 0 | 111.5 | V35 I36 L41 L42 V43 V59 | V35-L39 HydrophobicContact CG1-CD1 3.78Å; V35-L39 HydrophobicContact CG1-CG 4.47Å; V35-L39 WeakPolarHBondContact O-CB 3.31Å; V35-L39 VanDerWaalsContact O-CG 3.32Å; V35-L39 WeakPolarHBondContact O-CG 3.33Å; V35-L39 PolarHBondContact O-N 3.43Å; I36-L39 PolarHBondContact O-N 3.39Å; L39-L41 PolarHBondContact O-N 2.92Å; L39-L42 PolarHBondContact O-N 3.25Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.3Å; L39-V59 HydrophobicContact CD1-CG1 4.36Å; L39-V59 HydrophobicContact CD2-CG1 4.1Å; L39-V59 HydrophobicContact CG-CG1 4.16Å |
| 40 | F | 87.8 | Confident | 82.3 | Confident | 146 Ų | 146 | 74.4 Ų | 74.4 | 64% | 0.64 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -59.9 | -44 | 175.5 | -178.3 | -99.2 | 0 | 0 | 0 | 112.3 | I36 S37 I38 V43 K44 | I36-F40 PolarHBondContact O-N 3.49Å; S37-F40 PolarHBondContact O-N 2.94Å; I38-F40 VanDerWaalsContact C-N 3.3Å; I38-F40 PolarHBondContact O-N 3.24Å; F40-V43 PolarHBondContact O-N 3.38Å; F40-K44 PolarHBondContact O-N 2.83Å |
| 41 | L | 83.7 | Confident | 81 | Confident | 70 Ų | 70 | 75 Ų | 75 | 37% | 0.366 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.6 | -41.5 | 175.5 | -69.2 | 176.9 | 0 | 0 | 0 | 112.3 | S37 I38 L39 V43 K44 M45 V284 | S37-L41 WeakPolarHBondContact O-CG 3.24Å; S37-L41 PolarHBondContact O-N 3.44Å; S37-L41 VanDerWaalsContact O-N 3.13Å; I38-L41 HydrophobicContact CD1-CD1 4.48Å; I38-L41 PolarHBondContact O-N 3.5Å; L39-L41 PolarHBondContact O-N 2.92Å; L41-V43 VanDerWaalsContact C-N 3.34Å; L41-V43 PolarHBondContact O-N 3.17Å; L41-K44 PolarHBondContact O-N 3.3Å; L41-M45 WeakPolarHBondContact O-CB 3.27Å; L41-M45 VanDerWaalsContact O-CG 3.28Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 3.1Å; L41-V284 HydrophobicContact CD1-CG1 4.14Å; L41-V284 HydrophobicContact CD1-CG2 3.75Å |
| 42 | L | 83.3 | Confident | 80.1 | Confident | 35 Ų | 35 | 75.9 Ų | 75.9 | 18% | 0.183 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -63.1 | -39 | 178.9 | -73.6 | 172.5 | 0 | 0 | 0 | 112 | I38 L39 K44 M45 T52 I56 | I38-L42 HydrophobicContact CG2-CD1 3.65Å; I38-L42 HydrophobicContact CG2-CG 4.04Å; I38-L42 WeakPolarHBondContact O-CB 3.28Å; I38-L42 VanDerWaalsContact O-CG 3.26Å; I38-L42 WeakPolarHBondContact O-CG 3.28Å; I38-L42 PolarHBondContact O-N 2.94Å; L39-L42 PolarHBondContact O-N 3.25Å; L42-K44 VanDerWaalsContact C-N 3.3Å; L42-K44 PolarHBondContact O-N 3.44Å; L42-M45 PolarHBondContact O-N 2.96Å; L42-T52 HydrophobicContact CD2-CG2 3.4Å; L42-T52 VanDerWaalsContact CD2-CG2 3.4Å; L42-I56 HydrophobicContact CD1-CG1 3.76Å; L42-I56 HydrophobicContact CD2-CG1 4.42Å |
| 43 | V | 81.5 | Confident | 79.2 | Confident | 132 Ų | 132 | 74 Ų | 74 | 80% | 0.8 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -63.8 | -37.9 | 174.9 | 170.7 | 0 | 0 | 0 | 0 | 111.2 | L39 F40 L41 M45 | L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.3Å; F40-V43 PolarHBondContact O-N 3.38Å; L41-V43 VanDerWaalsContact C-N 3.34Å; L41-V43 PolarHBondContact O-N 3.17Å; V43-M45 VanDerWaalsContact C-N 3.34Å |
| 44 | K | 76.5 | Confident | 78.3 | Confident | 168 Ų | 168 | 71.3 Ų | 71.3 | 73% | 0.73 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -75.6 | -22.4 | 178.6 | -165.3 | 170.9 | -177.8 | 176.2 | 0 | 113.2 | F40 L41 L42 | F40-K44 PolarHBondContact O-N 2.83Å; L41-K44 PolarHBondContact O-N 3.3Å; L42-K44 VanDerWaalsContact C-N 3.3Å; L42-K44 PolarHBondContact O-N 3.44Å |
| 45 | M | 69.8 | Low | 77.8 | Confident | 100 Ų | 100 | 71.8 Ų | 71.8 | 49% | 0.493 | 37% | 0.369 | S | S | . | . | trans | -90.3 | 110.4 | -179.1 | -72.8 | -176 | 72.8 | 0 | 0 | 111.7 | L41 L42 V43 T47 | L41-M45 WeakPolarHBondContact O-CB 3.27Å; L41-M45 VanDerWaalsContact O-CG 3.28Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 3.1Å; L42-M45 PolarHBondContact O-N 2.96Å; V43-M45 VanDerWaalsContact C-N 3.34Å; M45-T47 PolarHBondContact O-N 3.44Å; M45-T47 VanDerWaalsContact O-N 3.11Å | ||
| 46 | N | 57.3 | Low | 77.4 | Confident | 168 Ų | 168 | 74 Ų | 74 | 90% | 0.898 | 38% | 0.38 | S | S | * | . | trans | -77.4 | 11.4 | 177.7 | -159.7 | 27.6 | 0 | 0 | 0 | 114.3 | ||||
| 47 | T | 58.7 | Low | 77.1 | Confident | 85 Ų | 85 | 69.4 Ų | 69.4 | 52% | 0.521 | 36% | 0.357 | S | S | . | . | trans | -115.3 | 115.6 | -173.3 | 57.3 | 0 | 0 | 0 | 0 | 112.3 | M45 T52 | M45-T47 PolarHBondContact O-N 3.44Å; M45-T47 VanDerWaalsContact O-N 3.11Å; T47-T52 PolarHBondContact O-OG1 2.91Å | ||
| 48 | R | 63.8 | Low | 77.1 | Confident | 182 Ų | 182 | 67.7 Ų | 67.7 | 69% | 0.687 | 34% | 0.344 | S | S | * | . | trans | -95.2 | 96.1 | 173.3 | -66.2 | -159.1 | -179.8 | -177.8 | 2.1 | 110.7 | K129 | R48-K129 WeakPolarHBondContact O-CE 3.36Š| ||
| 49 | S | 67.9 | Low | 77.3 | Confident | 41 Ų | 41 | 67.8 Ų | 67.8 | 29% | 0.287 | 35% | 0.346 | S | S | . | . | trans | -96.6 | 165.7 | 171 | 77.7 | 0 | 0 | 0 | 0 | 111.3 | T51 T52 M53 | S49-T51 PolarHBondContact O-N 3.04Å; S49-T51 PolarHBondContact OG-N 3.38Å; S49-T52 PolarHBondContact N-OG1 2.87Å; S49-T52 WeakPolarHBondContact O-CB 3.36Å; S49-T52 PolarHBondContact O-N 2.85Å; S49-T52 PolarHBondContact OG-N 2.79Å; S49-T52 PolarHBondContact OG-OG1 3.5Å; S49-M53 PolarHBondContact O-N 3.48Å | ||
| 50 | V | 65.8 | Low | 77.5 | Confident | 38 Ų | 38 | 67 Ų | 67 | 23% | 0.23 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -57.7 | -37.7 | 174.2 | -171.9 | 0 | 0 | 0 | 0 | 111.2 | M53 A54 T112 R128 A132 | V50-M53 PolarHBondContact O-N 2.94Å; V50-A54 PolarHBondContact O-N 3.36Å; V50-A54 VanDerWaalsContact O-N 3.09Å; V50-T112 HydrophobicContact CB-CG2 4.29Å; V50-T112 HydrophobicContact CG1-CG2 3.76Å; V50-R128 HydrophobicContact CG2-CG 3.74Å; V50-A132 HydrophobicContact CB-CB 4.47Å; V50-A132 HydrophobicContact CG1-CB 4.21Å; V50-A132 HydrophobicContact CG2-CB 4.06Å |
| 51 | T | 68 | Low | 77.7 | Confident | 23 Ų | 23 | 60.2 Ų | 60.2 | 14% | 0.141 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -66.8 | -41.1 | 174.6 | -48.3 | 0 | 0 | 0 | 0 | 111.7 | S49 M53 A54 V55 R113 | S49-T51 PolarHBondContact O-N 3.04Å; S49-T51 PolarHBondContact OG-N 3.38Å; T51-M53 VanDerWaalsContact C-N 3.28Å; T51-M53 PolarHBondContact O-N 3.38Å; T51-A54 PolarHBondContact O-N 2.98Å; T51-V55 WeakPolarHBondContact O-CG2 3.1Å; T51-V55 PolarHBondContact O-N 3.43Å; T51-R113 VanDerWaalsContact CG2-NH2 3.27Å; T51-R113 PolarHBondContact OG1-NE 3.32Å; T51-R113 PolarHBondContact OG1-NH2 2.99Å |
| 52 | T | 75.7 | Confident | 78.3 | Confident | 18 Ų | 18 | 56.9 Ų | 56.9 | 11% | 0.11 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.8 | -41.4 | 176.3 | -44.7 | 0 | 0 | 0 | 0 | 110.7 | L42 T47 S49 V55 I56 | L42-T52 HydrophobicContact CD2-CG2 3.4Å; L42-T52 VanDerWaalsContact CD2-CG2 3.4Å; T47-T52 PolarHBondContact O-OG1 2.91Å; S49-T52 PolarHBondContact N-OG1 2.87Å; S49-T52 WeakPolarHBondContact O-CB 3.36Å; S49-T52 PolarHBondContact O-N 2.85Å; S49-T52 PolarHBondContact OG-N 2.79Å; S49-T52 PolarHBondContact OG-OG1 3.5Å; T52-V55 PolarHBondContact O-N 2.89Å; T52-I56 HydrophobicContact CG2-CD1 4.49Å; T52-I56 WeakPolarHBondContact O-CG1 3.35Å; T52-I56 PolarHBondContact O-N 3.14Å |
| 53 | M | 78.3 | Confident | 78.9 | Confident | 41 Ų | 41 | 57.1 Ų | 57.1 | 20% | 0.202 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.8 | -43.1 | 176.4 | -170.7 | 67 | -174.4 | 0 | 0 | 112.2 | S49 V50 T51 V55 I56 N57 V133 | S49-M53 PolarHBondContact O-N 3.48Å; V50-M53 PolarHBondContact O-N 2.94Å; T51-M53 VanDerWaalsContact C-N 3.28Å; T51-M53 PolarHBondContact O-N 3.38Å; M53-V55 VanDerWaalsContact C-N 3.34Å; M53-V55 PolarHBondContact O-N 3.35Å; M53-I56 WeakPolarHBondContact O-CB 3.25Å; M53-I56 PolarHBondContact O-N 2.79Å; M53-N57 PolarHBondContact O-N 3.32Å; M53-N57 PolarHBondContact O-ND2 2.86Å; M53-V133 HydrophobicContact CE-CG1 4.49Å; M53-V133 HydrophobicContact CE-CG2 4.17Å; M53-V133 HydrophobicContact SD-CG2 4.21Å |
| 54 | A | 75.9 | Confident | 79.5 | Confident | 9 Ų | 9 | 53.9 Ų | 53.9 | 7% | 0.074 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66 | -36 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | V50 T51 I56 N57 L58 I109 | V50-A54 PolarHBondContact O-N 3.36Å; V50-A54 VanDerWaalsContact O-N 3.09Å; T51-A54 PolarHBondContact O-N 2.98Å; A54-I56 VanDerWaalsContact C-N 3.35Å; A54-N57 WeakPolarHBondContact O-CB 3.13Å; A54-N57 PolarHBondContact O-N 3.48Å; A54-L58 PolarHBondContact O-N 3.42Å; A54-I109 HydrophobicContact CB-CD1 3.79Å; A54-I109 HydrophobicContact CB-CG1 3.34Å |
| 55 | V | 82.8 | Confident | 80.4 | Confident | 11 Ų | 11 | 46 Ų | 46 | 7% | 0.067 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64 | -39.8 | 172 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | I38 T51 T52 M53 N57 L58 V59 L280 | I38-V55 HydrophobicContact CG2-CG1 3.69Å; T51-V55 WeakPolarHBondContact O-CG2 3.1Å; T51-V55 PolarHBondContact O-N 3.43Å; T52-V55 PolarHBondContact O-N 2.89Å; M53-V55 VanDerWaalsContact C-N 3.34Å; M53-V55 PolarHBondContact O-N 3.35Å; V55-N57 VanDerWaalsContact C-N 3.32Å; V55-N57 PolarHBondContact O-N 3.47Å; V55-L58 PolarHBondContact O-N 2.81Å; V55-V59 WeakPolarHBondContact O-CG2 3.48Å; V55-V59 PolarHBondContact O-N 3.4Å; V55-L280 HydrophobicContact CG1-CD2 4.43Å |
| 56 | I | 85.9 | Confident | 81.7 | Confident | 55 Ų | 55 | 41.6 Ų | 41.6 | 28% | 0.282 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.8 | -42.5 | 173.9 | -69.7 | 163.3 | 0 | 0 | 0 | 110.8 | L42 T52 M53 A54 L58 V59 V60 | L42-I56 HydrophobicContact CD1-CG1 3.76Å; L42-I56 HydrophobicContact CD2-CG1 4.42Å; T52-I56 HydrophobicContact CG2-CD1 4.49Å; T52-I56 WeakPolarHBondContact O-CG1 3.35Å; T52-I56 PolarHBondContact O-N 3.14Å; M53-I56 WeakPolarHBondContact O-CB 3.25Å; M53-I56 PolarHBondContact O-N 2.79Å; A54-I56 VanDerWaalsContact C-N 3.35Å; I56-L58 PolarHBondContact O-N 3.23Å; I56-V59 WeakPolarHBondContact O-CB 3.48Å; I56-V59 PolarHBondContact O-N 3.35Å; I56-V60 WeakPolarHBondContact O-CG2 3.15Å; I56-V60 PolarHBondContact O-N 2.98Å; I56-V60 VanDerWaalsContact O-N 3.09Å |
| 57 | N | 88.1 | Confident | 83.5 | Confident | 13 Ų | 13 | 39.6 Ų | 39.6 | 7% | 0.07 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.2 | -42.3 | 176.3 | -67.4 | -35.2 | 0 | 0 | 0 | 112.3 | M53 A54 V55 V59 V60 V61 F105 S136 W140 | M53-N57 PolarHBondContact O-N 3.32Å; M53-N57 PolarHBondContact O-ND2 2.86Å; A54-N57 WeakPolarHBondContact O-CB 3.13Å; A54-N57 PolarHBondContact O-N 3.48Å; V55-N57 VanDerWaalsContact C-N 3.32Å; V55-N57 PolarHBondContact O-N 3.47Å; N57-V59 VanDerWaalsContact C-N 3.35Å; N57-V60 PolarHBondContact O-N 3.24Å; N57-V61 WeakPolarHBondContact O-CG2 3.25Å; N57-V61 PolarHBondContact O-N 2.77Å; N57-F105 HydrophobicContact CB-CD1 3.74Å; N57-F105 HydrophobicContact CB-CE1 3.4Å; N57-F105 HydrophobicContact CB-CE2 4.23Å; N57-F105 HydrophobicContact CB-CG 4.31Å; N57-F105 HydrophobicContact CB-CZ 3.69Å; N57-F105 WeakPolarHBondContact ND2-CE1 3.26Å; N57-S136 PolarHBondContact ND2-OG 2.83Å; N57-S136 PolarHBondContact OD1-OG 3.45Å; N57-W140 HydrophobicContact CB-CZ2 4.36Å; N57-W140 PolarHBondContact OD1-NE1 3.49Å |
| 58 | L | 90.2 | Very high | 85.3 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -59.3 | -45.9 | 174.1 | -75.2 | 170 | 0 | 0 | 0 | 111.2 | A54 V55 I56 V60 V61 H62 T102 F105 Y106 I109 F230 L280 | A54-L58 PolarHBondContact O-N 3.42Å; V55-L58 PolarHBondContact O-N 2.81Å; I56-L58 PolarHBondContact O-N 3.23Å; L58-V60 VanDerWaalsContact C-N 3.28Å; L58-V60 PolarHBondContact O-N 3.39Å; L58-V61 PolarHBondContact O-N 3.05Å; L58-V61 VanDerWaalsContact O-N 3.11Å; L58-H62 VanDerWaalsContact C-CD2 3.48Å; L58-H62 PolarHBondContact O-CD2 3.26Å; L58-H62 PolarHBondContact O-N 3.42Å; L58-T102 HydrophobicContact CD2-CG2 4.01Å; L58-F105 HydrophobicContact CD2-CB 3.71Å; L58-F105 HydrophobicContact CD2-CG 4.48Å; L58-F105 HydrophobicContact CG-CB 4.13Å; L58-Y106 HydrophobicContact CD1-CD1 4.01Å; L58-Y106 HydrophobicContact CD1-CE1 3.7Å; L58-Y106 HydrophobicContact CD2-CD1 4.03Å; L58-Y106 HydrophobicContact CD2-CE1 3.72Å; L58-Y106 HydrophobicContact CG-CE1 4.39Å; L58-I109 HydrophobicContact CD1-CD1 3.63Å; L58-I109 HydrophobicContact CG-CD1 4.46Å; L58-F230 HydrophobicContact CD1-CE1 4.49Å; L58-L280 HydrophobicContact CB-CD2 4.47Å |
| 59 | V | 93 | Very high | 86.8 | Confident | 8 Ų | 8 | 27.3 Ų | 27.3 | 5% | 0.048 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -52.4 | -47.8 | 175.2 | 168.2 | 0 | 0 | 0 | 0 | 111 | V35 I38 L39 V55 I56 N57 V61 H62 S63 L280 | V35-V59 HydrophobicContact CG1-CG1 3.99Å; I38-V59 HydrophobicContact CB-CG2 4.4Å; I38-V59 HydrophobicContact CG2-CG2 3.61Å; L39-V59 HydrophobicContact CD1-CG1 4.36Å; L39-V59 HydrophobicContact CD2-CG1 4.1Å; L39-V59 HydrophobicContact CG-CG1 4.16Å; V55-V59 WeakPolarHBondContact O-CG2 3.48Å; V55-V59 PolarHBondContact O-N 3.4Å; I56-V59 WeakPolarHBondContact O-CB 3.48Å; I56-V59 PolarHBondContact O-N 3.35Å; N57-V59 VanDerWaalsContact C-N 3.35Å; V59-V61 PolarHBondContact O-N 3.05Å; V59-H62 PolarHBondContact O-N 3.31Å; V59-S63 WeakPolarHBondContact O-CB 3.48Å; V59-S63 PolarHBondContact O-N 3.09Å; V59-S63 PolarHBondContact O-OG 3.31Å; V59-L280 HydrophobicContact CB-CD1 4.46Å; V59-L280 HydrophobicContact CG2-CD1 3.6Å |
| 60 | V | 92.7 | Very high | 88.1 | Confident | 65 Ų | 65 | 27.8 Ų | 27.8 | 39% | 0.394 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -60.7 | -47.6 | 178.1 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | I56 N57 L58 H62 S63 V64 W140 | I56-V60 WeakPolarHBondContact O-CG2 3.15Å; I56-V60 PolarHBondContact O-N 2.98Å; I56-V60 VanDerWaalsContact O-N 3.09Å; N57-V60 PolarHBondContact O-N 3.24Å; L58-V60 VanDerWaalsContact C-N 3.28Å; L58-V60 PolarHBondContact O-N 3.39Å; V60-H62 PolarHBondContact O-N 3.4Å; V60-S63 PolarHBondContact O-N 3Å; V60-V64 HydrophobicContact CG1-CG2 4.46Å; V60-V64 WeakPolarHBondContact O-CG2 3.31Å; V60-V64 PolarHBondContact O-N 2.94Å; V60-W140 HydrophobicContact CB-CH2 4.46Å; V60-W140 HydrophobicContact CB-CZ2 4.13Å; V60-W140 HydrophobicContact CG1-CH2 3.95Å; V60-W140 HydrophobicContact CG1-CZ2 3.97Å |
| 61 | V | 93.5 | Very high | 89.4 | Confident | 2 Ų | 2 | 29.1 Ų | 29.1 | 1% | 0.012 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.9 | -47.4 | 178.6 | 172 | 0 | 0 | 0 | 0 | 111.5 | N57 L58 V59 F65 L101 T102 F105 W140 | N57-V61 WeakPolarHBondContact O-CG2 3.25Å; N57-V61 PolarHBondContact O-N 2.77Å; L58-V61 PolarHBondContact O-N 3.05Å; L58-V61 VanDerWaalsContact O-N 3.11Å; V59-V61 PolarHBondContact O-N 3.05Å; V61-F65 PolarHBondContact O-N 3.42Å; V61-F65 VanDerWaalsContact O-N 3.12Å; V61-L101 HydrophobicContact CG1-CB 3.84Å; V61-L101 HydrophobicContact CG1-CD1 4.45Å; V61-L101 HydrophobicContact CG2-CB 3.98Å; V61-L101 HydrophobicContact CG2-CD1 4.29Å; V61-L101 HydrophobicContact CG2-CD2 4.5Å; V61-T102 WeakPolarHBondContact CG1-OG1 3.13Å; V61-F105 HydrophobicContact CG2-CD2 3.81Å; V61-F105 HydrophobicContact CG2-CE2 3.53Å; V61-W140 HydrophobicContact CG2-CH2 3.38Å; V61-W140 HydrophobicContact CG2-CZ2 3.79Å; V61-W140 HydrophobicContact CG2-CZ3 4.29Å |
| 62 | H | 95.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65 | -44.2 | 178.1 | -65.2 | -57.4 | 0 | 0 | 0 | 111.6 | V35 L58 V59 V60 V64 F65 L66 H98 S276 C277 D279 | V35-H62 HydrophobicContact CG2-CB 4.01Å; L58-H62 VanDerWaalsContact C-CD2 3.48Å; L58-H62 PolarHBondContact O-CD2 3.26Å; L58-H62 PolarHBondContact O-N 3.42Å; V59-H62 PolarHBondContact O-N 3.31Å; V60-H62 PolarHBondContact O-N 3.4Å; H62-V64 PolarHBondContact O-N 3.27Å; H62-F65 PolarHBondContact O-N 3.3Å; H62-L66 WeakPolarHBondContact O-CB 3.38Å; H62-L66 WeakPolarHBondContact O-CD1 3.18Å; H62-L66 WeakPolarHBondContact O-CG 3.39Å; H62-L66 PolarHBondContact O-N 2.99Å; H62-H98 AromaticContact CE1-NE2 3.64Å; H62-H98 AromaticContact ND1-NE2 3.18Å; H62-H98 PolarHBondContact ND1-NE2 3.03Å; H62-H98 VanDerWaalsContact ND1-NE2 3.18Å; H62-S276 PolarHBondContact CE1-O 3.32Å; H62-C277 WeakPolarHBondContact ND1-CA 3.42Å; H62-C277 PolarHBondContact ND1-SG 2.98Å; H62-C277 VanDerWaalsContact ND1-SG 3.38Å; H62-D279 IonicContact CD2-OD1 3.57Å; H62-D279 IonicContact CE1-OD1 3.89Å; H62-D279 IonicContact NE2-OD1 3.45Å; H62-D279 PolarHBondContact NE2-OD1 2.93Å; H62-D279 IonicContact NE2-OD2 3.23Å |
| 63 | S | 95.8 | Very high | 91.4 | Very high | 40 Ų | 40 | 28.3 Ų | 28.3 | 28% | 0.28 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -58.5 | -48.7 | 177.7 | -66.7 | 0 | 0 | 0 | 0 | 111.9 | V59 V60 F65 L66 L67 | V59-S63 WeakPolarHBondContact O-CB 3.48Å; V59-S63 PolarHBondContact O-N 3.09Å; V59-S63 PolarHBondContact O-OG 3.31Å; V60-S63 PolarHBondContact O-N 3Å; S63-F65 VanDerWaalsContact C-N 3.31Å; S63-F65 PolarHBondContact O-N 3.44Å; S63-L66 PolarHBondContact O-N 3.24Å; S63-L67 WeakPolarHBondContact O-CG 3.38Å; S63-L67 PolarHBondContact O-N 2.97Å; S63-L67 VanDerWaalsContact O-N 3.08Å |
| 64 | V | 94.3 | Very high | 92 | Very high | 64 Ų | 64 | 28.3 Ų | 28.3 | 39% | 0.388 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -61.3 | -41.9 | 179.3 | 176.5 | 0 | 0 | 0 | 0 | 110.9 | V60 H62 M94 | V60-V64 HydrophobicContact CG1-CG2 4.46Å; V60-V64 WeakPolarHBondContact O-CG2 3.31Å; V60-V64 PolarHBondContact O-N 2.94Å; H62-V64 PolarHBondContact O-N 3.27Å; V64-M94 HydrophobicContact CB-CE 4.2Å; V64-M94 HydrophobicContact CG1-CE 3.67Å; V64-M94 HydrophobicContact CG1-SD 4.07Å |
| 65 | F | 95.8 | Very high | 92.6 | Very high | 4 Ų | 4 | 29.1 Ų | 29.1 | 2% | 0.018 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -65.9 | -46.9 | 176.9 | 172.6 | -104.1 | 0 | 0 | 0 | 112.4 | Y24 V27 V61 H62 S63 L67 T68 V69 M94 L95 H98 A274 C277 | Y24-F65 HydrophobicContact CE1-CZ 4.45Å; V27-F65 HydrophobicContact CG1-CE1 3.87Å; V61-F65 PolarHBondContact O-N 3.42Å; V61-F65 VanDerWaalsContact O-N 3.12Å; H62-F65 PolarHBondContact O-N 3.3Å; S63-F65 VanDerWaalsContact C-N 3.31Å; S63-F65 PolarHBondContact O-N 3.44Å; F65-L67 PolarHBondContact O-N 2.94Å; F65-T68 WeakPolarHBondContact O-CA 3.24Å; F65-T68 WeakPolarHBondContact O-CB 3.33Å; F65-T68 PolarHBondContact O-N 2.92Å; F65-T68 PolarHBondContact O-OG1 3.26Å; F65-V69 HydrophobicContact CD1-CG2 4.14Å; F65-V69 HydrophobicContact CE1-CG2 3.64Å; F65-V69 HydrophobicContact CE2-CG2 4.39Å; F65-V69 HydrophobicContact CZ-CG2 3.78Å; F65-V69 PolarHBondContact O-N 3.13Å; F65-M94 HydrophobicContact CB-CE 4Å; F65-M94 HydrophobicContact CD2-CG 4.13Å; F65-L95 HydrophobicContact CE2-CB 4.09Å; F65-L95 HydrophobicContact CE2-CD1 3.47Å; F65-L95 VanDerWaalsContact CE2-CD1 3.47Å; F65-L95 HydrophobicContact CE2-CG 4.36Å; F65-L95 HydrophobicContact CZ-CD1 3.56Å; F65-H98 HydrophobicContact CB-CB 3.93Å; F65-H98 VanDerWaalsContact CB-CD2 3.42Å; F65-H98 WeakPolarHBondContact CB-CD2 3.1Å; F65-H98 HydrophobicContact CD2-CB 3.62Å; F65-H98 AromaticContact CD2-CG 3.76Å; F65-H98 HydrophobicContact CE2-CB 4.38Å; F65-H98 HydrophobicContact CG-CB 3.82Å; F65-H98 AromaticContact CG-CD2 3.68Å; F65-H98 AromaticContact CG-CG 3.51Å; F65-A274 HydrophobicContact CE1-CB 3.83Å; F65-A274 HydrophobicContact CZ-CB 3.68Å; F65-C277 WeakPolarHBondContact CD1-SG 3.38Å |
| 66 | L | 96.9 | Very high | 92.9 | Very high | 6 Ų | 6 | 29.6 Ų | 29.6 | 3% | 0.031 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.1 | -32.8 | -180 | -72.2 | 167.2 | 0 | 0 | 0 | 112.3 | V27 L28 G31 L32 V35 H62 S63 T68 V69 P70 | V27-L66 HydrophobicContact CG1-CD2 4.18Å; V27-L66 WeakPolarHBondContact O-CD2 3.34Å; L28-L66 HydrophobicContact CD1-CD2 4.42Å; G31-L66 VanDerWaalsContact C-CD1 3.5Å; L32-L66 HydrophobicContact CD2-CD1 4.45Å; L32-L66 HydrophobicContact CG-CD1 4.48Å; V35-L66 HydrophobicContact CG2-CD1 4.21Å; H62-L66 WeakPolarHBondContact O-CB 3.38Å; H62-L66 WeakPolarHBondContact O-CD1 3.18Å; H62-L66 WeakPolarHBondContact O-CG 3.39Å; H62-L66 PolarHBondContact O-N 2.99Å; S63-L66 PolarHBondContact O-N 3.24Å; L66-T68 PolarHBondContact O-N 3.47Å; L66-V69 PolarHBondContact O-N 3.27Å; L66-P70 WeakPolarHBondContact O-CD 3.28Å |
| 67 | L | 96.3 | Very high | 93 | Very high | 126 Ų | 126 | 31.9 Ų | 31.9 | 66% | 0.66 | 18% | 0.175 | S | C | * | . | H | α-helix | trans | -62.4 | -27.3 | 173.2 | -70.5 | 172.7 | 0 | 0 | 0 | 113 | S63 F65 F71 | S63-L67 WeakPolarHBondContact O-CG 3.38Å; S63-L67 PolarHBondContact O-N 2.97Å; S63-L67 VanDerWaalsContact O-N 3.08Å; F65-L67 PolarHBondContact O-N 2.94Å; L67-F71 WeakPolarHBondContact O-CE2 3.49Å |
| 68 | T | 94.9 | Very high | 92.9 | Very high | 9 Ų | 9 | 37.3 Ų | 37.3 | 6% | 0.055 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -85.9 | -20.9 | 178.8 | 70 | 0 | 0 | 0 | 0 | 113.8 | F65 L66 F71 R72 F90 M94 | F65-T68 WeakPolarHBondContact O-CA 3.24Å; F65-T68 WeakPolarHBondContact O-CB 3.33Å; F65-T68 PolarHBondContact O-N 2.92Å; F65-T68 PolarHBondContact O-OG1 3.26Å; L66-T68 PolarHBondContact O-N 3.47Å; T68-F71 PolarHBondContact O-N 3.17Å; T68-R72 PolarHBondContact O-N 3.36Å; T68-F90 HydrophobicContact CG2-CE1 3.83Å; T68-M94 HydrophobicContact CG2-CB 4.15Å; T68-M94 HydrophobicContact CG2-CG 3.76Å |
| 69 | V | 95.3 | Very high | 92.6 | Very high | 1 Ų | 1 | 43.2 Ų | 43.2 | 1% | 0.006 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -59.9 | -43 | -175.8 | 173.8 | 0 | 0 | 0 | 0 | 113.7 | Y24 L28 F65 L66 F71 R72 L73 | Y24-V69 HydrophobicContact CD1-CG1 3.93Å; Y24-V69 HydrophobicContact CD1-CG2 4.44Å; Y24-V69 HydrophobicContact CG-CG1 4.43Å; L28-V69 HydrophobicContact CB-CG1 4.14Å; L28-V69 HydrophobicContact CD1-CB 4.45Å; L28-V69 HydrophobicContact CD1-CG1 4.47Å; F65-V69 HydrophobicContact CD1-CG2 4.14Å; F65-V69 HydrophobicContact CE1-CG2 3.64Å; F65-V69 HydrophobicContact CE2-CG2 4.39Å; F65-V69 HydrophobicContact CZ-CG2 3.78Å; F65-V69 PolarHBondContact O-N 3.13Å; L66-V69 PolarHBondContact O-N 3.27Å; V69-F71 VanDerWaalsContact C-N 3.26Å; V69-F71 PolarHBondContact O-N 3.38Å; V69-R72 PolarHBondContact O-N 3.4Å; V69-R72 VanDerWaalsContact O-N 3.1Å; V69-L73 HydrophobicContact CG1-CD1 4.04Å; V69-L73 HydrophobicContact CG1-CG 4.37Å; V69-L73 PolarHBondContact O-N 3.43Å |
| 70 | P | 95.7 | Very high | 92.1 | Very high | 51 Ų | 51 | 45.9 Ų | 45.9 | 33% | 0.331 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -57.9 | -34.8 | 178.6 | -27.8 | 35.5 | 0 | 0 | 0 | 114.2 | L28 L66 L73 T74 | L28-P70 HydrophobicContact CD1-CG 4.43Å; L66-P70 WeakPolarHBondContact O-CD 3.28Å; P70-L73 PolarHBondContact O-N 2.96Å; P70-T74 PolarHBondContact O-N 3.36Å; P70-T74 PolarHBondContact O-OG1 3.49Å |
| 71 | F | 93.9 | Very high | 91.8 | Very high | 66 Ų | 66 | 43.2 Ų | 43.2 | 29% | 0.289 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -69.7 | -38.9 | 178 | -59 | -79.7 | 0 | 0 | 0 | 111.4 | L67 T68 V69 T74 Y75 W81 F83 F87 V91 | L67-F71 WeakPolarHBondContact O-CE2 3.49Å; T68-F71 PolarHBondContact O-N 3.17Å; V69-F71 VanDerWaalsContact C-N 3.26Å; V69-F71 PolarHBondContact O-N 3.38Å; F71-T74 PolarHBondContact O-N 3.49Å; F71-Y75 PolarHBondContact O-N 3.29Å; F71-Y75 VanDerWaalsContact O-N 3.12Å; F71-W81 HydrophobicContact CB-CH2 4.09Å; F71-W81 HydrophobicContact CB-CZ3 4.44Å; F71-F83 HydrophobicContact CD1-CD1 4.27Å; F71-F83 HydrophobicContact CD1-CD2 4.21Å; F71-F83 AromaticContact CD1-CE1 3.94Å; F71-F83 HydrophobicContact CD1-CE1 3.94Å; F71-F83 AromaticContact CD1-CE2 3.89Å; F71-F83 HydrophobicContact CD1-CE2 3.89Å; F71-F83 HydrophobicContact CD1-CG 4.4Å; F71-F83 AromaticContact CD1-CZ 3.74Å; F71-F83 HydrophobicContact CD1-CZ 3.74Å; F71-F83 HydrophobicContact CE1-CD1 4.39Å; F71-F83 HydrophobicContact CE1-CE1 4.05Å; F71-F83 HydrophobicContact CE1-CZ 4.25Å; F71-F87 HydrophobicContact CB-CE1 4.09Å; F71-F87 AromaticContact CD1-CE1 3.53Å; F71-F87 HydrophobicContact CD1-CE1 3.53Å; F71-F87 HydrophobicContact CD1-CZ 4.12Å; F71-F87 AromaticContact CD2-CE1 3.94Å; F71-F87 HydrophobicContact CD2-CE1 3.94Å; F71-F87 AromaticContact CD2-CZ 3.78Å; F71-F87 HydrophobicContact CD2-CZ 3.78Å; F71-F87 AromaticContact CE1-CE1 3.82Å; F71-F87 HydrophobicContact CE1-CE1 3.82Å; F71-F87 HydrophobicContact CE1-CZ 4.13Å; F71-F87 HydrophobicContact CE2-CE1 4.22Å; F71-F87 AromaticContact CE2-CZ 3.81Å; F71-F87 HydrophobicContact CE2-CZ 3.81Å; F71-F87 AromaticContact CG-CE1 3.57Å; F71-F87 HydrophobicContact CG-CE1 3.57Å; F71-F87 AromaticContact CG-CZ 3.93Å; F71-F87 HydrophobicContact CG-CZ 3.93Å; F71-F87 HydrophobicContact CZ-CE1 4.15Å; F71-F87 AromaticContact CZ-CZ 3.97Å; F71-F87 HydrophobicContact CZ-CZ 3.97Å; F71-V91 HydrophobicContact CB-CG2 4.36Å |
| 72 | R | 91.6 | Very high | 91.5 | Very high | 14 Ų | 14 | 48.7 Ų | 48.7 | 5% | 0.053 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.2 | -41.4 | 173.5 | -169.6 | 166.5 | -176.8 | 156.4 | 0.4 | 111.9 | Y24 T68 V69 T74 Y75 L76 V91 F167 E267 | Y24-R72 HydrophobicContact CE2-CG 4.45Å; Y24-R72 PolarHBondContact OH-NE 3.43Å; Y24-R72 VanDerWaalsContact OH-NE 3.15Å; Y24-R72 PolarHBondContact OH-NH1 3.33Å; Y24-R72 PolarHBondContact OH-NH2 3.42Å; T68-R72 PolarHBondContact O-N 3.36Å; V69-R72 PolarHBondContact O-N 3.4Å; V69-R72 VanDerWaalsContact O-N 3.1Å; R72-T74 VanDerWaalsContact C-N 3.34Å; R72-T74 PolarHBondContact O-N 3Å; R72-Y75 WeakPolarHBondContact O-CB 3.46Å; R72-Y75 PolarHBondContact O-N 2.98Å; R72-L76 HydrophobicContact CG-CD1 4.45Å; R72-L76 WeakPolarHBondContact O-CG 3.26Å; R72-L76 PolarHBondContact O-N 3.3Å; R72-V91 HydrophobicContact CB-CG1 4.26Å; R72-F167 HydrophobicContact CB-CZ 4.24Å; R72-F167 HydrophobicContact CG-CE1 4.34Å; R72-F167 HydrophobicContact CG-CE2 4.29Å; R72-F167 HydrophobicContact CG-CZ 3.9Å; R72-E267 IonicContact CZ-OE2 3.86Å; R72-E267 IonicContact NH2-OE2 2.7Å; R72-E267 PolarHBondContact NH2-OE2 3.3Å |
| 73 | L | 92.8 | Very high | 91.1 | Very high | 9 Ų | 9 | 52.5 Ų | 52.5 | 5% | 0.047 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.8 | -43.8 | 172.9 | -80.7 | 168.9 | 0 | 0 | 0 | 111.9 | I21 F25 L28 V69 P70 Y75 L76 I77 | I21-L73 HydrophobicContact CG2-CD2 4.29Å; F25-L73 HydrophobicContact CD1-CD1 4.24Å; F25-L73 HydrophobicContact CD2-CD2 3.94Å; F25-L73 HydrophobicContact CE1-CD1 4.19Å; F25-L73 HydrophobicContact CE2-CD2 3.94Å; F25-L73 HydrophobicContact CG-CD1 4.47Å; F25-L73 HydrophobicContact CG-CD2 4.43Å; F25-L73 HydrophobicContact CZ-CD1 4.38Å; F25-L73 HydrophobicContact CZ-CD2 4.41Å; L28-L73 HydrophobicContact CD2-CD1 4.15Å; V69-L73 HydrophobicContact CG1-CD1 4.04Å; V69-L73 HydrophobicContact CG1-CG 4.37Å; V69-L73 PolarHBondContact O-N 3.43Å; P70-L73 PolarHBondContact O-N 2.96Å; L73-Y75 VanDerWaalsContact C-N 3.28Å; L73-Y75 PolarHBondContact O-N 2.93Å; L73-L76 PolarHBondContact O-N 3.4Å; L73-L76 VanDerWaalsContact O-N 3.14Å; L73-I77 WeakPolarHBondContact O-CG1 3.29Å; L73-I77 PolarHBondContact O-N 2.99Å |
