| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.8 | Very low | 63.5 | Low | 215 Ų | 215 | 93 Ų | 93 | 100% | 1.059 | 52% | 0.516 | S | S | * | . | 0 | 114.9 | 0 | -86.9 | 175.2 | 168.6 | 0 | 0 | 107.8 | F3 | M1-F3 PolarHBondContact O-N 3.35Š| |||
| 2 | V | 51.1 | Low | 63.7 | Low | 118 Ų | 118 | 90.6 Ų | 90.6 | 72% | 0.715 | 51% | 0.506 | S | S | * | . | trans | -71.7 | 111.1 | 174.5 | 179.8 | 0 | 0 | 0 | 0 | 107.6 | S4 | V2-S4 PolarHBondContact O-N 3.15Š| ||
| 3 | F | 60.1 | Low | 64.4 | Low | 69 Ų | 69 | 93.1 Ų | 93.1 | 30% | 0.303 | 51% | 0.51 | S | S | . | . | trans | -63.3 | 133.7 | 176.6 | -76.8 | -91.5 | 0 | 0 | 0 | 110 | M1 V7 K8 I137 N141 | M1-F3 PolarHBondContact O-N 3.35Å; F3-V7 HydrophobicContact CB-CB 4.41Å; F3-V7 HydrophobicContact CD1-CB 4.17Å; F3-V7 HydrophobicContact CD1-CG1 3.72Å; F3-V7 HydrophobicContact CD1-CG2 4.47Å; F3-V7 HydrophobicContact CE1-CG1 4.34Å; F3-K8 WeakPolarHBondContact O-CE 3.19Å; F3-I137 HydrophobicContact CD2-CG2 3.86Å; F3-I137 HydrophobicContact CE2-CG2 3.57Å; F3-I137 HydrophobicContact CZ-CG2 4.02Å; F3-N141 VanDerWaalsContact CD2-ND2 3.28Å; F3-N141 WeakPolarHBondContact CD2-ND2 3.26Å; F3-N141 WeakPolarHBondContact CD2-OD1 3.02Å; F3-N141 PolarHBondContact N-OD1 3.25Å | ||
| 4 | S | 74.8 | Confident | 64.5 | Low | 67 Ų | 67 | 92.6 Ų | 92.6 | 47% | 0.469 | 51% | 0.506 | S | S | . | . | trans | -58.1 | 148.7 | 176.3 | 68.9 | 0 | 0 | 0 | 0 | 110.4 | V2 S6 V7 K8 | V2-S4 PolarHBondContact O-N 3.15Å; S4-S6 PolarHBondContact O-N 2.66Å; S4-V7 PolarHBondContact O-N 2.9Å; S4-K8 PolarHBondContact O-N 3.38Å | ||
| 5 | S | 71.2 | Confident | 64.3 | Low | 89 Ų | 89 | 88.9 Ų | 88.9 | 62% | 0.622 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -52.8 | -32.3 | -179.1 | -57.6 | 0 | 0 | 0 | 0 | 112.5 | K8 I9 | S5-K8 PolarHBondContact O-N 3.16Å; S5-I9 WeakPolarHBondContact O-CG1 3.45Å; S5-I9 PolarHBondContact O-N 2.98Å |
| 6 | S | 70.7 | Confident | 64.3 | Low | 77 Ų | 77 | 86.8 Ų | 86.8 | 54% | 0.538 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.9 | -40.4 | 176.6 | -46.4 | 0 | 0 | 0 | 0 | 113.1 | S4 K8 I9 I10 | S4-S6 PolarHBondContact O-N 2.66Å; S6-K8 VanDerWaalsContact C-N 3.32Å; S6-K8 PolarHBondContact O-N 3.03Å; S6-I9 PolarHBondContact O-N 2.94Å; S6-I10 VanDerWaalsContact O-CG1 3.3Å; S6-I10 WeakPolarHBondContact O-CG1 3.35Å; S6-I10 PolarHBondContact O-N 3.43Å |
| 7 | V | 68.7 | Low | 64.6 | Low | 47 Ų | 47 | 86.9 Ų | 86.9 | 29% | 0.285 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -67.4 | -37.2 | 179.4 | -178.8 | 0 | 0 | 0 | 0 | 110.7 | F3 S4 I9 I10 L11 | F3-V7 HydrophobicContact CB-CB 4.41Å; F3-V7 HydrophobicContact CD1-CB 4.17Å; F3-V7 HydrophobicContact CD1-CG1 3.72Å; F3-V7 HydrophobicContact CD1-CG2 4.47Å; F3-V7 HydrophobicContact CE1-CG1 4.34Å; S4-V7 PolarHBondContact O-N 2.9Å; V7-I9 VanDerWaalsContact C-N 3.34Å; V7-I9 PolarHBondContact O-N 3.41Å; V7-I10 PolarHBondContact O-N 2.94Å; V7-L11 HydrophobicContact CG1-CD1 3.87Å; V7-L11 HydrophobicContact CG1-CG 4.15Å; V7-L11 WeakPolarHBondContact O-CB 3.34Å; V7-L11 VanDerWaalsContact O-CG 3.28Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 3.32Å |
| 8 | K | 59.7 | Low | 64.5 | Low | 92 Ų | 92 | 84.7 Ų | 84.7 | 40% | 0.4 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.8 | -46.9 | 175.9 | -59.3 | 179.7 | -173.8 | 174.2 | 0 | 110.8 | F3 S4 S5 S6 L11 T12 | F3-K8 WeakPolarHBondContact O-CE 3.19Å; S4-K8 PolarHBondContact O-N 3.38Å; S5-K8 PolarHBondContact O-N 3.16Å; S6-K8 VanDerWaalsContact C-N 3.32Å; S6-K8 PolarHBondContact O-N 3.03Å; K8-L11 PolarHBondContact O-N 3.35Å; K8-T12 PolarHBondContact O-N 3.14Å; K8-T12 PolarHBondContact O-OG1 3.22Å |
| 9 | I | 65.3 | Low | 64.4 | Low | 99 Ų | 99 | 82.2 Ų | 82.2 | 51% | 0.508 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.8 | -47.3 | 178.1 | -65.3 | 169.2 | 0 | 0 | 0 | 110.8 | S5 S6 V7 L11 T12 H13 | S5-I9 WeakPolarHBondContact O-CG1 3.45Å; S5-I9 PolarHBondContact O-N 2.98Å; S6-I9 PolarHBondContact O-N 2.94Å; V7-I9 VanDerWaalsContact C-N 3.34Å; V7-I9 PolarHBondContact O-N 3.41Å; I9-L11 PolarHBondContact O-N 2.85Å; I9-T12 PolarHBondContact O-N 3.34Å; I9-H13 VanDerWaalsContact CG2-CE1 3.47Å; I9-H13 WeakPolarHBondContact CG2-CE1 3.32Å; I9-H13 PolarHBondContact O-N 3.32Å; I9-H13 PolarHBondContact O-ND1 2.97Å |