| 74 | T | 91.8 | Very high | 90.6 | Very high | 41 Ų | 41 | 52.1 Ų | 52.1 | 25% | 0.252 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.2 | -42.8 | 177.2 | -58.1 | 0 | 0 | 0 | 0 | 111.2 | P70 F71 R72 I77 K78 F83 | P70-T74 PolarHBondContact O-N 3.36Å; P70-T74 PolarHBondContact O-OG1 3.49Å; F71-T74 PolarHBondContact O-N 3.49Å; R72-T74 VanDerWaalsContact C-N 3.34Å; R72-T74 PolarHBondContact O-N 3Å; T74-I77 PolarHBondContact O-N 2.98Å; T74-K78 HydrophobicContact CG2-CD 3.98Å; T74-K78 HydrophobicContact CG2-CG 4.42Å; T74-K78 WeakPolarHBondContact O-CB 3.48Å; T74-K78 PolarHBondContact O-N 3.32Å; T74-F83 HydrophobicContact CG2-CE2 4.27Å; T74-F83 HydrophobicContact CG2-CZ 4.39Å |
| 75 | Y | 89.2 | Confident | 90 | Very high | 27 Ų | 27 | 50.7 Ų | 50.7 | 11% | 0.106 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -64.5 | -43.6 | 174.7 | 176.4 | -103.6 | 0 | 0 | 0 | 113 | F71 R72 L73 I77 E79 W81 C166 F167 | F71-Y75 PolarHBondContact O-N 3.29Å; F71-Y75 VanDerWaalsContact O-N 3.12Å; R72-Y75 WeakPolarHBondContact O-CB 3.46Å; R72-Y75 PolarHBondContact O-N 2.98Å; L73-Y75 VanDerWaalsContact C-N 3.28Å; L73-Y75 PolarHBondContact O-N 2.93Å; Y75-I77 VanDerWaalsContact C-N 3.25Å; Y75-I77 PolarHBondContact O-N 3.5Å; Y75-E79 WeakPolarHBondContact O-CA 3.38Å; Y75-E79 PolarHBondContact O-N 3.49Å; Y75-W81 HydrophobicContact CD2-CB 3.99Å; Y75-W81 HydrophobicContact CD2-CE3 4.1Å; Y75-W81 HydrophobicContact CE2-CB 4.29Å; Y75-W81 HydrophobicContact CG-CE3 4.17Å; Y75-C166 HydrophobicContact CD2-CB 4.24Å; Y75-C166 HydrophobicContact CE2-CB 4.05Å; Y75-C166 PolarHBondContact OH-N 3.23Å; Y75-C166 PolarHBondContact OH-O 2.78Å; Y75-F167 AromaticContact CD1-CD2 3.4Å; Y75-F167 HydrophobicContact CD1-CD2 3.4Å; Y75-F167 AromaticContact CD1-CE2 3.44Å; Y75-F167 HydrophobicContact CD1-CE2 3.44Å; Y75-F167 VanDerWaalsContact CD1-CE2 3.44Å; Y75-F167 AromaticContact CE1-CD2 3.47Å; Y75-F167 HydrophobicContact CE1-CD2 3.47Å; Y75-F167 VanDerWaalsContact CE1-CD2 3.47Å; Y75-F167 HydrophobicContact CE1-CE2 4.02Å; Y75-F167 HydrophobicContact CG-CD2 4.06Å; Y75-F167 AromaticContact CG-CE2 3.73Å; Y75-F167 HydrophobicContact CG-CE2 3.73Å |
| 76 | L | 87.4 | Confident | 89.4 | Confident | 21 Ų | 21 | 55.4 Ų | 55.4 | 11% | 0.11 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.8 | -31.4 | 179.2 | -70.6 | 169.2 | 0 | 0 | 0 | 112.5 | T17 L20 I21 Y24 R72 L73 | T17-L76 HydrophobicContact CG2-CD2 4.49Å; T17-L76 WeakPolarHBondContact CG2-O 3.24Å; L20-L76 HydrophobicContact CB-CD1 4.15Å; L20-L76 HydrophobicContact CB-CD2 4.36Å; L20-L76 HydrophobicContact CD1-CD2 4.31Å; I21-L76 HydrophobicContact CD1-CB 4.28Å; I21-L76 HydrophobicContact CG1-CB 3.71Å; I21-L76 HydrophobicContact CG1-CD1 4.31Å; Y24-L76 HydrophobicContact CD2-CD1 3.66Å; Y24-L76 HydrophobicContact CE2-CD1 4.13Å; R72-L76 HydrophobicContact CG-CD1 4.45Å; R72-L76 WeakPolarHBondContact O-CG 3.26Å; R72-L76 PolarHBondContact O-N 3.3Å; L73-L76 PolarHBondContact O-N 3.4Å; L73-L76 VanDerWaalsContact O-N 3.14Å |
| 77 | I | 88.8 | Confident | 88.9 | Confident | 103 Ų | 103 | 58.1 Ų | 58.1 | 53% | 0.528 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -84.3 | -43.4 | 180 | -65 | 165.1 | 0 | 0 | 0 | 111.8 | I21 L73 T74 Y75 | I21-I77 HydrophobicContact CD1-CG1 4.06Å; I21-I77 HydrophobicContact CG1-CG1 4.49Å; L73-I77 WeakPolarHBondContact O-CG1 3.29Å; L73-I77 PolarHBondContact O-N 2.99Å; T74-I77 PolarHBondContact O-N 2.98Å; Y75-I77 VanDerWaalsContact C-N 3.25Å; Y75-I77 PolarHBondContact O-N 3.5Å |
| 78 | K | 86.5 | Confident | 88.4 | Confident | 126 Ų | 126 | 52.2 Ų | 52.2 | 55% | 0.548 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -90.7 | -9.1 | -175.5 | -64.2 | -170.4 | 175.3 | -172 | 0 | 113.9 | T74 T80 | T74-K78 HydrophobicContact CG2-CD 3.98Å; T74-K78 HydrophobicContact CG2-CG 4.42Å; T74-K78 WeakPolarHBondContact O-CB 3.48Å; T74-K78 PolarHBondContact O-N 3.32Å; K78-T80 PolarHBondContact O-N 3.25Å; K78-T80 PolarHBondContact O-OG1 3.33Å |
| 79 | E | 83.1 | Confident | 87.9 | Confident | 124 Ų | 124 | 55.2 Ų | 55.2 | 58% | 0.579 | 28% | 0.284 | S | S | * | . | S | Bend | trans | 53.9 | 11.4 | -175.2 | -56.4 | -170.8 | 164.6 | 0 | 0 | 115.1 | Y75 | Y75-E79 WeakPolarHBondContact O-CA 3.38Å; Y75-E79 PolarHBondContact O-N 3.49Å |
| 80 | T | 83.1 | Confident | 87.4 | Confident | 64 Ų | 64 | 59.5 Ų | 59.5 | 39% | 0.393 | 30% | 0.303 | S | S | . | . | S | Bend | trans | -137.4 | 135.1 | -173.3 | 49.6 | 0 | 0 | 0 | 0 | 110 | K78 | K78-T80 PolarHBondContact O-N 3.25Å; K78-T80 PolarHBondContact O-OG1 3.33Å |
| 81 | W | 85.7 | Confident | 87.1 | Confident | 10 Ų | 10 | 57.2 Ų | 57.2 | 4% | 0.038 | 29% | 0.288 | C | S | . | . | trans | -97 | 129.2 | 176.8 | -171.9 | -96 | 0 | 0 | 0 | 111 | F71 Y75 F83 G84 F87 C88 V91 K164 C166 F167 | F71-W81 HydrophobicContact CB-CH2 4.09Å; F71-W81 HydrophobicContact CB-CZ3 4.44Å; Y75-W81 HydrophobicContact CD2-CB 3.99Å; Y75-W81 HydrophobicContact CD2-CE3 4.1Å; Y75-W81 HydrophobicContact CE2-CB 4.29Å; Y75-W81 HydrophobicContact CG-CE3 4.17Å; W81-F83 HydrophobicContact CD2-CD2 4.17Å; W81-F83 AromaticContact CE2-CD2 3.95Å; W81-F83 HydrophobicContact CE3-CD2 4.28Å; W81-F83 AromaticContact CH2-CD2 3.99Å; W81-F83 HydrophobicContact CH2-CD2 3.99Å; W81-F83 HydrophobicContact CZ2-CB 3.8Å; W81-F83 AromaticContact CZ2-CD2 3.89Å; W81-F83 HydrophobicContact CZ2-CD2 3.89Å; W81-F83 HydrophobicContact CZ2-CG 4.29Å; W81-F83 HydrophobicContact CZ3-CD2 4.18Å; W81-G84 PolarHBondContact NE1-O 2.93Å; W81-F87 HydrophobicContact CH2-CD1 4.12Å; W81-F87 HydrophobicContact CH2-CE1 4.41Å; W81-F87 HydrophobicContact CZ2-CB 4.38Å; W81-F87 AromaticContact CZ2-CD1 3.6Å; W81-F87 HydrophobicContact CZ2-CD1 3.6Å; W81-F87 HydrophobicContact CZ2-CE1 4.31Å; W81-F87 HydrophobicContact CZ2-CG 4.33Å; W81-C88 HydrophobicContact CD2-CB 4.15Å; W81-C88 HydrophobicContact CG-CB 4.34Å; W81-C88 VanDerWaalsContact CZ2-CA 3.43Å; W81-C88 HydrophobicContact CZ2-CB 3.95Å; W81-V91 HydrophobicContact CH2-CB 4.14Å; W81-V91 HydrophobicContact CH2-CG1 4.35Å; W81-V91 HydrophobicContact CH2-CG2 4.04Å; W81-K164 PolarHBondContact N-O 3.46Å; W81-C166 HydrophobicContact CB-CB 3.88Å; W81-C166 HydrophobicContact CD2-CB 3.89Å; W81-C166 HydrophobicContact CE3-CB 3.91Å; W81-C166 HydrophobicContact CG-CB 3.88Å; W81-F167 HydrophobicContact CE3-CE2 4.22Å; W81-F167 HydrophobicContact CZ3-CE2 4.04Å; W81-F167 HydrophobicContact CZ3-CZ 4Å | ||
| 82 | I | 87.8 | Confident | 86.7 | Confident | 117 Ų | 117 | 54.1 Ų | 54.1 | 60% | 0.6 | 28% | 0.275 | S | S | * | . | trans | -121 | -3.2 | -176 | 63.7 | 169.6 | 0 | 0 | 0 | 114 | ||||
| 83 | F | 86.6 | Confident | 86.4 | Confident | 80 Ų | 80 | 53.5 Ų | 53.5 | 35% | 0.351 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -95.2 | 11.5 | -172.2 | -53.9 | -77.9 | 0 | 0 | 0 | 113.5 | F71 T74 W81 F87 | F71-F83 HydrophobicContact CD1-CD1 4.27Å; F71-F83 HydrophobicContact CD1-CD2 4.21Å; F71-F83 AromaticContact CD1-CE1 3.94Å; F71-F83 HydrophobicContact CD1-CE1 3.94Å; F71-F83 AromaticContact CD1-CE2 3.89Å; F71-F83 HydrophobicContact CD1-CE2 3.89Å; F71-F83 HydrophobicContact CD1-CG 4.4Å; F71-F83 AromaticContact CD1-CZ 3.74Å; F71-F83 HydrophobicContact CD1-CZ 3.74Å; F71-F83 HydrophobicContact CE1-CD1 4.39Å; F71-F83 HydrophobicContact CE1-CE1 4.05Å; F71-F83 HydrophobicContact CE1-CZ 4.25Å; T74-F83 HydrophobicContact CG2-CE2 4.27Å; T74-F83 HydrophobicContact CG2-CZ 4.39Å; W81-F83 HydrophobicContact CD2-CD2 4.17Å; W81-F83 AromaticContact CE2-CD2 3.95Å; W81-F83 HydrophobicContact CE3-CD2 4.28Å; W81-F83 AromaticContact CH2-CD2 3.99Å; W81-F83 HydrophobicContact CH2-CD2 3.99Å; W81-F83 HydrophobicContact CZ2-CB 3.8Å; W81-F83 AromaticContact CZ2-CD2 3.89Å; W81-F83 HydrophobicContact CZ2-CD2 3.89Å; W81-F83 HydrophobicContact CZ2-CG 4.29Å; W81-F83 HydrophobicContact CZ3-CD2 4.18Å; F83-F87 HydrophobicContact CB-CB 4.43Å; F83-F87 HydrophobicContact CB-CD1 3.54Å; F83-F87 HydrophobicContact CB-CE1 4.28Å; F83-F87 HydrophobicContact CB-CG 4.42Å; F83-F87 HydrophobicContact CG-CD1 4.13Å; F83-F87 HydrophobicContact CG-CE1 4.42Å; F83-F87 WeakPolarHBondContact O-CB 3.26Å |
| 84 | G | 85.7 | Confident | 86.2 | Confident | 32 Ų | 32 | 53.5 Ų | 53.5 | 33% | 0.33 | 27% | 0.272 | S | S | . | . | trans | 79.5 | 156.9 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | W81 F87 C88 | W81-G84 PolarHBondContact NE1-O 2.93Å; G84-F87 PolarHBondContact O-N 2.97Å; G84-C88 PolarHBondContact O-N 3.44Å; G84-C88 VanDerWaalsContact O-N 3.13Å | ||
| 85 | L | 82 | Confident | 86.1 | Confident | 33 Ų | 33 | 51.5 Ų | 51.5 | 17% | 0.173 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.1 | -40.5 | -174.8 | -174.9 | 62 | 0 | 0 | 0 | 114.5 | F87 C88 R89 | L85-F87 VanDerWaalsContact C-N 3.32Å; L85-F87 PolarHBondContact O-N 3.1Å; L85-C88 WeakPolarHBondContact O-CB 3.37Å; L85-C88 PolarHBondContact O-N 3.27Å; L85-R89 WeakPolarHBondContact O-CG 3.44Å; L85-R89 PolarHBondContact O-N 2.91Å |
| 86 | P | 82.6 | Confident | 86.1 | Confident | 103 Ų | 103 | 50.8 Ų | 50.8 | 67% | 0.669 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -60.3 | -41.7 | 178.6 | -24.9 | 35.2 | 0 | 0 | 0 | 112.7 | R89 F90 | P86-R89 PolarHBondContact O-N 3.27Å; P86-F90 PolarHBondContact O-N 3.26Å |
| 87 | F | 86.8 | Confident | 86.2 | Confident | 63 Ų | 63 | 50.2 Ų | 50.2 | 28% | 0.276 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -72.4 | -34.7 | 178.8 | -166.9 | -120.6 | 0 | 0 | 0 | 112 | F71 W81 F83 G84 L85 R89 F90 V91 | F71-F87 HydrophobicContact CB-CE1 4.09Å; F71-F87 AromaticContact CD1-CE1 3.53Å; F71-F87 HydrophobicContact CD1-CE1 3.53Å; F71-F87 HydrophobicContact CD1-CZ 4.12Å; F71-F87 AromaticContact CD2-CE1 3.94Å; F71-F87 HydrophobicContact CD2-CE1 3.94Å; F71-F87 AromaticContact CD2-CZ 3.78Å; F71-F87 HydrophobicContact CD2-CZ 3.78Å; F71-F87 AromaticContact CE1-CE1 3.82Å; F71-F87 HydrophobicContact CE1-CE1 3.82Å; F71-F87 HydrophobicContact CE1-CZ 4.13Å; F71-F87 HydrophobicContact CE2-CE1 4.22Å; F71-F87 AromaticContact CE2-CZ 3.81Å; F71-F87 HydrophobicContact CE2-CZ 3.81Å; F71-F87 AromaticContact CG-CE1 3.57Å; F71-F87 HydrophobicContact CG-CE1 3.57Å; F71-F87 AromaticContact CG-CZ 3.93Å; F71-F87 HydrophobicContact CG-CZ 3.93Å; F71-F87 HydrophobicContact CZ-CE1 4.15Å; F71-F87 AromaticContact CZ-CZ 3.97Å; F71-F87 HydrophobicContact CZ-CZ 3.97Å; W81-F87 HydrophobicContact CH2-CD1 4.12Å; W81-F87 HydrophobicContact CH2-CE1 4.41Å; W81-F87 HydrophobicContact CZ2-CB 4.38Å; W81-F87 AromaticContact CZ2-CD1 3.6Å; W81-F87 HydrophobicContact CZ2-CD1 3.6Å; W81-F87 HydrophobicContact CZ2-CE1 4.31Å; W81-F87 HydrophobicContact CZ2-CG 4.33Å; F83-F87 HydrophobicContact CB-CB 4.43Å; F83-F87 HydrophobicContact CB-CD1 3.54Å; F83-F87 HydrophobicContact CB-CE1 4.28Å; F83-F87 HydrophobicContact CB-CG 4.42Å; F83-F87 HydrophobicContact CG-CD1 4.13Å; F83-F87 HydrophobicContact CG-CE1 4.42Å; F83-F87 WeakPolarHBondContact O-CB 3.26Å; G84-F87 PolarHBondContact O-N 2.97Å; L85-F87 VanDerWaalsContact C-N 3.32Å; L85-F87 PolarHBondContact O-N 3.1Å; F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 3.37Å; F87-F90 HydrophobicContact CD2-CD1 4.07Å; F87-F90 AromaticContact CE2-CD1 3.89Å; F87-F90 HydrophobicContact CE2-CD1 3.89Å; F87-F90 HydrophobicContact CE2-CE1 4.4Å; F87-F90 PolarHBondContact O-N 2.98Å; F87-V91 HydrophobicContact CD1-CG2 4.11Å; F87-V91 HydrophobicContact CD2-CG2 4.34Å; F87-V91 HydrophobicContact CE1-CG2 3.79Å; F87-V91 HydrophobicContact CE2-CG2 4.02Å; F87-V91 HydrophobicContact CG-CG2 4.39Å; F87-V91 HydrophobicContact CZ-CG2 3.74Å; F87-V91 WeakPolarHBondContact O-CG2 3.22Å; F87-V91 PolarHBondContact O-N 3.4Å |
| 88 | C | 85.5 | Confident | 86.4 | Confident | 3 Ų | 3 | 45.3 Ų | 45.3 | 2% | 0.02 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -56.3 | -48.6 | 170.5 | 166.3 | 0 | 0 | 0 | 0 | 111.5 | W81 G84 L85 F90 V91 S92 C166 F169 | W81-C88 HydrophobicContact CD2-CB 4.15Å; W81-C88 HydrophobicContact CG-CB 4.34Å; W81-C88 VanDerWaalsContact CZ2-CA 3.43Å; W81-C88 HydrophobicContact CZ2-CB 3.95Å; G84-C88 PolarHBondContact O-N 3.44Å; G84-C88 VanDerWaalsContact O-N 3.13Å; L85-C88 WeakPolarHBondContact O-CB 3.37Å; L85-C88 PolarHBondContact O-N 3.27Å; C88-F90 VanDerWaalsContact C-N 3.33Å; C88-F90 PolarHBondContact O-N 2.94Å; C88-V91 PolarHBondContact O-N 2.86Å; C88-S92 VanDerWaalsContact O-CB 3.28Å; C88-S92 WeakPolarHBondContact O-CB 3.27Å; C88-S92 PolarHBondContact O-N 3.43Å; C88-C166 WeakPolarHBondContact CA-SG 3.31Å; C88-C166 HydrophobicContact CB-CB 4Å; C88-C166 WeakPolarHBondContact CB-SG 3.47Å; C88-C166 WeakPolarHBondContact SG-CA 3.47Å; C88-C166 WeakPolarHBondContact SG-CB 3.36Å; C88-C166 CovalentContact SG-SG 2.01Å; C88-C166 PolarHBondContact SG-SG 3.16Å; C88-F169 VanDerWaalsContact SG-CZ 3.58Å |
| 89 | R | 83.6 | Confident | 86.6 | Confident | 71 Ų | 71 | 39.4 Ų | 39.4 | 27% | 0.268 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -59.4 | -45.5 | 176.8 | -69 | 176 | -177.8 | 164.8 | 4.5 | 111 | L85 P86 F87 S92 A93 Y155 G156 F169 | L85-R89 WeakPolarHBondContact O-CG 3.44Å; L85-R89 PolarHBondContact O-N 2.91Å; P86-R89 PolarHBondContact O-N 3.27Å; F87-R89 VanDerWaalsContact C-N 3.34Å; F87-R89 PolarHBondContact O-N 3.37Å; R89-S92 PolarHBondContact O-N 2.91Å; R89-A93 WeakPolarHBondContact O-CB 3.39Å; R89-A93 PolarHBondContact O-N 2.88Å; R89-Y155 HydrophobicContact CB-CD1 4.49Å; R89-Y155 WeakPolarHBondContact CD-O 3.45Å; R89-Y155 PolarHBondContact NE-O 3.43Å; R89-G156 PolarHBondContact NE-O 2.95Å; R89-G156 PolarHBondContact NH2-O 3.36Å; R89-F169 HydrophobicContact CG-CE1 4.28Å; R89-F169 HydrophobicContact CG-CZ 4.08Å |
| 90 | F | 85.8 | Confident | 86.9 | Confident | 91 Ų | 91 | 34.6 Ų | 34.6 | 40% | 0.399 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.1 | -52.8 | 177.9 | 176.1 | -102.4 | 0 | 0 | 0 | 112.6 | T68 P86 F87 C88 S92 A93 M94 | T68-F90 HydrophobicContact CG2-CE1 3.83Å; P86-F90 PolarHBondContact O-N 3.26Å; F87-F90 HydrophobicContact CD2-CD1 4.07Å; F87-F90 AromaticContact CE2-CD1 3.89Å; F87-F90 HydrophobicContact CE2-CD1 3.89Å; F87-F90 HydrophobicContact CE2-CE1 4.4Å; F87-F90 PolarHBondContact O-N 2.98Å; C88-F90 VanDerWaalsContact C-N 3.33Å; C88-F90 PolarHBondContact O-N 2.94Å; F90-S92 VanDerWaalsContact C-N 3.27Å; F90-S92 PolarHBondContact O-N 3.24Å; F90-A93 PolarHBondContact O-N 3.07Å; F90-M94 HydrophobicContact CZ-SD 4.48Å; F90-M94 WeakPolarHBondContact O-CB 3.42Å; F90-M94 PolarHBondContact O-N 3.44Å |
| 91 | V | 88.9 | Confident | 87.3 | Confident | 3 Ų | 3 | 32 Ų | 32 | 2% | 0.018 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62.2 | -37.3 | -179.3 | 173.4 | 0 | 0 | 0 | 0 | 111.3 | F71 R72 W81 F87 C88 M94 F167 | F71-V91 HydrophobicContact CB-CG2 4.36Å; R72-V91 HydrophobicContact CB-CG1 4.26Å; W81-V91 HydrophobicContact CH2-CB 4.14Å; W81-V91 HydrophobicContact CH2-CG1 4.35Å; W81-V91 HydrophobicContact CH2-CG2 4.04Å; F87-V91 HydrophobicContact CD1-CG2 4.11Å; F87-V91 HydrophobicContact CD2-CG2 4.34Å; F87-V91 HydrophobicContact CE1-CG2 3.79Å; F87-V91 HydrophobicContact CE2-CG2 4.02Å; F87-V91 HydrophobicContact CG-CG2 4.39Å; F87-V91 HydrophobicContact CZ-CG2 3.74Å; F87-V91 WeakPolarHBondContact O-CG2 3.22Å; F87-V91 PolarHBondContact O-N 3.4Å; C88-V91 PolarHBondContact O-N 2.86Å; V91-M94 PolarHBondContact O-N 3.45Å; V91-F167 HydrophobicContact CG1-CE1 4.01Å; V91-F167 HydrophobicContact CG1-CZ 3.87Å |
| 92 | S | 84.7 | Confident | 87.6 | Confident | 1 Ų | 1 | 31.6 Ų | 31.6 | 1% | 0.007 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -71 | -39.3 | 176.5 | -169.6 | 0 | 0 | 0 | 0 | 113.1 | C88 R89 F90 M94 Y155 F167 | C88-S92 VanDerWaalsContact O-CB 3.28Å; C88-S92 WeakPolarHBondContact O-CB 3.27Å; C88-S92 PolarHBondContact O-N 3.43Å; R89-S92 PolarHBondContact O-N 2.91Å; F90-S92 VanDerWaalsContact C-N 3.27Å; F90-S92 PolarHBondContact O-N 3.24Å; S92-M94 VanDerWaalsContact C-N 3.3Å; S92-Y155 WeakPolarHBondContact OG-CE1 3.32Å; S92-Y155 VanDerWaalsContact OG-CZ 3.25Å; S92-Y155 PolarHBondContact OG-OH 3.43Å; S92-F167 VanDerWaalsContact CB-CD1 3.46Å; S92-F167 WeakPolarHBondContact OG-CD1 3.17Å |
| 93 | A | 85.4 | Confident | 87.7 | Confident | 1 Ų | 1 | 26.2 Ų | 26.2 | 1% | 0.008 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.6 | -35.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | R89 F90 L95 H96 I97 V151 V152 | R89-A93 WeakPolarHBondContact O-CB 3.39Å; R89-A93 PolarHBondContact O-N 2.88Å; F90-A93 PolarHBondContact O-N 3.07Å; A93-L95 PolarHBondContact O-N 2.9Å; A93-L95 VanDerWaalsContact O-N 3.17Å; A93-H96 PolarHBondContact O-N 2.89Å; A93-I97 HydrophobicContact CB-CD1 4.07Å; A93-I97 WeakPolarHBondContact O-CG1 3.24Å; A93-I97 PolarHBondContact O-N 2.9Å; A93-V151 HydrophobicContact CB-CG1 3.45Å; A93-V151 VanDerWaalsContact CB-CG1 3.45Å; A93-V152 HydrophobicContact CB-CG2 4.48Å |
| 94 | M | 89.9 | Confident | 87.8 | Confident | 9 Ų | 9 | 24.5 Ų | 24.5 | 4% | 0.044 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.3 | -33.7 | -173.8 | -170.1 | 61.7 | -147.5 | 0 | 0 | 112.9 | V64 F65 T68 F90 V91 S92 I97 H98 | V64-M94 HydrophobicContact CB-CE 4.2Å; V64-M94 HydrophobicContact CG1-CE 3.67Å; V64-M94 HydrophobicContact CG1-SD 4.07Å; F65-M94 HydrophobicContact CB-CE 4Å; F65-M94 HydrophobicContact CD2-CG 4.13Å; T68-M94 HydrophobicContact CG2-CB 4.15Å; T68-M94 HydrophobicContact CG2-CG 3.76Å; F90-M94 HydrophobicContact CZ-SD 4.48Å; F90-M94 WeakPolarHBondContact O-CB 3.42Å; F90-M94 PolarHBondContact O-N 3.44Å; V91-M94 PolarHBondContact O-N 3.45Å; S92-M94 VanDerWaalsContact C-N 3.3Å; M94-I97 HydrophobicContact CE-CG2 4.33Å; M94-I97 PolarHBondContact O-N 3.34Å; M94-I97 HydrophobicContact SD-CB 4.44Å; M94-I97 HydrophobicContact SD-CG2 4.32Å; M94-H98 HydrophobicContact CE-CB 4.29Å; M94-H98 WeakPolarHBondContact O-CB 3.37Å; M94-H98 PolarHBondContact O-N 3.36Å |
| 95 | L | 89.9 | Confident | 87.9 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -66.6 | -40.2 | 177 | -176.7 | 58.2 | 0 | 0 | 0 | 112.5 | Y24 F65 A93 M99 L270 A274 | Y24-L95 VanDerWaalsContact OH-CD2 3.32Å; Y24-L95 WeakPolarHBondContact OH-CD2 3.27Å; F65-L95 HydrophobicContact CE2-CB 4.09Å; F65-L95 HydrophobicContact CE2-CD1 3.47Å; F65-L95 VanDerWaalsContact CE2-CD1 3.47Å; F65-L95 HydrophobicContact CE2-CG 4.36Å; F65-L95 HydrophobicContact CZ-CD1 3.56Å; A93-L95 PolarHBondContact O-N 2.9Å; A93-L95 VanDerWaalsContact O-N 3.17Å; L95-M99 WeakPolarHBondContact O-CB 3.27Å; L95-M99 PolarHBondContact O-N 3.26Å; L95-L270 HydrophobicContact CD2-CB 4.49Å; L95-L270 HydrophobicContact CD2-CD1 4.33Å; L95-L270 HydrophobicContact CD2-CD2 3.78Å; L95-L270 HydrophobicContact CD2-CG 3.52Å; L95-L270 HydrophobicContact CG-CD1 4.18Å; L95-L270 HydrophobicContact CG-CD2 4.29Å; L95-L270 HydrophobicContact CG-CG 3.92Å; L95-A274 HydrophobicContact CD1-CB 3.82Å |
| 96 | H | 88.1 | Confident | 88.3 | Confident | 12 Ų | 12 | 21.6 Ų | 21.6 | 6% | 0.056 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -68.4 | -44.7 | 174.5 | -68.4 | 84.8 | 0 | 0 | 0 | 110.9 | A93 H98 M99 Y100 V151 Y241 L270 | A93-H96 PolarHBondContact O-N 2.89Å; H96-H98 VanDerWaalsContact C-N 3.31Å; H96-H98 PolarHBondContact O-N 3.48Å; H96-M99 PolarHBondContact O-N 3.27Å; H96-Y100 HydrophobicContact CB-CD2 4.49Å; H96-Y100 HydrophobicContact CB-CE2 4.28Å; H96-Y100 WeakPolarHBondContact O-CD2 3.43Å; H96-Y100 PolarHBondContact O-N 3.11Å; H96-V151 HydrophobicContact CB-CG1 4.49Å; H96-V151 HydrophobicContact CB-CG2 4.47Å; H96-Y241 PolarHBondContact NE2-OH 2.59Å; H96-L270 WeakPolarHBondContact CE1-CD2 3.3Å |
| 97 | I | 89.2 | Confident | 88.6 | Confident | 9 Ų | 9 | 17.8 Ų | 17.8 | 5% | 0.046 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -57.7 | -46.8 | 176.8 | -67.7 | 165.6 | 0 | 0 | 0 | 110.1 | A93 M94 Y100 L101 V147 V148 V151 | A93-I97 HydrophobicContact CB-CD1 4.07Å; A93-I97 WeakPolarHBondContact O-CG1 3.24Å; A93-I97 PolarHBondContact O-N 2.9Å; M94-I97 HydrophobicContact CE-CG2 4.33Å; M94-I97 PolarHBondContact O-N 3.34Å; M94-I97 HydrophobicContact SD-CB 4.44Å; M94-I97 HydrophobicContact SD-CG2 4.32Å; I97-Y100 PolarHBondContact O-N 2.76Å; I97-L101 HydrophobicContact CG2-CD1 3.49Å; I97-L101 VanDerWaalsContact CG2-CD1 3.49Å; I97-L101 HydrophobicContact CG2-CG 4.33Å; I97-L101 VanDerWaalsContact O-CB 3.28Å; I97-L101 WeakPolarHBondContact O-CB 3.35Å; I97-L101 WeakPolarHBondContact O-CG 3.44Å; I97-L101 PolarHBondContact O-N 3.2Å; I97-V147 HydrophobicContact CB-CG1 4.47Å; I97-V147 HydrophobicContact CG1-CG1 4.16Å; I97-V148 HydrophobicContact CD1-CG2 4.31Å; I97-V151 HydrophobicContact CG1-CB 4.31Å; I97-V151 HydrophobicContact CG1-CG1 4.4Å; I97-V151 HydrophobicContact CG1-CG2 4.29Å |
| 98 | H | 92.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -58.2 | -50.9 | 176.5 | 172.2 | -99.9 | 0 | 0 | 0 | 112.1 | H62 F65 M94 H96 Y100 L101 T102 S276 C277 | H62-H98 AromaticContact CE1-NE2 3.64Å; H62-H98 AromaticContact ND1-NE2 3.18Å; H62-H98 PolarHBondContact ND1-NE2 3.03Å; H62-H98 VanDerWaalsContact ND1-NE2 3.18Å; F65-H98 HydrophobicContact CB-CB 3.93Å; F65-H98 VanDerWaalsContact CB-CD2 3.42Å; F65-H98 WeakPolarHBondContact CB-CD2 3.1Å; F65-H98 HydrophobicContact CD2-CB 3.62Å; F65-H98 AromaticContact CD2-CG 3.76Å; F65-H98 HydrophobicContact CE2-CB 4.38Å; F65-H98 HydrophobicContact CG-CB 3.82Å; F65-H98 AromaticContact CG-CD2 3.68Å; F65-H98 AromaticContact CG-CG 3.51Å; M94-H98 HydrophobicContact CE-CB 4.29Å; M94-H98 WeakPolarHBondContact O-CB 3.37Å; M94-H98 PolarHBondContact O-N 3.36Å; H96-H98 VanDerWaalsContact C-N 3.31Å; H96-H98 PolarHBondContact O-N 3.48Å; H98-Y100 PolarHBondContact O-N 3.01Å; H98-L101 PolarHBondContact O-N 3.03Å; H98-T102 PolarHBondContact NE2-OG1 3.47Å; H98-T102 VanDerWaalsContact O-CB 3.27Å; H98-T102 WeakPolarHBondContact O-CB 3.39Å; H98-T102 PolarHBondContact O-N 2.97Å; H98-T102 PolarHBondContact O-OG1 2.89Å; H98-S276 PolarHBondContact CE1-OG 2.79Å; H98-C277 PolarHBondContact CE1-SG 3.27Å; H98-C277 PolarHBondContact NE2-SG 2.98Å; H98-C277 VanDerWaalsContact NE2-SG 3.4Å |
| 99 | M | 91.9 | Very high | 88.3 | Confident | 1 Ų | 1 | 17.4 Ų | 17.4 | 1% | 0.005 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -56.9 | -50.2 | 178.3 | 179.3 | -165.8 | 59.1 | 0 | 0 | 111.4 | L95 H96 F103 F238 Y241 T273 | L95-M99 WeakPolarHBondContact O-CB 3.27Å; L95-M99 PolarHBondContact O-N 3.26Å; H96-M99 PolarHBondContact O-N 3.27Å; M99-F103 WeakPolarHBondContact O-CB 3.3Å; M99-F103 PolarHBondContact O-N 2.99Å; M99-F238 HydrophobicContact CG-CD1 3.91Å; M99-F238 HydrophobicContact CG-CE1 4.13Å; M99-F238 HydrophobicContact CG-CG 4.46Å; M99-Y241 HydrophobicContact CE-CD1 4.17Å; M99-Y241 HydrophobicContact CE-CE1 3.8Å; M99-Y241 HydrophobicContact SD-CD1 3.48Å; M99-Y241 WeakPolarHBondContact SD-CD1 3.42Å; M99-Y241 HydrophobicContact SD-CE1 3.71Å; M99-T273 HydrophobicContact CG-CG2 4.11Å; M99-T273 HydrophobicContact SD-CG2 3.69Å |
| 100 | Y | 89.6 | Confident | 88.5 | Confident | 24 Ų | 24 | 14 Ų | 14 | 9% | 0.094 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -69.6 | -40.9 | -177.5 | -67.7 | -55.7 | 0 | 0 | 0 | 112.9 | H96 I97 H98 F103 L104 V147 I185 V189 | H96-Y100 HydrophobicContact CB-CD2 4.49Å; H96-Y100 HydrophobicContact CB-CE2 4.28Å; H96-Y100 WeakPolarHBondContact O-CD2 3.43Å; H96-Y100 PolarHBondContact O-N 3.11Å; I97-Y100 PolarHBondContact O-N 2.76Å; H98-Y100 PolarHBondContact O-N 3.01Å; Y100-F103 PolarHBondContact O-N 3.46Å; Y100-L104 WeakPolarHBondContact O-CB 3.37Å; Y100-L104 VanDerWaalsContact O-CG 3.28Å; Y100-L104 WeakPolarHBondContact O-CG 3.3Å; Y100-L104 PolarHBondContact O-N 3.01Å; Y100-V147 HydrophobicContact CD2-CG1 4.31Å; Y100-I185 HydrophobicContact CD1-CG2 4.23Å; Y100-I185 HydrophobicContact CE1-CG2 3.29Å; Y100-I185 HydrophobicContact CE2-CG2 4.47Å; Y100-I185 VanDerWaalsContact CZ-CG2 3.45Å; Y100-I185 VanDerWaalsContact OH-CG2 3.32Å; Y100-I185 WeakPolarHBondContact OH-CG2 3.18Å; Y100-V189 HydrophobicContact CD1-CG2 4.39Å; Y100-V189 HydrophobicContact CE1-CG2 4.14Å |
| 101 | L | 89.9 | Confident | 88.4 | Confident | 10 Ų | 10 | 12.6 Ų | 12.6 | 5% | 0.052 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -59.6 | -50.3 | 174.4 | -83.1 | 164.6 | 0 | 0 | 0 | 110.9 | V61 I97 H98 F103 L104 F105 W140 V143 | V61-L101 HydrophobicContact CG1-CB 3.84Å; V61-L101 HydrophobicContact CG1-CD1 4.45Å; V61-L101 HydrophobicContact CG2-CB 3.98Å; V61-L101 HydrophobicContact CG2-CD1 4.29Å; V61-L101 HydrophobicContact CG2-CD2 4.5Å; I97-L101 HydrophobicContact CG2-CD1 3.49Å; I97-L101 VanDerWaalsContact CG2-CD1 3.49Å; I97-L101 HydrophobicContact CG2-CG 4.33Å; I97-L101 VanDerWaalsContact O-CB 3.28Å; I97-L101 WeakPolarHBondContact O-CB 3.35Å; I97-L101 WeakPolarHBondContact O-CG 3.44Å; I97-L101 PolarHBondContact O-N 3.2Å; H98-L101 PolarHBondContact O-N 3.03Å; L101-F103 VanDerWaalsContact C-N 3.33Å; L101-F103 PolarHBondContact O-N 3.47Å; L101-L104 PolarHBondContact O-N 3.38Å; L101-F105 HydrophobicContact CD2-CE2 3.98Å; L101-F105 WeakPolarHBondContact O-CD2 3.44Å; L101-F105 PolarHBondContact O-N 3.41Å; L101-W140 HydrophobicContact CD1-CZ3 4.36Å; L101-W140 HydrophobicContact CD2-CE3 4.31Å; L101-W140 HydrophobicContact CD2-CZ3 3.99Å; L101-V143 HydrophobicContact CD2-CB 4.05Å; L101-V143 HydrophobicContact CD2-CG1 3.29Å; L101-V143 HydrophobicContact CG-CG1 4.01Å |
| 102 | T | 92.3 | Very high | 88 | Confident | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -59.9 | -45.2 | -179.4 | -55 | 0 | 0 | 0 | 0 | 110.8 | L58 V61 H98 L104 F105 Y106 F238 | L58-T102 HydrophobicContact CD2-CG2 4.01Å; V61-T102 WeakPolarHBondContact CG1-OG1 3.13Å; H98-T102 PolarHBondContact NE2-OG1 3.47Å; H98-T102 VanDerWaalsContact O-CB 3.27Å; H98-T102 WeakPolarHBondContact O-CB 3.39Å; H98-T102 PolarHBondContact O-N 2.97Å; H98-T102 PolarHBondContact O-OG1 2.89Å; T102-L104 PolarHBondContact O-N 3.01Å; T102-F105 PolarHBondContact O-N 3.49Å; T102-Y106 HydrophobicContact CG2-CD2 4.27Å; T102-Y106 HydrophobicContact CG2-CE1 3.99Å; T102-Y106 HydrophobicContact CG2-CE2 3.65Å; T102-Y106 VanDerWaalsContact CG2-CZ 3.47Å; T102-Y106 PolarHBondContact O-N 3.16Å; T102-F238 HydrophobicContact CG2-CE2 4.4Å; T102-F238 HydrophobicContact CG2-CZ 3.83Å |