| 10 | I | 70.5 | Confident | 64.6 | Low | 97 Ų | 97 | 82.7 Ų | 82.7 | 50% | 0.497 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.4 | -45.9 | 179.2 | -68.2 | 164.9 | 0 | 0 | 0 | 110.7 | S6 V7 T12 H13 L14 | S6-I10 VanDerWaalsContact O-CG1 3.3Å; S6-I10 WeakPolarHBondContact O-CG1 3.35Å; S6-I10 PolarHBondContact O-N 3.43Å; V7-I10 PolarHBondContact O-N 2.94Å; I10-T12 VanDerWaalsContact C-N 3.33Å; I10-T12 PolarHBondContact O-N 2.89Å; I10-H13 PolarHBondContact O-N 3.02Å; I10-L14 HydrophobicContact CG2-CD1 3.91Å; I10-L14 HydrophobicContact CG2-CG 4.35Å; I10-L14 WeakPolarHBondContact O-CB 3.42Å; I10-L14 WeakPolarHBondContact O-CG 3.46Å; I10-L14 PolarHBondContact O-N 3.26Å |
| 11 | L | 62.9 | Low | 64.7 | Low | 53 Ų | 53 | 82.9 Ų | 82.9 | 28% | 0.277 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.7 | -39.8 | 177.4 | -71.5 | 173.7 | 0 | 0 | 0 | 111.8 | V7 K8 I9 L14 F15 I137 | V7-L11 HydrophobicContact CG1-CD1 3.87Å; V7-L11 HydrophobicContact CG1-CG 4.15Å; V7-L11 WeakPolarHBondContact O-CB 3.34Å; V7-L11 VanDerWaalsContact O-CG 3.28Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 3.32Å; K8-L11 PolarHBondContact O-N 3.35Å; I9-L11 PolarHBondContact O-N 2.85Å; L11-L14 PolarHBondContact O-N 3.13Å; L11-F15 VanDerWaalsContact O-CB 3.26Å; L11-F15 WeakPolarHBondContact O-CB 3.35Å; L11-F15 PolarHBondContact O-N 3.11Å; L11-I137 HydrophobicContact CD1-CG2 4.5Å |
| 12 | T | 65.9 | Low | 65.7 | Low | 64 Ų | 64 | 73.5 Ų | 73.5 | 39% | 0.393 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.1 | -40.8 | 173.7 | -56.5 | 0 | 0 | 0 | 0 | 112 | K8 I9 I10 F15 C16 | K8-T12 PolarHBondContact O-N 3.14Å; K8-T12 PolarHBondContact O-OG1 3.22Å; I9-T12 PolarHBondContact O-N 3.34Å; I10-T12 VanDerWaalsContact C-N 3.33Å; I10-T12 PolarHBondContact O-N 2.89Å; T12-F15 WeakPolarHBondContact O-CB 3.46Å; T12-F15 PolarHBondContact O-N 3.44Å; T12-C16 PolarHBondContact O-N 3.27Å; T12-C16 PolarHBondContact O-SG 2.77Å |
| 13 | H | 72.1 | Confident | 66.6 | Low | 123 Ų | 123 | 71.8 Ų | 71.8 | 57% | 0.569 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -68.5 | -42.4 | 177.7 | -75.1 | 66.9 | 0 | 0 | 0 | 111.9 | I9 I10 F15 C16 L17 | I9-H13 VanDerWaalsContact CG2-CE1 3.47Å; I9-H13 WeakPolarHBondContact CG2-CE1 3.32Å; I9-H13 PolarHBondContact O-N 3.32Å; I9-H13 PolarHBondContact O-ND1 2.97Å; I10-H13 PolarHBondContact O-N 3.02Å; H13-F15 VanDerWaalsContact C-N 3.26Å; H13-F15 PolarHBondContact O-N 3.22Å; H13-C16 PolarHBondContact O-N 2.95Å; H13-L17 WeakPolarHBondContact O-CB 3.42Å; H13-L17 PolarHBondContact O-N 3Å |
| 14 | L | 65.6 | Low | 67 | Low | 86 Ų | 86 | 73.2 Ų | 73.2 | 45% | 0.45 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61 | -38.4 | 173.2 | -72.8 | 172.6 | 0 | 0 | 0 | 111.1 | I10 L11 L17 N18 | I10-L14 HydrophobicContact CG2-CD1 3.91Å; I10-L14 HydrophobicContact CG2-CG 4.35Å; I10-L14 WeakPolarHBondContact O-CB 3.42Å; I10-L14 WeakPolarHBondContact O-CG 3.46Å; I10-L14 PolarHBondContact O-N 3.26Å; L11-L14 PolarHBondContact O-N 3.13Å; L14-L17 PolarHBondContact O-N 3.33Å; L14-N18 PolarHBondContact O-N 3.33Å; L14-N18 PolarHBondContact O-ND2 3.46Å |
| 15 | F | 61.6 | Low | 66.5 | Low | 38 Ų | 38 | 71.2 Ų | 71.2 | 17% | 0.167 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.2 | -49.5 | 173.3 | 170.1 | -94.5 | 0 | 0 | 0 | 111.8 | L11 T12 H13 L17 N18 I19 L55 L59 L131 | L11-F15 VanDerWaalsContact O-CB 3.26Å; L11-F15 WeakPolarHBondContact O-CB 3.35Å; L11-F15 PolarHBondContact O-N 3.11Å; T12-F15 WeakPolarHBondContact O-CB 3.46Å; T12-F15 PolarHBondContact O-N 3.44Å; H13-F15 VanDerWaalsContact C-N 3.26Å; H13-F15 PolarHBondContact O-N 3.22Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-L17 PolarHBondContact O-N 3.46Å; F15-N18 PolarHBondContact O-N 2.65Å; F15-I19 HydrophobicContact CD1-CD1 4.06Å; F15-I19 HydrophobicContact CE1-CD1 3.35Å; F15-I19 HydrophobicContact CE1-CG1 4.39Å; F15-I19 HydrophobicContact CE2-CD1 4.12Å; F15-I19 HydrophobicContact CZ-CD1 3.42Å; F15-I19 VanDerWaalsContact CZ-CD1 3.42Å; F15-I19 HydrophobicContact CZ-CG1 4.33Å; F15-I19 PolarHBondContact O-N 2.87Å; F15-L55 HydrophobicContact CE2-CD1 4.39Å; F15-L55 HydrophobicContact CZ-CD1 4.38Å; F15-L55 HydrophobicContact CZ-CG 4.49Å; F15-L59 HydrophobicContact CD1-CD1 4.49Å; F15-L59 HydrophobicContact CE1-CD1 3.69Å; F15-L59 HydrophobicContact CE1-CD2 4.22Å; F15-L59 HydrophobicContact CE1-CG 4.44Å; F15-L59 HydrophobicContact CZ-CD1 4.34Å; F15-L131 HydrophobicContact CD2-CD1 4.09Å; F15-L131 HydrophobicContact CE2-CD1 3.52Å |
| 16 | C | 65.6 | Low | 66.1 | Low | 54 Ų | 54 | 67.9 Ų | 67.9 | 37% | 0.365 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 176.4 | -69.1 | 0 | 0 | 0 | 0 | 111.9 | T12 H13 N18 I19 I20 | T12-C16 PolarHBondContact O-N 3.27Å; T12-C16 PolarHBondContact O-SG 2.77Å; H13-C16 PolarHBondContact O-N 2.95Å; C16-N18 VanDerWaalsContact C-N 3.35Å; C16-N18 PolarHBondContact O-N 2.94Å; C16-I19 PolarHBondContact O-N 3.39Å; C16-I20 WeakPolarHBondContact O-CG1 3.43Å; C16-I20 PolarHBondContact O-N 3.47Å |
| 17 | L | 69.1 | Low | 66 | Low | 90 Ų | 90 | 66.5 Ų | 66.5 | 47% | 0.471 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -60.8 | -43.3 | 176.6 | -174.4 | 68.4 | 0 | 0 | 0 | 111.4 | H13 L14 F15 I19 I20 L21 | H13-L17 WeakPolarHBondContact O-CB 3.42Å; H13-L17 PolarHBondContact O-N 3Å; L14-L17 PolarHBondContact O-N 3.33Å; F15-L17 VanDerWaalsContact C-N 3.31Å; F15-L17 PolarHBondContact O-N 3.46Å; L17-I19 PolarHBondContact O-N 3.23Å; L17-I20 PolarHBondContact O-N 3.35Å; L17-L21 HydrophobicContact CG-CD1 4.11Å; L17-L21 HydrophobicContact CG-CG 4.44Å; L17-L21 WeakPolarHBondContact O-CB 3.41Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 3.47Å |
| 18 | N | 62 | Low | 65.8 | Low | 47 Ų | 47 | 69.8 Ų | 69.8 | 25% | 0.251 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -64.1 | -38.5 | 177.4 | -79.9 | -64.1 | 0 | 0 | 0 | 112.5 | L14 F15 C16 L21 C22 C127 | L14-N18 PolarHBondContact O-N 3.33Å; L14-N18 PolarHBondContact O-ND2 3.46Å; F15-N18 PolarHBondContact O-N 2.65Å; C16-N18 VanDerWaalsContact C-N 3.35Å; C16-N18 PolarHBondContact O-N 2.94Å; N18-L21 PolarHBondContact O-N 2.96Å; N18-C22 WeakPolarHBondContact O-CB 3.46Å; N18-C22 PolarHBondContact O-N 3.13Å; N18-C127 HydrophobicContact CB-CB 4.5Å; N18-C127 PolarHBondContact OD1-SG 3.4Å |
| 19 | I | 62.8 | Low | 65.9 | Low | 37 Ų | 37 | 67.2 Ų | 67.2 | 19% | 0.19 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.9 | -47.6 | 172.9 | -68.5 | 178.2 | 0 | 0 | 0 | 110.6 | F15 C16 L17 L21 C22 I23 L55 | F15-I19 HydrophobicContact CD1-CD1 4.06Å; F15-I19 HydrophobicContact CE1-CD1 3.35Å; F15-I19 HydrophobicContact CE1-CG1 4.39Å; F15-I19 HydrophobicContact CE2-CD1 4.12Å; F15-I19 HydrophobicContact CZ-CD1 3.42Å; F15-I19 VanDerWaalsContact CZ-CD1 3.42Å; F15-I19 HydrophobicContact CZ-CG1 4.33Å; F15-I19 PolarHBondContact O-N 2.87Å; C16-I19 PolarHBondContact O-N 3.39Å; L17-I19 PolarHBondContact O-N 3.23Å; I19-L21 PolarHBondContact O-N 3.05Å; I19-C22 WeakPolarHBondContact O-CB 3.48Å; I19-C22 PolarHBondContact O-N 3.3Å; I19-I23 HydrophobicContact CG2-CD1 3.8Å; I19-I23 HydrophobicContact CG2-CG1 4.4Å; I19-I23 WeakPolarHBondContact O-CG1 3.31Å; I19-I23 PolarHBondContact O-N 2.98Å; I19-L55 HydrophobicContact CD1-CD2 3.88Å; I19-L55 HydrophobicContact CD1-CG 4.4Å; I19-L55 HydrophobicContact CG1-CD2 3.89Å |
| 20 | I | 68.3 | Low | 65.8 | Low | 92 Ų | 92 | 65.4 Ų | 65.4 | 47% | 0.472 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.7 | -46.5 | 179.5 | -68 | 166.2 | 0 | 0 | 0 | 110.4 | C16 L17 C22 I23 I24 | C16-I20 WeakPolarHBondContact O-CG1 3.43Å; C16-I20 PolarHBondContact O-N 3.47Å; L17-I20 PolarHBondContact O-N 3.35Å; I20-C22 VanDerWaalsContact C-N 3.32Å; I20-C22 PolarHBondContact O-N 3.47Å; I20-I23 PolarHBondContact O-N 3.46Å; I20-I24 HydrophobicContact CG2-CD1 3.71Å; I20-I24 HydrophobicContact CG2-CG1 4.38Å; I20-I24 VanDerWaalsContact O-CG1 3.27Å; I20-I24 WeakPolarHBondContact O-CG1 3.27Å; I20-I24 PolarHBondContact O-N 3.35Å |