| 103 | F | 91.4 | Very high | 87.8 | Confident | 4 Ų | 4 | 17.5 Ų | 17.5 | 2% | 0.018 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -57.2 | -50.2 | 174.7 | 176.5 | -105.4 | 0 | 0 | 0 | 112.4 | M99 Y100 L101 F105 Y106 V107 V189 I192 I234 F238 | M99-F103 WeakPolarHBondContact O-CB 3.3Å; M99-F103 PolarHBondContact O-N 2.99Å; Y100-F103 PolarHBondContact O-N 3.46Å; L101-F103 VanDerWaalsContact C-N 3.33Å; L101-F103 PolarHBondContact O-N 3.47Å; F103-F105 VanDerWaalsContact C-N 3.33Å; F103-F105 PolarHBondContact O-N 2.97Å; F103-Y106 PolarHBondContact O-N 3.46Å; F103-V107 HydrophobicContact CD1-CG2 4.2Å; F103-V107 HydrophobicContact CD2-CG2 4.47Å; F103-V107 HydrophobicContact CE1-CG2 3.85Å; F103-V107 HydrophobicContact CE2-CG2 4.14Å; F103-V107 HydrophobicContact CZ-CG2 3.83Å; F103-V107 VanDerWaalsContact O-CG2 3.26Å; F103-V107 WeakPolarHBondContact O-CG2 3.08Å; F103-V107 PolarHBondContact O-N 3.42Å; F103-V189 HydrophobicContact CD1-CG1 4.49Å; F103-V189 HydrophobicContact CD1-CG2 4.26Å; F103-V189 HydrophobicContact CD2-CG1 4.26Å; F103-V189 HydrophobicContact CE1-CB 4.33Å; F103-V189 HydrophobicContact CE1-CG1 4.16Å; F103-V189 HydrophobicContact CE1-CG2 4.04Å; F103-V189 HydrophobicContact CE2-CG1 3.92Å; F103-V189 HydrophobicContact CZ-CB 4.3Å; F103-V189 HydrophobicContact CZ-CG1 3.85Å; F103-V189 HydrophobicContact CZ-CG2 4.5Å; F103-I192 HydrophobicContact CE1-CB 4.39Å; F103-I192 HydrophobicContact CE1-CG2 4.16Å; F103-I192 HydrophobicContact CZ-CB 3.89Å; F103-I192 HydrophobicContact CZ-CG2 3.66Å; F103-I234 HydrophobicContact CD2-CD1 4.37Å; F103-I234 HydrophobicContact CD2-CG1 4.33Å; F103-I234 HydrophobicContact CD2-CG2 4.24Å; F103-I234 HydrophobicContact CE2-CD1 4.37Å; F103-I234 HydrophobicContact CE2-CG2 4.01Å; F103-F238 HydrophobicContact CB-CD2 4.13Å; F103-F238 HydrophobicContact CB-CE2 4Å; F103-F238 HydrophobicContact CD2-CD2 4Å; F103-F238 HydrophobicContact CD2-CE2 4.47Å |
| 104 | L | 87.9 | Confident | 87.7 | Confident | 45 Ų | 45 | 18.1 Ų | 18.1 | 24% | 0.236 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -62.5 | -39.8 | -179.8 | -70.9 | 170.6 | 0 | 0 | 0 | 112.1 | Y100 L101 T102 V107 V108 V143 | Y100-L104 WeakPolarHBondContact O-CB 3.37Å; Y100-L104 VanDerWaalsContact O-CG 3.28Å; Y100-L104 WeakPolarHBondContact O-CG 3.3Å; Y100-L104 PolarHBondContact O-N 3.01Å; L101-L104 PolarHBondContact O-N 3.38Å; T102-L104 PolarHBondContact O-N 3.01Å; L104-V107 PolarHBondContact O-N 3.34Å; L104-V108 WeakPolarHBondContact O-CG2 3.26Å; L104-V108 PolarHBondContact O-N 2.94Å; L104-V143 HydrophobicContact CD1-CB 4.35Å; L104-V143 HydrophobicContact CD1-CG1 3.65Å; L104-V143 HydrophobicContact CD1-CG2 3.65Å |
| 105 | F | 87.4 | Confident | 87.2 | Confident | 3 Ų | 3 | 21.9 Ų | 21.9 | 1% | 0.013 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -64.4 | -40.7 | 174.4 | -77.8 | -61.3 | 0 | 0 | 0 | 112.2 | N57 L58 V61 L101 T102 F103 V108 I109 L139 W140 | N57-F105 HydrophobicContact CB-CD1 3.74Å; N57-F105 HydrophobicContact CB-CE1 3.4Å; N57-F105 HydrophobicContact CB-CE2 4.23Å; N57-F105 HydrophobicContact CB-CG 4.31Å; N57-F105 HydrophobicContact CB-CZ 3.69Å; N57-F105 WeakPolarHBondContact ND2-CE1 3.26Å; L58-F105 HydrophobicContact CD2-CB 3.71Å; L58-F105 HydrophobicContact CD2-CG 4.48Å; L58-F105 HydrophobicContact CG-CB 4.13Å; V61-F105 HydrophobicContact CG2-CD2 3.81Å; V61-F105 HydrophobicContact CG2-CE2 3.53Å; L101-F105 HydrophobicContact CD2-CE2 3.98Å; L101-F105 WeakPolarHBondContact O-CD2 3.44Å; L101-F105 PolarHBondContact O-N 3.41Å; T102-F105 PolarHBondContact O-N 3.49Å; F103-F105 VanDerWaalsContact C-N 3.33Å; F103-F105 PolarHBondContact O-N 2.97Å; F105-V108 PolarHBondContact O-N 2.92Å; F105-I109 VanDerWaalsContact O-CG1 3.24Å; F105-I109 WeakPolarHBondContact O-CG1 3.35Å; F105-I109 PolarHBondContact O-N 3.06Å; F105-L139 HydrophobicContact CD1-CD2 4.04Å; F105-L139 HydrophobicContact CE1-CD2 3.68Å; F105-L139 HydrophobicContact CZ-CD2 4.44Å; F105-W140 HydrophobicContact CE2-CH2 4.22Å; F105-W140 AromaticContact CE2-CZ2 3.86Å; F105-W140 HydrophobicContact CE2-CZ2 3.86Å; F105-W140 AromaticContact CZ-CD2 3.94Å; F105-W140 HydrophobicContact CZ-CD2 3.94Å; F105-W140 AromaticContact CZ-CE2 3.47Å; F105-W140 VanDerWaalsContact CZ-CE2 3.47Å; F105-W140 HydrophobicContact CZ-CG 4.32Å; F105-W140 HydrophobicContact CZ-CH2 4.46Å; F105-W140 AromaticContact CZ-CZ2 3.77Å; F105-W140 HydrophobicContact CZ-CZ2 3.77Å; F105-W140 AromaticContact CZ-NE1 3.55Å |
| 106 | Y | 90.1 | Very high | 86.6 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -61.8 | -43.1 | 173.1 | -66.5 | -19.1 | 0 | 0 | 0 | 112.5 | L58 T102 F103 V108 I109 L110 F230 V233 I234 F238 D279 | L58-Y106 HydrophobicContact CD1-CD1 4.01Å; L58-Y106 HydrophobicContact CD1-CE1 3.7Å; L58-Y106 HydrophobicContact CD2-CD1 4.03Å; L58-Y106 HydrophobicContact CD2-CE1 3.72Å; L58-Y106 HydrophobicContact CG-CE1 4.39Å; T102-Y106 HydrophobicContact CG2-CD2 4.27Å; T102-Y106 HydrophobicContact CG2-CE1 3.99Å; T102-Y106 HydrophobicContact CG2-CE2 3.65Å; T102-Y106 VanDerWaalsContact CG2-CZ 3.47Å; T102-Y106 PolarHBondContact O-N 3.16Å; F103-Y106 PolarHBondContact O-N 3.46Å; Y106-V108 VanDerWaalsContact C-N 3.32Å; Y106-V108 PolarHBondContact O-N 3.4Å; Y106-I109 HydrophobicContact CD1-CD1 4.47Å; Y106-I109 PolarHBondContact O-N 2.81Å; Y106-L110 WeakPolarHBondContact O-CB 3.28Å; Y106-L110 VanDerWaalsContact O-CG 3.29Å; Y106-L110 WeakPolarHBondContact O-CG 3.5Å; Y106-L110 PolarHBondContact O-N 3.23Å; Y106-F230 AromaticContact CD1-CD1 3.71Å; Y106-F230 HydrophobicContact CD1-CD1 3.71Å; Y106-F230 HydrophobicContact CD1-CE1 4.26Å; Y106-F230 HydrophobicContact CD1-CG 4.43Å; Y106-F230 AromaticContact CE1-CD1 3.56Å; Y106-F230 HydrophobicContact CE1-CD1 3.56Å; Y106-F230 AromaticContact CE1-CE1 3.91Å; Y106-F230 HydrophobicContact CE1-CE1 3.91Å; Y106-F230 HydrophobicContact CG-CD1 4.42Å; Y106-V233 HydrophobicContact CE2-CB 4.21Å; Y106-V233 HydrophobicContact CE2-CG1 3.76Å; Y106-I234 HydrophobicContact CD2-CD1 4.17Å; Y106-I234 HydrophobicContact CD2-CG1 3.69Å; Y106-I234 HydrophobicContact CE2-CG1 4.47Å; Y106-F238 AromaticContact CD2-CE2 3.92Å; Y106-F238 HydrophobicContact CD2-CE2 3.92Å; Y106-F238 AromaticContact CE2-CE2 3.84Å; Y106-F238 HydrophobicContact CE2-CE2 3.84Å; Y106-F238 HydrophobicContact CE2-CZ 4.11Å; Y106-D279 VanDerWaalsContact OH-CB 3.26Å; Y106-D279 WeakPolarHBondContact OH-CB 3.1Å; Y106-D279 PolarHBondContact OH-OD2 3.44Å |
| 107 | V | 88.3 | Confident | 86.1 | Confident | 23 Ų | 23 | 28.3 Ų | 28.3 | 14% | 0.139 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -56.8 | -48.3 | 175.3 | 175.2 | 0 | 0 | 0 | 0 | 110.2 | F103 L104 I109 L110 V111 I192 L196 | F103-V107 HydrophobicContact CD1-CG2 4.2Å; F103-V107 HydrophobicContact CD2-CG2 4.47Å; F103-V107 HydrophobicContact CE1-CG2 3.85Å; F103-V107 HydrophobicContact CE2-CG2 4.14Å; F103-V107 HydrophobicContact CZ-CG2 3.83Å; F103-V107 VanDerWaalsContact O-CG2 3.26Å; F103-V107 WeakPolarHBondContact O-CG2 3.08Å; F103-V107 PolarHBondContact O-N 3.42Å; L104-V107 PolarHBondContact O-N 3.34Å; V107-I109 VanDerWaalsContact C-N 3.35Å; V107-I109 PolarHBondContact O-N 3.18Å; V107-L110 PolarHBondContact O-N 3.11Å; V107-V111 HydrophobicContact CG1-CG2 4.13Å; V107-V111 WeakPolarHBondContact O-CB 3.18Å; V107-V111 VanDerWaalsContact O-CG2 3.27Å; V107-V111 WeakPolarHBondContact O-CG2 3.5Å; V107-V111 PolarHBondContact O-N 2.98Å; V107-I192 HydrophobicContact CG1-CG2 4.08Å; V107-I192 HydrophobicContact CG2-CG2 3.56Å; V107-L196 HydrophobicContact CB-CD1 4.35Å; V107-L196 HydrophobicContact CG1-CD1 4.49Å; V107-L196 HydrophobicContact CG2-CD1 3.83Å |
| 108 | V | 83.8 | Confident | 85.6 | Confident | 54 Ų | 54 | 32.6 Ų | 32.6 | 33% | 0.327 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -62.6 | -41.4 | 179.5 | 169.8 | 0 | 0 | 0 | 0 | 111.7 | L104 F105 Y106 T112 L139 | L104-V108 WeakPolarHBondContact O-CG2 3.26Å; L104-V108 PolarHBondContact O-N 2.94Å; F105-V108 PolarHBondContact O-N 2.92Å; Y106-V108 VanDerWaalsContact C-N 3.32Å; Y106-V108 PolarHBondContact O-N 3.4Å; V108-T112 WeakPolarHBondContact O-CB 3.37Å; V108-T112 PolarHBondContact O-N 3.49Å; V108-T112 PolarHBondContact O-OG1 3.34Å; V108-L139 HydrophobicContact CB-CD2 4.47Å; V108-L139 HydrophobicContact CG1-CD2 4.48Å; V108-L139 HydrophobicContact CG2-CD1 4.47Å; V108-L139 HydrophobicContact CG2-CD2 3.78Å |
| 109 | I | 82.9 | Confident | 84.5 | Confident | 5 Ų | 5 | 38.1 Ų | 38.1 | 3% | 0.026 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -59.7 | -51.8 | 175.5 | -70.5 | 164.4 | 0 | 0 | 0 | 110.3 | A54 L58 F105 Y106 V107 T112 R113 F230 | A54-I109 HydrophobicContact CB-CD1 3.79Å; A54-I109 HydrophobicContact CB-CG1 3.34Å; L58-I109 HydrophobicContact CD1-CD1 3.63Å; L58-I109 HydrophobicContact CG-CD1 4.46Å; F105-I109 VanDerWaalsContact O-CG1 3.24Å; F105-I109 WeakPolarHBondContact O-CG1 3.35Å; F105-I109 PolarHBondContact O-N 3.06Å; Y106-I109 HydrophobicContact CD1-CD1 4.47Å; Y106-I109 PolarHBondContact O-N 2.81Å; V107-I109 VanDerWaalsContact C-N 3.35Å; V107-I109 PolarHBondContact O-N 3.18Å; I109-T112 PolarHBondContact O-N 3.39Å; I109-R113 WeakPolarHBondContact O-CB 3.25Å; I109-R113 VanDerWaalsContact O-CG 3.24Å; I109-R113 WeakPolarHBondContact O-CG 3.18Å; I109-R113 PolarHBondContact O-N 3.25Å; I109-F230 HydrophobicContact CG2-CD2 4.36Å; I109-F230 HydrophobicContact CG2-CE2 4.32Å |
| 110 | L | 87.4 | Confident | 82.8 | Confident | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.7 | -48.1 | -176.1 | -69 | 167.9 | 0 | 0 | 0 | 111.6 | Y106 V107 T112 R113 Y114 L196 N227 F230 I231 I234 | Y106-L110 WeakPolarHBondContact O-CB 3.28Å; Y106-L110 VanDerWaalsContact O-CG 3.29Å; Y106-L110 WeakPolarHBondContact O-CG 3.5Å; Y106-L110 PolarHBondContact O-N 3.23Å; V107-L110 PolarHBondContact O-N 3.11Å; L110-T112 VanDerWaalsContact C-N 3.33Å; L110-T112 PolarHBondContact O-N 3.38Å; L110-R113 WeakPolarHBondContact O-CB 3.22Å; L110-R113 PolarHBondContact O-N 3.07Å; L110-R113 VanDerWaalsContact O-N 3.09Å; L110-Y114 HydrophobicContact CB-CE1 4.4Å; L110-Y114 HydrophobicContact CB-CE2 4.48Å; L110-Y114 HydrophobicContact CD2-CE1 4.42Å; L110-Y114 WeakPolarHBondContact O-CD1 3.32Å; L110-Y114 PolarHBondContact O-N 2.9Å; L110-L196 HydrophobicContact CB-CD2 3.89Å; L110-L196 HydrophobicContact CD1-CB 4.49Å; L110-L196 HydrophobicContact CD1-CD1 3.83Å; L110-L196 HydrophobicContact CD1-CD2 4.32Å; L110-L196 HydrophobicContact CD1-CG 4.46Å; L110-N227 HydrophobicContact CD2-CB 3.65Å; L110-F230 HydrophobicContact CD2-CB 4.44Å; L110-I231 HydrophobicContact CD1-CD1 4.35Å; L110-I231 HydrophobicContact CD1-CG1 3.57Å; L110-I231 HydrophobicContact CD2-CD1 4.16Å; L110-I231 HydrophobicContact CD2-CG1 3.98Å; L110-I231 HydrophobicContact CG-CG1 4.45Å; L110-I234 HydrophobicContact CD1-CD1 4.19Å |
| 111 | V | 84.9 | Confident | 81 | Confident | 61 Ų | 61 | 55.1 Ų | 55.1 | 37% | 0.37 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 177.1 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | V107 R113 Y114 L115 L196 | V107-V111 HydrophobicContact CG1-CG2 4.13Å; V107-V111 WeakPolarHBondContact O-CB 3.18Å; V107-V111 VanDerWaalsContact O-CG2 3.27Å; V107-V111 WeakPolarHBondContact O-CG2 3.5Å; V107-V111 PolarHBondContact O-N 2.98Å; V111-R113 VanDerWaalsContact C-N 3.28Å; V111-R113 PolarHBondContact O-N 3.01Å; V111-Y114 PolarHBondContact O-N 3.09Å; V111-L115 HydrophobicContact CG1-CD1 4.02Å; V111-L115 HydrophobicContact CG1-CG 4.32Å; V111-L115 WeakPolarHBondContact O-CB 3.24Å; V111-L115 VanDerWaalsContact O-CG 3.28Å; V111-L115 WeakPolarHBondContact O-CG 3.44Å; V111-L115 PolarHBondContact O-N 3.28Å; V111-L196 HydrophobicContact CG2-CD2 4.1Å |
| 112 | T | 79.1 | Confident | 79.1 | Confident | 33 Ų | 33 | 61.2 Ų | 61.2 | 20% | 0.202 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -59 | -42.8 | 175.9 | -61.7 | 0 | 0 | 0 | 0 | 111 | V50 V108 I109 L110 L115 I116 | V50-T112 HydrophobicContact CB-CG2 4.29Å; V50-T112 HydrophobicContact CG1-CG2 3.76Å; V108-T112 WeakPolarHBondContact O-CB 3.37Å; V108-T112 PolarHBondContact O-N 3.49Å; V108-T112 PolarHBondContact O-OG1 3.34Å; I109-T112 PolarHBondContact O-N 3.39Å; L110-T112 VanDerWaalsContact C-N 3.33Å; L110-T112 PolarHBondContact O-N 3.38Å; T112-L115 PolarHBondContact O-N 3.18Å; T112-I116 HydrophobicContact CG2-CD1 3.9Å; T112-I116 VanDerWaalsContact O-CG1 3.25Å; T112-I116 WeakPolarHBondContact O-CG1 3.12Å; T112-I116 PolarHBondContact O-N 3.45Å |
| 113 | R | 80.9 | Confident | 77 | Confident | 74 Ų | 74 | 70.5 Ų | 70.5 | 28% | 0.279 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -65.8 | -40.6 | 177.8 | -73.4 | -70.9 | -169.9 | -174.5 | 2.2 | 112.3 | T51 I109 L110 V111 I116 F117 | T51-R113 VanDerWaalsContact CG2-NH2 3.27Å; T51-R113 PolarHBondContact OG1-NE 3.32Å; T51-R113 PolarHBondContact OG1-NH2 2.99Å; I109-R113 WeakPolarHBondContact O-CB 3.25Å; I109-R113 VanDerWaalsContact O-CG 3.24Å; I109-R113 WeakPolarHBondContact O-CG 3.18Å; I109-R113 PolarHBondContact O-N 3.25Å; L110-R113 WeakPolarHBondContact O-CB 3.22Å; L110-R113 PolarHBondContact O-N 3.07Å; L110-R113 VanDerWaalsContact O-N 3.09Å; V111-R113 VanDerWaalsContact C-N 3.28Å; V111-R113 PolarHBondContact O-N 3.01Å; R113-I116 PolarHBondContact O-N 2.92Å; R113-F117 PolarHBondContact O-N 3.26Å |
| 114 | Y | 83.8 | Confident | 74.8 | Confident | 13 Ų | 13 | 74.9 Ų | 74.9 | 5% | 0.051 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -65.5 | -43.5 | 176.7 | -59.9 | -8.2 | 0 | 0 | 0 | 110.8 | L110 V111 I116 F117 F118 L196 F199 Q200 I203 I231 | L110-Y114 HydrophobicContact CB-CE1 4.4Å; L110-Y114 HydrophobicContact CB-CE2 4.48Å; L110-Y114 HydrophobicContact CD2-CE1 4.42Å; L110-Y114 WeakPolarHBondContact O-CD1 3.32Å; L110-Y114 PolarHBondContact O-N 2.9Å; V111-Y114 PolarHBondContact O-N 3.09Å; Y114-I116 VanDerWaalsContact C-N 3.33Å; Y114-I116 PolarHBondContact O-N 3.03Å; Y114-F117 WeakPolarHBondContact O-CB 3.48Å; Y114-F117 PolarHBondContact O-N 3.37Å; Y114-F117 VanDerWaalsContact O-N 3.14Å; Y114-F118 WeakPolarHBondContact O-CD2 3.37Å; Y114-F118 PolarHBondContact O-N 3.09Å; Y114-L196 HydrophobicContact CE2-CD2 3.92Å; Y114-L196 PolarHBondContact OH-O 2.94Å; Y114-F199 HydrophobicContact CD2-CB 3.9Å; Y114-F199 HydrophobicContact CD2-CG 4.48Å; Y114-F199 HydrophobicContact CE2-CB 3.6Å; Y114-Q200 WeakPolarHBondContact OH-CB 3.23Å; Y114-Q200 PolarHBondContact OH-OE1 2.86Å; Y114-I203 HydrophobicContact CD1-CD1 3.49Å; Y114-I203 VanDerWaalsContact CD1-CD1 3.49Å; Y114-I203 HydrophobicContact CD2-CD1 4.44Å; Y114-I203 HydrophobicContact CE1-CD1 4.06Å; Y114-I203 HydrophobicContact CG-CD1 3.74Å; Y114-I231 WeakPolarHBondContact OH-CD1 3.32Å |
| 115 | L | 80.4 | Confident | 73.2 | Confident | 89 Ų | 89 | 78.3 Ų | 78.3 | 47% | 0.466 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 175.4 | -71.6 | 175.2 | 0 | 0 | 0 | 111.9 | V111 T112 F117 K119 | V111-L115 HydrophobicContact CG1-CD1 4.02Å; V111-L115 HydrophobicContact CG1-CG 4.32Å; V111-L115 WeakPolarHBondContact O-CB 3.24Å; V111-L115 VanDerWaalsContact O-CG 3.28Å; V111-L115 WeakPolarHBondContact O-CG 3.44Å; V111-L115 PolarHBondContact O-N 3.28Å; T112-L115 PolarHBondContact O-N 3.18Å; L115-F117 VanDerWaalsContact C-N 3.33Å; L115-K119 WeakPolarHBondContact O-CA 3.28Å; L115-K119 WeakPolarHBondContact O-CB 3.32Å; L115-K119 PolarHBondContact O-N 3.23Å |
| 116 | I | 76.9 | Confident | 71.2 | Confident | 88 Ų | 88 | 85.4 Ų | 85.4 | 45% | 0.451 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -64.4 | -38.1 | 175.4 | -69.6 | 165.4 | 0 | 0 | 0 | 111.3 | T112 R113 Y114 K119 | T112-I116 HydrophobicContact CG2-CD1 3.9Å; T112-I116 VanDerWaalsContact O-CG1 3.25Å; T112-I116 WeakPolarHBondContact O-CG1 3.12Å; T112-I116 PolarHBondContact O-N 3.45Å; R113-I116 PolarHBondContact O-N 2.92Å; Y114-I116 VanDerWaalsContact C-N 3.33Å; Y114-I116 PolarHBondContact O-N 3.03Å; I116-K119 CarbonylContact O-C 3.54Å; I116-K119 VanDerWaalsContact O-O 3.04Å |
| 117 | F | 77.3 | Confident | 69.5 | Low | 58 Ų | 58 | 92.2 Ų | 92.2 | 25% | 0.254 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64.9 | -47.3 | 177.9 | 177.8 | -97.2 | 0 | 0 | 0 | 112.1 | R113 Y114 L115 I203 | R113-F117 PolarHBondContact O-N 3.26Å; Y114-F117 WeakPolarHBondContact O-CB 3.48Å; Y114-F117 PolarHBondContact O-N 3.37Å; Y114-F117 VanDerWaalsContact O-N 3.14Å; L115-F117 VanDerWaalsContact C-N 3.33Å; F117-I203 HydrophobicContact CD1-CD1 4.22Å; F117-I203 HydrophobicContact CD1-CG1 3.99Å; F117-I203 HydrophobicContact CD1-CG2 3.94Å; F117-I203 HydrophobicContact CD2-CG2 4.29Å; F117-I203 HydrophobicContact CE1-CB 4.33Å; F117-I203 HydrophobicContact CE1-CG1 4.05Å; F117-I203 HydrophobicContact CE1-CG2 3.72Å; F117-I203 HydrophobicContact CE2-CG2 4.08Å; F117-I203 HydrophobicContact CG-CG2 4.22Å; F117-I203 HydrophobicContact CZ-CG2 3.79Å |
| 118 | F | 78 | Confident | 68.2 | Low | 100 Ų | 100 | 96.7 Ų | 96.7 | 44% | 0.439 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -77.9 | -40 | -179.6 | -71.7 | -67.9 | 0 | 0 | 0 | 113.3 | Y114 R120 F202 I203 L206 | Y114-F118 WeakPolarHBondContact O-CD2 3.37Å; Y114-F118 PolarHBondContact O-N 3.09Å; F118-R120 PolarHBondContact O-N 3.37Å; F118-F202 HydrophobicContact CE1-CE1 4.35Å; F118-F202 HydrophobicContact CZ-CD1 4.22Å; F118-F202 HydrophobicContact CZ-CE1 4.12Å; F118-I203 HydrophobicContact CE2-CD1 3.87Å; F118-I203 HydrophobicContact CE2-CG1 3.92Å; F118-I203 HydrophobicContact CZ-CD1 4.28Å; F118-I203 HydrophobicContact CZ-CG1 3.79Å; F118-L206 HydrophobicContact CE1-CD1 4.32Å |
| 119 | K | 69.8 | Low | 67.1 | Low | 116 Ų | 116 | 98.5 Ų | 98.5 | 50% | 0.504 | 45% | 0.446 | S | S | . | . | trans | -88.9 | 83.6 | 173.4 | -64.4 | -174.5 | 177.6 | 178.3 | 0 | 107.7 | L115 I116 K121 | L115-K119 WeakPolarHBondContact O-CA 3.28Å; L115-K119 WeakPolarHBondContact O-CB 3.32Å; L115-K119 PolarHBondContact O-N 3.23Å; I116-K119 CarbonylContact O-C 3.54Å; I116-K119 VanDerWaalsContact O-O 3.04Å; K119-K121 HydrophobicContact CB-CB 4.35Å; K119-K121 HydrophobicContact CB-CD 4.14Å; K119-K121 HydrophobicContact CB-CG 3.96Å; K119-K121 HydrophobicContact CD-CD 4.26Å; K119-K121 PolarHBondContact O-N 2.8Å | ||
| 120 | R | 55.8 | Low | 66 | Low | 215 Ų | 215 | 103.9 Ų | 103.9 | 81% | 0.811 | 47% | 0.474 | S | S | * | . | trans | -61.6 | 67.1 | 166.3 | -154.5 | -177.2 | -160.2 | -178.9 | 2.9 | 109.4 | F118 | F118-R120 PolarHBondContact O-N 3.37Š| ||
| 121 | K | 52.2 | Low | 65.1 | Low | 166 Ų | 166 | 110.1 Ų | 110.1 | 72% | 0.722 | 50% | 0.503 | S | S | * | . | trans | -107.6 | 125.9 | -165.5 | -87.4 | -166.7 | -179 | -158.8 | 0 | 112.8 | K119 | K119-K121 HydrophobicContact CB-CB 4.35Å; K119-K121 HydrophobicContact CB-CD 4.14Å; K119-K121 HydrophobicContact CB-CG 3.96Å; K119-K121 HydrophobicContact CD-CD 4.26Å; K119-K121 PolarHBondContact O-N 2.8Å | ||
| 122 | D | 50 | Low | 64.2 | Low | 139 Ų | 139 | 108 Ų | 108 | 74% | 0.743 | 49% | 0.491 | S | S | * | . | trans | -59.8 | 142.1 | 179.4 | -69.1 | -63.8 | 0 | 0 | 0 | 115.3 | V124 | D122-V124 PolarHBondContact O-N 3.34Š| ||
| 123 | K | 47.8 | Very low | 63.7 | Low | 194 Ų | 194 | 109.8 Ų | 109.8 | 84% | 0.843 | 50% | 0.502 | S | S | * | . | trans | 26.4 | 83 | 139.8 | -56.5 | -173 | -178 | -178.3 | 0 | 118.7 | ||||
| 124 | V | 45.3 | Very low | 63.2 | Low | 96 Ų | 96 | 109.2 Ų | 109.2 | 58% | 0.582 | 51% | 0.513 | S | S | * | . | trans | -154 | 102.4 | 131.7 | -143.7 | 0 | 0 | 0 | 0 | 110.4 | D122 Y127 | D122-V124 PolarHBondContact O-N 3.34Å; V124-Y127 HydrophobicContact CB-CD2 4.28Å; V124-Y127 HydrophobicContact CG1-CD2 3.69Å; V124-Y127 HydrophobicContact CG1-CE2 4.19Å | ||
| 125 | E | 55.2 | Low | 62.5 | Low | 117 Ų | 117 | 111.7 Ų | 111.7 | 55% | 0.547 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -80.2 | -24.4 | -167.6 | -170.6 | 140.4 | -141.5 | 0 | 0 | 114.5 | R128 | E125-R128 IonicContact OE1-NH2 2.64Å; E125-R128 PolarHBondContact OE1-NH2 2.98Å |
| 126 | F | 46.3 | Very low | 62.1 | Low | 152 Ų | 152 | 107.9 Ų | 107.9 | 67% | 0.667 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -76.2 | -51.6 | -176.8 | -178 | -102.2 | 0 | 0 | 0 | 112.9 | R128 K129 L130 | F126-R128 PolarHBondContact O-N 3.33Å; F126-K129 PolarHBondContact O-N 2.93Å; F126-L130 PolarHBondContact O-N 3.16Å |
| 127 | Y | 52.7 | Low | 62 | Low | 144 Ų | 144 | 106.1 Ų | 106.1 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59 | -36.7 | 177.2 | -68 | -76.1 | 0 | 0 | 0 | 111.9 | V124 K129 L130 H131 | V124-Y127 HydrophobicContact CB-CD2 4.28Å; V124-Y127 HydrophobicContact CG1-CD2 3.69Å; V124-Y127 HydrophobicContact CG1-CE2 4.19Å; Y127-K129 VanDerWaalsContact C-N 3.26Å; Y127-K129 PolarHBondContact O-N 3.42Å; Y127-L130 PolarHBondContact O-N 2.89Å; Y127-H131 WeakPolarHBondContact O-CB 3.15Å; Y127-H131 PolarHBondContact O-CD2 3.09Å; Y127-H131 PolarHBondContact O-N 3.03Å |
| 128 | R | 61.9 | Low | 61.9 | Low | 116 Ų | 116 | 105.3 Ų | 105.3 | 44% | 0.438 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -58.7 | -32.7 | 176.7 | -169.7 | 173.8 | 65.6 | -171 | -0 | 113.5 | V50 E125 F126 A132 | V50-R128 HydrophobicContact CG2-CG 3.74Å; E125-R128 IonicContact OE1-NH2 2.64Å; E125-R128 PolarHBondContact OE1-NH2 2.98Å; F126-R128 PolarHBondContact O-N 3.33Å; R128-A132 VanDerWaalsContact O-CB 3.24Å; R128-A132 WeakPolarHBondContact O-CB 3.43Å; R128-A132 PolarHBondContact O-N 2.95Å; R128-A132 VanDerWaalsContact O-N 3.13Å |
| 129 | K | 59.5 | Low | 61.7 | Low | 93 Ų | 93 | 102.4 Ų | 102.4 | 40% | 0.404 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -73.8 | -47.9 | 178.9 | -68.7 | 174.5 | -174.6 | 176.2 | 0 | 111.7 | R48 F126 Y127 A132 V133 | R48-K129 WeakPolarHBondContact O-CE 3.36Å; F126-K129 PolarHBondContact O-N 2.93Å; Y127-K129 VanDerWaalsContact C-N 3.26Å; Y127-K129 PolarHBondContact O-N 3.42Å; K129-A132 PolarHBondContact O-N 3.41Å; K129-V133 WeakPolarHBondContact O-CG2 3.26Å; K129-V133 PolarHBondContact O-N 3.49Å |
| 130 | L | 60.8 | Low | 62.1 | Low | 118 Ų | 118 | 99.2 Ų | 99.2 | 62% | 0.618 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.1 | -42.6 | -179.8 | -173.4 | 62.6 | 0 | 0 | 0 | 111.3 | F126 Y127 A132 V133 A134 | F126-L130 PolarHBondContact O-N 3.16Å; Y127-L130 PolarHBondContact O-N 2.89Å; L130-A132 VanDerWaalsContact C-N 3.33Å; L130-A132 PolarHBondContact O-N 3.45Å; L130-V133 PolarHBondContact O-N 2.68Å; L130-A134 WeakPolarHBondContact O-CB 3.44Å; L130-A134 PolarHBondContact O-N 3.26Å |
| 131 | H | 68.5 | Low | 63 | Low | 131 Ų | 131 | 93.1 Ų | 93.1 | 61% | 0.606 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.3 | -38 | 173.4 | -77.9 | -72.2 | 0 | 0 | 0 | 112.5 | Y127 A135 | Y127-H131 WeakPolarHBondContact O-CB 3.15Å; Y127-H131 PolarHBondContact O-CD2 3.09Å; Y127-H131 PolarHBondContact O-N 3.03Å; H131-A135 WeakPolarHBondContact O-CB 3.32Å; H131-A135 PolarHBondContact O-N 3.47Å |
| 132 | A | 66.3 | Low | 63.9 | Low | 15 Ų | 15 | 90 Ų | 90 | 12% | 0.124 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -68.7 | -39.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | V50 R128 K129 L130 S136 | V50-A132 HydrophobicContact CB-CB 4.47Å; V50-A132 HydrophobicContact CG1-CB 4.21Å; V50-A132 HydrophobicContact CG2-CB 4.06Å; R128-A132 VanDerWaalsContact O-CB 3.24Å; R128-A132 WeakPolarHBondContact O-CB 3.43Å; R128-A132 PolarHBondContact O-N 2.95Å; R128-A132 VanDerWaalsContact O-N 3.13Å; K129-A132 PolarHBondContact O-N 3.41Å; L130-A132 VanDerWaalsContact C-N 3.33Å; L130-A132 PolarHBondContact O-N 3.45Å; A132-S136 WeakPolarHBondContact O-CB 3.44Å; A132-S136 PolarHBondContact O-N 3.47Å |
| 133 | V | 69.3 | Low | 64.9 | Low | 72 Ų | 72 | 83.7 Ų | 83.7 | 44% | 0.436 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -68.3 | -45.8 | 176.6 | 174.8 | 0 | 0 | 0 | 0 | 110.8 | M53 K129 L130 S136 A137 | M53-V133 HydrophobicContact CE-CG1 4.49Å; M53-V133 HydrophobicContact CE-CG2 4.17Å; M53-V133 HydrophobicContact SD-CG2 4.21Å; K129-V133 WeakPolarHBondContact O-CG2 3.26Å; K129-V133 PolarHBondContact O-N 3.49Å; L130-V133 PolarHBondContact O-N 2.68Å; V133-S136 WeakPolarHBondContact O-CB 3.07Å; V133-S136 PolarHBondContact O-N 3.3Å; V133-A137 PolarHBondContact O-N 3.09Å |
| 134 | A | 68.8 | Low | 66.2 | Low | 61 Ų | 61 | 78.3 Ų | 78.3 | 50% | 0.504 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.5 | -43.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L130 S136 A137 G138 | L130-A134 WeakPolarHBondContact O-CB 3.44Å; L130-A134 PolarHBondContact O-N 3.26Å; A134-S136 VanDerWaalsContact C-N 3.31Å; A134-S136 PolarHBondContact O-N 3.48Å; A134-A137 PolarHBondContact O-N 2.99Å; A134-G138 PolarHBondContact O-N 3.18Å |
| 135 | A | 69 | Low | 67.5 | Low | 65 Ų | 65 | 78.2 Ų | 78.2 | 54% | 0.537 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63.8 | -37.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.9 | H131 G138 L139 | H131-A135 WeakPolarHBondContact O-CB 3.32Å; H131-A135 PolarHBondContact O-N 3.47Å; A135-G138 PolarHBondContact O-N 3.25Å; A135-L139 VanDerWaalsContact O-CB 3.24Å; A135-L139 WeakPolarHBondContact O-CB 3.49Å; A135-L139 PolarHBondContact O-N 3.09Å |
| 136 | S | 73.4 | Confident | 68.1 | Low | 9 Ų | 9 | 76.5 Ų | 76.5 | 6% | 0.063 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -63.5 | -46.6 | 174.5 | -177.7 | 0 | 0 | 0 | 0 | 111.7 | N57 A132 V133 A134 L139 W140 | N57-S136 PolarHBondContact ND2-OG 2.83Å; N57-S136 PolarHBondContact OD1-OG 3.45Å; A132-S136 WeakPolarHBondContact O-CB 3.44Å; A132-S136 PolarHBondContact O-N 3.47Å; V133-S136 WeakPolarHBondContact O-CB 3.07Å; V133-S136 PolarHBondContact O-N 3.3Å; A134-S136 VanDerWaalsContact C-N 3.31Å; A134-S136 PolarHBondContact O-N 3.48Å; S136-L139 PolarHBondContact O-N 3.48Å; S136-W140 VanDerWaalsContact O-CD1 3.22Å; S136-W140 PolarHBondContact O-N 3.24Å |
| 137 | A | 74.8 | Confident | 69.3 | Low | 52 Ų | 52 | 70.1 Ų | 70.1 | 43% | 0.43 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | V133 A134 W140 T141 | V133-A137 PolarHBondContact O-N 3.09Å; A134-A137 PolarHBondContact O-N 2.99Å; A137-W140 PolarHBondContact O-N 2.99Å; A137-T141 WeakPolarHBondContact O-CB 3.22Å; A137-T141 PolarHBondContact O-N 3.11Å; A137-T141 PolarHBondContact O-OG1 3.29Å |
| 138 | G | 74.4 | Confident | 70.1 | Confident | 41 Ų | 41 | 65.5 Ų | 65.5 | 42% | 0.423 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A134 A135 T141 L142 | A134-G138 PolarHBondContact O-N 3.18Å; A135-G138 PolarHBondContact O-N 3.25Å; G138-T141 PolarHBondContact O-N 3.03Å; G138-L142 WeakPolarHBondContact O-CB 3.34Å; G138-L142 PolarHBondContact O-N 3.48Å |
| 139 | L | 73.3 | Confident | 70.2 | Confident | 39 Ų | 39 | 63 Ų | 63 | 20% | 0.204 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.5 | -47.8 | 175.9 | -178.3 | 68.9 | 0 | 0 | 0 | 111.3 | F105 V108 A135 S136 T141 L142 V143 | F105-L139 HydrophobicContact CD1-CD2 4.04Å; F105-L139 HydrophobicContact CE1-CD2 3.68Å; F105-L139 HydrophobicContact CZ-CD2 4.44Å; V108-L139 HydrophobicContact CB-CD2 4.47Å; V108-L139 HydrophobicContact CG1-CD2 4.48Å; V108-L139 HydrophobicContact CG2-CD1 4.47Å; V108-L139 HydrophobicContact CG2-CD2 3.78Å; A135-L139 VanDerWaalsContact O-CB 3.24Å; A135-L139 WeakPolarHBondContact O-CB 3.49Å; A135-L139 PolarHBondContact O-N 3.09Å; S136-L139 PolarHBondContact O-N 3.48Å; L139-T141 VanDerWaalsContact C-N 3.3Å; L139-T141 PolarHBondContact O-N 3.34Å; L139-L142 PolarHBondContact O-N 3.23Å; L139-V143 HydrophobicContact CD1-CG2 3.82Å; L139-V143 HydrophobicContact CG-CG2 4.1Å; L139-V143 WeakPolarHBondContact O-CB 3.46Å; L139-V143 WeakPolarHBondContact O-CG2 3.5Å; L139-V143 PolarHBondContact O-N 2.86Å |
| 140 | W | 79.4 | Confident | 70.5 | Confident | 48 Ų | 48 | 62.3 Ų | 62.3 | 18% | 0.182 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -56.6 | -46 | 176 | -90.2 | 108.3 | 0 | 0 | 0 | 112.1 | N57 V60 V61 L101 F105 S136 A137 V143 I144 | N57-W140 HydrophobicContact CB-CZ2 4.36Å; N57-W140 PolarHBondContact OD1-NE1 3.49Å; V60-W140 HydrophobicContact CB-CH2 4.46Å; V60-W140 HydrophobicContact CB-CZ2 4.13Å; V60-W140 HydrophobicContact CG1-CH2 3.95Å; V60-W140 HydrophobicContact CG1-CZ2 3.97Å; V61-W140 HydrophobicContact CG2-CH2 3.38Å; V61-W140 HydrophobicContact CG2-CZ2 3.79Å; V61-W140 HydrophobicContact CG2-CZ3 4.29Å; L101-W140 HydrophobicContact CD1-CZ3 4.36Å; L101-W140 HydrophobicContact CD2-CE3 4.31Å; L101-W140 HydrophobicContact CD2-CZ3 3.99Å; F105-W140 HydrophobicContact CE2-CH2 4.22Å; F105-W140 AromaticContact CE2-CZ2 3.86Å; F105-W140 HydrophobicContact CE2-CZ2 3.86Å; F105-W140 AromaticContact CZ-CD2 3.94Å; F105-W140 HydrophobicContact CZ-CD2 3.94Å; F105-W140 AromaticContact CZ-CE2 3.47Å; F105-W140 VanDerWaalsContact CZ-CE2 3.47Å; F105-W140 HydrophobicContact CZ-CG 4.32Å; F105-W140 HydrophobicContact CZ-CH2 4.46Å; F105-W140 AromaticContact CZ-CZ2 3.77Å; F105-W140 HydrophobicContact CZ-CZ2 3.77Å; F105-W140 AromaticContact CZ-NE1 3.55Å; S136-W140 VanDerWaalsContact O-CD1 3.22Å; S136-W140 PolarHBondContact O-N 3.24Å; A137-W140 PolarHBondContact O-N 2.99Å; W140-V143 PolarHBondContact O-N 2.96Å; W140-I144 HydrophobicContact CE3-CD1 3.75Å; W140-I144 HydrophobicContact CE3-CG1 4.11Å; W140-I144 HydrophobicContact CZ3-CD1 4.29Å; W140-I144 VanDerWaalsContact O-CB 3.3Å; W140-I144 WeakPolarHBondContact O-CB 3.5Å; W140-I144 VanDerWaalsContact O-CG1 3.26Å; W140-I144 WeakPolarHBondContact O-CG1 3.45Å; W140-I144 PolarHBondContact O-N 3.45Å |
| 141 | T | 74.2 | Confident | 70.8 | Confident | 87 Ų | 87 | 57.8 Ų | 57.8 | 53% | 0.534 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -60.9 | -49.1 | 178.5 | -53.2 | 0 | 0 | 0 | 0 | 110.5 | A137 G138 L139 V143 I144 V145 | A137-T141 WeakPolarHBondContact O-CB 3.22Å; A137-T141 PolarHBondContact O-N 3.11Å; A137-T141 PolarHBondContact O-OG1 3.29Å; G138-T141 PolarHBondContact O-N 3.03Å; L139-T141 VanDerWaalsContact C-N 3.3Å; L139-T141 PolarHBondContact O-N 3.34Å; T141-V143 PolarHBondContact O-N 3.47Å; T141-I144 PolarHBondContact O-N 3.4Å; T141-V145 HydrophobicContact CG2-CG2 4.38Å; T141-V145 VanDerWaalsContact O-CB 3.26Å; T141-V145 WeakPolarHBondContact O-CB 3.18Å; T141-V145 WeakPolarHBondContact O-CG2 3.37Å; T141-V145 PolarHBondContact O-N 2.87Å |
| 142 | L | 71.6 | Confident | 70.6 | Confident | 100 Ų | 100 | 54.8 Ų | 54.8 | 52% | 0.524 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.3 | -46 | 178.9 | -175.4 | 67.7 | 0 | 0 | 0 | 111.9 | G138 L139 V145 I146 | G138-L142 WeakPolarHBondContact O-CB 3.34Å; G138-L142 PolarHBondContact O-N 3.48Å; L139-L142 PolarHBondContact O-N 3.23Å; L142-V145 PolarHBondContact O-N 3.02Å; L142-I146 HydrophobicContact CD1-CD1 3.59Å; L142-I146 HydrophobicContact CD1-CG1 4.35Å; L142-I146 HydrophobicContact CG-CD1 3.82Å; L142-I146 WeakPolarHBondContact O-CB 3.47Å; L142-I146 VanDerWaalsContact O-CG1 3.25Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 3.34Å |
| 143 | V | 71.1 | Confident | 70.2 | Confident | 8 Ų | 8 | 56.8 Ų | 56.8 | 5% | 0.048 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -70.6 | -40 | -176.9 | -177.6 | 0 | 0 | 0 | 0 | 111.1 | L101 L104 L139 W140 T141 I146 V147 | L101-V143 HydrophobicContact CD2-CB 4.05Å; L101-V143 HydrophobicContact CD2-CG1 3.29Å; L101-V143 HydrophobicContact CG-CG1 4.01Å; L104-V143 HydrophobicContact CD1-CB 4.35Å; L104-V143 HydrophobicContact CD1-CG1 3.65Å; L104-V143 HydrophobicContact CD1-CG2 3.65Å; L139-V143 HydrophobicContact CD1-CG2 3.82Å; L139-V143 HydrophobicContact CG-CG2 4.1Å; L139-V143 WeakPolarHBondContact O-CB 3.46Å; L139-V143 WeakPolarHBondContact O-CG2 3.5Å; L139-V143 PolarHBondContact O-N 2.86Å; W140-V143 PolarHBondContact O-N 2.96Å; T141-V143 PolarHBondContact O-N 3.47Å; V143-I146 PolarHBondContact O-N 3.21Å; V143-V147 HydrophobicContact CG1-CB 4.33Å; V143-V147 HydrophobicContact CG1-CG2 3.65Å; V143-V147 WeakPolarHBondContact O-CA 3.43Å; V143-V147 WeakPolarHBondContact O-CB 3.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.39Å; V143-V147 PolarHBondContact O-N 2.91Å |
| 144 | I | 74.2 | Confident | 69.8 | Low | 80 Ų | 80 | 58.9 Ų | 58.9 | 41% | 0.41 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -64.2 | -47.3 | 174.9 | -71.4 | 170.1 | 0 | 0 | 0 | 110.1 | W140 T141 I146 V148 P149 | W140-I144 HydrophobicContact CE3-CD1 3.75Å; W140-I144 HydrophobicContact CE3-CG1 4.11Å; W140-I144 HydrophobicContact CZ3-CD1 4.29Å; W140-I144 VanDerWaalsContact O-CB 3.3Å; W140-I144 WeakPolarHBondContact O-CB 3.5Å; W140-I144 VanDerWaalsContact O-CG1 3.26Å; W140-I144 WeakPolarHBondContact O-CG1 3.45Å; W140-I144 PolarHBondContact O-N 3.45Å; T141-I144 PolarHBondContact O-N 3.4Å; I144-I146 VanDerWaalsContact C-N 3.27Å; I144-I146 PolarHBondContact O-N 3.31Å; I144-V148 HydrophobicContact CG2-CB 4.44Å; I144-V148 HydrophobicContact CG2-CG2 4.07Å; I144-V148 VanDerWaalsContact O-CB 3.22Å; I144-V148 WeakPolarHBondContact O-CB 3.42Å; I144-V148 PolarHBondContact O-N 3.03Å; I144-P149 WeakPolarHBondContact O-CD 3.19Å |
| 145 | V | 72.6 | Confident | 69.5 | Low | 94 Ų | 94 | 57.7 Ų | 57.7 | 57% | 0.57 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -66 | -28 | -178.1 | 171.3 | 0 | 0 | 0 | 0 | 112.6 | T141 L142 P149 | T141-V145 HydrophobicContact CG2-CG2 4.38Å; T141-V145 VanDerWaalsContact O-CB 3.26Å; T141-V145 WeakPolarHBondContact O-CB 3.18Å; T141-V145 WeakPolarHBondContact O-CG2 3.37Å; T141-V145 PolarHBondContact O-N 2.87Å; L142-V145 PolarHBondContact O-N 3.02Å; V145-P149 WeakPolarHBondContact O-CD 3.32Å; V145-P149 WeakPolarHBondContact O-CG 3.35Å |
| 146 | I | 68.6 | Low | 69 | Low | 82 Ų | 82 | 54.6 Ų | 54.6 | 42% | 0.421 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -89.1 | -56.9 | 177 | -65.7 | 173.6 | 0 | 0 | 0 | 110.5 | L142 V143 I144 L150 | L142-I146 HydrophobicContact CD1-CD1 3.59Å; L142-I146 HydrophobicContact CD1-CG1 4.35Å; L142-I146 HydrophobicContact CG-CD1 3.82Å; L142-I146 WeakPolarHBondContact O-CB 3.47Å; L142-I146 VanDerWaalsContact O-CG1 3.25Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 3.34Å; V143-I146 PolarHBondContact O-N 3.21Å; I144-I146 VanDerWaalsContact C-N 3.27Å; I144-I146 PolarHBondContact O-N 3.31Å; I146-L150 HydrophobicContact CG2-CD1 3.62Å; I146-L150 VanDerWaalsContact O-CB 3.23Å; I146-L150 WeakPolarHBondContact O-CB 3.41Å; I146-L150 VanDerWaalsContact O-CD1 3.31Å; I146-L150 WeakPolarHBondContact O-CD1 3.4Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.01Å; I146-L150 VanDerWaalsContact O-N 3.16Å |
| 147 | V | 70.9 | Confident | 68.4 | Low | 17 Ų | 17 | 58.1 Ų | 58.1 | 10% | 0.103 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -72.4 | -43.1 | -169.5 | -179.3 | 0 | 0 | 0 | 0 | 111.6 | I97 Y100 V143 V151 | I97-V147 HydrophobicContact CB-CG1 4.47Å; I97-V147 HydrophobicContact CG1-CG1 4.16Å; Y100-V147 HydrophobicContact CD2-CG1 4.31Å; V143-V147 HydrophobicContact CG1-CB 4.33Å; V143-V147 HydrophobicContact CG1-CG2 3.65Å; V143-V147 WeakPolarHBondContact O-CA 3.43Å; V143-V147 WeakPolarHBondContact O-CB 3.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.39Å; V143-V147 PolarHBondContact O-N 2.91Å; V147-V151 HydrophobicContact CG1-CG2 4.26Å; V147-V151 WeakPolarHBondContact O-CB 3.33Å; V147-V151 VanDerWaalsContact O-CG2 3.24Å; V147-V151 WeakPolarHBondContact O-CG2 3.49Å; V147-V151 PolarHBondContact O-N 2.73Å |
| 148 | V | 69.1 | Low | 67.6 | Low | 48 Ų | 48 | 59.2 Ų | 59.2 | 29% | 0.291 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -68.1 | -50 | -175.4 | 179.5 | 0 | 0 | 0 | 0 | 110.9 | I97 I144 L150 V151 V152 | I97-V148 HydrophobicContact CD1-CG2 4.31Å; I144-V148 HydrophobicContact CG2-CB 4.44Å; I144-V148 HydrophobicContact CG2-CG2 4.07Å; I144-V148 VanDerWaalsContact O-CB 3.22Å; I144-V148 WeakPolarHBondContact O-CB 3.42Å; I144-V148 PolarHBondContact O-N 3.03Å; V148-L150 PolarHBondContact O-N 3.44Å; V148-V151 PolarHBondContact O-N 2.78Å; V148-V152 HydrophobicContact CG1-CB 4.47Å; V148-V152 HydrophobicContact CG1-CG2 3.76Å; V148-V152 WeakPolarHBondContact O-CB 3.26Å; V148-V152 VanDerWaalsContact O-CG2 3.25Å; V148-V152 WeakPolarHBondContact O-CG2 3.44Å; V148-V152 PolarHBondContact O-N 3.44Å |
| 149 | P | 64.2 | Low | 67 | Low | 62 Ų | 62 | 60.4 Ų | 60.4 | 40% | 0.403 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -61.9 | -42.2 | 174.5 | -28.8 | 39.7 | 0 | 0 | 0 | 113.6 | I144 V145 V151 S153 | I144-P149 WeakPolarHBondContact O-CD 3.19Å; V145-P149 WeakPolarHBondContact O-CD 3.32Å; V145-P149 WeakPolarHBondContact O-CG 3.35Å; P149-V151 VanDerWaalsContact C-N 3.27Å; P149-V151 PolarHBondContact O-N 3.42Å; P149-S153 WeakPolarHBondContact O-CB 3.32Å; P149-S153 PolarHBondContact O-N 2.95Å; P149-S153 PolarHBondContact O-OG 3.23Å |
| 150 | L | 66.4 | Low | 66.4 | Low | 80 Ų | 80 | 68.1 Ų | 68.1 | 42% | 0.419 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -60.3 | -38.8 | 178.7 | -77.2 | 172.8 | 0 | 0 | 0 | 112.3 | I146 V148 I181 | I146-L150 HydrophobicContact CG2-CD1 3.62Å; I146-L150 VanDerWaalsContact O-CB 3.23Å; I146-L150 WeakPolarHBondContact O-CB 3.41Å; I146-L150 VanDerWaalsContact O-CD1 3.31Å; I146-L150 WeakPolarHBondContact O-CD1 3.4Å; I146-L150 WeakPolarHBondContact O-CG 3.49Å; I146-L150 PolarHBondContact O-N 3.01Å; I146-L150 VanDerWaalsContact O-N 3.16Å; V148-L150 PolarHBondContact O-N 3.44Å; L150-I181 HydrophobicContact CD2-CG2 4.46Å |
| 151 | V | 66.7 | Low | 65.6 | Low | 22 Ų | 22 | 67.3 Ų | 67.3 | 13% | 0.133 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -79.4 | -54.4 | 177.8 | -178.6 | 0 | 0 | 0 | 0 | 110.2 | A93 H96 I97 V147 V148 P149 Y155 | A93-V151 HydrophobicContact CB-CG1 3.45Å; A93-V151 VanDerWaalsContact CB-CG1 3.45Å; H96-V151 HydrophobicContact CB-CG1 4.49Å; H96-V151 HydrophobicContact CB-CG2 4.47Å; I97-V151 HydrophobicContact CG1-CB 4.31Å; I97-V151 HydrophobicContact CG1-CG1 4.4Å; I97-V151 HydrophobicContact CG1-CG2 4.29Å; V147-V151 HydrophobicContact CG1-CG2 4.26Å; V147-V151 WeakPolarHBondContact O-CB 3.33Å; V147-V151 VanDerWaalsContact O-CG2 3.24Å; V147-V151 WeakPolarHBondContact O-CG2 3.49Å; V147-V151 PolarHBondContact O-N 2.73Å; V148-V151 PolarHBondContact O-N 2.78Å; P149-V151 VanDerWaalsContact C-N 3.27Å; P149-V151 PolarHBondContact O-N 3.42Å; V151-Y155 HydrophobicContact CG1-CD2 4.42Å; V151-Y155 WeakPolarHBondContact O-CB 3.4Å; V151-Y155 PolarHBondContact O-N 2.87Å |
| 152 | V | 65.1 | Low | 65.2 | Low | 69 Ų | 69 | 67.6 Ų | 67.6 | 42% | 0.418 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -72.6 | -38.1 | -169.8 | 176.9 | 0 | 0 | 0 | 0 | 113.4 | A93 V148 R154 Y155 | A93-V152 HydrophobicContact CB-CG2 4.48Å; V148-V152 HydrophobicContact CG1-CB 4.47Å; V148-V152 HydrophobicContact CG1-CG2 3.76Å; V148-V152 WeakPolarHBondContact O-CB 3.26Å; V148-V152 VanDerWaalsContact O-CG2 3.25Å; V148-V152 WeakPolarHBondContact O-CG2 3.44Å; V148-V152 PolarHBondContact O-N 3.44Å; V152-R154 PolarHBondContact O-N 3.23Å; V152-R154 VanDerWaalsContact O-N 3.09Å; V152-Y155 PolarHBondContact O-N 3.45Å |
| 153 | S | 58 | Low | 64.9 | Low | 57 Ų | 57 | 69.1 Ų | 69.1 | 40% | 0.399 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -9.5 | -175.2 | 69.4 | 0 | 0 | 0 | 0 | 114.2 | P149 I157 | P149-S153 WeakPolarHBondContact O-CB 3.32Å; P149-S153 PolarHBondContact O-N 2.95Å; P149-S153 PolarHBondContact O-OG 3.23Å; S153-I157 WeakPolarHBondContact O-CD1 3.04Å |
| 154 | R | 60 | Low | 64.7 | Low | 115 Ų | 115 | 75.1 Ų | 75.1 | 43% | 0.434 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.7 | -1 | -176 | -56.7 | -59.9 | 179.5 | -172.2 | 1.6 | 113.3 | V152 G156 | V152-R154 PolarHBondContact O-N 3.23Å; V152-R154 VanDerWaalsContact O-N 3.09Å; R154-G156 PolarHBondContact O-N 3.5Å |
| 155 | Y | 62.5 | Low | 64.6 | Low | 36 Ų | 36 | 75.5 Ų | 75.5 | 14% | 0.141 | 38% | 0.38 | C | S | . | . | S | Bend | trans | -83.8 | 99.6 | -174.2 | -144.5 | -101.4 | 0 | 0 | 0 | 111.8 | R89 S92 V151 V152 F169 | R89-Y155 HydrophobicContact CB-CD1 4.49Å; R89-Y155 WeakPolarHBondContact CD-O 3.45Å; R89-Y155 PolarHBondContact NE-O 3.43Å; S92-Y155 WeakPolarHBondContact OG-CE1 3.32Å; S92-Y155 VanDerWaalsContact OG-CZ 3.25Å; S92-Y155 PolarHBondContact OG-OH 3.43Å; V151-Y155 HydrophobicContact CG1-CD2 4.42Å; V151-Y155 WeakPolarHBondContact O-CB 3.4Å; V151-Y155 PolarHBondContact O-N 2.87Å; V152-Y155 PolarHBondContact O-N 3.45Å; Y155-F169 HydrophobicContact CD1-CB 4.34Å; Y155-F169 HydrophobicContact CD1-CD1 4.36Å; Y155-F169 AromaticContact CD1-CD2 3.76Å; Y155-F169 HydrophobicContact CD1-CD2 3.76Å; Y155-F169 HydrophobicContact CD1-CE2 4.01Å; Y155-F169 AromaticContact CD1-CG 3.89Å; Y155-F169 HydrophobicContact CD1-CG 3.89Å; Y155-F169 HydrophobicContact CD1-CZ 4.41Å; Y155-F169 HydrophobicContact CE1-CB 3.86Å; Y155-F169 HydrophobicContact CE1-CD1 4.36Å; Y155-F169 AromaticContact CE1-CD2 3.02Å; Y155-F169 HydrophobicContact CE1-CD2 3.02Å; Y155-F169 AromaticContact CE1-CE2 3.48Å; Y155-F169 HydrophobicContact CE1-CE2 3.48Å; Y155-F169 VanDerWaalsContact CE1-CE2 3.48Å; Y155-F169 AromaticContact CE1-CG 3.49Å; Y155-F169 HydrophobicContact CE1-CG 3.49Å; Y155-F169 VanDerWaalsContact CE1-CG 3.49Å; Y155-F169 HydrophobicContact CE1-CZ 4.31Å; Y155-F169 HydrophobicContact CE2-CB 4.4Å; Y155-F169 AromaticContact CZ-CD2 3.67Å |
| 156 | G | 59.1 | Low | 64.6 | Low | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 35% | 0.353 | C | S | . | . | S | Bend | trans | 69.7 | 37.1 | 169.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | R89 R154 Y161 E172 | R89-G156 PolarHBondContact NE-O 2.95Å; R89-G156 PolarHBondContact NH2-O 3.36Å; R154-G156 PolarHBondContact O-N 3.5Å; G156-Y161 VanDerWaalsContact C-CE2 3.49Å; G156-Y161 WeakPolarHBondContact O-CD2 3.39Å; G156-E172 WeakPolarHBondContact CA-OE1 3.36Å |
| 157 | I | 61.1 | Low | 64.8 | Low | 83 Ų | 83 | 67.9 Ų | 67.9 | 43% | 0.426 | 34% | 0.336 | S | S | . | . | trans | -101.9 | -26.7 | -175.5 | -55.5 | -173.9 | 0 | 0 | 0 | 111.3 | S153 E172 | S153-I157 WeakPolarHBondContact O-CD1 3.04Å; I157-E172 PolarHBondContact N-OE1 3.46Å | ||
| 158 | H | 58.1 | Low | 64.7 | Low | 76 Ų | 76 | 72.5 Ų | 72.5 | 35% | 0.352 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -92.1 | -0.1 | -169.2 | -64.4 | -79.9 | 0 | 0 | 0 | 114 | E172 Y175 Y177 | H158-E172 WeakPolarHBondContact CB-OE1 3.27Å; H158-E172 WeakPolarHBondContact CB-OE2 3.23Å; H158-E172 IonicContact CD2-OE1 2.85Å; H158-E172 IonicContact CD2-OE2 3.63Å; H158-E172 PolarHBondContact CD2-OE2 3.39Å; H158-E172 IonicContact CG-OE1 3.02Å; H158-E172 IonicContact CG-OE2 3.88Å; H158-E172 PolarHBondContact N-OE1 2.97Å; H158-Y175 HydrophobicContact CB-CE2 3.89Å; H158-Y177 PolarHBondContact NE2-OH 3.24Å |
| 159 | E | 60.1 | Low | 64.5 | Low | 66 Ų | 66 | 70.5 Ų | 70.5 | 31% | 0.308 | 34% | 0.343 | S | S | . | . | S | Bend | trans | -137.9 | 156.8 | 177.3 | -66.5 | -157.8 | -163.1 | 0 | 0 | 114.3 | Y161 K171 | E159-Y161 HydrophobicContact CB-CD2 4.26Å; E159-Y161 HydrophobicContact CB-CE1 4.43Å; E159-Y161 HydrophobicContact CB-CE2 3.71Å; E159-Y161 WeakPolarHBondContact O-CD2 3.37Å; E159-Y161 PolarHBondContact O-N 3.04Å; E159-K171 WeakPolarHBondContact OE1-CB 3.16Å; E159-K171 WeakPolarHBondContact OE1-CD 3.4Å; E159-K171 WeakPolarHBondContact OE2-CD 3.44Å; E159-K171 WeakPolarHBondContact OE2-CE 3.23Å; E159-K171 IonicContact OE2-NZ 3.87Å; E159-K171 PolarHBondContact OE2-NZ 3.11Å |
| 160 | E | 60.8 | Low | 64.6 | Low | 201 Ų | 201 | 69.2 Ų | 69.2 | 94% | 0.939 | 33% | 0.331 | S | S | * | . | trans | -71.2 | 92.7 | 167.1 | -70.7 | -173.2 | 173 | 0 | 0 | 109.9 | ||||
| 161 | Y | 64.3 | Low | 64.6 | Low | 30 Ų | 30 | 71.1 Ų | 71.1 | 12% | 0.118 | 34% | 0.336 | C | S | . | . | trans | -84.8 | 131.9 | 171.7 | -65.2 | -76.9 | 0 | 0 | 0 | 110.1 | G156 E159 E163 K168 F169 | G156-Y161 VanDerWaalsContact C-CE2 3.49Å; G156-Y161 WeakPolarHBondContact O-CD2 3.39Å; E159-Y161 HydrophobicContact CB-CD2 4.26Å; E159-Y161 HydrophobicContact CB-CE1 4.43Å; E159-Y161 HydrophobicContact CB-CE2 3.71Å; E159-Y161 WeakPolarHBondContact O-CD2 3.37Å; E159-Y161 PolarHBondContact O-N 3.04Å; Y161-E163 PolarHBondContact O-N 3.32Å; Y161-K168 VanDerWaalsContact CE1-O 3.3Å; Y161-K168 WeakPolarHBondContact CE1-O 3.26Å; Y161-F169 HydrophobicContact CD1-CD1 4.22Å; Y161-F169 HydrophobicContact CD1-CE1 4.35Å; Y161-F169 HydrophobicContact CD2-CD1 4.15Å; Y161-F169 HydrophobicContact CD2-CE1 4.04Å; Y161-F169 HydrophobicContact CE1-CD1 4.02Å; Y161-F169 AromaticContact CE2-CD1 3.95Å; Y161-F169 HydrophobicContact CE2-CD1 3.95Å; Y161-F169 HydrophobicContact CE2-CE1 4.29Å; Y161-F169 HydrophobicContact CG-CD1 4.28Å; Y161-F169 HydrophobicContact CG-CE1 4.07Å; Y161-F169 AromaticContact CZ-CD1 3.87Å | ||
| 162 | N | 65 | Low | 64.7 | Low | 93 Ų | 93 | 70.4 Ų | 70.4 | 50% | 0.497 | 33% | 0.331 | S | S | . | . | trans | -62.8 | 121.5 | 172 | -175.3 | -17.2 | 0 | 0 | 0 | 109.5 | K164 H165 | N162-K164 PolarHBondContact O-N 2.91Å; N162-K164 WeakPolarHBondContact OD1-CB 3.48Å; N162-K164 PolarHBondContact OD1-N 3.03Å; N162-H165 PolarHBondContact O-N 3.15Å | ||
| 163 | E | 65.3 | Low | 64.9 | Low | 133 Ų | 133 | 68 Ų | 68 | 62% | 0.621 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.2 | -23.4 | -178.8 | -59.5 | -172.4 | 158.7 | 0 | 0 | 113.3 | Y161 | Y161-E163 PolarHBondContact O-N 3.32Š|
| 164 | K | 66.8 | Low | 65.4 | Low | 134 Ų | 134 | 67.9 Ų | 67.9 | 58% | 0.583 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.1 | -22.9 | 180 | -61.8 | -177 | 178.5 | -179.8 | 0 | 113.8 | W81 N162 | W81-K164 PolarHBondContact N-O 3.46Å; N162-K164 PolarHBondContact O-N 2.91Å; N162-K164 WeakPolarHBondContact OD1-CB 3.48Å; N162-K164 PolarHBondContact OD1-N 3.03Å |
| 165 | H | 71.4 | Confident | 66.2 | Low | 87 Ų | 87 | 66.8 Ų | 66.8 | 40% | 0.403 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -115.2 | 93.9 | -177.2 | -70.5 | -64.6 | 0 | 0 | 0 | 111.6 | N162 | N162-H165 PolarHBondContact O-N 3.15Š|
| 166 | C | 73.9 | Confident | 67 | Low | 2 Ų | 2 | 70.1 Ų | 70.1 | 1% | 0.014 | 34% | 0.339 | C | S | . | . | trans | -81.7 | 165.1 | 178.2 | -170.8 | 0 | 0 | 0 | 0 | 112.4 | Y75 W81 C88 K168 | Y75-C166 HydrophobicContact CD2-CB 4.24Å; Y75-C166 HydrophobicContact CE2-CB 4.05Å; Y75-C166 PolarHBondContact OH-N 3.23Å; Y75-C166 PolarHBondContact OH-O 2.78Å; W81-C166 HydrophobicContact CB-CB 3.88Å; W81-C166 HydrophobicContact CD2-CB 3.89Å; W81-C166 HydrophobicContact CE3-CB 3.91Å; W81-C166 HydrophobicContact CG-CB 3.88Å; C88-C166 WeakPolarHBondContact CA-SG 3.31Å; C88-C166 HydrophobicContact CB-CB 4Å; C88-C166 WeakPolarHBondContact CB-SG 3.47Å; C88-C166 WeakPolarHBondContact SG-CA 3.47Å; C88-C166 WeakPolarHBondContact SG-CB 3.36Å; C88-C166 CovalentContact SG-SG 2.01Å; C88-C166 PolarHBondContact SG-SG 3.16Å; C166-K168 VanDerWaalsContact C-N 3.34Å; C166-K168 PolarHBondContact O-N 3.41Å | ||
| 167 | F | 71.9 | Confident | 67.9 | Low | 14 Ų | 14 | 74.2 Ų | 74.2 | 6% | 0.061 | 36% | 0.355 | C | S | . | . | S | Bend | trans | 68.8 | 16.8 | 174.7 | -47 | -79.6 | 0 | 0 | 0 | 116.4 | R72 Y75 W81 V91 S92 | R72-F167 HydrophobicContact CB-CZ 4.24Å; R72-F167 HydrophobicContact CG-CE1 4.34Å; R72-F167 HydrophobicContact CG-CE2 4.29Å; R72-F167 HydrophobicContact CG-CZ 3.9Å; Y75-F167 AromaticContact CD1-CD2 3.4Å; Y75-F167 HydrophobicContact CD1-CD2 3.4Å; Y75-F167 AromaticContact CD1-CE2 3.44Å; Y75-F167 HydrophobicContact CD1-CE2 3.44Å; Y75-F167 VanDerWaalsContact CD1-CE2 3.44Å; Y75-F167 AromaticContact CE1-CD2 3.47Å; Y75-F167 HydrophobicContact CE1-CD2 3.47Å; Y75-F167 VanDerWaalsContact CE1-CD2 3.47Å; Y75-F167 HydrophobicContact CE1-CE2 4.02Å; Y75-F167 HydrophobicContact CG-CD2 4.06Å; Y75-F167 AromaticContact CG-CE2 3.73Å; Y75-F167 HydrophobicContact CG-CE2 3.73Å; W81-F167 HydrophobicContact CE3-CE2 4.22Å; W81-F167 HydrophobicContact CZ3-CE2 4.04Å; W81-F167 HydrophobicContact CZ3-CZ 4Å; V91-F167 HydrophobicContact CG1-CE1 4.01Å; V91-F167 HydrophobicContact CG1-CZ 3.87Å; S92-F167 VanDerWaalsContact CB-CD1 3.46Å; S92-F167 WeakPolarHBondContact OG-CD1 3.17Å |
| 168 | K | 69 | Low | 68.7 | Low | 114 Ų | 114 | 71 Ų | 71 | 50% | 0.496 | 34% | 0.339 | S | S | . | . | trans | -108.4 | 55.4 | 177.5 | -67 | -175.1 | 179.6 | 176.9 | 0 | 112.7 | Y161 C166 H170 | Y161-K168 VanDerWaalsContact CE1-O 3.3Å; Y161-K168 WeakPolarHBondContact CE1-O 3.26Å; C166-K168 VanDerWaalsContact C-N 3.34Å; C166-K168 PolarHBondContact O-N 3.41Å; K168-H170 PolarHBondContact O-N 2.78Å | ||
| 169 | F | 65.1 | Low | 69.8 | Low | 7 Ų | 7 | 69 Ų | 69 | 3% | 0.031 | 33% | 0.33 | C | S | . | . | trans | -95.7 | 22.2 | -172.5 | -59.7 | -74.7 | 0 | 0 | 0 | 115 | C88 R89 Y155 Y161 K171 E172 | C88-F169 VanDerWaalsContact SG-CZ 3.58Å; R89-F169 HydrophobicContact CG-CE1 4.28Å; R89-F169 HydrophobicContact CG-CZ 4.08Å; Y155-F169 HydrophobicContact CD1-CB 4.34Å; Y155-F169 HydrophobicContact CD1-CD1 4.36Å; Y155-F169 AromaticContact CD1-CD2 3.76Å; Y155-F169 HydrophobicContact CD1-CD2 3.76Å; Y155-F169 HydrophobicContact CD1-CE2 4.01Å; Y155-F169 AromaticContact CD1-CG 3.89Å; Y155-F169 HydrophobicContact CD1-CG 3.89Å; Y155-F169 HydrophobicContact CD1-CZ 4.41Å; Y155-F169 HydrophobicContact CE1-CB 3.86Å; Y155-F169 HydrophobicContact CE1-CD1 4.36Å; Y155-F169 AromaticContact CE1-CD2 3.02Å; Y155-F169 HydrophobicContact CE1-CD2 3.02Å; Y155-F169 AromaticContact CE1-CE2 3.48Å; Y155-F169 HydrophobicContact CE1-CE2 3.48Å; Y155-F169 VanDerWaalsContact CE1-CE2 3.48Å; Y155-F169 AromaticContact CE1-CG 3.49Å; Y155-F169 HydrophobicContact CE1-CG 3.49Å; Y155-F169 VanDerWaalsContact CE1-CG 3.49Å; Y155-F169 HydrophobicContact CE1-CZ 4.31Å; Y155-F169 HydrophobicContact CE2-CB 4.4Å; Y155-F169 AromaticContact CZ-CD2 3.67Å; Y161-F169 HydrophobicContact CD1-CD1 4.22Å; Y161-F169 HydrophobicContact CD1-CE1 4.35Å; Y161-F169 HydrophobicContact CD2-CD1 4.15Å; Y161-F169 HydrophobicContact CD2-CE1 4.04Å; Y161-F169 HydrophobicContact CE1-CD1 4.02Å; Y161-F169 AromaticContact CE2-CD1 3.95Å; Y161-F169 HydrophobicContact CE2-CD1 3.95Å; Y161-F169 HydrophobicContact CE2-CE1 4.29Å; Y161-F169 HydrophobicContact CG-CD1 4.28Å; Y161-F169 HydrophobicContact CG-CE1 4.07Å; Y161-F169 AromaticContact CZ-CD1 3.87Å; F169-K171 VanDerWaalsContact C-N 3.26Å; F169-K171 PolarHBondContact O-N 3.25Å; F169-E172 PolarHBondContact O-N 3.01Å | ||
| 170 | H | 66.5 | Low | 71 | Confident | 35 Ų | 35 | 69.8 Ų | 69.8 | 16% | 0.162 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -65.8 | -24.4 | -171.5 | -52.8 | 102 | 0 | 0 | 0 | 114.7 | K168 E172 L173 Y248 | K168-H170 PolarHBondContact O-N 2.78Å; H170-E172 VanDerWaalsContact C-N 3.28Å; H170-E172 PolarHBondContact O-N 3.11Å; H170-L173 WeakPolarHBondContact O-CB 3.1Å; H170-L173 PolarHBondContact O-N 2.92Å; H170-L173 VanDerWaalsContact O-N 3.15Å; H170-Y248 VanDerWaalsContact CB-OH 3.32Å; H170-Y248 WeakPolarHBondContact CB-OH 2.99Å; H170-Y248 AromaticContact CD2-CZ 3.87Å; H170-Y248 PolarHBondContact CD2-OH 2.88Å; H170-Y248 VanDerWaalsContact CG-OH 3.29Å |
| 171 | K | 66.2 | Low | 72.1 | Confident | 120 Ų | 120 | 63.5 Ų | 63.5 | 52% | 0.522 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -71.8 | -24.6 | -173.6 | -59.1 | 179 | 175.8 | 179.3 | 0 | 112.9 | E159 F169 L173 A174 | E159-K171 WeakPolarHBondContact OE1-CB 3.16Å; E159-K171 WeakPolarHBondContact OE1-CD 3.4Å; E159-K171 WeakPolarHBondContact OE2-CD 3.44Å; E159-K171 WeakPolarHBondContact OE2-CE 3.23Å; E159-K171 IonicContact OE2-NZ 3.87Å; E159-K171 PolarHBondContact OE2-NZ 3.11Å; F169-K171 VanDerWaalsContact C-N 3.26Å; F169-K171 PolarHBondContact O-N 3.25Å; K171-L173 PolarHBondContact O-N 3.31Å; K171-A174 VanDerWaalsContact O-CB 3.22Å; K171-A174 WeakPolarHBondContact O-CB 2.84Å; K171-A174 PolarHBondContact O-N 3.1Å |
| 172 | E | 69 | Low | 73.1 | Confident | 7 Ų | 7 | 63 Ų | 63 | 3% | 0.033 | 31% | 0.31 | C | S | . | . | G | 310 helix | trans | -62.3 | -26 | 172.1 | -59.1 | -67.3 | -173.3 | 0 | 0 | 112.8 | G156 I157 H158 F169 H170 A174 Y175 | G156-E172 WeakPolarHBondContact CA-OE1 3.36Å; I157-E172 PolarHBondContact N-OE1 3.46Å; H158-E172 WeakPolarHBondContact CB-OE1 3.27Å; H158-E172 WeakPolarHBondContact CB-OE2 3.23Å; H158-E172 IonicContact CD2-OE1 2.85Å; H158-E172 IonicContact CD2-OE2 3.63Å; H158-E172 PolarHBondContact CD2-OE2 3.39Å; H158-E172 IonicContact CG-OE1 3.02Å; H158-E172 IonicContact CG-OE2 3.88Å; H158-E172 PolarHBondContact N-OE1 2.97Å; F169-E172 PolarHBondContact O-N 3.01Å; H170-E172 VanDerWaalsContact C-N 3.28Å; H170-E172 PolarHBondContact O-N 3.11Å; E172-A174 PolarHBondContact O-N 2.83Å; E172-Y175 WeakPolarHBondContact O-CD2 3.37Å; E172-Y175 PolarHBondContact O-N 3.44Å; E172-Y175 WeakPolarHBondContact OE2-CE2 3.48Å |