| 21 | L | 66.3 | Low | 65.4 | Low | 87 Ų | 87 | 71.1 Ų | 71.1 | 46% | 0.455 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.8 | -38.8 | 177.3 | -69.7 | 175.1 | 0 | 0 | 0 | 111.9 | L17 N18 I19 I24 S25 | L17-L21 HydrophobicContact CG-CD1 4.11Å; L17-L21 HydrophobicContact CG-CG 4.44Å; L17-L21 WeakPolarHBondContact O-CB 3.41Å; L17-L21 VanDerWaalsContact O-CG 3.27Å; L17-L21 WeakPolarHBondContact O-CG 3.47Å; L17-L21 PolarHBondContact O-N 3.47Å; N18-L21 PolarHBondContact O-N 2.96Å; I19-L21 PolarHBondContact O-N 3.05Å; L21-I24 PolarHBondContact O-N 2.86Å; L21-S25 VanDerWaalsContact O-CB 3.3Å; L21-S25 WeakPolarHBondContact O-CB 3.3Å; L21-S25 PolarHBondContact O-N 3.42Å |
| 22 | C | 66.2 | Low | 65.1 | Low | 17 Ų | 17 | 74.1 Ų | 74.1 | 12% | 0.115 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -62.7 | -46.3 | 174.5 | -175.8 | 0 | 0 | 0 | 0 | 111.5 | N18 I19 I20 S25 L26 | N18-C22 WeakPolarHBondContact O-CB 3.46Å; N18-C22 PolarHBondContact O-N 3.13Å; I19-C22 WeakPolarHBondContact O-CB 3.48Å; I19-C22 PolarHBondContact O-N 3.3Å; I20-C22 VanDerWaalsContact C-N 3.32Å; I20-C22 PolarHBondContact O-N 3.47Å; C22-S25 WeakPolarHBondContact O-CB 3.32Å; C22-S25 PolarHBondContact O-N 3.43Å; C22-L26 PolarHBondContact O-N 2.85Å |
| 23 | I | 68.7 | Low | 64.5 | Low | 83 Ų | 83 | 73.5 Ų | 73.5 | 43% | 0.426 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 176.5 | -67.8 | 168.8 | 0 | 0 | 0 | 111 | I19 I20 S25 L26 A27 L52 | I19-I23 HydrophobicContact CG2-CD1 3.8Å; I19-I23 HydrophobicContact CG2-CG1 4.4Å; I19-I23 WeakPolarHBondContact O-CG1 3.31Å; I19-I23 PolarHBondContact O-N 2.98Å; I20-I23 PolarHBondContact O-N 3.46Å; I23-S25 VanDerWaalsContact C-N 3.32Å; I23-S25 PolarHBondContact O-N 2.92Å; I23-L26 PolarHBondContact O-N 3.33Å; I23-A27 WeakPolarHBondContact O-CB 3.42Å; I23-A27 PolarHBondContact O-N 3.17Å; I23-L52 HydrophobicContact CG1-CD2 4.4Å |
| 24 | I | 69.5 | Low | 63.8 | Low | 99 Ų | 99 | 70.6 Ų | 70.6 | 51% | 0.508 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 177.6 | -69.6 | 168.8 | 0 | 0 | 0 | 110.4 | I20 L21 A27 K28 | I20-I24 HydrophobicContact CG2-CD1 3.71Å; I20-I24 HydrophobicContact CG2-CG1 4.38Å; I20-I24 VanDerWaalsContact O-CG1 3.27Å; I20-I24 WeakPolarHBondContact O-CG1 3.27Å; I20-I24 PolarHBondContact O-N 3.35Å; L21-I24 PolarHBondContact O-N 2.86Å; I24-A27 PolarHBondContact O-N 3.46Å; I24-K28 WeakPolarHBondContact O-CB 3.49Å; I24-K28 PolarHBondContact O-N 3.33Å |
| 25 | S | 62.9 | Low | 63.2 | Low | 25 Ų | 25 | 75 Ų | 75 | 18% | 0.175 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 175.5 | -173.8 | 0 | 0 | 0 | 0 | 111.3 | L21 C22 I23 A27 K28 N29 Y120 | L21-S25 VanDerWaalsContact O-CB 3.3Å; L21-S25 WeakPolarHBondContact O-CB 3.3Å; L21-S25 PolarHBondContact O-N 3.42Å; C22-S25 WeakPolarHBondContact O-CB 3.32Å; C22-S25 PolarHBondContact O-N 3.43Å; I23-S25 VanDerWaalsContact C-N 3.32Å; I23-S25 PolarHBondContact O-N 2.92Å; S25-A27 PolarHBondContact O-N 2.94Å; S25-K28 PolarHBondContact O-N 3.28Å; S25-N29 PolarHBondContact O-N 3.26Å; S25-N29 PolarHBondContact O-ND2 3.29Å; S25-Y120 VanDerWaalsContact OG-CD1 3.26Å; S25-Y120 WeakPolarHBondContact OG-CD1 3.47Å |
| 26 | L | 64.1 | Low | 63 | Low | 19 Ų | 19 | 81.6 Ų | 81.6 | 10% | 0.099 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 174.6 | -111.7 | 93.9 | 0 | 0 | 0 | 112.2 | C22 I23 K28 N29 N30 L52 | C22-L26 PolarHBondContact O-N 2.85Å; I23-L26 PolarHBondContact O-N 3.33Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.47Å; L26-N29 PolarHBondContact O-N 3.4Å; L26-N30 WeakPolarHBondContact O-CB 3.29Å; L26-N30 PolarHBondContact O-N 2.95Å; L26-L52 HydrophobicContact CD2-CD1 4.1Å |
| 27 | A | 67.4 | Low | 62.5 | Low | 48 Ų | 48 | 85 Ų | 85 | 40% | 0.397 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -64.9 | -38.3 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I23 I24 S25 R31 | I23-A27 WeakPolarHBondContact O-CB 3.42Å; I23-A27 PolarHBondContact O-N 3.17Å; I24-A27 PolarHBondContact O-N 3.46Å; S25-A27 PolarHBondContact O-N 2.94Å; A27-R31 PolarHBondContact O-N 3.11Å |
| 28 | K | 65 | Low | 62.6 | Low | 115 Ų | 115 | 83.2 Ų | 83.2 | 50% | 0.5 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -67.5 | -43.4 | 176.1 | -170.2 | 173.2 | 177.9 | -177.2 | 0 | 111.2 | I24 S25 L26 R31 V32 Y120 | I24-K28 WeakPolarHBondContact O-CB 3.49Å; I24-K28 PolarHBondContact O-N 3.33Å; S25-K28 PolarHBondContact O-N 3.28Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.47Å; K28-R31 PolarHBondContact O-N 3.42Å; K28-V32 PolarHBondContact O-N 3.17Å; K28-Y120 WeakPolarHBondContact CD-OH 3.48Å; K28-Y120 VanDerWaalsContact CE-OH 3.31Å; K28-Y120 WeakPolarHBondContact CE-OH 3.3Å; K28-Y120 PolarHBondContact NZ-OH 3.47Å |
| 29 | N | 61.7 | Low | 63.3 | Low | 38 Ų | 38 | 87.7 Ų | 87.7 | 20% | 0.203 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 177.7 | -71.5 | -19.7 | 0 | 0 | 0 | 111.7 | S25 L26 R31 V32 T33 | S25-N29 PolarHBondContact O-N 3.26Å; S25-N29 PolarHBondContact O-ND2 3.29Å; L26-N29 PolarHBondContact O-N 3.4Å; N29-R31 PolarHBondContact O-N 2.69Å; N29-V32 PolarHBondContact O-N 2.93Å; N29-V32 VanDerWaalsContact O-N 3.08Å; N29-T33 PolarHBondContact O-N 3.4Å; N29-T33 PolarHBondContact O-OG1 3.38Å |
| 30 | N | 64.3 | Low | 63.6 | Low | 61 Ų | 61 | 87.8 Ų | 87.8 | 33% | 0.326 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -59.7 | -30.4 | 176.2 | -79.3 | -13.1 | 0 | 0 | 0 | 113.7 | L26 I45 | L26-N30 WeakPolarHBondContact O-CB 3.29Å; L26-N30 PolarHBondContact O-N 2.95Å; N30-I45 WeakPolarHBondContact OD1-CD1 3.26Å |
| 31 | R | 60.9 | Low | 63.6 | Low | 218 Ų | 218 | 85 Ų | 85 | 82% | 0.823 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -72.7 | -37.1 | 175.4 | -74 | -178.3 | -177.6 | -176.5 | 1.6 | 112.2 | A27 K28 N29 | A27-R31 PolarHBondContact O-N 3.11Å; K28-R31 PolarHBondContact O-N 3.42Å; N29-R31 PolarHBondContact O-N 2.69Å |
| 32 | V | 56.3 | Low | 63.9 | Low | 116 Ų | 116 | 86.9 Ų | 86.9 | 70% | 0.703 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -77.6 | -32.7 | -177.8 | -179.4 | 0 | 0 | 0 | 0 | 111.6 | K28 N29 | K28-V32 PolarHBondContact O-N 3.17Å; N29-V32 PolarHBondContact O-N 2.93Å; N29-V32 VanDerWaalsContact O-N 3.08Å |
| 33 | T | 55.1 | Low | 64.5 | Low | 50 Ų | 50 | 89.1 Ų | 89.1 | 31% | 0.307 | 46% | 0.461 | S | S | . | . | S | Bend | trans | -92.4 | 3.8 | -176.3 | 49.2 | 0 | 0 | 0 | 0 | 115.4 | N29 Q35 | N29-T33 PolarHBondContact O-N 3.4Å; N29-T33 PolarHBondContact O-OG1 3.38Å; T33-Q35 PolarHBondContact O-N 3.18Å |
| 34 | A | 56 | Low | 64.8 | Low | 63 Ų | 63 | 86.9 Ų | 86.9 | 52% | 0.521 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -8.2 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 35 | Q | 54.5 | Low | 65.1 | Low | 177 Ų | 177 | 84.1 Ų | 84.1 | 83% | 0.827 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.4 | -11.4 | -172.4 | -78.2 | -176.6 | -34.7 | 0 | 0 | 116.8 | T33 | T33-Q35 PolarHBondContact O-N 3.18Š|
| 36 | H | 55.6 | Low | 66 | Low | 177 Ų | 177 | 86.5 Ų | 86.5 | 82% | 0.819 | 45% | 0.45 | S | S | * | . | S | Bend | trans | -148.1 | 63.1 | 176.7 | -78.3 | -73.8 | 0 | 0 | 0 | 113.7 | S38 | H36-S38 PolarHBondContact O-N 3.41Š|
| 37 | K | 55.8 | Low | 66.7 | Low | 127 Ų | 127 | 86.9 Ų | 86.9 | 55% | 0.552 | 46% | 0.455 | S | S | * | . | trans | -62.9 | 102 | -176.2 | -72.5 | -176.7 | -179.7 | 177.7 | 0 | 113.5 | E41 | K37-E41 WeakPolarHBondContact CA-OE2 3.21Š| ||
| 38 | S | 71.6 | Confident | 67.4 | Low | 51 Ų | 51 | 84.7 Ų | 84.7 | 36% | 0.357 | 44% | 0.436 | S | S | . | . | trans | -68.4 | 155.4 | 161.1 | 69.7 | 0 | 0 | 0 | 0 | 110.5 | H36 A40 E41 K42 | H36-S38 PolarHBondContact O-N 3.41Å; S38-A40 PolarHBondContact O-N 3.2Å; S38-E41 PolarHBondContact O-N 3.11Å; S38-E41 VanDerWaalsContact O-N 3.09Å; S38-E41 PolarHBondContact OG-N 3.26Å; S38-K42 PolarHBondContact O-N 3.44Å | ||