| 173 | L | 68.8 | Low | 74.1 | Confident | 17 Ų | 17 | 61.2 Ų | 61.2 | 9% | 0.089 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -73.6 | -6 | 177.3 | -72.9 | 70 | 0 | 0 | 0 | 112.1 | H170 K171 Y175 K179 Y248 L249 | H170-L173 WeakPolarHBondContact O-CB 3.1Å; H170-L173 PolarHBondContact O-N 2.92Å; H170-L173 VanDerWaalsContact O-N 3.15Å; K171-L173 PolarHBondContact O-N 3.31Å; L173-Y175 VanDerWaalsContact C-N 3.31Å; L173-K179 WeakPolarHBondContact O-CE 3.22Å; L173-K179 WeakPolarHBondContact O-CG 3.47Å; L173-Y248 HydrophobicContact CD2-CD1 4.08Å; L173-Y248 HydrophobicContact CD2-CE1 3.58Å; L173-L249 HydrophobicContact CB-CD2 4.49Å; L173-L249 HydrophobicContact CD2-CD2 3.84Å; L173-L249 HydrophobicContact CG-CD2 4.39Å |
| 174 | A | 68.6 | Low | 75.2 | Confident | 56 Ų | 56 | 60.9 Ų | 60.9 | 46% | 0.463 | 30% | 0.297 | S | S | . | . | G | 310 helix | trans | -71.7 | -27 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | K171 E172 K179 | K171-A174 VanDerWaalsContact O-CB 3.22Å; K171-A174 WeakPolarHBondContact O-CB 2.84Å; K171-A174 PolarHBondContact O-N 3.1Å; E172-A174 PolarHBondContact O-N 2.83Å; A174-K179 WeakPolarHBondContact O-CE 3.39Å; A174-K179 PolarHBondContact O-NZ 3.46Å |
| 175 | Y | 77 | Confident | 76.2 | Confident | 91 Ų | 91 | 56.6 Ų | 56.6 | 36% | 0.357 | 28% | 0.28 | S | S | . | . | S | Bend | trans | -71 | 129.8 | -179 | -65.2 | -72.9 | 0 | 0 | 0 | 112.4 | H158 E172 L173 Y177 V178 K179 | H158-Y175 HydrophobicContact CB-CE2 3.89Å; E172-Y175 WeakPolarHBondContact O-CD2 3.37Å; E172-Y175 PolarHBondContact O-N 3.44Å; E172-Y175 WeakPolarHBondContact OE2-CE2 3.48Å; L173-Y175 VanDerWaalsContact C-N 3.31Å; Y175-Y177 VanDerWaalsContact C-N 3.33Å; Y175-Y177 HydrophobicContact CD1-CE1 4.23Å; Y175-Y177 AromaticContact CG-CE1 3.97Å; Y175-Y177 HydrophobicContact CG-CE1 3.97Å; Y175-Y177 PolarHBondContact O-N 3.01Å; Y175-V178 PolarHBondContact O-N 3.42Å; Y175-V178 VanDerWaalsContact O-N 3.11Å; Y175-K179 WeakPolarHBondContact O-CG 3.43Å; Y175-K179 PolarHBondContact O-N 3.12Å; Y175-K179 VanDerWaalsContact O-N 3.07Å |
| 176 | T | 78.6 | Confident | 77.1 | Confident | 106 Ų | 106 | 52.4 Ų | 52.4 | 65% | 0.65 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -55.2 | -42.7 | -175.4 | -54.3 | 0 | 0 | 0 | 0 | 113.3 | K179 V180 | T176-K179 WeakPolarHBondContact O-CB 3.32Å; T176-K179 PolarHBondContact O-N 3.48Å; T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.39Å |
| 177 | Y | 78.8 | Confident | 77.9 | Confident | 86 Ų | 86 | 57.2 Ų | 57.2 | 34% | 0.337 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -66.9 | -38.4 | 179.7 | 68 | -89.8 | 0 | 0 | 0 | 112.6 | H158 Y175 K179 V180 I181 | H158-Y177 PolarHBondContact NE2-OH 3.24Å; Y175-Y177 VanDerWaalsContact C-N 3.33Å; Y175-Y177 HydrophobicContact CD1-CE1 4.23Å; Y175-Y177 AromaticContact CG-CE1 3.97Å; Y175-Y177 HydrophobicContact CG-CE1 3.97Å; Y175-Y177 PolarHBondContact O-N 3.01Å; Y177-K179 VanDerWaalsContact C-N 3.31Å; Y177-K179 PolarHBondContact O-N 3.19Å; Y177-V180 PolarHBondContact O-N 3.43Å; Y177-I181 WeakPolarHBondContact O-CG1 3.49Å; Y177-I181 PolarHBondContact O-N 3.32Å |
| 178 | V | 78.5 | Confident | 78.8 | Confident | 15 Ų | 15 | 61.7 Ų | 61.7 | 9% | 0.091 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63.7 | -41.7 | 176.3 | -179.3 | 0 | 0 | 0 | 0 | 109.8 | Y175 I181 N182 | Y175-V178 PolarHBondContact O-N 3.42Å; Y175-V178 VanDerWaalsContact O-N 3.11Å; V178-I181 PolarHBondContact O-N 3.45Å; V178-N182 WeakPolarHBondContact O-CB 3.2Å; V178-N182 PolarHBondContact O-N 2.94Å; V178-N182 PolarHBondContact O-ND2 3.36Å |
| 179 | K | 80.3 | Confident | 79.9 | Confident | 36 Ų | 36 | 56.4 Ų | 56.4 | 16% | 0.157 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.6 | -52.4 | 175.6 | -65.9 | 171.7 | 179.1 | 169.7 | 0 | 111.5 | L173 A174 Y175 T176 Y177 I181 N182 Y183 T253 | L173-K179 WeakPolarHBondContact O-CE 3.22Å; L173-K179 WeakPolarHBondContact O-CG 3.47Å; A174-K179 WeakPolarHBondContact O-CE 3.39Å; A174-K179 PolarHBondContact O-NZ 3.46Å; Y175-K179 WeakPolarHBondContact O-CG 3.43Å; Y175-K179 PolarHBondContact O-N 3.12Å; Y175-K179 VanDerWaalsContact O-N 3.07Å; T176-K179 WeakPolarHBondContact O-CB 3.32Å; T176-K179 PolarHBondContact O-N 3.48Å; Y177-K179 VanDerWaalsContact C-N 3.31Å; Y177-K179 PolarHBondContact O-N 3.19Å; K179-I181 VanDerWaalsContact C-N 3.32Å; K179-I181 PolarHBondContact O-N 3.25Å; K179-N182 WeakPolarHBondContact O-CB 3.27Å; K179-N182 PolarHBondContact O-N 3.32Å; K179-N182 VanDerWaalsContact O-N 3.09Å; K179-Y183 VanDerWaalsContact O-CD2 3.22Å; K179-Y183 WeakPolarHBondContact O-CD2 3.41Å; K179-Y183 PolarHBondContact O-N 2.78Å; K179-T253 HydrophobicContact CD-CG2 3.6Å |
| 180 | V | 85 | Confident | 81.2 | Confident | 82 Ų | 82 | 57.5 Ų | 57.5 | 50% | 0.497 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -56.8 | -47.4 | -179.3 | 171.7 | 0 | 0 | 0 | 0 | 110.7 | T176 Y177 N182 Y183 M184 | T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.39Å; Y177-V180 PolarHBondContact O-N 3.43Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 3.4Å; V180-Y183 PolarHBondContact O-N 3.26Å; V180-M184 HydrophobicContact CG1-CG 4.37Å; V180-M184 VanDerWaalsContact O-CG 3.26Å; V180-M184 WeakPolarHBondContact O-CG 3.46Å; V180-M184 PolarHBondContact O-N 3.45Å |
| 181 | I | 83.9 | Confident | 82.5 | Confident | 68 Ų | 68 | 58 Ų | 58 | 35% | 0.349 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59.2 | -44.6 | 176.9 | -68.6 | 168.7 | 0 | 0 | 0 | 111 | L150 Y177 V178 K179 M184 I185 | L150-I181 HydrophobicContact CD2-CG2 4.46Å; Y177-I181 WeakPolarHBondContact O-CG1 3.49Å; Y177-I181 PolarHBondContact O-N 3.32Å; V178-I181 PolarHBondContact O-N 3.45Å; K179-I181 VanDerWaalsContact C-N 3.32Å; K179-I181 PolarHBondContact O-N 3.25Å; I181-M184 PolarHBondContact O-N 2.96Å; I181-I185 HydrophobicContact CG2-CD1 3.72Å; I181-I185 HydrophobicContact CG2-CG1 4.44Å; I181-I185 VanDerWaalsContact O-CG1 3.26Å; I181-I185 WeakPolarHBondContact O-CG1 3.22Å; I181-I185 PolarHBondContact O-N 3.27Å |
| 182 | N | 85.4 | Confident | 83.8 | Confident | 19 Ų | 19 | 54.1 Ų | 54.1 | 10% | 0.102 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 178.2 | -86 | -100.4 | 0 | 0 | 0 | 112.2 | V178 K179 V180 M184 I185 V186 R245 L249 | V178-N182 WeakPolarHBondContact O-CB 3.2Å; V178-N182 PolarHBondContact O-N 2.94Å; V178-N182 PolarHBondContact O-ND2 3.36Å; K179-N182 WeakPolarHBondContact O-CB 3.27Å; K179-N182 PolarHBondContact O-N 3.32Å; K179-N182 VanDerWaalsContact O-N 3.09Å; V180-N182 VanDerWaalsContact C-N 3.33Å; V180-N182 PolarHBondContact O-N 3.4Å; N182-M184 PolarHBondContact O-N 3.04Å; N182-I185 PolarHBondContact O-N 3.39Å; N182-V186 WeakPolarHBondContact O-CB 3.11Å; N182-V186 WeakPolarHBondContact O-CG2 3.48Å; N182-V186 PolarHBondContact O-N 2.92Å; N182-R245 PolarHBondContact OD1-NE 3.45Å; N182-R245 PolarHBondContact OD1-NH2 3.37Å; N182-L249 HydrophobicContact CB-CD1 3.82Å; N182-L249 HydrophobicContact CB-CD2 4.32Å |
| 183 | Y | 87.1 | Confident | 85 | Confident | 57 Ų | 57 | 53.9 Ų | 53.9 | 22% | 0.224 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 176.1 | -80.2 | -71.6 | 0 | 0 | 0 | 112 | K179 V180 I185 V186 I187 I246 L249 N250 | K179-Y183 VanDerWaalsContact O-CD2 3.22Å; K179-Y183 WeakPolarHBondContact O-CD2 3.41Å; K179-Y183 PolarHBondContact O-N 2.78Å; V180-Y183 PolarHBondContact O-N 3.26Å; Y183-I185 VanDerWaalsContact C-N 3.32Å; Y183-I185 PolarHBondContact O-N 3.13Å; Y183-V186 PolarHBondContact O-N 3.47Å; Y183-I187 WeakPolarHBondContact O-CB 3.41Å; Y183-I187 VanDerWaalsContact O-CG1 3.27Å; Y183-I187 WeakPolarHBondContact O-CG1 3.43Å; Y183-I187 PolarHBondContact O-N 3.34Å; Y183-I246 HydrophobicContact CE1-CG2 4.23Å; Y183-L249 HydrophobicContact CD1-CD1 4.37Å; Y183-L249 HydrophobicContact CD2-CD1 4.32Å; Y183-L249 HydrophobicContact CE1-CB 4.33Å; Y183-L249 HydrophobicContact CE1-CD1 4.24Å; Y183-L249 HydrophobicContact CE2-CB 4.04Å; Y183-L249 HydrophobicContact CE2-CD1 4.16Å; Y183-L249 HydrophobicContact CG-CD1 4.41Å; Y183-L249 WeakPolarHBondContact OH-CB 3.49Å; Y183-N250 PolarHBondContact OH-N 2.98Å; Y183-N250 PolarHBondContact OH-OD1 3.29Å |
| 184 | M | 87.9 | Confident | 86.3 | Confident | 126 Ų | 126 | 56.5 Ų | 56.5 | 62% | 0.621 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -59 | -44.5 | 177.4 | -70.2 | -61 | -68.8 | 0 | 0 | 111.5 | V180 I181 N182 F188 | V180-M184 HydrophobicContact CG1-CG 4.37Å; V180-M184 VanDerWaalsContact O-CG 3.26Å; V180-M184 WeakPolarHBondContact O-CG 3.46Å; V180-M184 PolarHBondContact O-N 3.45Å; I181-M184 PolarHBondContact O-N 2.96Å; N182-M184 PolarHBondContact O-N 3.04Å; M184-F188 VanDerWaalsContact O-CB 3.22Å; M184-F188 WeakPolarHBondContact O-CB 3.24Å; M184-F188 PolarHBondContact O-N 3.28Å |
| 185 | I | 87.9 | Confident | 87.5 | Confident | 43 Ų | 43 | 57.8 Ų | 57.8 | 22% | 0.221 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.1 | -46.7 | 177.5 | -67.7 | 166.3 | 0 | 0 | 0 | 110.9 | Y100 I181 N182 Y183 F188 V189 | Y100-I185 HydrophobicContact CD1-CG2 4.23Å; Y100-I185 HydrophobicContact CE1-CG2 3.29Å; Y100-I185 HydrophobicContact CE2-CG2 4.47Å; Y100-I185 VanDerWaalsContact CZ-CG2 3.45Å; Y100-I185 VanDerWaalsContact OH-CG2 3.32Å; Y100-I185 WeakPolarHBondContact OH-CG2 3.18Å; I181-I185 HydrophobicContact CG2-CD1 3.72Å; I181-I185 HydrophobicContact CG2-CG1 4.44Å; I181-I185 VanDerWaalsContact O-CG1 3.26Å; I181-I185 WeakPolarHBondContact O-CG1 3.22Å; I181-I185 PolarHBondContact O-N 3.27Å; N182-I185 PolarHBondContact O-N 3.39Å; Y183-I185 VanDerWaalsContact C-N 3.32Å; Y183-I185 PolarHBondContact O-N 3.13Å; I185-F188 PolarHBondContact O-N 3.08Å; I185-V189 HydrophobicContact CG2-CG2 4.37Å; I185-V189 WeakPolarHBondContact O-CG2 3.5Å; I185-V189 PolarHBondContact O-N 3.32Å |
| 186 | V | 90.1 | Very high | 88.3 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.5 | -48.3 | -178.9 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | N182 Y183 F188 V189 I190 Q242 R245 I246 | N182-V186 WeakPolarHBondContact O-CB 3.11Å; N182-V186 WeakPolarHBondContact O-CG2 3.48Å; N182-V186 PolarHBondContact O-N 2.92Å; Y183-V186 PolarHBondContact O-N 3.47Å; V186-F188 VanDerWaalsContact C-N 3.31Å; V186-F188 PolarHBondContact O-N 3.42Å; V186-V189 PolarHBondContact O-N 3.07Å; V186-I190 HydrophobicContact CG1-CD1 3.83Å; V186-I190 WeakPolarHBondContact O-CG1 3.44Å; V186-I190 PolarHBondContact O-N 3.3Å; V186-Q242 HydrophobicContact CG1-CB 4.17Å; V186-Q242 WeakPolarHBondContact CG1-O 3.33Å; V186-R245 HydrophobicContact CG2-CB 4.23Å; V186-R245 HydrophobicContact CG2-CG 3.92Å; V186-I246 HydrophobicContact CG1-CD1 3.72Å; V186-I246 HydrophobicContact CG1-CG1 3.44Å; V186-I246 VanDerWaalsContact CG1-CG1 3.44Å |
| 187 | I | 90.9 | Very high | 89 | Confident | 103 Ų | 103 | 50.6 Ų | 50.6 | 53% | 0.528 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 177.4 | -68.7 | 167.2 | 0 | 0 | 0 | 110.2 | Y183 I190 A191 | Y183-I187 WeakPolarHBondContact O-CB 3.41Å; Y183-I187 VanDerWaalsContact O-CG1 3.27Å; Y183-I187 WeakPolarHBondContact O-CG1 3.43Å; Y183-I187 PolarHBondContact O-N 3.34Å; I187-I190 PolarHBondContact O-N 2.94Å; I187-A191 VanDerWaalsContact O-CB 3.24Å; I187-A191 WeakPolarHBondContact O-CB 3.22Å; I187-A191 PolarHBondContact O-N 3.32Å |
| 188 | F | 90.6 | Very high | 89.8 | Confident | 108 Ų | 108 | 51 Ų | 51 | 47% | 0.474 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60 | -47.6 | 177.8 | 176.6 | -99.7 | 0 | 0 | 0 | 112.3 | M184 I185 V186 I190 A191 I192 | M184-F188 VanDerWaalsContact O-CB 3.22Å; M184-F188 WeakPolarHBondContact O-CB 3.24Å; M184-F188 PolarHBondContact O-N 3.28Å; I185-F188 PolarHBondContact O-N 3.08Å; V186-F188 VanDerWaalsContact C-N 3.31Å; V186-F188 PolarHBondContact O-N 3.42Å; F188-I190 PolarHBondContact O-N 2.87Å; F188-A191 PolarHBondContact O-N 2.8Å; F188-I192 HydrophobicContact CD2-CG1 4.21Å; F188-I192 HydrophobicContact CE1-CG1 4.18Å; F188-I192 HydrophobicContact CE2-CD1 4.15Å; F188-I192 HydrophobicContact CE2-CG1 3.83Å; F188-I192 HydrophobicContact CZ-CD1 4.3Å; F188-I192 HydrophobicContact CZ-CG1 3.82Å; F188-I192 WeakPolarHBondContact O-CB 3.44Å; F188-I192 VanDerWaalsContact O-CG1 3.31Å; F188-I192 WeakPolarHBondContact O-CG1 3.34Å; F188-I192 PolarHBondContact O-N 3.04Å |
| 189 | V | 90.6 | Very high | 90.3 | Very high | 3 Ų | 3 | 55 Ų | 55 | 2% | 0.018 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.1 | -46 | 179.5 | 173 | 0 | 0 | 0 | 0 | 111.1 | Y100 F103 I185 V186 A193 Q242 | Y100-V189 HydrophobicContact CD1-CG2 4.39Å; Y100-V189 HydrophobicContact CE1-CG2 4.14Å; F103-V189 HydrophobicContact CD1-CG1 4.49Å; F103-V189 HydrophobicContact CD1-CG2 4.26Å; F103-V189 HydrophobicContact CD2-CG1 4.26Å; F103-V189 HydrophobicContact CE1-CB 4.33Å; F103-V189 HydrophobicContact CE1-CG1 4.16Å; F103-V189 HydrophobicContact CE1-CG2 4.04Å; F103-V189 HydrophobicContact CE2-CG1 3.92Å; F103-V189 HydrophobicContact CZ-CB 4.3Å; F103-V189 HydrophobicContact CZ-CG1 3.85Å; F103-V189 HydrophobicContact CZ-CG2 4.5Å; I185-V189 HydrophobicContact CG2-CG2 4.37Å; I185-V189 WeakPolarHBondContact O-CG2 3.5Å; I185-V189 PolarHBondContact O-N 3.32Å; V186-V189 PolarHBondContact O-N 3.07Å; V189-A193 WeakPolarHBondContact O-CB 3.37Å; V189-A193 PolarHBondContact O-N 3.17Å; V189-Q242 HydrophobicContact CB-CG 4.22Å; V189-Q242 HydrophobicContact CG1-CG 3.71Å |
| 190 | I | 93.2 | Very high | 90.8 | Very high | 30 Ų | 30 | 53.3 Ų | 53.3 | 15% | 0.154 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63 | -47.5 | 178.7 | -66.1 | 170.4 | 0 | 0 | 0 | 110.4 | V186 I187 F188 I192 A193 V194 L239 Q242 F243 I246 | V186-I190 HydrophobicContact CG1-CD1 3.83Å; V186-I190 WeakPolarHBondContact O-CG1 3.44Å; V186-I190 PolarHBondContact O-N 3.3Å; I187-I190 PolarHBondContact O-N 2.94Å; F188-I190 PolarHBondContact O-N 2.87Å; I190-I192 PolarHBondContact O-N 3.41Å; I190-A193 PolarHBondContact O-N 3.38Å; I190-V194 HydrophobicContact CG2-CG2 4.43Å; I190-V194 WeakPolarHBondContact O-CG2 3.32Å; I190-V194 PolarHBondContact O-N 3.39Å; I190-L239 HydrophobicContact CG1-CD2 4.08Å; I190-Q242 HydrophobicContact CD1-CB 4.07Å; I190-Q242 HydrophobicContact CG1-CB 3.92Å; I190-F243 HydrophobicContact CD1-CD1 4.28Å; I190-F243 HydrophobicContact CD1-CE1 4.12Å; I190-F243 HydrophobicContact CD1-CZ 4.46Å; I190-F243 HydrophobicContact CG2-CZ 4.48Å; I190-I246 HydrophobicContact CD1-CD1 4.01Å |
| 191 | A | 94.8 | Very high | 91.1 | Very high | 44 Ų | 44 | 53.4 Ų | 53.4 | 36% | 0.364 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -58.9 | -47.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | I187 F188 A193 V194 I195 | I187-A191 VanDerWaalsContact O-CB 3.24Å; I187-A191 WeakPolarHBondContact O-CB 3.22Å; I187-A191 PolarHBondContact O-N 3.32Å; F188-A191 PolarHBondContact O-N 2.8Å; A191-A193 PolarHBondContact O-N 3.46Å; A191-V194 PolarHBondContact O-N 3.05Å; A191-I195 VanDerWaalsContact O-CG1 3.24Å; A191-I195 WeakPolarHBondContact O-CG1 3.42Å; A191-I195 PolarHBondContact O-N 3.46Å |
| 192 | I | 93.5 | Very high | 91.4 | Very high | 39 Ų | 39 | 55.3 Ų | 55.3 | 20% | 0.2 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.7 | -41.1 | 178.3 | -67.2 | -66.9 | 0 | 0 | 0 | 111.3 | F103 V107 F188 I190 V194 I195 L196 | F103-I192 HydrophobicContact CE1-CB 4.39Å; F103-I192 HydrophobicContact CE1-CG2 4.16Å; F103-I192 HydrophobicContact CZ-CB 3.89Å; F103-I192 HydrophobicContact CZ-CG2 3.66Å; V107-I192 HydrophobicContact CG1-CG2 4.08Å; V107-I192 HydrophobicContact CG2-CG2 3.56Å; F188-I192 HydrophobicContact CD2-CG1 4.21Å; F188-I192 HydrophobicContact CE1-CG1 4.18Å; F188-I192 HydrophobicContact CE2-CD1 4.15Å; F188-I192 HydrophobicContact CE2-CG1 3.83Å; F188-I192 HydrophobicContact CZ-CD1 4.3Å; F188-I192 HydrophobicContact CZ-CG1 3.82Å; F188-I192 WeakPolarHBondContact O-CB 3.44Å; F188-I192 VanDerWaalsContact O-CG1 3.31Å; F188-I192 WeakPolarHBondContact O-CG1 3.34Å; F188-I192 PolarHBondContact O-N 3.04Å; I190-I192 PolarHBondContact O-N 3.41Å; I192-V194 PolarHBondContact O-N 3.09Å; I192-I195 PolarHBondContact O-N 3.33Å; I192-L196 HydrophobicContact CG2-CD1 4Å; I192-L196 HydrophobicContact CG2-CG 4.32Å; I192-L196 WeakPolarHBondContact O-CB 3.47Å; I192-L196 VanDerWaalsContact O-CG 3.27Å; I192-L196 WeakPolarHBondContact O-CG 3.2Å; I192-L196 PolarHBondContact O-N 3.06Å |
| 193 | A | 93.8 | Very high | 91.4 | Very high | 2 Ų | 2 | 54.4 Ų | 54.4 | 2% | 0.017 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112 | V189 I190 A191 L196 L197 I234 L239 | V189-A193 WeakPolarHBondContact O-CB 3.37Å; V189-A193 PolarHBondContact O-N 3.17Å; I190-A193 PolarHBondContact O-N 3.38Å; A191-A193 PolarHBondContact O-N 3.46Å; A193-L196 PolarHBondContact O-N 3.4Å; A193-L197 PolarHBondContact O-N 2.98Å; A193-I234 HydrophobicContact CB-CG2 3.83Å; A193-L239 HydrophobicContact CB-CD2 3.93Å; A193-L239 HydrophobicContact CB-CG 4.48Å |
| 194 | V | 95.2 | Very high | 91.3 | Very high | 73 Ų | 73 | 54.4 Ų | 54.4 | 44% | 0.442 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 176.6 | 173 | 0 | 0 | 0 | 0 | 111.1 | I190 A191 I192 L196 L197 V198 | I190-V194 HydrophobicContact CG2-CG2 4.43Å; I190-V194 WeakPolarHBondContact O-CG2 3.32Å; I190-V194 PolarHBondContact O-N 3.39Å; A191-V194 PolarHBondContact O-N 3.05Å; I192-V194 PolarHBondContact O-N 3.09Å; V194-L196 PolarHBondContact O-N 2.99Å; V194-L197 WeakPolarHBondContact O-CB 3.34Å; V194-L197 PolarHBondContact O-N 3.46Å; V194-V198 HydrophobicContact CG1-CG2 4.31Å; V194-V198 WeakPolarHBondContact O-CG2 3.41Å; V194-V198 PolarHBondContact O-N 3.4Å |
| 195 | I | 94.4 | Very high | 91.2 | Very high | 82 Ų | 82 | 53.5 Ų | 53.5 | 42% | 0.421 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.3 | -49.7 | 176.7 | -71.5 | 166.3 | 0 | 0 | 0 | 110.2 | A191 I192 L197 V198 F199 | A191-I195 VanDerWaalsContact O-CG1 3.24Å; A191-I195 WeakPolarHBondContact O-CG1 3.42Å; A191-I195 PolarHBondContact O-N 3.46Å; I192-I195 PolarHBondContact O-N 3.33Å; I195-L197 VanDerWaalsContact C-N 3.28Å; I195-L197 PolarHBondContact O-N 3Å; I195-V198 PolarHBondContact O-N 3.08Å; I195-F199 HydrophobicContact CG2-CD2 3.64Å; I195-F199 HydrophobicContact CG2-CE2 3.76Å; I195-F199 VanDerWaalsContact O-CD2 3.31Å; I195-F199 WeakPolarHBondContact O-CD2 3.35Å; I195-F199 PolarHBondContact O-N 3.31Å |
| 196 | L | 93.6 | Very high | 91 | Very high | 6 Ų | 6 | 54.3 Ų | 54.3 | 3% | 0.031 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.3 | -39.1 | 179.7 | -72.4 | 173.6 | 0 | 0 | 0 | 112.8 | V107 L110 V111 Y114 I192 A193 V194 Q200 I234 | V107-L196 HydrophobicContact CB-CD1 4.35Å; V107-L196 HydrophobicContact CG1-CD1 4.49Å; V107-L196 HydrophobicContact CG2-CD1 3.83Å; L110-L196 HydrophobicContact CB-CD2 3.89Å; L110-L196 HydrophobicContact CD1-CB 4.49Å; L110-L196 HydrophobicContact CD1-CD1 3.83Å; L110-L196 HydrophobicContact CD1-CD2 4.32Å; L110-L196 HydrophobicContact CD1-CG 4.46Å; V111-L196 HydrophobicContact CG2-CD2 4.1Å; Y114-L196 HydrophobicContact CE2-CD2 3.92Å; Y114-L196 PolarHBondContact OH-O 2.94Å; I192-L196 HydrophobicContact CG2-CD1 4Å; I192-L196 HydrophobicContact CG2-CG 4.32Å; I192-L196 WeakPolarHBondContact O-CB 3.47Å; I192-L196 VanDerWaalsContact O-CG 3.27Å; I192-L196 WeakPolarHBondContact O-CG 3.2Å; I192-L196 PolarHBondContact O-N 3.06Å; A193-L196 PolarHBondContact O-N 3.4Å; V194-L196 PolarHBondContact O-N 2.99Å; L196-Q200 WeakPolarHBondContact O-CB 3.43Å; L196-Q200 PolarHBondContact O-N 3.01Å; L196-I234 HydrophobicContact CD1-CD1 4.32Å |
| 197 | L | 93.8 | Very high | 90.4 | Very high | 41 Ų | 41 | 55 Ų | 55 | 22% | 0.215 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.3 | -50.5 | 175.4 | -87.3 | 159.4 | 0 | 0 | 0 | 112.4 | A193 V194 I195 F199 Q200 V201 I231 L235 | A193-L197 PolarHBondContact O-N 2.98Å; V194-L197 WeakPolarHBondContact O-CB 3.34Å; V194-L197 PolarHBondContact O-N 3.46Å; I195-L197 VanDerWaalsContact C-N 3.28Å; I195-L197 PolarHBondContact O-N 3Å; L197-F199 VanDerWaalsContact C-N 3.32Å; L197-F199 PolarHBondContact O-N 3.13Å; L197-Q200 PolarHBondContact O-N 3.42Å; L197-Q200 VanDerWaalsContact O-N 3.14Å; L197-V201 WeakPolarHBondContact O-CG2 3.49Å; L197-V201 PolarHBondContact O-N 3.33Å; L197-I231 HydrophobicContact CD1-CG2 4.34Å; L197-I231 HydrophobicContact CD2-CG2 3.18Å; L197-I231 HydrophobicContact CG-CG2 3.51Å; L197-L235 HydrophobicContact CD1-CD1 3.93Å; L197-L235 HydrophobicContact CD1-CD2 3.46Å; L197-L235 VanDerWaalsContact CD1-CD2 3.46Å; L197-L235 HydrophobicContact CD1-CG 3.88Å; L197-L235 HydrophobicContact CD2-CD1 3.88Å; L197-L235 HydrophobicContact CG-CD1 4.48Å |
| 198 | V | 94.3 | Very high | 89.7 | Confident | 93 Ų | 93 | 54 Ų | 54 | 56% | 0.564 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -60 | -45.5 | 180 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | V194 I195 Q200 V201 F202 | V194-V198 HydrophobicContact CG1-CG2 4.31Å; V194-V198 WeakPolarHBondContact O-CG2 3.41Å; V194-V198 PolarHBondContact O-N 3.4Å; I195-V198 PolarHBondContact O-N 3.08Å; V198-Q200 PolarHBondContact O-N 3.45Å; V198-V201 PolarHBondContact O-N 3.34Å; V198-F202 WeakPolarHBondContact O-CB 3.43Å; V198-F202 PolarHBondContact O-N 2.94Å |
| 199 | F | 90.8 | Very high | 89 | Confident | 99 Ų | 99 | 55.6 Ų | 55.6 | 43% | 0.434 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.2 | -41.5 | 175.1 | -88.9 | -78.8 | 0 | 0 | 0 | 112.4 | Y114 I195 L197 F202 I203 | Y114-F199 HydrophobicContact CD2-CB 3.9Å; Y114-F199 HydrophobicContact CD2-CG 4.48Å; Y114-F199 HydrophobicContact CE2-CB 3.6Å; I195-F199 HydrophobicContact CG2-CD2 3.64Å; I195-F199 HydrophobicContact CG2-CE2 3.76Å; I195-F199 VanDerWaalsContact O-CD2 3.31Å; I195-F199 WeakPolarHBondContact O-CD2 3.35Å; I195-F199 PolarHBondContact O-N 3.31Å; L197-F199 VanDerWaalsContact C-N 3.32Å; L197-F199 PolarHBondContact O-N 3.13Å; F199-F202 PolarHBondContact O-N 3.18Å; F199-I203 VanDerWaalsContact O-CG1 3.28Å; F199-I203 WeakPolarHBondContact O-CG1 3.16Å; F199-I203 PolarHBondContact O-N 2.69Å |
| 200 | Q | 90.7 | Very high | 88.1 | Confident | 1 Ų | 1 | 63.5 Ų | 63.5 | 1% | 0.005 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 177.6 | -173.3 | 61.2 | 21.3 | 0 | 0 | 111.8 | Y114 L196 L197 V198 F202 I203 I204 Q224 I231 | Y114-Q200 WeakPolarHBondContact OH-CB 3.23Å; Y114-Q200 PolarHBondContact OH-OE1 2.86Å; L196-Q200 WeakPolarHBondContact O-CB 3.43Å; L196-Q200 PolarHBondContact O-N 3.01Å; L197-Q200 PolarHBondContact O-N 3.42Å; L197-Q200 VanDerWaalsContact O-N 3.14Å; V198-Q200 PolarHBondContact O-N 3.45Å; Q200-F202 VanDerWaalsContact C-N 3.31Å; Q200-F202 PolarHBondContact O-N 3.25Å; Q200-I203 PolarHBondContact O-N 3.27Å; Q200-I204 HydrophobicContact CG-CD1 3.95Å; Q200-I204 VanDerWaalsContact O-CG1 3.3Å; Q200-I204 WeakPolarHBondContact O-CG1 3.44Å; Q200-I204 PolarHBondContact O-N 3.45Å; Q200-Q224 PolarHBondContact NE2-O 3.43Å; Q200-I231 HydrophobicContact CB-CD1 3.46Å; Q200-I231 VanDerWaalsContact CB-CD1 3.46Å; Q200-I231 HydrophobicContact CG-CD1 3.58Å |
| 201 | V | 90.1 | Very high | 86.5 | Confident | 85 Ų | 85 | 64.6 Ų | 64.6 | 52% | 0.515 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.6 | -44.2 | 178 | 172.1 | 0 | 0 | 0 | 0 | 110 | L197 V198 I203 I204 M205 | L197-V201 WeakPolarHBondContact O-CG2 3.49Å; L197-V201 PolarHBondContact O-N 3.33Å; V198-V201 PolarHBondContact O-N 3.34Å; V201-I203 PolarHBondContact O-N 3.12Å; V201-I204 PolarHBondContact O-N 3.38Å; V201-M205 HydrophobicContact CG1-CG 4.28Å; V201-M205 WeakPolarHBondContact O-CB 3.1Å; V201-M205 VanDerWaalsContact O-CG 3.25Å; V201-M205 WeakPolarHBondContact O-CG 3.12Å; V201-M205 PolarHBondContact O-N 2.97Å |
| 202 | F | 89.8 | Confident | 84.6 | Confident | 107 Ų | 107 | 73.3 Ų | 73.3 | 47% | 0.469 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 175.8 | 178.7 | -107.2 | 0 | 0 | 0 | 112.5 | F118 V198 F199 Q200 I204 M205 L206 | F118-F202 HydrophobicContact CE1-CE1 4.35Å; F118-F202 HydrophobicContact CZ-CD1 4.22Å; F118-F202 HydrophobicContact CZ-CE1 4.12Å; V198-F202 WeakPolarHBondContact O-CB 3.43Å; V198-F202 PolarHBondContact O-N 2.94Å; F199-F202 PolarHBondContact O-N 3.18Å; Q200-F202 VanDerWaalsContact C-N 3.31Å; Q200-F202 PolarHBondContact O-N 3.25Å; F202-I204 PolarHBondContact O-N 2.89Å; F202-M205 PolarHBondContact O-N 2.85Å; F202-L206 HydrophobicContact CD1-CD1 3.93Å; F202-L206 HydrophobicContact CD1-CG 4.49Å; F202-L206 HydrophobicContact CE1-CD1 3.38Å; F202-L206 HydrophobicContact CE1-CG 4.14Å; F202-L206 HydrophobicContact CE2-CD1 4.32Å; F202-L206 HydrophobicContact CE2-CD2 4.39Å; F202-L206 HydrophobicContact CE2-CG 4.25Å; F202-L206 HydrophobicContact CZ-CD1 3.6Å; F202-L206 HydrophobicContact CZ-CD2 4.2Å; F202-L206 HydrophobicContact CZ-CG 4.01Å; F202-L206 WeakPolarHBondContact O-CG 3.42Å; F202-L206 PolarHBondContact O-N 3.21Å |
| 203 | I | 86.4 | Confident | 82.4 | Confident | 0 Ų | 0 | 79.7 Ų | 79.7 | 0% | 0 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 176.1 | -71.6 | 168 | 0 | 0 | 0 | 111.3 | Y114 F117 F118 F199 Q200 V201 M205 L206 M207 Q224 | Y114-I203 HydrophobicContact CD1-CD1 3.49Å; Y114-I203 VanDerWaalsContact CD1-CD1 3.49Å; Y114-I203 HydrophobicContact CD2-CD1 4.44Å; Y114-I203 HydrophobicContact CE1-CD1 4.06Å; Y114-I203 HydrophobicContact CG-CD1 3.74Å; F117-I203 HydrophobicContact CD1-CD1 4.22Å; F117-I203 HydrophobicContact CD1-CG1 3.99Å; F117-I203 HydrophobicContact CD1-CG2 3.94Å; F117-I203 HydrophobicContact CD2-CG2 4.29Å; F117-I203 HydrophobicContact CE1-CB 4.33Å; F117-I203 HydrophobicContact CE1-CG1 4.05Å; F117-I203 HydrophobicContact CE1-CG2 3.72Å; F117-I203 HydrophobicContact CE2-CG2 4.08Å; F117-I203 HydrophobicContact CG-CG2 4.22Å; F117-I203 HydrophobicContact CZ-CG2 3.79Å; F118-I203 HydrophobicContact CE2-CD1 3.87Å; F118-I203 HydrophobicContact CE2-CG1 3.92Å; F118-I203 HydrophobicContact CZ-CD1 4.28Å; F118-I203 HydrophobicContact CZ-CG1 3.79Å; F199-I203 VanDerWaalsContact O-CG1 3.28Å; F199-I203 WeakPolarHBondContact O-CG1 3.16Å; F199-I203 PolarHBondContact O-N 2.69Å; Q200-I203 PolarHBondContact O-N 3.27Å; V201-I203 PolarHBondContact O-N 3.12Å; I203-M205 VanDerWaalsContact C-N 3.35Å; I203-M205 PolarHBondContact O-N 2.83Å; I203-L206 PolarHBondContact O-N 2.96Å; I203-M207 VanDerWaalsContact O-CB 3.28Å; I203-M207 WeakPolarHBondContact O-CB 3.19Å; I203-M207 PolarHBondContact O-N 3.4Å; I203-Q224 HydrophobicContact CG2-CG 4.38Å |