| 39 | I | 76.9 | Confident | 68.2 | Low | 141 Ų | 141 | 84 Ų | 84 | 72% | 0.723 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -55.7 | -35.5 | 175.4 | -67.6 | 163.2 | 0 | 0 | 0 | 110.7 | E41 K42 V43 | I39-E41 VanDerWaalsContact C-N 3.34Å; I39-E41 PolarHBondContact O-N 2.87Å; I39-K42 PolarHBondContact O-N 2.88Å; I39-V43 WeakPolarHBondContact O-CG2 3.44Å; I39-V43 PolarHBondContact O-N 3.29Å; I39-V43 VanDerWaalsContact O-N 3.14Å |
| 40 | A | 68 | Low | 69.3 | Low | 39 Ų | 39 | 87.5 Ų | 87.5 | 32% | 0.322 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -60.3 | -38.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S38 V43 Y44 I97 | S38-A40 PolarHBondContact O-N 3.2Å; A40-V43 PolarHBondContact O-N 3.47Å; A40-Y44 WeakPolarHBondContact O-CB 3.49Å; A40-Y44 PolarHBondContact O-N 3.17Å; A40-I97 HydrophobicContact CB-CG2 4.19Å |
| 41 | E | 68.7 | Low | 70.2 | Confident | 35 Ų | 35 | 84.6 Ų | 84.6 | 16% | 0.164 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -67.6 | -36.2 | 176.4 | -71 | -177.2 | 172.2 | 0 | 0 | 112.6 | K37 S38 I39 V43 Y44 I45 | K37-E41 WeakPolarHBondContact CA-OE2 3.21Å; S38-E41 PolarHBondContact O-N 3.11Å; S38-E41 VanDerWaalsContact O-N 3.09Å; S38-E41 PolarHBondContact OG-N 3.26Å; I39-E41 VanDerWaalsContact C-N 3.34Å; I39-E41 PolarHBondContact O-N 2.87Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.26Å; E41-Y44 PolarHBondContact O-N 3Å; E41-I45 WeakPolarHBondContact O-CG1 3.38Å; E41-I45 PolarHBondContact O-N 3.38Å |
| 42 | K | 73.9 | Confident | 71.2 | Confident | 125 Ų | 125 | 76 Ų | 76 | 54% | 0.543 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.5 | -41.1 | 174.9 | -68.4 | -177.6 | 179.4 | 178.1 | 0 | 111.2 | S38 I39 S46 | S38-K42 PolarHBondContact O-N 3.44Å; I39-K42 PolarHBondContact O-N 2.88Å; K42-S46 WeakPolarHBondContact O-CB 3.41Å; K42-S46 PolarHBondContact O-N 3.42Å; K42-S46 VanDerWaalsContact O-N 3.08Å; K42-S46 PolarHBondContact O-OG 3.22Å |
| 43 | V | 77.2 | Confident | 72.7 | Confident | 65 Ų | 65 | 75.4 Ų | 75.4 | 39% | 0.394 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.2 | -43.3 | 175.4 | 179.1 | 0 | 0 | 0 | 0 | 110.5 | I39 A40 E41 I45 S46 S47 I97 | I39-V43 WeakPolarHBondContact O-CG2 3.44Å; I39-V43 PolarHBondContact O-N 3.29Å; I39-V43 VanDerWaalsContact O-N 3.14Å; A40-V43 PolarHBondContact O-N 3.47Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-V43 PolarHBondContact O-N 3.26Å; V43-I45 PolarHBondContact O-N 2.92Å; V43-S46 PolarHBondContact O-N 3.19Å; V43-S47 WeakPolarHBondContact O-CB 3.4Å; V43-S47 PolarHBondContact O-N 3.45Å; V43-S47 PolarHBondContact O-OG 3.06Å; V43-S47 VanDerWaalsContact O-OG 3.07Å; V43-I97 HydrophobicContact CB-CD1 4.37Å; V43-I97 HydrophobicContact CG1-CD1 3.69Å |
| 44 | Y | 75 | Confident | 74.3 | Confident | 36 Ų | 36 | 74.3 Ų | 74.3 | 14% | 0.141 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -56.9 | -49.3 | 176.7 | 170.2 | -99.2 | 0 | 0 | 0 | 112.8 | A40 E41 S47 S48 S94 H98 | A40-Y44 WeakPolarHBondContact O-CB 3.49Å; A40-Y44 PolarHBondContact O-N 3.17Å; E41-Y44 PolarHBondContact O-N 3Å; Y44-S47 PolarHBondContact O-N 3.38Å; Y44-S48 VanDerWaalsContact O-CB 3.31Å; Y44-S48 WeakPolarHBondContact O-CB 3.47Å; Y44-S48 PolarHBondContact O-N 3.21Å; Y44-S48 PolarHBondContact O-OG 2.9Å; Y44-S94 WeakPolarHBondContact CD2-O 3.34Å; Y44-H98 HydrophobicContact CD2-CB 4.4Å; Y44-H98 HydrophobicContact CE2-CB 4.17Å |
| 45 | I | 76.9 | Confident | 75.6 | Confident | 41 Ų | 41 | 72 Ų | 72 | 21% | 0.21 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -63.9 | -43.6 | 179.4 | -66.3 | 168.8 | 0 | 0 | 0 | 110.3 | N30 E41 V43 S48 L49 | N30-I45 WeakPolarHBondContact OD1-CD1 3.26Å; E41-I45 WeakPolarHBondContact O-CG1 3.38Å; E41-I45 PolarHBondContact O-N 3.38Å; V43-I45 PolarHBondContact O-N 2.92Å; I45-S48 PolarHBondContact O-N 3.33Å; I45-L49 VanDerWaalsContact O-CB 3.22Å; I45-L49 WeakPolarHBondContact O-CB 3.36Å; I45-L49 PolarHBondContact O-N 2.86Å |
| 46 | S | 80.9 | Confident | 77.1 | Confident | 74 Ų | 74 | 69.8 Ų | 69.8 | 52% | 0.517 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.7 | -44.6 | -179.1 | -55.3 | 0 | 0 | 0 | 0 | 111.7 | K42 V43 L49 F50 | K42-S46 WeakPolarHBondContact O-CB 3.41Å; K42-S46 PolarHBondContact O-N 3.42Å; K42-S46 VanDerWaalsContact O-N 3.08Å; K42-S46 PolarHBondContact O-OG 3.22Å; V43-S46 PolarHBondContact O-N 3.19Å; S46-L49 PolarHBondContact O-N 2.92Å; S46-F50 WeakPolarHBondContact O-CB 3.47Å; S46-F50 PolarHBondContact O-N 3.46Å |