| 204 | I | 84.8 | Confident | 80.3 | Confident | 58 Ų | 58 | 82.8 Ų | 82.8 | 30% | 0.297 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 177.5 | -67.2 | 169.1 | 0 | 0 | 0 | 110.3 | Q200 V201 F202 M207 V208 | Q200-I204 HydrophobicContact CG-CD1 3.95Å; Q200-I204 VanDerWaalsContact O-CG1 3.3Å; Q200-I204 WeakPolarHBondContact O-CG1 3.44Å; Q200-I204 PolarHBondContact O-N 3.45Å; V201-I204 PolarHBondContact O-N 3.38Å; F202-I204 PolarHBondContact O-N 2.89Å; I204-M207 WeakPolarHBondContact O-CB 3.46Å; I204-M207 PolarHBondContact O-N 2.93Å; I204-V208 HydrophobicContact CG2-CG2 4.3Å; I204-V208 WeakPolarHBondContact O-CG2 3.4Å; I204-V208 PolarHBondContact O-N 3.48Å |
| 205 | M | 85.1 | Confident | 78.2 | Confident | 106 Ų | 106 | 86.8 Ų | 86.8 | 52% | 0.522 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.9 | -46.5 | 178.6 | -71.4 | -63.7 | -68.8 | 0 | 0 | 112.1 | V201 F202 I203 M207 V208 Q209 | V201-M205 HydrophobicContact CG1-CG 4.28Å; V201-M205 WeakPolarHBondContact O-CB 3.1Å; V201-M205 VanDerWaalsContact O-CG 3.25Å; V201-M205 WeakPolarHBondContact O-CG 3.12Å; V201-M205 PolarHBondContact O-N 2.97Å; F202-M205 PolarHBondContact O-N 2.85Å; I203-M205 VanDerWaalsContact C-N 3.35Å; I203-M205 PolarHBondContact O-N 2.83Å; M205-M207 VanDerWaalsContact C-N 3.25Å; M205-M207 PolarHBondContact O-N 2.81Å; M205-V208 PolarHBondContact O-N 3.17Å; M205-Q209 WeakPolarHBondContact O-CG 3.4Å; M205-Q209 PolarHBondContact O-N 3.4Å |
| 206 | L | 83.6 | Confident | 76.1 | Confident | 61 Ų | 61 | 88.6 Ų | 88.6 | 32% | 0.319 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.2 | -39.7 | 174 | -73 | 179.7 | 0 | 0 | 0 | 111.8 | F118 F202 I203 K210 | F118-L206 HydrophobicContact CE1-CD1 4.32Å; F202-L206 HydrophobicContact CD1-CD1 3.93Å; F202-L206 HydrophobicContact CD1-CG 4.49Å; F202-L206 HydrophobicContact CE1-CD1 3.38Å; F202-L206 HydrophobicContact CE1-CG 4.14Å; F202-L206 HydrophobicContact CE2-CD1 4.32Å; F202-L206 HydrophobicContact CE2-CD2 4.39Å; F202-L206 HydrophobicContact CE2-CG 4.25Å; F202-L206 HydrophobicContact CZ-CD1 3.6Å; F202-L206 HydrophobicContact CZ-CD2 4.2Å; F202-L206 HydrophobicContact CZ-CG 4.01Å; F202-L206 WeakPolarHBondContact O-CG 3.42Å; F202-L206 PolarHBondContact O-N 3.21Å; I203-L206 PolarHBondContact O-N 2.96Å; L206-K210 WeakPolarHBondContact O-CB 3.47Å; L206-K210 PolarHBondContact O-N 3.37Å; L206-K210 VanDerWaalsContact O-N 3.17Å |
| 207 | M | 78.5 | Confident | 74.4 | Confident | 15 Ų | 15 | 89.3 Ų | 89.3 | 7% | 0.074 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -68 | -46.2 | 180 | -177.5 | 172.1 | 173 | 0 | 0 | 111.4 | I203 I204 M205 Q209 K210 L211 S217 E220 F221 Q224 | I203-M207 VanDerWaalsContact O-CB 3.28Å; I203-M207 WeakPolarHBondContact O-CB 3.19Å; I203-M207 PolarHBondContact O-N 3.4Å; I204-M207 WeakPolarHBondContact O-CB 3.46Å; I204-M207 PolarHBondContact O-N 2.93Å; M205-M207 VanDerWaalsContact C-N 3.25Å; M205-M207 PolarHBondContact O-N 2.81Å; M207-Q209 VanDerWaalsContact C-N 3.33Å; M207-Q209 PolarHBondContact O-N 2.94Å; M207-K210 CarbonylContact O-C 3.6Å; M207-K210 PolarHBondContact O-N 3.03Å; M207-K210 VanDerWaalsContact O-N 3.1Å; M207-L211 HydrophobicContact CE-CD1 3.47Å; M207-L211 VanDerWaalsContact CE-CD1 3.47Å; M207-L211 HydrophobicContact CG-CD1 3.71Å; M207-L211 WeakPolarHBondContact O-CB 3.46Å; M207-L211 PolarHBondContact O-N 3.38Å; M207-S217 VanDerWaalsContact CE-O 3.27Å; M207-S217 WeakPolarHBondContact CE-O 3.1Å; M207-E220 HydrophobicContact CE-CB 3.82Å; M207-E220 HydrophobicContact SD-CB 4.25Å; M207-F221 HydrophobicContact CE-CB 3.82Å; M207-Q224 HydrophobicContact SD-CG 3.93Å |
| 208 | V | 76.3 | Confident | 73 | Confident | 80 Ų | 80 | 92 Ų | 92 | 49% | 0.485 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.2 | -42.5 | 176.7 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | I204 M205 K210 L211 | I204-V208 HydrophobicContact CG2-CG2 4.3Å; I204-V208 WeakPolarHBondContact O-CG2 3.4Å; I204-V208 PolarHBondContact O-N 3.48Å; M205-V208 PolarHBondContact O-N 3.17Å; V208-K210 VanDerWaalsContact C-N 3.26Å; V208-K210 PolarHBondContact O-N 3.42Å; V208-L211 PolarHBondContact O-N 3.18Å |
| 209 | Q | 76.6 | Confident | 71.6 | Confident | 143 Ų | 143 | 95.5 Ų | 95.5 | 67% | 0.668 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -61.3 | -34.5 | 175.6 | -73.4 | 176.3 | -7.3 | 0 | 0 | 112.5 | M205 M207 | M205-Q209 WeakPolarHBondContact O-CG 3.4Å; M205-Q209 PolarHBondContact O-N 3.4Å; M207-Q209 VanDerWaalsContact C-N 3.33Å; M207-Q209 PolarHBondContact O-N 2.94Å |
| 210 | K | 71.4 | Confident | 70.6 | Confident | 168 Ų | 168 | 94.8 Ų | 94.8 | 73% | 0.73 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -87.5 | -19.2 | -179.3 | -151.6 | 170.5 | -171.1 | 174.1 | 0 | 113.6 | L206 M207 V208 R212 | L206-K210 WeakPolarHBondContact O-CB 3.47Å; L206-K210 PolarHBondContact O-N 3.37Å; L206-K210 VanDerWaalsContact O-N 3.17Å; M207-K210 CarbonylContact O-C 3.6Å; M207-K210 PolarHBondContact O-N 3.03Å; M207-K210 VanDerWaalsContact O-N 3.1Å; V208-K210 VanDerWaalsContact C-N 3.26Å; V208-K210 PolarHBondContact O-N 3.42Å; K210-R212 PolarHBondContact O-N 3.35Å |
| 211 | L | 59.3 | Low | 69.6 | Low | 53 Ų | 53 | 96.8 Ų | 96.8 | 28% | 0.277 | 47% | 0.471 | S | S | . | . | G | 310 helix | trans | -68 | -11.9 | -174.9 | -131.6 | 74.2 | 0 | 0 | 0 | 114.6 | M207 V208 H213 S217 | M207-L211 HydrophobicContact CE-CD1 3.47Å; M207-L211 VanDerWaalsContact CE-CD1 3.47Å; M207-L211 HydrophobicContact CG-CD1 3.71Å; M207-L211 WeakPolarHBondContact O-CB 3.46Å; M207-L211 PolarHBondContact O-N 3.38Å; V208-L211 PolarHBondContact O-N 3.18Å; L211-H213 PolarHBondContact O-N 3.39Å; L211-S217 VanDerWaalsContact CD1-CB 3.41Å; L211-S217 VanDerWaalsContact CD1-OG 3.27Å; L211-S217 WeakPolarHBondContact CD1-OG 3.2Å; L211-S217 WeakPolarHBondContact CD2-OG 3.33Å; L211-S217 VanDerWaalsContact CG-OG 3.32Å; L211-S217 WeakPolarHBondContact CG-OG 3.34Å |
| 212 | R | 54.8 | Low | 68.7 | Low | 228 Ų | 228 | 94.8 Ų | 94.8 | 86% | 0.86 | 45% | 0.454 | S | S | * | . | G | 310 helix | trans | -60.1 | -5.2 | 176.8 | -168.8 | 169.5 | 157.7 | 173.6 | -5.2 | 113.5 | K210 | K210-R212 PolarHBondContact O-N 3.35Š|
| 213 | H | 47.3 | Very low | 67.9 | Low | 172 Ų | 172 | 91 Ų | 91 | 80% | 0.796 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -136.9 | 2.1 | -168.7 | -107.5 | -78.5 | 0 | 0 | 0 | 120.1 | L211 | L211-H213 PolarHBondContact O-N 3.39Š|
| 214 | S | 49.1 | Very low | 67.6 | Low | 68 Ų | 68 | 91.7 Ų | 91.7 | 48% | 0.476 | 45% | 0.447 | S | S | . | . | trans | -163.5 | 144.7 | -178.7 | -171.2 | 0 | 0 | 0 | 0 | 118.9 | L216 S217 | S214-L216 PolarHBondContact O-N 3.49Å; S214-L216 PolarHBondContact OG-N 3.2Å; S214-S217 WeakPolarHBondContact O-CB 3.18Å; S214-S217 PolarHBondContact O-N 3.24Å | ||
| 215 | L | 51.3 | Low | 67.3 | Low | 156 Ų | 156 | 91.4 Ų | 91.4 | 82% | 0.817 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.4 | -19.5 | 168.7 | -89.8 | 146.1 | 0 | 0 | 0 | 115.4 | S217 H218 | L215-S217 PolarHBondContact O-N 3.04Å; L215-S217 VanDerWaalsContact O-N 3.16Å; L215-H218 PolarHBondContact O-N 3.41Å |
| 216 | L | 50.9 | Low | 67.1 | Low | 120 Ų | 120 | 90.3 Ų | 90.3 | 63% | 0.628 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -18.1 | 171.9 | -90.7 | 144.4 | 0 | 0 | 0 | 113 | S214 H218 | S214-L216 PolarHBondContact O-N 3.49Å; S214-L216 PolarHBondContact OG-N 3.2Å; L216-H218 VanDerWaalsContact C-N 3.31Å; L216-H218 PolarHBondContact O-N 3.35Å |
| 217 | S | 57.7 | Low | 67.1 | Low | 22 Ų | 22 | 87.5 Ų | 87.5 | 15% | 0.154 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -47.2 | -44.8 | 171.1 | 159.7 | 0 | 0 | 0 | 0 | 114.2 | M207 L211 S214 L215 Q219 E220 F221 | M207-S217 VanDerWaalsContact CE-O 3.27Å; M207-S217 WeakPolarHBondContact CE-O 3.1Å; L211-S217 VanDerWaalsContact CD1-CB 3.41Å; L211-S217 VanDerWaalsContact CD1-OG 3.27Å; L211-S217 WeakPolarHBondContact CD1-OG 3.2Å; L211-S217 WeakPolarHBondContact CD2-OG 3.33Å; L211-S217 VanDerWaalsContact CG-OG 3.32Å; L211-S217 WeakPolarHBondContact CG-OG 3.34Å; S214-S217 WeakPolarHBondContact O-CB 3.18Å; S214-S217 PolarHBondContact O-N 3.24Å; L215-S217 PolarHBondContact O-N 3.04Å; L215-S217 VanDerWaalsContact O-N 3.16Å; S217-Q219 PolarHBondContact O-N 3.37Å; S217-E220 PolarHBondContact O-N 3.34Å; S217-F221 WeakPolarHBondContact O-CB 3.41Å; S217-F221 PolarHBondContact O-N 3.16Å |
| 218 | H | 63.8 | Low | 67.5 | Low | 97 Ų | 97 | 90.6 Ų | 90.6 | 45% | 0.449 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66.3 | -44.2 | -166.7 | -99.7 | -77.2 | 0 | 0 | 0 | 112.9 | L215 L216 F221 W222 | L215-H218 PolarHBondContact O-N 3.41Å; L216-H218 VanDerWaalsContact C-N 3.31Å; L216-H218 PolarHBondContact O-N 3.35Å; H218-F221 PolarHBondContact O-N 3.49Å; H218-W222 PolarHBondContact O-N 3.02Å; H218-W222 VanDerWaalsContact O-N 3.16Å |
| 219 | Q | 65.3 | Low | 68.1 | Low | 167 Ų | 167 | 89.6 Ų | 89.6 | 78% | 0.78 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -70.8 | -39 | -178.7 | -177.7 | 173.1 | -29.4 | 0 | 0 | 112 | S217 F221 A223 | S217-Q219 PolarHBondContact O-N 3.37Å; Q219-F221 VanDerWaalsContact C-N 3.31Å; Q219-A223 PolarHBondContact O-N 3.23Å |
| 220 | E | 69.2 | Low | 68.7 | Low | 84 Ų | 84 | 83.1 Ų | 83.1 | 39% | 0.393 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.7 | -35.5 | 175.1 | -66.5 | -175 | 170.3 | 0 | 0 | 111 | M207 S217 A223 Q224 | M207-E220 HydrophobicContact CE-CB 3.82Å; M207-E220 HydrophobicContact SD-CB 4.25Å; S217-E220 PolarHBondContact O-N 3.34Å; E220-A223 WeakPolarHBondContact O-CB 3.33Å; E220-A223 PolarHBondContact O-N 3.43Å; E220-A223 VanDerWaalsContact O-N 3.13Å; E220-Q224 WeakPolarHBondContact O-CG 3.32Å; E220-Q224 PolarHBondContact O-N 3.15Å |
| 221 | F | 70.9 | Confident | 69.7 | Low | 42 Ų | 42 | 75.3 Ų | 75.3 | 18% | 0.184 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.6 | -46.9 | 179 | 175.3 | -97.6 | 0 | 0 | 0 | 111.1 | M207 S217 H218 Q219 A223 Q224 L225 W299 | M207-F221 HydrophobicContact CE-CB 3.82Å; S217-F221 WeakPolarHBondContact O-CB 3.41Å; S217-F221 PolarHBondContact O-N 3.16Å; H218-F221 PolarHBondContact O-N 3.49Å; Q219-F221 VanDerWaalsContact C-N 3.31Å; F221-A223 PolarHBondContact O-N 3.23Å; F221-Q224 PolarHBondContact O-N 2.64Å; F221-Q224 VanDerWaalsContact O-N 3.1Å; F221-L225 PolarHBondContact O-N 3.31Å; F221-W299 HydrophobicContact CE2-CD2 4.43Å; F221-W299 HydrophobicContact CE2-CE3 4.08Å; F221-W299 AromaticContact CE2-CH2 3.89Å; F221-W299 HydrophobicContact CE2-CH2 3.89Å; F221-W299 HydrophobicContact CE2-CZ2 4.24Å; F221-W299 AromaticContact CE2-CZ3 3.8Å; F221-W299 HydrophobicContact CE2-CZ3 3.8Å; F221-W299 HydrophobicContact CZ-CD2 4.25Å; F221-W299 AromaticContact CZ-CE3 3.91Å; F221-W299 HydrophobicContact CZ-CE3 3.91Å; F221-W299 HydrophobicContact CZ-CZ3 4.07Å |
| 222 | W | 71.4 | Confident | 71.3 | Confident | 43 Ų | 43 | 74 Ų | 74 | 16% | 0.163 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -61 | -30.6 | 174.6 | -73.7 | 114.7 | 0 | 0 | 0 | 112.6 | H218 L225 K226 K292 I295 I296 | H218-W222 PolarHBondContact O-N 3.02Å; H218-W222 VanDerWaalsContact O-N 3.16Å; W222-L225 HydrophobicContact CE3-CD2 3.92Å; W222-L225 HydrophobicContact CZ3-CD2 3.64Å; W222-K226 VanDerWaalsContact O-CG 3.32Å; W222-K226 WeakPolarHBondContact O-CG 3.39Å; W222-K226 PolarHBondContact O-N 3.39Å; W222-K292 HydrophobicContact CE3-CG 4.15Å; W222-K292 HydrophobicContact CH2-CB 3.54Å; W222-K292 HydrophobicContact CH2-CD 4.48Å; W222-K292 HydrophobicContact CH2-CG 3.54Å; W222-K292 HydrophobicContact CZ2-CB 3.76Å; W222-K292 HydrophobicContact CZ2-CD 4.4Å; W222-K292 HydrophobicContact CZ2-CG 3.88Å; W222-K292 HydrophobicContact CZ3-CB 4.15Å; W222-K292 HydrophobicContact CZ3-CG 3.63Å; W222-I295 HydrophobicContact CH2-CB 4.32Å; W222-I295 HydrophobicContact CH2-CG2 4.36Å; W222-I296 HydrophobicContact CZ2-CD1 4.13Å; W222-I296 HydrophobicContact CZ2-CG1 4.07Å |
| 223 | A | 72.8 | Confident | 73.1 | Confident | 29 Ų | 29 | 63.9 Ų | 63.9 | 24% | 0.24 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.2 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q219 E220 F221 K226 N227 | Q219-A223 PolarHBondContact O-N 3.23Å; E220-A223 WeakPolarHBondContact O-CB 3.33Å; E220-A223 PolarHBondContact O-N 3.43Å; E220-A223 VanDerWaalsContact O-N 3.13Å; F221-A223 PolarHBondContact O-N 3.23Å; A223-K226 PolarHBondContact O-N 2.59Å; A223-N227 PolarHBondContact O-N 3.44Å; A223-N227 PolarHBondContact O-OD1 3.34Å |
| 224 | Q | 79 | Confident | 75.3 | Confident | 14 Ų | 14 | 55.9 Ų | 55.9 | 7% | 0.065 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67.6 | -36.9 | 177 | -61.3 | -48.9 | -29.4 | 0 | 0 | 112.8 | Q200 I203 M207 E220 F221 K226 N227 L228 | Q200-Q224 PolarHBondContact NE2-O 3.43Å; I203-Q224 HydrophobicContact CG2-CG 4.38Å; M207-Q224 HydrophobicContact SD-CG 3.93Å; E220-Q224 WeakPolarHBondContact O-CG 3.32Å; E220-Q224 PolarHBondContact O-N 3.15Å; F221-Q224 PolarHBondContact O-N 2.64Å; F221-Q224 VanDerWaalsContact O-N 3.1Å; Q224-K226 VanDerWaalsContact C-N 3.3Å; Q224-K226 PolarHBondContact O-N 3.07Å; Q224-N227 WeakPolarHBondContact O-CB 3.38Å; Q224-N227 PolarHBondContact O-N 2.97Å; Q224-N227 VanDerWaalsContact O-N 3.16Å; Q224-N227 PolarHBondContact OE1-ND2 3.14Å; Q224-L228 PolarHBondContact O-N 2.92Å |
| 225 | L | 79.1 | Confident | 77.4 | Confident | 52 Ų | 52 | 55.7 Ų | 55.7 | 27% | 0.272 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 175.5 | -175.5 | 64.5 | 0 | 0 | 0 | 111.8 | F221 W222 L228 F229 I295 | F221-L225 PolarHBondContact O-N 3.31Å; W222-L225 HydrophobicContact CE3-CD2 3.92Å; W222-L225 HydrophobicContact CZ3-CD2 3.64Å; L225-L228 PolarHBondContact O-N 3.02Å; L225-F229 PolarHBondContact O-N 2.75Å; L225-I295 HydrophobicContact CD2-CD1 3.73Å; L225-I295 HydrophobicContact CD2-CG2 4.39Å |
| 226 | K | 80.5 | Confident | 79.3 | Confident | 82 Ų | 82 | 53.1 Ų | 53.1 | 36% | 0.357 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -65.2 | -37.7 | 173.6 | -72.4 | 173.7 | -178.6 | -174.6 | 0 | 112.4 | W222 A223 Q224 F229 F230 F283 | W222-K226 VanDerWaalsContact O-CG 3.32Å; W222-K226 WeakPolarHBondContact O-CG 3.39Å; W222-K226 PolarHBondContact O-N 3.39Å; A223-K226 PolarHBondContact O-N 2.59Å; Q224-K226 VanDerWaalsContact C-N 3.3Å; Q224-K226 PolarHBondContact O-N 3.07Å; K226-F229 WeakPolarHBondContact O-CB 3.25Å; K226-F229 PolarHBondContact O-N 2.96Å; K226-F230 WeakPolarHBondContact O-CD2 3.47Å; K226-F230 PolarHBondContact O-N 3.13Å; K226-F283 HydrophobicContact CB-CE2 4.47Å; K226-F283 HydrophobicContact CD-CE2 4.05Å; K226-F283 HydrophobicContact CD-CZ 4.34Å; K226-F283 HydrophobicContact CG-CE2 4.14Å |
| 227 | N | 84.9 | Confident | 81.3 | Confident | 3 Ų | 3 | 47.8 Ų | 47.8 | 2% | 0.016 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.5 | -43.9 | 173.9 | -64.9 | -12.6 | 0 | 0 | 0 | 110.9 | L110 A223 Q224 F229 F230 I231 | L110-N227 HydrophobicContact CD2-CB 3.65Å; A223-N227 PolarHBondContact O-N 3.44Å; A223-N227 PolarHBondContact O-OD1 3.34Å; Q224-N227 WeakPolarHBondContact O-CB 3.38Å; Q224-N227 PolarHBondContact O-N 2.97Å; Q224-N227 VanDerWaalsContact O-N 3.16Å; Q224-N227 PolarHBondContact OE1-ND2 3.14Å; N227-F229 VanDerWaalsContact C-N 3.26Å; N227-F229 PolarHBondContact O-N 3.17Å; N227-F230 PolarHBondContact O-N 3.32Å; N227-I231 WeakPolarHBondContact O-CG1 3.5Å; N227-I231 PolarHBondContact O-N 3.4Å; N227-I231 VanDerWaalsContact O-N 3.09Å |
| 228 | L | 86.6 | Confident | 83 | Confident | 80 Ų | 80 | 46.8 Ų | 46.8 | 42% | 0.419 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -60.5 | -36.4 | 176.8 | -171.8 | 67.4 | 0 | 0 | 0 | 112.1 | Q224 L225 I231 G232 | Q224-L228 PolarHBondContact O-N 2.92Å; L225-L228 PolarHBondContact O-N 3.02Å; L228-I231 PolarHBondContact O-N 3.06Å; L228-G232 PolarHBondContact O-N 3.15Å |
| 229 | F | 89.1 | Confident | 84.4 | Confident | 59 Ų | 59 | 43 Ų | 43 | 26% | 0.259 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -57.4 | -52.5 | 173.8 | 171.3 | -97.2 | 0 | 0 | 0 | 111.9 | L225 K226 N227 I231 G232 V233 D279 L282 F283 | L225-F229 PolarHBondContact O-N 2.75Å; K226-F229 WeakPolarHBondContact O-CB 3.25Å; K226-F229 PolarHBondContact O-N 2.96Å; N227-F229 VanDerWaalsContact C-N 3.26Å; N227-F229 PolarHBondContact O-N 3.17Å; F229-I231 VanDerWaalsContact C-N 3.3Å; F229-I231 PolarHBondContact O-N 2.66Å; F229-G232 WeakPolarHBondContact O-CA 3.25Å; F229-G232 PolarHBondContact O-N 2.94Å; F229-G232 VanDerWaalsContact O-N 3.1Å; F229-V233 HydrophobicContact CE1-CG2 4.09Å; F229-V233 HydrophobicContact CE2-CG2 4.25Å; F229-V233 HydrophobicContact CZ-CG2 3.88Å; F229-V233 WeakPolarHBondContact O-CG2 3.41Å; F229-V233 PolarHBondContact O-N 2.93Å; F229-D279 HydrophobicContact CE1-CB 4.28Å; F229-D279 HydrophobicContact CZ-CB 4.32Å; F229-D279 WeakPolarHBondContact CZ-O 3.31Å; F229-L282 HydrophobicContact CE2-CB 3.63Å; F229-L282 HydrophobicContact CE2-CD1 4.18Å; F229-L282 HydrophobicContact CZ-CB 3.52Å; F229-L282 HydrophobicContact CZ-CD1 4.27Å; F229-F283 HydrophobicContact CD1-CD2 4.49Å; F229-F283 HydrophobicContact CE1-CB 4.19Å |
| 230 | F | 89.2 | Confident | 85.7 | Confident | 7 Ų | 7 | 37.1 Ų | 37.1 | 3% | 0.031 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.2 | -38.5 | 178.8 | -68.8 | -64.9 | 0 | 0 | 0 | 112.5 | L58 Y106 I109 L110 K226 N227 G232 V233 I234 F283 | L58-F230 HydrophobicContact CD1-CE1 4.49Å; Y106-F230 AromaticContact CD1-CD1 3.71Å; Y106-F230 HydrophobicContact CD1-CD1 3.71Å; Y106-F230 HydrophobicContact CD1-CE1 4.26Å; Y106-F230 HydrophobicContact CD1-CG 4.43Å; Y106-F230 AromaticContact CE1-CD1 3.56Å; Y106-F230 HydrophobicContact CE1-CD1 3.56Å; Y106-F230 AromaticContact CE1-CE1 3.91Å; Y106-F230 HydrophobicContact CE1-CE1 3.91Å; Y106-F230 HydrophobicContact CG-CD1 4.42Å; I109-F230 HydrophobicContact CG2-CD2 4.36Å; I109-F230 HydrophobicContact CG2-CE2 4.32Å; L110-F230 HydrophobicContact CD2-CB 4.44Å; K226-F230 WeakPolarHBondContact O-CD2 3.47Å; K226-F230 PolarHBondContact O-N 3.13Å; N227-F230 PolarHBondContact O-N 3.32Å; F230-G232 VanDerWaalsContact C-N 3.34Å; F230-V233 PolarHBondContact O-N 2.96Å; F230-I234 WeakPolarHBondContact O-CG1 3.43Å; F230-I234 PolarHBondContact O-N 2.81Å; F230-F283 HydrophobicContact CE2-CD2 4.3Å; F230-F283 HydrophobicContact CE2-CE2 4.16Å; F230-F283 AromaticContact CZ-CD2 3.89Å; F230-F283 HydrophobicContact CZ-CD2 3.89Å; F230-F283 HydrophobicContact CZ-CE2 4.05Å |
| 231 | I | 92 | Very high | 86.9 | Confident | 3 Ų | 3 | 33.2 Ų | 33.2 | 2% | 0.015 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.1 | -41 | 174.5 | -67.1 | 168.9 | 0 | 0 | 0 | 111.2 | L110 Y114 L197 Q200 N227 L228 F229 V233 I234 L235 | L110-I231 HydrophobicContact CD1-CD1 4.35Å; L110-I231 HydrophobicContact CD1-CG1 3.57Å; L110-I231 HydrophobicContact CD2-CD1 4.16Å; L110-I231 HydrophobicContact CD2-CG1 3.98Å; L110-I231 HydrophobicContact CG-CG1 4.45Å; Y114-I231 WeakPolarHBondContact OH-CD1 3.32Å; L197-I231 HydrophobicContact CD1-CG2 4.34Å; L197-I231 HydrophobicContact CD2-CG2 3.18Å; L197-I231 HydrophobicContact CG-CG2 3.51Å; Q200-I231 HydrophobicContact CB-CD1 3.46Å; Q200-I231 VanDerWaalsContact CB-CD1 3.46Å; Q200-I231 HydrophobicContact CG-CD1 3.58Å; N227-I231 WeakPolarHBondContact O-CG1 3.5Å; N227-I231 PolarHBondContact O-N 3.4Å; N227-I231 VanDerWaalsContact O-N 3.09Å; L228-I231 PolarHBondContact O-N 3.06Å; F229-I231 VanDerWaalsContact C-N 3.3Å; F229-I231 PolarHBondContact O-N 2.66Å; I231-V233 VanDerWaalsContact C-N 3.31Å; I231-V233 PolarHBondContact O-N 3.44Å; I231-I234 WeakPolarHBondContact O-CB 3.43Å; I231-I234 PolarHBondContact O-N 3.22Å; I231-L235 HydrophobicContact CG2-CD1 4.38Å; I231-L235 HydrophobicContact CG2-CG 4.49Å; I231-L235 WeakPolarHBondContact O-CG 3.22Å; I231-L235 PolarHBondContact O-N 3.23Å |
| 232 | G | 91.7 | Very high | 87.9 | Confident | 27 Ų | 27 | 31.2 Ų | 31.2 | 28% | 0.278 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -58.9 | -41.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L228 F229 F230 L235 V236 | L228-G232 PolarHBondContact O-N 3.15Å; F229-G232 WeakPolarHBondContact O-CA 3.25Å; F229-G232 PolarHBondContact O-N 2.94Å; F229-G232 VanDerWaalsContact O-N 3.1Å; F230-G232 VanDerWaalsContact C-N 3.34Å; G232-L235 PolarHBondContact O-N 3.36Å; G232-V236 WeakPolarHBondContact O-CB 3.46Å; G232-V236 WeakPolarHBondContact O-CG2 3.3Å; G232-V236 PolarHBondContact O-N 3.05Å |
| 233 | V | 92.5 | Very high | 89 | Confident | 14 Ų | 14 | 34.7 Ų | 34.7 | 9% | 0.085 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -62.1 | -43.8 | 174.2 | 179.4 | 0 | 0 | 0 | 0 | 111.2 | Y106 F229 F230 I231 L235 V236 C237 D279 | Y106-V233 HydrophobicContact CE2-CB 4.21Å; Y106-V233 HydrophobicContact CE2-CG1 3.76Å; F229-V233 HydrophobicContact CE1-CG2 4.09Å; F229-V233 HydrophobicContact CE2-CG2 4.25Å; F229-V233 HydrophobicContact CZ-CG2 3.88Å; F229-V233 WeakPolarHBondContact O-CG2 3.41Å; F229-V233 PolarHBondContact O-N 2.93Å; F230-V233 PolarHBondContact O-N 2.96Å; I231-V233 VanDerWaalsContact C-N 3.31Å; I231-V233 PolarHBondContact O-N 3.44Å; V233-L235 VanDerWaalsContact C-N 3.35Å; V233-L235 PolarHBondContact O-N 3.33Å; V233-V236 PolarHBondContact O-N 2.88Å; V233-C237 HydrophobicContact CG1-CB 4.36Å; V233-C237 WeakPolarHBondContact O-CB 3.48Å; V233-C237 PolarHBondContact O-N 3.36Å; V233-D279 HydrophobicContact CG2-CB 4.33Å |
| 234 | I | 93.4 | Very high | 89.9 | Confident | 4 Ų | 4 | 34.9 Ų | 34.9 | 2% | 0.021 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -58.7 | -47.5 | 175.4 | -66.5 | 169 | 0 | 0 | 0 | 110.8 | F103 Y106 L110 A193 L196 F230 I231 F238 L239 | F103-I234 HydrophobicContact CD2-CD1 4.37Å; F103-I234 HydrophobicContact CD2-CG1 4.33Å; F103-I234 HydrophobicContact CD2-CG2 4.24Å; F103-I234 HydrophobicContact CE2-CD1 4.37Å; F103-I234 HydrophobicContact CE2-CG2 4.01Å; Y106-I234 HydrophobicContact CD2-CD1 4.17Å; Y106-I234 HydrophobicContact CD2-CG1 3.69Å; Y106-I234 HydrophobicContact CE2-CG1 4.47Å; L110-I234 HydrophobicContact CD1-CD1 4.19Å; A193-I234 HydrophobicContact CB-CG2 3.83Å; L196-I234 HydrophobicContact CD1-CD1 4.32Å; F230-I234 WeakPolarHBondContact O-CG1 3.43Å; F230-I234 PolarHBondContact O-N 2.81Å; I231-I234 WeakPolarHBondContact O-CB 3.43Å; I231-I234 PolarHBondContact O-N 3.22Å; I234-F238 HydrophobicContact CB-CD2 4.31Å; I234-F238 HydrophobicContact CG1-CD2 4.11Å; I234-F238 HydrophobicContact CG1-CE2 4.35Å; I234-F238 HydrophobicContact CG2-CD2 4.35Å; I234-F238 WeakPolarHBondContact O-CA 3.3Å; I234-F238 WeakPolarHBondContact O-CB 3.49Å; I234-F238 PolarHBondContact O-N 3.29Å; I234-L239 PolarHBondContact O-N 3.12Å; I234-L239 VanDerWaalsContact O-N 3.11Å |
| 235 | L | 93.2 | Very high | 90.4 | Very high | 65 Ų | 65 | 35 Ų | 35 | 34% | 0.34 | 18% | 0.184 | S | C | . | . | I | π-helix | trans | -63.1 | -42.2 | -178.6 | -79.4 | -177.9 | 0 | 0 | 0 | 113 | L197 I231 G232 V233 L239 P240 | L197-L235 HydrophobicContact CD1-CD1 3.93Å; L197-L235 HydrophobicContact CD1-CD2 3.46Å; L197-L235 VanDerWaalsContact CD1-CD2 3.46Å; L197-L235 HydrophobicContact CD1-CG 3.88Å; L197-L235 HydrophobicContact CD2-CD1 3.88Å; L197-L235 HydrophobicContact CG-CD1 4.48Å; I231-L235 HydrophobicContact CG2-CD1 4.38Å; I231-L235 HydrophobicContact CG2-CG 4.49Å; I231-L235 WeakPolarHBondContact O-CG 3.22Å; I231-L235 PolarHBondContact O-N 3.23Å; G232-L235 PolarHBondContact O-N 3.36Å; V233-L235 VanDerWaalsContact C-N 3.35Å; V233-L235 PolarHBondContact O-N 3.33Å; L235-L239 HydrophobicContact CD2-CD1 3.31Å; L235-L239 HydrophobicContact CD2-CG 4.19Å; L235-P240 WeakPolarHBondContact O-CD 3.32Å |
| 236 | V | 91.9 | Very high | 90.9 | Very high | 101 Ų | 101 | 34.8 Ų | 34.8 | 61% | 0.612 | 18% | 0.183 | S | C | * | . | I | π-helix | trans | -86.3 | -40.3 | -174 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | G232 V233 P240 | G232-V236 WeakPolarHBondContact O-CB 3.46Å; G232-V236 WeakPolarHBondContact O-CG2 3.3Å; G232-V236 PolarHBondContact O-N 3.05Å; V233-V236 PolarHBondContact O-N 2.88Å; V236-P240 WeakPolarHBondContact O-CG 3.45Å |
| 237 | C | 92.7 | Very high | 91.3 | Very high | 9 Ų | 9 | 36.9 Ų | 36.9 | 6% | 0.061 | 19% | 0.189 | C | C | . | . | I | π-helix | trans | -91.8 | -34.6 | -173 | -59.7 | 0 | 0 | 0 | 0 | 112.7 | V233 T273 | V233-C237 HydrophobicContact CG1-CB 4.36Å; V233-C237 WeakPolarHBondContact O-CB 3.48Å; V233-C237 PolarHBondContact O-N 3.36Å; C237-T273 WeakPolarHBondContact O-CA 3.33Å; C237-T273 VanDerWaalsContact O-CG2 3.3Å; C237-T273 WeakPolarHBondContact O-CG2 3.48Å |
| 238 | F | 93.2 | Very high | 91.3 | Very high | 1 Ų | 1 | 37 Ų | 37 | 0% | 0.004 | 19% | 0.19 | C | C | . | . | I | π-helix | trans | -105.8 | -46.8 | -169.3 | -55.1 | -26.5 | 0 | 0 | 0 | 113.3 | M99 T102 F103 Y106 I234 P240 Y241 Q242 T273 | M99-F238 HydrophobicContact CG-CD1 3.91Å; M99-F238 HydrophobicContact CG-CE1 4.13Å; M99-F238 HydrophobicContact CG-CG 4.46Å; T102-F238 HydrophobicContact CG2-CE2 4.4Å; T102-F238 HydrophobicContact CG2-CZ 3.83Å; F103-F238 HydrophobicContact CB-CD2 4.13Å; F103-F238 HydrophobicContact CB-CE2 4Å; F103-F238 HydrophobicContact CD2-CD2 4Å; F103-F238 HydrophobicContact CD2-CE2 4.47Å; Y106-F238 AromaticContact CD2-CE2 3.92Å; Y106-F238 HydrophobicContact CD2-CE2 3.92Å; Y106-F238 AromaticContact CE2-CE2 3.84Å; Y106-F238 HydrophobicContact CE2-CE2 3.84Å; Y106-F238 HydrophobicContact CE2-CZ 4.11Å; I234-F238 HydrophobicContact CB-CD2 4.31Å; I234-F238 HydrophobicContact CG1-CD2 4.11Å; I234-F238 HydrophobicContact CG1-CE2 4.35Å; I234-F238 HydrophobicContact CG2-CD2 4.35Å; I234-F238 WeakPolarHBondContact O-CA 3.3Å; I234-F238 WeakPolarHBondContact O-CB 3.49Å; I234-F238 PolarHBondContact O-N 3.29Å; F238-P240 VanDerWaalsContact C-CD 3.48Å; F238-Y241 PolarHBondContact O-N 3.44Å; F238-Q242 WeakPolarHBondContact O-CG 3.38Å; F238-Q242 PolarHBondContact O-N 3.2Å; F238-Q242 VanDerWaalsContact O-N 3.11Å; F238-T273 HydrophobicContact CD1-CG2 4.27Å |