| 47 | S | 79.9 | Confident | 78.5 | Confident | 28 Ų | 28 | 63 Ų | 63 | 20% | 0.196 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -66.5 | -41 | 177.6 | -65.4 | 0 | 0 | 0 | 0 | 112.3 | V43 Y44 F50 G51 S94 | V43-S47 WeakPolarHBondContact O-CB 3.4Å; V43-S47 PolarHBondContact O-N 3.45Å; V43-S47 PolarHBondContact O-OG 3.06Å; V43-S47 VanDerWaalsContact O-OG 3.07Å; Y44-S47 PolarHBondContact O-N 3.38Å; S47-F50 PolarHBondContact O-N 2.96Å; S47-G51 PolarHBondContact O-N 3.26Å; S47-S94 VanDerWaalsContact CB-OG 3.23Å; S47-S94 WeakPolarHBondContact CB-OG 3.28Å |
| 48 | S | 81 | Confident | 79.9 | Confident | 1 Ų | 1 | 57.2 Ų | 57.2 | 1% | 0.007 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -67.3 | -40.9 | 177.2 | -59.7 | 0 | 0 | 0 | 0 | 111.7 | Y44 I45 G51 L52 S94 | Y44-S48 VanDerWaalsContact O-CB 3.31Å; Y44-S48 WeakPolarHBondContact O-CB 3.47Å; Y44-S48 PolarHBondContact O-N 3.21Å; Y44-S48 PolarHBondContact O-OG 2.9Å; I45-S48 PolarHBondContact O-N 3.33Å; S48-G51 PolarHBondContact O-N 2.94Å; S48-L52 WeakPolarHBondContact O-CG 3.28Å; S48-L52 PolarHBondContact O-N 2.89Å; S48-S94 PolarHBondContact N-OG 2.87Å; S48-S94 WeakPolarHBondContact OG-CB 3.43Å; S48-S94 PolarHBondContact OG-OG 3.26Å |
| 49 | L | 82.2 | Confident | 80.5 | Confident | 100 Ų | 100 | 56.8 Ų | 56.8 | 52% | 0.524 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66 | -42 | 177 | -173.8 | 132.4 | 0 | 0 | 0 | 111.4 | I45 S46 L52 L53 | I45-L49 VanDerWaalsContact O-CB 3.22Å; I45-L49 WeakPolarHBondContact O-CB 3.36Å; I45-L49 PolarHBondContact O-N 2.86Å; S46-L49 PolarHBondContact O-N 2.92Å; L49-L52 PolarHBondContact O-N 3.48Å; L49-L53 HydrophobicContact CD2-CD1 3.86Å; L49-L53 HydrophobicContact CD2-CG 4.49Å; L49-L53 WeakPolarHBondContact O-CG 3.33Å; L49-L53 PolarHBondContact O-N 2.97Å |
| 50 | F | 84.7 | Confident | 80.9 | Confident | 113 Ų | 113 | 53.7 Ų | 53.7 | 50% | 0.496 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.5 | -41.4 | 173.9 | -174.6 | -106.2 | 0 | 0 | 0 | 112.1 | S46 S47 L52 L53 L54 C90 | S46-F50 WeakPolarHBondContact O-CB 3.47Å; S46-F50 PolarHBondContact O-N 3.46Å; S47-F50 PolarHBondContact O-N 2.96Å; F50-L52 PolarHBondContact O-N 3.3Å; F50-L53 PolarHBondContact O-N 3.31Å; F50-L54 HydrophobicContact CD1-CD1 3.86Å; F50-L54 HydrophobicContact CD1-CG 4.42Å; F50-L54 HydrophobicContact CE1-CD1 3.45Å; F50-L54 VanDerWaalsContact CE1-CD1 3.45Å; F50-L54 HydrophobicContact CE1-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 4.01Å; F50-L54 HydrophobicContact CZ-CD2 4.38Å; F50-L54 HydrophobicContact CZ-CG 4.22Å; F50-L54 WeakPolarHBondContact O-CG 3.48Å; F50-L54 PolarHBondContact O-N 3.32Å; F50-C90 VanDerWaalsContact CD1-SG 3.51Å |
| 51 | G | 83.6 | Confident | 81.9 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -58.4 | -44.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S47 S48 L53 L54 L55 S87 | S47-G51 PolarHBondContact O-N 3.26Å; S48-G51 PolarHBondContact O-N 2.94Å; G51-L53 PolarHBondContact O-N 3.42Å; G51-L54 PolarHBondContact O-N 3.35Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 2.94Å; G51-S87 PolarHBondContact O-OG 3.35Å |
| 52 | L | 82.2 | Confident | 82.6 | Confident | 38 Ų | 38 | 54.6 Ų | 54.6 | 20% | 0.199 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.3 | -40.9 | 175.4 | -75 | 168.9 | 0 | 0 | 0 | 112.7 | I23 L26 S48 L49 F50 L55 F56 F91 | I23-L52 HydrophobicContact CG1-CD2 4.4Å; L26-L52 HydrophobicContact CD2-CD1 4.1Å; S48-L52 WeakPolarHBondContact O-CG 3.28Å; S48-L52 PolarHBondContact O-N 2.89Å; L49-L52 PolarHBondContact O-N 3.48Å; F50-L52 PolarHBondContact O-N 3.3Å; L52-L55 PolarHBondContact O-N 2.9Å; L52-F56 WeakPolarHBondContact O-CB 3.34Å; L52-F56 PolarHBondContact O-N 3.2Å; L52-F91 HydrophobicContact CD2-CZ 3.91Å; L52-F91 HydrophobicContact CG-CE1 4.25Å; L52-F91 HydrophobicContact CG-CZ 3.93Å |