| 239 | L | 93.4 | Very high | 91.2 | Very high | 17 Ų | 17 | 33.3 Ų | 33.3 | 9% | 0.089 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -58.6 | -41.1 | -176.7 | -74.6 | -163.5 | 0 | 0 | 0 | 114.9 | I190 A193 I234 L235 Y241 Q242 F243 | I190-L239 HydrophobicContact CG1-CD2 4.08Å; A193-L239 HydrophobicContact CB-CD2 3.93Å; A193-L239 HydrophobicContact CB-CG 4.48Å; I234-L239 PolarHBondContact O-N 3.12Å; I234-L239 VanDerWaalsContact O-N 3.11Å; L235-L239 HydrophobicContact CD2-CD1 3.31Å; L235-L239 HydrophobicContact CD2-CG 4.19Å; L239-Y241 PolarHBondContact O-N 2.98Å; L239-Q242 PolarHBondContact O-N 3.08Å; L239-F243 HydrophobicContact CB-CD2 4.3Å; L239-F243 HydrophobicContact CB-CE2 4.15Å; L239-F243 HydrophobicContact CD1-CE2 4.24Å; L239-F243 WeakPolarHBondContact O-CD2 3.37Å; L239-F243 PolarHBondContact O-N 3.24Å |
| 240 | P | 93.9 | Very high | 90.9 | Very high | 44 Ų | 44 | 33.8 Ų | 33.8 | 29% | 0.286 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -59.2 | -39.8 | -179.2 | -26 | 36.9 | 0 | 0 | 0 | 111.6 | L235 V236 F238 F244 F269 | L235-P240 WeakPolarHBondContact O-CD 3.32Å; V236-P240 WeakPolarHBondContact O-CG 3.45Å; F238-P240 VanDerWaalsContact C-CD 3.48Å; P240-F244 VanDerWaalsContact O-CB 3.32Å; P240-F244 WeakPolarHBondContact O-CB 3.41Å; P240-F244 PolarHBondContact O-N 3.49Å; P240-F269 HydrophobicContact CB-CD1 3.92Å; P240-F269 HydrophobicContact CB-CE1 3.96Å |
| 241 | Y | 93.4 | Very high | 90.6 | Very high | 1 Ų | 1 | 35 Ų | 35 | 0% | 0.004 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65.7 | -43.7 | 173.9 | 173.1 | -109.1 | 0 | 0 | 0 | 112.4 | H96 M99 F238 L239 F243 F244 R245 F269 L270 T273 | H96-Y241 PolarHBondContact NE2-OH 2.59Å; M99-Y241 HydrophobicContact CE-CD1 4.17Å; M99-Y241 HydrophobicContact CE-CE1 3.8Å; M99-Y241 HydrophobicContact SD-CD1 3.48Å; M99-Y241 WeakPolarHBondContact SD-CD1 3.42Å; M99-Y241 HydrophobicContact SD-CE1 3.71Å; F238-Y241 PolarHBondContact O-N 3.44Å; L239-Y241 PolarHBondContact O-N 2.98Å; Y241-F243 PolarHBondContact O-N 2.97Å; Y241-F244 PolarHBondContact O-N 3.3Å; Y241-R245 VanDerWaalsContact O-CB 3.22Å; Y241-R245 WeakPolarHBondContact O-CB 3.36Å; Y241-R245 PolarHBondContact O-N 2.79Å; Y241-R245 PolarHBondContact OH-NH1 3.27Å; Y241-F269 HydrophobicContact CD2-CB 3.92Å; Y241-L270 HydrophobicContact CD1-CD1 4.42Å; Y241-L270 HydrophobicContact CD2-CB 3.93Å; Y241-L270 HydrophobicContact CD2-CD1 4.41Å; Y241-L270 HydrophobicContact CE1-CD1 3.87Å; Y241-L270 HydrophobicContact CE2-CB 3.66Å; Y241-L270 HydrophobicContact CE2-CD1 3.87Å; Y241-L270 HydrophobicContact CE2-CG 4.29Å; Y241-T273 HydrophobicContact CD1-CG2 4.16Å; Y241-T273 HydrophobicContact CG-CG2 4.06Å |
| 242 | Q | 92.8 | Very high | 89.8 | Confident | 1 Ų | 1 | 36.9 Ų | 36.9 | 1% | 0.005 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.5 | -45.7 | 178.7 | -61.4 | -52.1 | -27.6 | 0 | 0 | 111.9 | V186 V189 I190 F238 L239 R245 I246 | V186-Q242 HydrophobicContact CG1-CB 4.17Å; V186-Q242 WeakPolarHBondContact CG1-O 3.33Å; V189-Q242 HydrophobicContact CB-CG 4.22Å; V189-Q242 HydrophobicContact CG1-CG 3.71Å; I190-Q242 HydrophobicContact CD1-CB 4.07Å; I190-Q242 HydrophobicContact CG1-CB 3.92Å; F238-Q242 WeakPolarHBondContact O-CG 3.38Å; F238-Q242 PolarHBondContact O-N 3.2Å; F238-Q242 VanDerWaalsContact O-N 3.11Å; L239-Q242 PolarHBondContact O-N 3.08Å; Q242-R245 WeakPolarHBondContact O-CB 3.47Å; Q242-R245 PolarHBondContact O-N 3.21Å; Q242-I246 WeakPolarHBondContact O-CG1 3.44Å; Q242-I246 PolarHBondContact O-N 2.81Å |
| 243 | F | 92.9 | Very high | 88.8 | Confident | 115 Ų | 115 | 38 Ų | 38 | 50% | 0.504 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -63.2 | -45.8 | 175.6 | -74.5 | -66.7 | 0 | 0 | 0 | 112 | I190 L239 Y241 R245 I246 Y247 | I190-F243 HydrophobicContact CD1-CD1 4.28Å; I190-F243 HydrophobicContact CD1-CE1 4.12Å; I190-F243 HydrophobicContact CD1-CZ 4.46Å; I190-F243 HydrophobicContact CG2-CZ 4.48Å; L239-F243 HydrophobicContact CB-CD2 4.3Å; L239-F243 HydrophobicContact CB-CE2 4.15Å; L239-F243 HydrophobicContact CD1-CE2 4.24Å; L239-F243 WeakPolarHBondContact O-CD2 3.37Å; L239-F243 PolarHBondContact O-N 3.24Å; Y241-F243 PolarHBondContact O-N 2.97Å; F243-R245 VanDerWaalsContact C-N 3.26Å; F243-R245 PolarHBondContact O-N 2.93Å; F243-I246 WeakPolarHBondContact O-CB 3.23Å; F243-I246 PolarHBondContact O-N 3.13Å; F243-Y247 PolarHBondContact O-N 3.24Å |
| 244 | F | 91.8 | Very high | 87.6 | Confident | 33 Ų | 33 | 45 Ų | 45 | 15% | 0.145 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.8 | -34 | 178 | -168.3 | -94.4 | 0 | 0 | 0 | 112 | P240 Y241 I246 Y247 Y248 I262 Y265 N266 F269 | P240-F244 VanDerWaalsContact O-CB 3.32Å; P240-F244 WeakPolarHBondContact O-CB 3.41Å; P240-F244 PolarHBondContact O-N 3.49Å; Y241-F244 PolarHBondContact O-N 3.3Å; F244-I246 VanDerWaalsContact C-N 3.34Å; F244-I246 PolarHBondContact O-N 3.01Å; F244-Y247 HydrophobicContact CD2-CD1 4.42Å; F244-Y247 AromaticContact CE2-CD1 3.97Å; F244-Y247 HydrophobicContact CE2-CD1 3.97Å; F244-Y247 HydrophobicContact CE2-CE1 4.43Å; F244-Y247 HydrophobicContact CZ-CD1 4.25Å; F244-Y247 WeakPolarHBondContact O-CB 3.47Å; F244-Y247 PolarHBondContact O-N 3.46Å; F244-Y248 WeakPolarHBondContact O-CB 3.39Å; F244-Y248 PolarHBondContact O-N 3.47Å; F244-I262 HydrophobicContact CZ-CG2 4.16Å; F244-Y265 HydrophobicContact CZ-CG 4.41Å; F244-N266 HydrophobicContact CD1-CB 4.2Å; F244-N266 HydrophobicContact CE1-CB 3.83Å; F244-N266 VanDerWaalsContact CE1-N 3.29Å; F244-F269 HydrophobicContact CB-CB 4.44Å; F244-F269 HydrophobicContact CB-CD1 4.46Å; F244-F269 HydrophobicContact CB-CD2 3.81Å; F244-F269 HydrophobicContact CB-CE2 4.15Å; F244-F269 HydrophobicContact CB-CG 3.99Å; F244-F269 AromaticContact CD1-CD2 3.67Å; F244-F269 HydrophobicContact CD1-CD2 3.67Å; F244-F269 HydrophobicContact CD1-CE2 4.29Å; F244-F269 HydrophobicContact CD1-CG 4.37Å; F244-F269 AromaticContact CD2-CD2 3.65Å; F244-F269 HydrophobicContact CD2-CD2 3.65Å; F244-F269 AromaticContact CD2-CE2 3.4Å; F244-F269 HydrophobicContact CD2-CE2 3.4Å; F244-F269 HydrophobicContact CD2-CZ 4.19Å; F244-F269 HydrophobicContact CE1-CD2 4.18Å; F244-F269 HydrophobicContact CE2-CD2 4.15Å; F244-F269 AromaticContact CE2-CE2 3.84Å; F244-F269 HydrophobicContact CE2-CE2 3.84Å; F244-F269 AromaticContact CG-CD2 3.38Å; F244-F269 HydrophobicContact CG-CD2 3.38Å; F244-F269 AromaticContact CG-CE2 3.66Å; F244-F269 HydrophobicContact CG-CE2 3.66Å; F244-F269 HydrophobicContact CG-CG 4.06Å; F244-F269 HydrophobicContact CZ-CD2 4.41Å; F244-F269 HydrophobicContact CZ-CE2 4.46Å |
| 245 | R | 89.9 | Confident | 86.1 | Confident | 16 Ų | 16 | 46.7 Ų | 46.7 | 6% | 0.06 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.9 | -37.3 | 177.4 | -172.1 | 64.1 | 168.9 | -138.7 | -6.6 | 112.1 | N182 V186 Y241 Q242 F243 Y248 L249 | N182-R245 PolarHBondContact OD1-NE 3.45Å; N182-R245 PolarHBondContact OD1-NH2 3.37Å; V186-R245 HydrophobicContact CG2-CB 4.23Å; V186-R245 HydrophobicContact CG2-CG 3.92Å; Y241-R245 VanDerWaalsContact O-CB 3.22Å; Y241-R245 WeakPolarHBondContact O-CB 3.36Å; Y241-R245 PolarHBondContact O-N 2.79Å; Y241-R245 PolarHBondContact OH-NH1 3.27Å; Q242-R245 WeakPolarHBondContact O-CB 3.47Å; Q242-R245 PolarHBondContact O-N 3.21Å; F243-R245 VanDerWaalsContact C-N 3.26Å; F243-R245 PolarHBondContact O-N 2.93Å; R245-Y248 PolarHBondContact O-N 3Å; R245-L249 HydrophobicContact CG-CD1 4.2Å; R245-L249 WeakPolarHBondContact O-CB 3.42Å; R245-L249 WeakPolarHBondContact O-CD1 3.01Å; R245-L249 VanDerWaalsContact O-CG 3.24Å; R245-L249 WeakPolarHBondContact O-CG 3.28Å; R245-L249 PolarHBondContact O-N 3.28Å |
| 246 | I | 89.2 | Confident | 84.3 | Confident | 49 Ų | 49 | 52 Ų | 52 | 25% | 0.251 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59.7 | -50.5 | 172.1 | -60.5 | 177.9 | 0 | 0 | 0 | 109.9 | Y183 V186 I190 Q242 F243 F244 Y248 L249 N250 | Y183-I246 HydrophobicContact CE1-CG2 4.23Å; V186-I246 HydrophobicContact CG1-CD1 3.72Å; V186-I246 HydrophobicContact CG1-CG1 3.44Å; V186-I246 VanDerWaalsContact CG1-CG1 3.44Å; I190-I246 HydrophobicContact CD1-CD1 4.01Å; Q242-I246 WeakPolarHBondContact O-CG1 3.44Å; Q242-I246 PolarHBondContact O-N 2.81Å; F243-I246 WeakPolarHBondContact O-CB 3.23Å; F243-I246 PolarHBondContact O-N 3.13Å; F244-I246 VanDerWaalsContact C-N 3.34Å; F244-I246 PolarHBondContact O-N 3.01Å; I246-Y248 VanDerWaalsContact C-N 3.33Å; I246-Y248 PolarHBondContact O-N 2.01Å; I246-L249 PolarHBondContact O-N 3.39Å; I246-N250 PolarHBondContact O-N 2.88Å; I246-N250 VanDerWaalsContact O-N 3.07Å; I246-N250 PolarHBondContact O-ND2 3Å |
| 247 | Y | 89.2 | Confident | 82.6 | Confident | 125 Ų | 125 | 52.3 Ų | 52.3 | 49% | 0.49 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -59.6 | -45.5 | 178.2 | 175.1 | -101.2 | 0 | 0 | 0 | 111.4 | F243 F244 L249 N250 V251 I262 | F243-Y247 PolarHBondContact O-N 3.24Å; F244-Y247 HydrophobicContact CD2-CD1 4.42Å; F244-Y247 AromaticContact CE2-CD1 3.97Å; F244-Y247 HydrophobicContact CE2-CD1 3.97Å; F244-Y247 HydrophobicContact CE2-CE1 4.43Å; F244-Y247 HydrophobicContact CZ-CD1 4.25Å; F244-Y247 WeakPolarHBondContact O-CB 3.47Å; F244-Y247 PolarHBondContact O-N 3.46Å; Y247-L249 PolarHBondContact O-N 2.7Å; Y247-N250 PolarHBondContact O-N 3.23Å; Y247-V251 HydrophobicContact CD1-CG2 4.47Å; Y247-V251 HydrophobicContact CD2-CG2 4.38Å; Y247-V251 HydrophobicContact CE1-CG2 4.01Å; Y247-V251 HydrophobicContact CE2-CG2 3.92Å; Y247-V251 WeakPolarHBondContact O-CG2 3.48Å; Y247-V251 PolarHBondContact O-N 3.35Å; Y247-I262 HydrophobicContact CE1-CG2 4.3Å |
| 248 | Y | 85.4 | Confident | 80.9 | Confident | 7 Ų | 7 | 57.5 Ų | 57.5 | 3% | 0.027 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.6 | -47.1 | 178.8 | 180 | -122.1 | 0 | 0 | 0 | 112.4 | H170 L173 F244 R245 I246 N250 V251 V252 I262 A263 N266 | H170-Y248 VanDerWaalsContact CB-OH 3.32Å; H170-Y248 WeakPolarHBondContact CB-OH 2.99Å; H170-Y248 AromaticContact CD2-CZ 3.87Å; H170-Y248 PolarHBondContact CD2-OH 2.88Å; H170-Y248 VanDerWaalsContact CG-OH 3.29Å; L173-Y248 HydrophobicContact CD2-CD1 4.08Å; L173-Y248 HydrophobicContact CD2-CE1 3.58Å; F244-Y248 WeakPolarHBondContact O-CB 3.39Å; F244-Y248 PolarHBondContact O-N 3.47Å; R245-Y248 PolarHBondContact O-N 3Å; I246-Y248 VanDerWaalsContact C-N 3.33Å; I246-Y248 PolarHBondContact O-N 2.01Å; Y248-N250 PolarHBondContact O-N 2.97Å; Y248-V251 PolarHBondContact O-N 3.46Å; Y248-V252 HydrophobicContact CD2-CG2 3.92Å; Y248-V252 HydrophobicContact CE1-CG2 4.24Å; Y248-V252 HydrophobicContact CE2-CG2 3.47Å; Y248-V252 VanDerWaalsContact CE2-CG2 3.47Å; Y248-V252 HydrophobicContact CG-CG2 4.47Å; Y248-V252 WeakPolarHBondContact O-CB 3.38Å; Y248-V252 VanDerWaalsContact O-CG2 3.3Å; Y248-V252 WeakPolarHBondContact O-CG2 3.5Å; Y248-V252 PolarHBondContact O-N 3.42Å; Y248-I262 HydrophobicContact CD2-CG2 3.63Å; Y248-I262 HydrophobicContact CE2-CG2 4.22Å; Y248-A263 HydrophobicContact CE2-CB 4.38Å; Y248-N266 HydrophobicContact CD1-CB 4.25Å; Y248-N266 HydrophobicContact CD2-CB 4.32Å; Y248-N266 HydrophobicContact CE1-CB 4.44Å; Y248-N266 HydrophobicContact CG-CB 4.18Å |
| 249 | L | 83.6 | Confident | 79.7 | Confident | 1 Ų | 1 | 61.1 Ų | 61.1 | 1% | 0.005 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 177.5 | -71.7 | 164.8 | 0 | 0 | 0 | 111.8 | L173 N182 Y183 R245 I246 Y247 V251 V252 T253 | L173-L249 HydrophobicContact CB-CD2 4.49Å; L173-L249 HydrophobicContact CD2-CD2 3.84Å; L173-L249 HydrophobicContact CG-CD2 4.39Å; N182-L249 HydrophobicContact CB-CD1 3.82Å; N182-L249 HydrophobicContact CB-CD2 4.32Å; Y183-L249 HydrophobicContact CD1-CD1 4.37Å; Y183-L249 HydrophobicContact CD2-CD1 4.32Å; Y183-L249 HydrophobicContact CE1-CB 4.33Å; Y183-L249 HydrophobicContact CE1-CD1 4.24Å; Y183-L249 HydrophobicContact CE2-CB 4.04Å; Y183-L249 HydrophobicContact CE2-CD1 4.16Å; Y183-L249 HydrophobicContact CG-CD1 4.41Å; Y183-L249 WeakPolarHBondContact OH-CB 3.49Å; R245-L249 HydrophobicContact CG-CD1 4.2Å; R245-L249 WeakPolarHBondContact O-CB 3.42Å; R245-L249 WeakPolarHBondContact O-CD1 3.01Å; R245-L249 VanDerWaalsContact O-CG 3.24Å; R245-L249 WeakPolarHBondContact O-CG 3.28Å; R245-L249 PolarHBondContact O-N 3.28Å; I246-L249 PolarHBondContact O-N 3.39Å; Y247-L249 PolarHBondContact O-N 2.7Å; L249-V251 VanDerWaalsContact C-N 3.32Å; L249-V251 PolarHBondContact O-N 3.46Å; L249-V252 PolarHBondContact O-N 3.29Å; L249-T253 WeakPolarHBondContact O-CG2 3.5Å; L249-T253 PolarHBondContact O-N 3.34Å; L249-T253 PolarHBondContact O-OG1 3.3Å |
| 250 | N | 83.7 | Confident | 78.5 | Confident | 70 Ų | 70 | 64.1 Ų | 64.1 | 37% | 0.374 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.6 | -36.9 | 178 | -75.9 | -28.1 | 0 | 0 | 0 | 112.7 | Y183 I246 Y247 Y248 T253 H254 | Y183-N250 PolarHBondContact OH-N 2.98Å; Y183-N250 PolarHBondContact OH-OD1 3.29Å; I246-N250 PolarHBondContact O-N 2.88Å; I246-N250 VanDerWaalsContact O-N 3.07Å; I246-N250 PolarHBondContact O-ND2 3Å; Y247-N250 PolarHBondContact O-N 3.23Å; Y248-N250 PolarHBondContact O-N 2.97Å; N250-T253 PolarHBondContact O-OG1 2.97Å; N250-H254 PolarHBondContact O-N 2.76Å; N250-H254 PolarHBondContact O-ND1 2.73Å |
| 251 | V | 82 | Confident | 77.6 | Confident | 32 Ų | 32 | 69 Ų | 69 | 19% | 0.194 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -73.9 | -47.1 | 178.4 | 175.8 | 0 | 0 | 0 | 0 | 110.5 | Y247 Y248 L249 T253 H254 S255 I262 | Y247-V251 HydrophobicContact CD1-CG2 4.47Å; Y247-V251 HydrophobicContact CD2-CG2 4.38Å; Y247-V251 HydrophobicContact CE1-CG2 4.01Å; Y247-V251 HydrophobicContact CE2-CG2 3.92Å; Y247-V251 WeakPolarHBondContact O-CG2 3.48Å; Y247-V251 PolarHBondContact O-N 3.35Å; Y248-V251 PolarHBondContact O-N 3.46Å; L249-V251 VanDerWaalsContact C-N 3.32Å; L249-V251 PolarHBondContact O-N 3.46Å; V251-T253 PolarHBondContact O-N 2.92Å; V251-H254 PolarHBondContact O-N 3.04Å; V251-H254 VanDerWaalsContact O-N 3.08Å; V251-S255 PolarHBondContact O-N 3.15Å; V251-S255 PolarHBondContact O-OG 3.43Å; V251-I262 HydrophobicContact CB-CD1 4.32Å; V251-I262 HydrophobicContact CG1-CD1 3.53Å; V251-I262 HydrophobicContact CG2-CD1 4.43Å |
| 252 | V | 76.8 | Confident | 77 | Confident | 42 Ų | 42 | 69.9 Ų | 69.9 | 26% | 0.255 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -60 | -29.1 | 178.1 | 172.1 | 0 | 0 | 0 | 0 | 111.9 | Y248 L249 | Y248-V252 HydrophobicContact CD2-CG2 3.92Å; Y248-V252 HydrophobicContact CE1-CG2 4.24Å; Y248-V252 HydrophobicContact CE2-CG2 3.47Å; Y248-V252 VanDerWaalsContact CE2-CG2 3.47Å; Y248-V252 HydrophobicContact CG-CG2 4.47Å; Y248-V252 WeakPolarHBondContact O-CB 3.38Å; Y248-V252 VanDerWaalsContact O-CG2 3.3Å; Y248-V252 WeakPolarHBondContact O-CG2 3.5Å; Y248-V252 PolarHBondContact O-N 3.42Å; L249-V252 PolarHBondContact O-N 3.29Å |
| 253 | T | 70.7 | Confident | 76.3 | Confident | 50 Ų | 50 | 70.3 Ų | 70.3 | 31% | 0.307 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -75.2 | -32.8 | 175.7 | 58.6 | 0 | 0 | 0 | 0 | 114.1 | K179 L249 N250 V251 | K179-T253 HydrophobicContact CD-CG2 3.6Å; L249-T253 WeakPolarHBondContact O-CG2 3.5Å; L249-T253 PolarHBondContact O-N 3.34Å; L249-T253 PolarHBondContact O-OG1 3.3Å; N250-T253 PolarHBondContact O-OG1 2.97Å; V251-T253 PolarHBondContact O-N 2.92Å |
| 254 | H | 67.6 | Low | 75.7 | Confident | 162 Ų | 162 | 67.2 Ų | 67.2 | 75% | 0.75 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -96.6 | -24.2 | -173.1 | -75.2 | 88 | 0 | 0 | 0 | 113.2 | N250 V251 | N250-H254 PolarHBondContact O-N 2.76Å; N250-H254 PolarHBondContact O-ND1 2.73Å; V251-H254 PolarHBondContact O-N 3.04Å; V251-H254 VanDerWaalsContact O-N 3.08Å |
| 255 | S | 61.6 | Low | 75.3 | Confident | 40 Ų | 40 | 71.6 Ų | 71.6 | 28% | 0.28 | 38% | 0.376 | S | S | . | . | trans | -100.4 | 117.7 | 178.7 | 68 | 0 | 0 | 0 | 0 | 111.7 | V251 T257 | V251-S255 PolarHBondContact O-N 3.15Å; V251-S255 PolarHBondContact O-OG 3.43Å; S255-T257 PolarHBondContact O-N 2.85Å; S255-T257 PolarHBondContact OG-O 2.64Å | ||
| 256 | N | 55.8 | Low | 75.2 | Confident | 175 Ų | 175 | 71 Ų | 71 | 94% | 0.936 | 37% | 0.374 | S | S | * | . | S | Bend | trans | -69.1 | -6.7 | 166.1 | -75.2 | -18.3 | 0 | 0 | 0 | 113 | ||
| 257 | T | 56.2 | Low | 75 | Confident | 108 Ų | 108 | 69.6 Ų | 69.6 | 66% | 0.663 | 37% | 0.366 | S | S | * | . | S | Bend | trans | -103.1 | 120.7 | 179 | 49.5 | 0 | 0 | 0 | 0 | 110.8 | S255 N259 | S255-T257 PolarHBondContact O-N 2.85Å; S255-T257 PolarHBondContact OG-O 2.64Å; T257-N259 PolarHBondContact O-N 2.7Å |
| 258 | C | 56.7 | Low | 75 | Confident | 119 Ų | 119 | 66 Ų | 66 | 80% | 0.804 | 36% | 0.355 | S | S | * | . | trans | -66.2 | 99.7 | 176.2 | 177.5 | 0 | 0 | 0 | 0 | 110.3 | S260 | C258-S260 PolarHBondContact O-N 2.68Å; C258-S260 VanDerWaalsContact O-N 3.16Å | ||
| 259 | N | 67.7 | Low | 75.3 | Confident | 76 Ų | 76 | 68.8 Ų | 68.8 | 41% | 0.406 | 37% | 0.368 | S | S | . | . | trans | -80.1 | 96.9 | 174.2 | -166.7 | -9.8 | 0 | 0 | 0 | 110.1 | T257 K261 I262 A263 | T257-N259 PolarHBondContact O-N 2.7Å; N259-K261 PolarHBondContact O-N 3.38Å; N259-K261 VanDerWaalsContact O-N 3.1Å; N259-K261 PolarHBondContact OD1-N 3.23Å; N259-I262 HydrophobicContact CB-CD1 3.95Å; N259-I262 HydrophobicContact CB-CG1 4.04Å; N259-I262 WeakPolarHBondContact ND2-CD1 3.19Å; N259-I262 PolarHBondContact O-N 3.18Å; N259-A263 PolarHBondContact O-N 2.78Å | ||
| 260 | S | 67.3 | Low | 75.6 | Confident | 81 Ų | 81 | 68.9 Ų | 68.9 | 57% | 0.566 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -54.5 | -28.6 | -179.8 | 55.7 | 0 | 0 | 0 | 0 | 113.4 | C258 F264 | C258-S260 PolarHBondContact O-N 2.68Å; C258-S260 VanDerWaalsContact O-N 3.16Å; S260-F264 VanDerWaalsContact O-CB 3.25Å; S260-F264 WeakPolarHBondContact O-CB 3.14Å; S260-F264 PolarHBondContact O-N 3.1Å; S260-F264 VanDerWaalsContact O-N 3.09Å |
| 261 | K | 76.8 | Confident | 76 | Confident | 146 Ų | 146 | 65.5 Ų | 65.5 | 64% | 0.635 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -66.3 | -38.5 | 176.7 | -64.3 | -173.8 | 176.5 | -172.5 | 0 | 113 | N259 F264 Y265 | N259-K261 PolarHBondContact O-N 3.38Å; N259-K261 VanDerWaalsContact O-N 3.1Å; N259-K261 PolarHBondContact OD1-N 3.23Å; K261-F264 WeakPolarHBondContact O-CB 3.25Å; K261-F264 PolarHBondContact O-N 3.37Å; K261-Y265 WeakPolarHBondContact O-CD2 3.35Å; K261-Y265 PolarHBondContact O-N 3Å |
| 262 | I | 80.6 | Confident | 76.6 | Confident | 20 Ų | 20 | 65.8 Ų | 65.8 | 10% | 0.103 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -77.9 | -41 | -175.8 | -52.5 | 178.3 | 0 | 0 | 0 | 110.5 | F244 Y247 Y248 V251 N259 F264 Y265 N266 | F244-I262 HydrophobicContact CZ-CG2 4.16Å; Y247-I262 HydrophobicContact CE1-CG2 4.3Å; Y248-I262 HydrophobicContact CD2-CG2 3.63Å; Y248-I262 HydrophobicContact CE2-CG2 4.22Å; V251-I262 HydrophobicContact CB-CD1 4.32Å; V251-I262 HydrophobicContact CG1-CD1 3.53Å; V251-I262 HydrophobicContact CG2-CD1 4.43Å; N259-I262 HydrophobicContact CB-CD1 3.95Å; N259-I262 HydrophobicContact CB-CG1 4.04Å; N259-I262 WeakPolarHBondContact ND2-CD1 3.19Å; N259-I262 PolarHBondContact O-N 3.18Å; I262-F264 PolarHBondContact O-N 3.4Å; I262-Y265 PolarHBondContact O-N 3.39Å; I262-N266 PolarHBondContact O-N 3.16Å |
| 263 | A | 77.4 | Confident | 77.4 | Confident | 10 Ų | 10 | 63.8 Ų | 63.8 | 8% | 0.083 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56.6 | -38.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111 | Y248 N259 N266 E267 | Y248-A263 HydrophobicContact CE2-CB 4.38Å; N259-A263 PolarHBondContact O-N 2.78Å; A263-N266 WeakPolarHBondContact O-CB 3.13Å; A263-N266 PolarHBondContact O-N 3.11Å; A263-E267 PolarHBondContact O-N 3.15Å; A263-E267 VanDerWaalsContact O-N 3.16Å |
| 264 | F | 79.3 | Confident | 78.6 | Confident | 50 Ų | 50 | 61.4 Ų | 61.4 | 22% | 0.219 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 175.4 | 174.8 | -94.2 | 0 | 0 | 0 | 113.3 | V16 L20 S260 K261 I262 N266 E267 I268 | V16-F264 HydrophobicContact CB-CZ 4.24Å; V16-F264 HydrophobicContact CG1-CD1 4.05Å; V16-F264 HydrophobicContact CG1-CD2 4.09Å; V16-F264 HydrophobicContact CG1-CE1 3.17Å; V16-F264 HydrophobicContact CG1-CE2 3.24Å; V16-F264 HydrophobicContact CG1-CG 4.46Å; V16-F264 HydrophobicContact CG1-CZ 2.76Å; L20-F264 HydrophobicContact CD1-CE2 3.9Å; L20-F264 HydrophobicContact CD1-CZ 4.44Å; S260-F264 VanDerWaalsContact O-CB 3.25Å; S260-F264 WeakPolarHBondContact O-CB 3.14Å; S260-F264 PolarHBondContact O-N 3.1Å; S260-F264 VanDerWaalsContact O-N 3.09Å; K261-F264 WeakPolarHBondContact O-CB 3.25Å; K261-F264 PolarHBondContact O-N 3.37Å; I262-F264 PolarHBondContact O-N 3.4Å; F264-N266 VanDerWaalsContact C-N 3.27Å; F264-N266 PolarHBondContact O-N 3.35Å; F264-E267 WeakPolarHBondContact O-CB 3.4Å; F264-E267 PolarHBondContact O-N 2.97Å; F264-E267 VanDerWaalsContact O-N 3.1Å; F264-I268 HydrophobicContact CD1-CD1 4.34Å; F264-I268 HydrophobicContact CE1-CD1 3.22Å; F264-I268 HydrophobicContact CE1-CG1 3.69Å; F264-I268 HydrophobicContact CE2-CG1 4.31Å; F264-I268 HydrophobicContact CZ-CD1 3.32Å; F264-I268 HydrophobicContact CZ-CG1 3.4Å; F264-I268 VanDerWaalsContact CZ-CG1 3.4Å; F264-I268 PolarHBondContact O-N 2.97Å; F264-I268 VanDerWaalsContact O-N 3.11Å |
| 265 | Y | 84.9 | Confident | 79.8 | Confident | 125 Ų | 125 | 56.9 Ų | 56.9 | 49% | 0.49 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -60.6 | -37.4 | 175.4 | -73.4 | -64.7 | 0 | 0 | 0 | 112.3 | F244 K261 I262 E267 I268 F269 | F244-Y265 HydrophobicContact CZ-CG 4.41Å; K261-Y265 WeakPolarHBondContact O-CD2 3.35Å; K261-Y265 PolarHBondContact O-N 3Å; I262-Y265 PolarHBondContact O-N 3.39Å; Y265-E267 VanDerWaalsContact C-N 3.27Å; Y265-E267 PolarHBondContact O-N 2.88Å; Y265-I268 PolarHBondContact O-N 3.1Å; Y265-I268 VanDerWaalsContact O-N 3.15Å; Y265-F269 VanDerWaalsContact O-CD2 3.24Å; Y265-F269 WeakPolarHBondContact O-CD2 3.5Å; Y265-F269 PolarHBondContact O-N 3.04Å |
| 266 | N | 86.6 | Confident | 81.4 | Confident | 2 Ų | 2 | 55 Ų | 55 | 1% | 0.011 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -57.4 | -43.1 | 174.4 | 173.8 | 83.2 | 0 | 0 | 0 | 111.1 | F244 Y248 I262 A263 F264 F269 L270 | F244-N266 HydrophobicContact CD1-CB 4.2Å; F244-N266 HydrophobicContact CE1-CB 3.83Å; F244-N266 VanDerWaalsContact CE1-N 3.29Å; Y248-N266 HydrophobicContact CD1-CB 4.25Å; Y248-N266 HydrophobicContact CD2-CB 4.32Å; Y248-N266 HydrophobicContact CE1-CB 4.44Å; Y248-N266 HydrophobicContact CG-CB 4.18Å; I262-N266 PolarHBondContact O-N 3.16Å; A263-N266 WeakPolarHBondContact O-CB 3.13Å; A263-N266 PolarHBondContact O-N 3.11Å; F264-N266 VanDerWaalsContact C-N 3.27Å; F264-N266 PolarHBondContact O-N 3.35Å; N266-F269 PolarHBondContact O-N 2.88Å; N266-L270 VanDerWaalsContact O-CB 3.25Å; N266-L270 WeakPolarHBondContact O-CB 3.43Å; N266-L270 PolarHBondContact O-N 3.39Å |
| 267 | E | 85.2 | Confident | 83.2 | Confident | 21 Ų | 21 | 46.7 Ų | 46.7 | 10% | 0.098 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.2 | -35.5 | 176.2 | -74.2 | -59 | 132.8 | 0 | 0 | 113.4 | R72 A263 F264 Y265 S271 | R72-E267 IonicContact CZ-OE2 3.86Å; R72-E267 IonicContact NH2-OE2 2.7Å; R72-E267 PolarHBondContact NH2-OE2 3.3Å; A263-E267 PolarHBondContact O-N 3.15Å; A263-E267 VanDerWaalsContact O-N 3.16Å; F264-E267 WeakPolarHBondContact O-CB 3.4Å; F264-E267 PolarHBondContact O-N 2.97Å; F264-E267 VanDerWaalsContact O-N 3.1Å; Y265-E267 VanDerWaalsContact C-N 3.27Å; Y265-E267 PolarHBondContact O-N 2.88Å; E267-S271 VanDerWaalsContact O-CB 3.26Å; E267-S271 WeakPolarHBondContact O-CB 3.45Å; E267-S271 PolarHBondContact O-N 3.04Å; E267-S271 PolarHBondContact O-OG 3.12Å |
| 268 | I | 88.6 | Confident | 84.9 | Confident | 50 Ų | 50 | 42.2 Ų | 42.2 | 26% | 0.256 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.1 | -55.5 | 171.4 | -71 | -175.8 | 0 | 0 | 0 | 110 | L20 F264 Y265 L270 S271 V272 | L20-I268 HydrophobicContact CD2-CG1 4.33Å; F264-I268 HydrophobicContact CD1-CD1 4.34Å; F264-I268 HydrophobicContact CE1-CD1 3.22Å; F264-I268 HydrophobicContact CE1-CG1 3.69Å; F264-I268 HydrophobicContact CE2-CG1 4.31Å; F264-I268 HydrophobicContact CZ-CD1 3.32Å; F264-I268 HydrophobicContact CZ-CG1 3.4Å; F264-I268 VanDerWaalsContact CZ-CG1 3.4Å; F264-I268 PolarHBondContact O-N 2.97Å; F264-I268 VanDerWaalsContact O-N 3.11Å; Y265-I268 PolarHBondContact O-N 3.1Å; Y265-I268 VanDerWaalsContact O-N 3.15Å; I268-L270 VanDerWaalsContact C-N 3.26Å; I268-L270 PolarHBondContact O-N 3.09Å; I268-S271 CarbonylContact O-C 3.58Å; I268-S271 WeakPolarHBondContact O-CA 3.42Å; I268-S271 WeakPolarHBondContact O-CB 3.26Å; I268-S271 PolarHBondContact O-N 3.23Å; I268-V272 HydrophobicContact CG2-CG2 4.41Å; I268-V272 WeakPolarHBondContact O-CG2 3.32Å; I268-V272 PolarHBondContact O-N 3.4Å |
| 269 | F | 91.8 | Very high | 86.5 | Confident | 65 Ų | 65 | 36.6 Ų | 36.6 | 29% | 0.285 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -60.4 | -39.6 | -176.9 | -81.6 | -73.4 | 0 | 0 | 0 | 111.5 | P240 Y241 F244 Y265 N266 V272 | P240-F269 HydrophobicContact CB-CD1 3.92Å; P240-F269 HydrophobicContact CB-CE1 3.96Å; Y241-F269 HydrophobicContact CD2-CB 3.92Å; F244-F269 HydrophobicContact CB-CB 4.44Å; F244-F269 HydrophobicContact CB-CD1 4.46Å; F244-F269 HydrophobicContact CB-CD2 3.81Å; F244-F269 HydrophobicContact CB-CE2 4.15Å; F244-F269 HydrophobicContact CB-CG 3.99Å; F244-F269 AromaticContact CD1-CD2 3.67Å; F244-F269 HydrophobicContact CD1-CD2 3.67Å; F244-F269 HydrophobicContact CD1-CE2 4.29Å; F244-F269 HydrophobicContact CD1-CG 4.37Å; F244-F269 AromaticContact CD2-CD2 3.65Å; F244-F269 HydrophobicContact CD2-CD2 3.65Å; F244-F269 AromaticContact CD2-CE2 3.4Å; F244-F269 HydrophobicContact CD2-CE2 3.4Å; F244-F269 HydrophobicContact CD2-CZ 4.19Å; F244-F269 HydrophobicContact CE1-CD2 4.18Å; F244-F269 HydrophobicContact CE2-CD2 4.15Å; F244-F269 AromaticContact CE2-CE2 3.84Å; F244-F269 HydrophobicContact CE2-CE2 3.84Å; F244-F269 AromaticContact CG-CD2 3.38Å; F244-F269 HydrophobicContact CG-CD2 3.38Å; F244-F269 AromaticContact CG-CE2 3.66Å; F244-F269 HydrophobicContact CG-CE2 3.66Å; F244-F269 HydrophobicContact CG-CG 4.06Å; F244-F269 HydrophobicContact CZ-CD2 4.41Å; F244-F269 HydrophobicContact CZ-CE2 4.46Å; Y265-F269 VanDerWaalsContact O-CD2 3.24Å; Y265-F269 WeakPolarHBondContact O-CD2 3.5Å; Y265-F269 PolarHBondContact O-N 3.04Å; N266-F269 PolarHBondContact O-N 2.88Å; F269-V272 WeakPolarHBondContact O-CB 3.44Å; F269-V272 PolarHBondContact O-N 3.32Å |
| 270 | L | 91.3 | Very high | 87.6 | Confident | 2 Ų | 2 | 33.1 Ų | 33.1 | 1% | 0.01 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.9 | -42.7 | 173.4 | -177.8 | 66.8 | 0 | 0 | 0 | 111.1 | L95 H96 Y241 N266 I268 V272 T273 | L95-L270 HydrophobicContact CD2-CB 4.49Å; L95-L270 HydrophobicContact CD2-CD1 4.33Å; L95-L270 HydrophobicContact CD2-CD2 3.78Å; L95-L270 HydrophobicContact CD2-CG 3.52Å; L95-L270 HydrophobicContact CG-CD1 4.18Å; L95-L270 HydrophobicContact CG-CD2 4.29Å; L95-L270 HydrophobicContact CG-CG 3.92Å; H96-L270 WeakPolarHBondContact CE1-CD2 3.3Å; Y241-L270 HydrophobicContact CD1-CD1 4.42Å; Y241-L270 HydrophobicContact CD2-CB 3.93Å; Y241-L270 HydrophobicContact CD2-CD1 4.41Å; Y241-L270 HydrophobicContact CE1-CD1 3.87Å; Y241-L270 HydrophobicContact CE2-CB 3.66Å; Y241-L270 HydrophobicContact CE2-CD1 3.87Å; Y241-L270 HydrophobicContact CE2-CG 4.29Å; N266-L270 VanDerWaalsContact O-CB 3.25Å; N266-L270 WeakPolarHBondContact O-CB 3.43Å; N266-L270 PolarHBondContact O-N 3.39Å; I268-L270 VanDerWaalsContact C-N 3.26Å; I268-L270 PolarHBondContact O-N 3.09Å; L270-V272 VanDerWaalsContact C-N 3.32Å; L270-V272 PolarHBondContact O-N 2.99Å; L270-T273 WeakPolarHBondContact O-CB 3.34Å; L270-T273 WeakPolarHBondContact O-CG2 2.82Å; L270-T273 PolarHBondContact O-N 3.24Å; L270-T273 VanDerWaalsContact O-N 3.15Å; L270-T273 PolarHBondContact O-OG1 3.1Å |
| 271 | S | 91.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -65.4 | -34.1 | 178.1 | -58.9 | 0 | 0 | 0 | 0 | 112.3 | L20 L23 Y24 E267 I268 T273 A274 | L20-S271 WeakPolarHBondContact CD2-OG 3.13Å; L23-S271 WeakPolarHBondContact CD2-O 3.47Å; Y24-S271 WeakPolarHBondContact OH-CB 3.37Å; Y24-S271 PolarHBondContact OH-OG 3.03Å; E267-S271 VanDerWaalsContact O-CB 3.26Å; E267-S271 WeakPolarHBondContact O-CB 3.45Å; E267-S271 PolarHBondContact O-N 3.04Å; E267-S271 PolarHBondContact O-OG 3.12Å; I268-S271 CarbonylContact O-C 3.58Å; I268-S271 WeakPolarHBondContact O-CA 3.42Å; I268-S271 WeakPolarHBondContact O-CB 3.26Å; I268-S271 PolarHBondContact O-N 3.23Å; S271-T273 PolarHBondContact O-N 3Å; S271-A274 WeakPolarHBondContact O-CB 3.45Å; S271-A274 PolarHBondContact O-N 3.24Å |
| 272 | V | 93.3 | Very high | 89.1 | Confident | 37 Ų | 37 | 28 Ų | 28 | 22% | 0.224 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -57.5 | -32.2 | 173.2 | 168.4 | 0 | 0 | 0 | 0 | 111.9 | L23 I268 F269 L270 A274 I275 | L23-V272 HydrophobicContact CD1-CG2 4.13Å; I268-V272 HydrophobicContact CG2-CG2 4.41Å; I268-V272 WeakPolarHBondContact O-CG2 3.32Å; I268-V272 PolarHBondContact O-N 3.4Å; F269-V272 WeakPolarHBondContact O-CB 3.44Å; F269-V272 PolarHBondContact O-N 3.32Å; L270-V272 VanDerWaalsContact C-N 3.32Å; L270-V272 PolarHBondContact O-N 2.99Å; V272-A274 PolarHBondContact O-N 2.83Å; V272-A274 VanDerWaalsContact O-N 3.17Å; V272-I275 HydrophobicContact CG1-CD1 4.28Å; V272-I275 VanDerWaalsContact O-CB 3.27Å; V272-I275 WeakPolarHBondContact O-CB 3.24Å; V272-I275 WeakPolarHBondContact O-CG1 3.36Å; V272-I275 PolarHBondContact O-N 2.92Å |
| 273 | T | 94.7 | Very high | 89.2 | Confident | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -59.7 | -28.7 | 175.5 | 75 | 0 | 0 | 0 | 0 | 112.4 | M99 C237 F238 Y241 L270 S271 I275 S276 | M99-T273 HydrophobicContact CG-CG2 4.11Å; M99-T273 HydrophobicContact SD-CG2 3.69Å; C237-T273 WeakPolarHBondContact O-CA 3.33Å; C237-T273 VanDerWaalsContact O-CG2 3.3Å; C237-T273 WeakPolarHBondContact O-CG2 3.48Å; F238-T273 HydrophobicContact CD1-CG2 4.27Å; Y241-T273 HydrophobicContact CD1-CG2 4.16Å; Y241-T273 HydrophobicContact CG-CG2 4.06Å; L270-T273 WeakPolarHBondContact O-CB 3.34Å; L270-T273 WeakPolarHBondContact O-CG2 2.82Å; L270-T273 PolarHBondContact O-N 3.24Å; L270-T273 VanDerWaalsContact O-N 3.15Å; L270-T273 PolarHBondContact O-OG1 3.1Å; S271-T273 PolarHBondContact O-N 3Å; T273-I275 PolarHBondContact O-N 3.01Å; T273-S276 VanDerWaalsContact O-CB 3.25Å; T273-S276 WeakPolarHBondContact O-CB 3.27Å; T273-S276 PolarHBondContact O-N 3.38Å; T273-S276 VanDerWaalsContact O-N 3.14Å; T273-S276 PolarHBondContact O-OG 3.37Å |
| 274 | A | 94.9 | Very high | 89.5 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 15% | 0.149 | C | C | . | . | G | 310 helix | trans | -68 | -21.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y24 V27 F65 L95 S271 V272 S276 C277 | Y24-A274 HydrophobicContact CE1-CB 4.5Å; V27-A274 HydrophobicContact CG1-CB 4.14Å; V27-A274 HydrophobicContact CG2-CB 3.97Å; F65-A274 HydrophobicContact CE1-CB 3.83Å; F65-A274 HydrophobicContact CZ-CB 3.68Å; L95-A274 HydrophobicContact CD1-CB 3.82Å; S271-A274 WeakPolarHBondContact O-CB 3.45Å; S271-A274 PolarHBondContact O-N 3.24Å; V272-A274 PolarHBondContact O-N 2.83Å; V272-A274 VanDerWaalsContact O-N 3.17Å; A274-S276 PolarHBondContact O-N 2.91Å; A274-S276 VanDerWaalsContact O-N 3.13Å; A274-C277 WeakPolarHBondContact O-CB 3.24Å; A274-C277 PolarHBondContact O-N 3.42Å; A274-C277 PolarHBondContact O-SG 3.4Å; A274-C277 VanDerWaalsContact O-SG 3.35Å |
| 275 | I | 94.4 | Very high | 89.6 | Confident | 67 Ų | 67 | 33.9 Ų | 33.9 | 34% | 0.344 | 16% | 0.163 | S | C | . | . | G | 310 helix | trans | -59.5 | -22.9 | 173.7 | -61.4 | 174.7 | 0 | 0 | 0 | 110.9 | L23 V27 V272 T273 C277 C278 | L23-I275 HydrophobicContact CD1-CD1 4.2Å; L23-I275 HydrophobicContact CD2-CG1 4.42Å; L23-I275 HydrophobicContact CG-CD1 4.41Å; L23-I275 HydrophobicContact CG-CG1 4.34Å; V27-I275 HydrophobicContact CG2-CG1 4.27Å; V272-I275 HydrophobicContact CG1-CD1 4.28Å; V272-I275 VanDerWaalsContact O-CB 3.27Å; V272-I275 WeakPolarHBondContact O-CB 3.24Å; V272-I275 WeakPolarHBondContact O-CG1 3.36Å; V272-I275 PolarHBondContact O-N 2.92Å; T273-I275 PolarHBondContact O-N 3.01Å; I275-C277 PolarHBondContact O-N 3.39Å; I275-C278 WeakPolarHBondContact O-CB 3.43Å; I275-C278 PolarHBondContact O-N 3.29Å |
| 276 | S | 93.6 | Very high | 88.8 | Confident | 1 Ų | 1 | 29.4 Ų | 29.4 | 1% | 0.007 | 16% | 0.155 | C | C | . | . | G | 310 helix | trans | -56.8 | -16.6 | 170.9 | 65.7 | 0 | 0 | 0 | 0 | 113.8 | H62 H98 T273 A274 C278 D279 | H62-S276 PolarHBondContact CE1-O 3.32Å; H98-S276 PolarHBondContact CE1-OG 2.79Å; T273-S276 VanDerWaalsContact O-CB 3.25Å; T273-S276 WeakPolarHBondContact O-CB 3.27Å; T273-S276 PolarHBondContact O-N 3.38Å; T273-S276 VanDerWaalsContact O-N 3.14Å; T273-S276 PolarHBondContact O-OG 3.37Å; A274-S276 PolarHBondContact O-N 2.91Å; A274-S276 VanDerWaalsContact O-N 3.13Å; S276-C278 PolarHBondContact O-N 2.88Å; S276-D279 WeakPolarHBondContact O-CB 3.28Å; S276-D279 PolarHBondContact O-N 2.92Å; S276-D279 VanDerWaalsContact O-N 3.15Å |
| 277 | C | 93.2 | Very high | 87.9 | Confident | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 17% | 0.168 | C | C | . | . | G | 310 helix | trans | -67.5 | -19 | 171.2 | -63.6 | 0 | 0 | 0 | 0 | 114.4 | V27 G31 H62 F65 H98 A274 I275 | V27-C277 HydrophobicContact CG1-CB 4.15Å; G31-C277 WeakPolarHBondContact CA-O 3.47Å; H62-C277 WeakPolarHBondContact ND1-CA 3.42Å; H62-C277 PolarHBondContact ND1-SG 2.98Å; H62-C277 VanDerWaalsContact ND1-SG 3.38Å; F65-C277 WeakPolarHBondContact CD1-SG 3.38Å; H98-C277 PolarHBondContact CE1-SG 3.27Å; H98-C277 PolarHBondContact NE2-SG 2.98Å; H98-C277 VanDerWaalsContact NE2-SG 3.4Å; A274-C277 WeakPolarHBondContact O-CB 3.24Å; A274-C277 PolarHBondContact O-N 3.42Å; A274-C277 PolarHBondContact O-SG 3.4Å; A274-C277 VanDerWaalsContact O-SG 3.35Å; I275-C277 PolarHBondContact O-N 3.39Å |
| 278 | C | 92.4 | Very high | 86.9 | Confident | 15 Ų | 15 | 31.6 Ų | 31.6 | 10% | 0.101 | 18% | 0.177 | C | C | . | . | G | 310 helix | trans | -81.7 | -2.9 | 174.6 | -61.5 | 0 | 0 | 0 | 0 | 112.1 | I275 S276 L280 L281 L282 | I275-C278 WeakPolarHBondContact O-CB 3.43Å; I275-C278 PolarHBondContact O-N 3.29Å; S276-C278 PolarHBondContact O-N 2.88Å; C278-L280 VanDerWaalsContact C-N 3.3Å; C278-L280 PolarHBondContact O-N 3.49Å; C278-L281 WeakPolarHBondContact O-CB 3.4Å; C278-L281 PolarHBondContact O-N 3.3Å; C278-L282 VanDerWaalsContact O-CG 3.31Å; C278-L282 WeakPolarHBondContact O-CG 3.5Å; C278-L282 PolarHBondContact O-N 2.93Å |
| 279 | D | 91.1 | Very high | 85.4 | Confident | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.005 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -57.5 | -41.4 | -179.5 | 74.9 | -43.4 | 0 | 0 | 0 | 112.1 | H62 Y106 F229 V233 S276 L281 L282 F283 | H62-D279 IonicContact CD2-OD1 3.57Å; H62-D279 IonicContact CE1-OD1 3.89Å; H62-D279 IonicContact NE2-OD1 3.45Å; H62-D279 PolarHBondContact NE2-OD1 2.93Å; H62-D279 IonicContact NE2-OD2 3.23Å; Y106-D279 VanDerWaalsContact OH-CB 3.26Å; Y106-D279 WeakPolarHBondContact OH-CB 3.1Å; Y106-D279 PolarHBondContact OH-OD2 3.44Å; F229-D279 HydrophobicContact CE1-CB 4.28Å; F229-D279 HydrophobicContact CZ-CB 4.32Å; F229-D279 WeakPolarHBondContact CZ-O 3.31Å; V233-D279 HydrophobicContact CG2-CB 4.33Å; S276-D279 WeakPolarHBondContact O-CB 3.28Å; S276-D279 PolarHBondContact O-N 2.92Å; S276-D279 VanDerWaalsContact O-N 3.15Å; D279-L281 VanDerWaalsContact C-N 3.35Å; D279-L281 PolarHBondContact O-N 3.48Å; D279-L282 CarbonylContact O-C 3.46Å; D279-L282 PolarHBondContact O-N 3.26Å; D279-F283 VanDerWaalsContact O-CB 3.23Å; D279-F283 WeakPolarHBondContact O-CB 3.43Å; D279-F283 PolarHBondContact O-N 2.8Å |
| 280 | L | 89.6 | Confident | 83.5 | Confident | 3 Ų | 3 | 41.1 Ų | 41.1 | 2% | 0.016 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64 | -42.3 | 179.1 | -68.9 | -170.8 | 0 | 0 | 0 | 110.9 | V35 I38 V55 L58 V59 C278 F283 V284 | V35-L280 HydrophobicContact CG2-CD1 4.01Å; I38-L280 HydrophobicContact CG1-CB 3.87Å; I38-L280 HydrophobicContact CG1-CD1 4.44Å; I38-L280 HydrophobicContact CG1-CD2 4.21Å; I38-L280 HydrophobicContact CG1-CG 4.39Å; V55-L280 HydrophobicContact CG1-CD2 4.43Å; L58-L280 HydrophobicContact CB-CD2 4.47Å; V59-L280 HydrophobicContact CB-CD1 4.46Å; V59-L280 HydrophobicContact CG2-CD1 3.6Å; C278-L280 VanDerWaalsContact C-N 3.3Å; C278-L280 PolarHBondContact O-N 3.49Å; L280-F283 PolarHBondContact O-N 2.97Å; L280-V284 WeakPolarHBondContact O-CG2 3.35Å; L280-V284 PolarHBondContact O-N 2.98Å |
| 281 | L | 89.7 | Confident | 81.8 | Confident | 27 Ų | 27 | 45.3 Ų | 45.3 | 14% | 0.141 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.1 | -48.8 | 176.1 | -175.7 | 59.2 | 0 | 0 | 0 | 110.8 | V33 C278 D279 F283 V284 F285 | V33-L281 HydrophobicContact CB-CD1 4.4Å; V33-L281 HydrophobicContact CG1-CD1 3.7Å; V33-L281 HydrophobicContact CG1-CD2 4.48Å; C278-L281 WeakPolarHBondContact O-CB 3.4Å; C278-L281 PolarHBondContact O-N 3.3Å; D279-L281 VanDerWaalsContact C-N 3.35Å; D279-L281 PolarHBondContact O-N 3.48Å; L281-F283 VanDerWaalsContact C-N 3.29Å; L281-F283 PolarHBondContact O-N 3.25Å; L281-V284 PolarHBondContact O-N 3.48Å; L281-F285 HydrophobicContact CD1-CD2 3.92Å; L281-F285 HydrophobicContact CD1-CE2 3.38Å; L281-F285 HydrophobicContact CD1-CZ 4.22Å; L281-F285 HydrophobicContact CD2-CE2 4.2Å; L281-F285 HydrophobicContact CG-CD2 3.84Å; L281-F285 HydrophobicContact CG-CE2 3.58Å; L281-F285 WeakPolarHBondContact O-CD2 3.19Å; L281-F285 PolarHBondContact O-N 2.89Å |
| 282 | L | 86.1 | Confident | 80.4 | Confident | 91 Ų | 91 | 48.7 Ų | 48.7 | 48% | 0.476 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.5 | -35.4 | 177.6 | -68.2 | 174.6 | 0 | 0 | 0 | 111.9 | F229 C278 D279 F285 G286 | F229-L282 HydrophobicContact CE2-CB 3.63Å; F229-L282 HydrophobicContact CE2-CD1 4.18Å; F229-L282 HydrophobicContact CZ-CB 3.52Å; F229-L282 HydrophobicContact CZ-CD1 4.27Å; C278-L282 VanDerWaalsContact O-CG 3.31Å; C278-L282 WeakPolarHBondContact O-CG 3.5Å; C278-L282 PolarHBondContact O-N 2.93Å; D279-L282 CarbonylContact O-C 3.46Å; D279-L282 PolarHBondContact O-N 3.26Å; L282-F285 PolarHBondContact O-N 3.18Å; L282-G286 PolarHBondContact O-N 3.39Å |
| 283 | F | 83.8 | Confident | 78.9 | Confident | 49 Ų | 49 | 50.9 Ų | 50.9 | 22% | 0.215 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.3 | -40.7 | 175.7 | -179.4 | -93.5 | 0 | 0 | 0 | 111.7 | I38 K226 F229 F230 D279 L280 L281 G287 | I38-F283 HydrophobicContact CD1-CD1 3.96Å; I38-F283 HydrophobicContact CD1-CE1 4.48Å; K226-F283 HydrophobicContact CB-CE2 4.47Å; K226-F283 HydrophobicContact CD-CE2 4.05Å; K226-F283 HydrophobicContact CD-CZ 4.34Å; K226-F283 HydrophobicContact CG-CE2 4.14Å; F229-F283 HydrophobicContact CD1-CD2 4.49Å; F229-F283 HydrophobicContact CE1-CB 4.19Å; F230-F283 HydrophobicContact CE2-CD2 4.3Å; F230-F283 HydrophobicContact CE2-CE2 4.16Å; F230-F283 AromaticContact CZ-CD2 3.89Å; F230-F283 HydrophobicContact CZ-CD2 3.89Å; F230-F283 HydrophobicContact CZ-CE2 4.05Å; D279-F283 VanDerWaalsContact O-CB 3.23Å; D279-F283 WeakPolarHBondContact O-CB 3.43Å; D279-F283 PolarHBondContact O-N 2.8Å; L280-F283 PolarHBondContact O-N 2.97Å; L281-F283 VanDerWaalsContact C-N 3.29Å; L281-F283 PolarHBondContact O-N 3.25Å; F283-G287 PolarHBondContact O-N 2.98Å |
| 284 | V | 82.8 | Confident | 77.5 | Confident | 37 Ų | 37 | 56.3 Ų | 56.3 | 22% | 0.224 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.1 | -48.9 | 173.7 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | I38 L41 L280 L281 G287 S288 | I38-V284 HydrophobicContact CD1-CG2 3.42Å; I38-V284 VanDerWaalsContact CD1-CG2 3.42Å; I38-V284 HydrophobicContact CG1-CG2 3.72Å; L41-V284 HydrophobicContact CD1-CG1 4.14Å; L41-V284 HydrophobicContact CD1-CG2 3.75Å; L280-V284 WeakPolarHBondContact O-CG2 3.35Å; L280-V284 PolarHBondContact O-N 2.98Å; L281-V284 PolarHBondContact O-N 3.48Å; V284-G287 PolarHBondContact O-N 3.49Å; V284-G287 VanDerWaalsContact O-N 3.16Å; V284-S288 PolarHBondContact O-N 3.16Å |
| 285 | F | 80.9 | Confident | 76.1 | Confident | 119 Ų | 119 | 58 Ų | 58 | 52% | 0.522 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 179.3 | -77.3 | -59.9 | 0 | 0 | 0 | 112.6 | L281 L282 G287 S288 F291 | L281-F285 HydrophobicContact CD1-CD2 3.92Å; L281-F285 HydrophobicContact CD1-CE2 3.38Å; L281-F285 HydrophobicContact CD1-CZ 4.22Å; L281-F285 HydrophobicContact CD2-CE2 4.2Å; L281-F285 HydrophobicContact CG-CD2 3.84Å; L281-F285 HydrophobicContact CG-CE2 3.58Å; L281-F285 WeakPolarHBondContact O-CD2 3.19Å; L281-F285 PolarHBondContact O-N 2.89Å; L282-F285 PolarHBondContact O-N 3.18Å; F285-G287 PolarHBondContact O-N 2.97Å; F285-S288 VanDerWaalsContact O-CB 3.22Å; F285-S288 WeakPolarHBondContact O-CB 3.37Å; F285-S288 PolarHBondContact O-N 3.49Å; F285-S288 PolarHBondContact O-OG 3.33Å; F285-F291 WeakPolarHBondContact O-CB 3.25Å |
| 286 | G | 69.9 | Low | 74.7 | Confident | 30 Ų | 30 | 57.1 Ų | 57.1 | 31% | 0.309 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.6 | -22.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L282 S288 | L282-G286 PolarHBondContact O-N 3.39Å; G286-S288 VanDerWaalsContact C-N 3.35Å |
| 287 | G | 66.9 | Low | 73.3 | Confident | 29 Ų | 29 | 61 Ų | 61 | 30% | 0.299 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -77.9 | -15 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | F283 V284 F285 K292 | F283-G287 PolarHBondContact O-N 2.98Å; V284-G287 PolarHBondContact O-N 3.49Å; V284-G287 VanDerWaalsContact O-N 3.16Å; F285-G287 PolarHBondContact O-N 2.97Å; G287-K292 VanDerWaalsContact O-CE 3.23Å; G287-K292 WeakPolarHBondContact O-CE 3.35Å |
| 288 | S | 64.6 | Low | 72.1 | Confident | 41 Ų | 41 | 66.2 Ų | 66.2 | 29% | 0.287 | 33% | 0.331 | S | S | . | . | S | Bend | trans | -67.6 | 147.5 | -175.8 | 74.5 | 0 | 0 | 0 | 0 | 112.6 | V284 F285 G286 W290 F291 K292 | V284-S288 PolarHBondContact O-N 3.16Å; F285-S288 VanDerWaalsContact O-CB 3.22Å; F285-S288 WeakPolarHBondContact O-CB 3.37Å; F285-S288 PolarHBondContact O-N 3.49Å; F285-S288 PolarHBondContact O-OG 3.33Å; G286-S288 VanDerWaalsContact C-N 3.35Å; S288-W290 PolarHBondContact O-N 2.98Å; S288-F291 PolarHBondContact O-N 3.14Å; S288-F291 PolarHBondContact OG-N 2.83Å; S288-K292 WeakPolarHBondContact O-CG 3.26Å; S288-K292 PolarHBondContact O-N 2.88Å |
| 289 | H | 57.2 | Low | 70.7 | Confident | 148 Ų | 148 | 70.2 Ų | 70.2 | 69% | 0.685 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -57.5 | -35.2 | -179.8 | -167.9 | -82.6 | 0 | 0 | 0 | 112.3 | K292 Q293 | H289-K292 PolarHBondContact O-N 3.35Å; H289-Q293 WeakPolarHBondContact O-CB 3.01Å; H289-Q293 PolarHBondContact O-N 3.45Å |
| 290 | W | 50.3 | Low | 69.5 | Low | 167 Ų | 167 | 74.5 Ų | 74.5 | 63% | 0.633 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -63.8 | -47.2 | 178.1 | -177.9 | 84.5 | 0 | 0 | 0 | 112.6 | S288 K292 Q293 K294 | S288-W290 PolarHBondContact O-N 2.98Å; W290-K292 VanDerWaalsContact C-N 3.28Å; W290-K292 PolarHBondContact O-N 2.93Å; W290-Q293 PolarHBondContact O-N 3.43Å; W290-K294 HydrophobicContact CH2-CD 4.05Å; W290-K294 HydrophobicContact CZ2-CD 4.2Å; W290-K294 PolarHBondContact O-N 3.44Å; W290-K294 VanDerWaalsContact O-N 3.12Å |
| 291 | F | 56.3 | Low | 68.2 | Low | 89 Ų | 89 | 78.9 Ų | 78.9 | 39% | 0.39 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -67.1 | -35.3 | 177.9 | -139.8 | -87.5 | 0 | 0 | 0 | 111.2 | F285 S288 I295 | F285-F291 WeakPolarHBondContact O-CB 3.25Å; S288-F291 PolarHBondContact O-N 3.14Å; S288-F291 PolarHBondContact OG-N 2.83Å; F291-I295 HydrophobicContact CD1-CD1 3.78Å; F291-I295 HydrophobicContact CD1-CG1 4.27Å; F291-I295 HydrophobicContact CE1-CD1 3.95Å; F291-I295 HydrophobicContact CE1-CG1 4.47Å; F291-I295 WeakPolarHBondContact O-CG1 3.44Å; F291-I295 PolarHBondContact O-N 3.35Å |
| 292 | K | 62.7 | Low | 66.9 | Low | 71 Ų | 71 | 82.4 Ų | 82.4 | 31% | 0.309 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.1 | -45 | 174.6 | -69.8 | -179.7 | 176.2 | 173 | 0 | 112.1 | W222 G287 S288 H289 W290 I295 I296 | W222-K292 HydrophobicContact CE3-CG 4.15Å; W222-K292 HydrophobicContact CH2-CB 3.54Å; W222-K292 HydrophobicContact CH2-CD 4.48Å; W222-K292 HydrophobicContact CH2-CG 3.54Å; W222-K292 HydrophobicContact CZ2-CB 3.76Å; W222-K292 HydrophobicContact CZ2-CD 4.4Å; W222-K292 HydrophobicContact CZ2-CG 3.88Å; W222-K292 HydrophobicContact CZ3-CB 4.15Å; W222-K292 HydrophobicContact CZ3-CG 3.63Å; G287-K292 VanDerWaalsContact O-CE 3.23Å; G287-K292 WeakPolarHBondContact O-CE 3.35Å; S288-K292 WeakPolarHBondContact O-CG 3.26Å; S288-K292 PolarHBondContact O-N 2.88Å; H289-K292 PolarHBondContact O-N 3.35Å; W290-K292 VanDerWaalsContact C-N 3.28Å; W290-K292 PolarHBondContact O-N 2.93Å; K292-I295 PolarHBondContact O-N 2.99Å; K292-I296 WeakPolarHBondContact O-CD1 3.33Å; K292-I296 VanDerWaalsContact O-CG1 3.27Å; K292-I296 WeakPolarHBondContact O-CG1 3.19Å; K292-I296 PolarHBondContact O-N 3.36Å; K292-I296 VanDerWaalsContact O-N 3.12Å |
| 293 | Q | 62.1 | Low | 65.4 | Low | 84 Ų | 84 | 83.7 Ų | 83.7 | 39% | 0.393 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.1 | -48.7 | 178.8 | -158.3 | 71.8 | 26.5 | 0 | 0 | 111.4 | H289 W290 I295 I296 D297 | H289-Q293 WeakPolarHBondContact O-CB 3.01Å; H289-Q293 PolarHBondContact O-N 3.45Å; W290-Q293 PolarHBondContact O-N 3.43Å; Q293-I295 VanDerWaalsContact C-N 3.29Å; Q293-I295 PolarHBondContact O-N 3.29Å; Q293-I296 WeakPolarHBondContact O-CB 3.29Å; Q293-I296 PolarHBondContact O-N 2.91Å; Q293-I296 VanDerWaalsContact O-N 3.08Å; Q293-D297 VanDerWaalsContact O-CG 3.26Å; Q293-D297 PolarHBondContact O-N 3.46Å |
| 294 | K | 65.6 | Low | 63.9 | Low | 113 Ų | 113 | 87.2 Ų | 87.2 | 49% | 0.491 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.3 | -32.7 | -177.6 | -162.2 | 169.8 | -176 | 177.6 | 0 | 113.5 | W290 L298 | W290-K294 HydrophobicContact CH2-CD 4.05Å; W290-K294 HydrophobicContact CZ2-CD 4.2Å; W290-K294 PolarHBondContact O-N 3.44Å; W290-K294 VanDerWaalsContact O-N 3.12Å; K294-L298 PolarHBondContact O-N 3.3Å; K294-L298 VanDerWaalsContact O-N 3.13Å |
| 295 | I | 64.8 | Low | 62 | Low | 35 Ų | 35 | 99 Ų | 99 | 18% | 0.179 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -74.2 | -37.7 | 174.5 | -69.4 | -178.5 | 0 | 0 | 0 | 111.5 | W222 L225 F291 K292 Q293 D297 L298 W299 | W222-I295 HydrophobicContact CH2-CB 4.32Å; W222-I295 HydrophobicContact CH2-CG2 4.36Å; L225-I295 HydrophobicContact CD2-CD1 3.73Å; L225-I295 HydrophobicContact CD2-CG2 4.39Å; F291-I295 HydrophobicContact CD1-CD1 3.78Å; F291-I295 HydrophobicContact CD1-CG1 4.27Å; F291-I295 HydrophobicContact CE1-CD1 3.95Å; F291-I295 HydrophobicContact CE1-CG1 4.47Å; F291-I295 WeakPolarHBondContact O-CG1 3.44Å; F291-I295 PolarHBondContact O-N 3.35Å; K292-I295 PolarHBondContact O-N 2.99Å; Q293-I295 VanDerWaalsContact C-N 3.29Å; Q293-I295 PolarHBondContact O-N 3.29Å; I295-D297 VanDerWaalsContact C-N 3.27Å; I295-D297 PolarHBondContact O-N 3.49Å; I295-L298 PolarHBondContact O-N 2.93Å; I295-W299 WeakPolarHBondContact O-CB 3.34Å; I295-W299 PolarHBondContact O-N 3.31Å |
| 296 | I | 66.1 | Low | 61.1 | Low | 49 Ų | 49 | 98 Ų | 98 | 25% | 0.251 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60 | -43.1 | 173.4 | -68 | 163.9 | 0 | 0 | 0 | 109.7 | W222 K292 Q293 W299 N300 | W222-I296 HydrophobicContact CZ2-CD1 4.13Å; W222-I296 HydrophobicContact CZ2-CG1 4.07Å; K292-I296 WeakPolarHBondContact O-CD1 3.33Å; K292-I296 VanDerWaalsContact O-CG1 3.27Å; K292-I296 WeakPolarHBondContact O-CG1 3.19Å; K292-I296 PolarHBondContact O-N 3.36Å; K292-I296 VanDerWaalsContact O-N 3.12Å; Q293-I296 WeakPolarHBondContact O-CB 3.29Å; Q293-I296 PolarHBondContact O-N 2.91Å; Q293-I296 VanDerWaalsContact O-N 3.08Å; I296-W299 PolarHBondContact O-N 3.4Å; I296-N300 VanDerWaalsContact O-CG 3.26Å; I296-N300 PolarHBondContact O-N 3.42Å; I296-N300 PolarHBondContact O-ND2 3.11Å |
| 297 | D | 64.3 | Low | 60.6 | Low | 83 Ų | 83 | 101.5 Ų | 101.5 | 44% | 0.444 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.5 | -46 | 178.3 | -60.3 | -25.9 | 0 | 0 | 0 | 111.9 | Q293 I295 W299 N300 C301 | Q293-D297 VanDerWaalsContact O-CG 3.26Å; Q293-D297 PolarHBondContact O-N 3.46Å; I295-D297 VanDerWaalsContact C-N 3.27Å; I295-D297 PolarHBondContact O-N 3.49Å; D297-W299 VanDerWaalsContact C-N 3.32Å; D297-W299 PolarHBondContact O-N 2.92Å; D297-N300 PolarHBondContact O-N 2.84Å; D297-C301 PolarHBondContact O-N 3.14Å; D297-C301 PolarHBondContact O-SG 3.34Å |
| 298 | L | 66.6 | Low | 60.3 | Low | 110 Ų | 110 | 105.6 Ų | 105.6 | 58% | 0.576 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.9 | -40.2 | 174.4 | -84.8 | 160.7 | 0 | 0 | 0 | 112.6 | K294 I295 C301 V302 | K294-L298 PolarHBondContact O-N 3.3Å; K294-L298 VanDerWaalsContact O-N 3.13Å; I295-L298 PolarHBondContact O-N 2.93Å; L298-C301 WeakPolarHBondContact O-CB 3.41Å; L298-C301 PolarHBondContact O-N 3.09Å; L298-V302 WeakPolarHBondContact O-CG2 3.35Å; L298-V302 PolarHBondContact O-N 3.42Å; L298-V302 VanDerWaalsContact O-N 3.09Å |
| 299 | W | 63.1 | Low | 60 | Low | 99 Ų | 99 | 109.4 Ų | 109.4 | 38% | 0.375 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69.6 | -40.5 | -179.8 | -171.9 | -92.5 | 0 | 0 | 0 | 112 | F221 I295 I296 D297 C301 V302 L303 | F221-W299 HydrophobicContact CE2-CD2 4.43Å; F221-W299 HydrophobicContact CE2-CE3 4.08Å; F221-W299 AromaticContact CE2-CH2 3.89Å; F221-W299 HydrophobicContact CE2-CH2 3.89Å; F221-W299 HydrophobicContact CE2-CZ2 4.24Å; F221-W299 AromaticContact CE2-CZ3 3.8Å; F221-W299 HydrophobicContact CE2-CZ3 3.8Å; F221-W299 HydrophobicContact CZ-CD2 4.25Å; F221-W299 AromaticContact CZ-CE3 3.91Å; F221-W299 HydrophobicContact CZ-CE3 3.91Å; F221-W299 HydrophobicContact CZ-CZ3 4.07Å; I295-W299 WeakPolarHBondContact O-CB 3.34Å; I295-W299 PolarHBondContact O-N 3.31Å; I296-W299 PolarHBondContact O-N 3.4Å; D297-W299 VanDerWaalsContact C-N 3.32Å; D297-W299 PolarHBondContact O-N 2.92Å; W299-C301 VanDerWaalsContact C-N 3.26Å; W299-C301 PolarHBondContact O-N 2.88Å; W299-V302 PolarHBondContact O-N 3.14Å; W299-V302 VanDerWaalsContact O-N 3.09Å; W299-L303 VanDerWaalsContact CD1-CD1 3.41Å; W299-L303 HydrophobicContact CD2-CD1 4.34Å; W299-L303 HydrophobicContact CG-CD1 4.26Å; W299-L303 HydrophobicContact CZ2-CD1 4.11Å; W299-L303 PolarHBondContact O-N 3.02Å |
| 300 | N | 67.2 | Low | 60.2 | Low | 90 Ų | 90 | 106.9 Ų | 106.9 | 48% | 0.481 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.8 | -36.2 | 172.8 | -70.1 | -22.3 | 0 | 0 | 0 | 111.4 | I296 D297 C304 | I296-N300 VanDerWaalsContact O-CG 3.26Å; I296-N300 PolarHBondContact O-N 3.42Å; I296-N300 PolarHBondContact O-ND2 3.11Å; D297-N300 PolarHBondContact O-N 2.84Å; N300-C304 WeakPolarHBondContact O-CB 3.33Å; N300-C304 PolarHBondContact O-N 2.93Å |
| 301 | C | 61.3 | Low | 60.9 | Low | 96 Ų | 96 | 102.9 Ų | 102.9 | 65% | 0.649 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.3 | -35.5 | 172 | -73.2 | 0 | 0 | 0 | 0 | 113.3 | D297 L298 W299 | D297-C301 PolarHBondContact O-N 3.14Å; D297-C301 PolarHBondContact O-SG 3.34Å; L298-C301 WeakPolarHBondContact O-CB 3.41Å; L298-C301 PolarHBondContact O-N 3.09Å; W299-C301 VanDerWaalsContact C-N 3.26Å; W299-C301 PolarHBondContact O-N 2.88Å |
| 302 | V | 62.2 | Low | 61.2 | Low | 100 Ų | 100 | 103.9 Ų | 103.9 | 61% | 0.606 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -75.4 | -34.5 | 178.8 | 172.5 | 0 | 0 | 0 | 0 | 112 | L298 W299 | L298-V302 WeakPolarHBondContact O-CG2 3.35Å; L298-V302 PolarHBondContact O-N 3.42Å; L298-V302 VanDerWaalsContact O-N 3.09Å; W299-V302 PolarHBondContact O-N 3.14Å; W299-V302 VanDerWaalsContact O-N 3.09Å |
| 303 | L | 54.5 | Low | 61.1 | Low | 118 Ų | 118 | 106.5 Ų | 106.5 | 62% | 0.618 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -78.8 | -14.1 | 176.5 | -105.1 | 120.6 | 0 | 0 | 0 | 114.6 | W299 R305 | W299-L303 VanDerWaalsContact CD1-CD1 3.41Å; W299-L303 HydrophobicContact CD2-CD1 4.34Å; W299-L303 HydrophobicContact CG-CD1 4.26Å; W299-L303 HydrophobicContact CZ2-CD1 4.11Å; W299-L303 PolarHBondContact O-N 3.02Å; L303-R305 VanDerWaalsContact C-N 3.26Å; L303-R305 PolarHBondContact O-N 3.14Å |
| 304 | C | 52.6 | Low | 61 | Low | 123 Ų | 123 | 108.3 Ų | 108.3 | 83% | 0.831 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.6 | 9.3 | 174.6 | -93.6 | 0 | 0 | 0 | 0 | 114 | N300 | N300-C304 WeakPolarHBondContact O-CB 3.33Å; N300-C304 PolarHBondContact O-N 2.93Å |
| 305 | R | 43.8 | Very low | 60.6 | Low | 284 Ų | 284 | 107.9 Ų | 107.9 | 100% | 1.072 | 55% | 0.553 | S | S | * | * | trans | -120.1 | 0 | 175.5 | -165.9 | -179.8 | -161.4 | 178.5 | 6 | 110.7 | L303 | L303-R305 VanDerWaalsContact C-N 3.26Å; L303-R305 PolarHBondContact O-N 3.14Å |
Retrieved 305 of 305 residues in 147.2 ms
(Link to these results)