| 53 | L | 87.4 | Confident | 83 | Confident | 103 Ų | 103 | 52.8 Ų | 52.8 | 54% | 0.539 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.1 | -41.6 | 176.1 | -71.5 | 173.1 | 0 | 0 | 0 | 111.8 | L49 F50 G51 F56 A57 | L49-L53 HydrophobicContact CD2-CD1 3.86Å; L49-L53 HydrophobicContact CD2-CG 4.49Å; L49-L53 WeakPolarHBondContact O-CG 3.33Å; L49-L53 PolarHBondContact O-N 2.97Å; F50-L53 PolarHBondContact O-N 3.31Å; G51-L53 PolarHBondContact O-N 3.42Å; L53-F56 PolarHBondContact O-N 2.93Å; L53-A57 WeakPolarHBondContact O-CB 3.3Å; L53-A57 PolarHBondContact O-N 2.67Å |
| 54 | L | 88.3 | Confident | 83.4 | Confident | 26 Ų | 26 | 53.4 Ų | 53.4 | 14% | 0.136 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.6 | -40.9 | 175 | -74.7 | 174.9 | 0 | 0 | 0 | 112.2 | F50 G51 F56 A57 A58 L86 | F50-L54 HydrophobicContact CD1-CD1 3.86Å; F50-L54 HydrophobicContact CD1-CG 4.42Å; F50-L54 HydrophobicContact CE1-CD1 3.45Å; F50-L54 VanDerWaalsContact CE1-CD1 3.45Å; F50-L54 HydrophobicContact CE1-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 4.01Å; F50-L54 HydrophobicContact CZ-CD2 4.38Å; F50-L54 HydrophobicContact CZ-CG 4.22Å; F50-L54 WeakPolarHBondContact O-CG 3.48Å; F50-L54 PolarHBondContact O-N 3.32Å; G51-L54 PolarHBondContact O-N 3.35Å; L54-F56 VanDerWaalsContact C-N 3.33Å; L54-A57 PolarHBondContact O-N 2.81Å; L54-A58 WeakPolarHBondContact O-CB 3.36Å; L54-A58 PolarHBondContact O-N 3.36Å; L54-L86 HydrophobicContact CD1-CB 3.76Å |
| 55 | L | 83.3 | Confident | 83.8 | Confident | 15 Ų | 15 | 51.8 Ų | 51.8 | 8% | 0.079 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63.4 | -40.9 | 175.7 | -169.6 | 66 | 0 | 0 | 0 | 111.4 | F15 I19 G51 L52 A58 L59 T84 F91 L131 | F15-L55 HydrophobicContact CE2-CD1 4.39Å; F15-L55 HydrophobicContact CZ-CD1 4.38Å; F15-L55 HydrophobicContact CZ-CG 4.49Å; I19-L55 HydrophobicContact CD1-CD2 3.88Å; I19-L55 HydrophobicContact CD1-CG 4.4Å; I19-L55 HydrophobicContact CG1-CD2 3.89Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 2.94Å; L52-L55 PolarHBondContact O-N 2.9Å; L55-A58 WeakPolarHBondContact O-CB 3.44Å; L55-A58 PolarHBondContact O-N 2.93Å; L55-L59 PolarHBondContact O-N 3.43Å; L55-T84 HydrophobicContact CD1-CG2 4.46Å; L55-F91 HydrophobicContact CD2-CE2 4.49Å; L55-L131 HydrophobicContact CD1-CD1 3.97Å; L55-L131 HydrophobicContact CD1-CD2 4.03Å |
| 56 | F | 85.6 | Confident | 83.9 | Confident | 130 Ų | 130 | 55 Ų | 55 | 57% | 0.57 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -65.1 | -42.2 | 175.8 | -170.7 | -105.3 | 0 | 0 | 0 | 111.8 | L52 L53 L54 L59 I60 | L52-F56 WeakPolarHBondContact O-CB 3.34Å; L52-F56 PolarHBondContact O-N 3.2Å; L53-F56 PolarHBondContact O-N 2.93Å; L54-F56 VanDerWaalsContact C-N 3.33Å; F56-L59 WeakPolarHBondContact O-CB 3.47Å; F56-L59 PolarHBondContact O-N 2.96Å; F56-I60 HydrophobicContact CD1-CD1 3.72Å; F56-I60 HydrophobicContact CE1-CD1 3.43Å; F56-I60 VanDerWaalsContact CE1-CD1 3.43Å; F56-I60 HydrophobicContact CE1-CG1 4.31Å; F56-I60 HydrophobicContact CZ-CD1 4.1Å; F56-I60 WeakPolarHBondContact O-CG1 3.22Å; F56-I60 PolarHBondContact O-N 3.32Å |
| 57 | A | 86.3 | Confident | 84 | Confident | 36 Ų | 36 | 57.9 Ų | 57.9 | 30% | 0.298 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.7 | -42.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L53 L54 L59 I60 L61 | L53-A57 WeakPolarHBondContact O-CB 3.3Å; L53-A57 PolarHBondContact O-N 2.67Å; L54-A57 PolarHBondContact O-N 2.81Å; A57-L59 VanDerWaalsContact C-N 3.31Å; A57-L59 PolarHBondContact O-N 3.48Å; A57-I60 PolarHBondContact O-N 2.92Å; A57-L61 WeakPolarHBondContact O-CB 3.4Å; A57-L61 VanDerWaalsContact O-CG 3.31Å; A57-L61 WeakPolarHBondContact O-CG 3.48Å; A57-L61 PolarHBondContact O-N 2.78Å |
| 58 | A | 84.3 | Confident | 84.2 | Confident | 4 Ų | 4 | 58.1 Ų | 58.1 | 3% | 0.033 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.3 | -41.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L54 L55 L61 F62 C83 T84 | L54-A58 WeakPolarHBondContact O-CB 3.36Å; L54-A58 PolarHBondContact O-N 3.36Å; L55-A58 WeakPolarHBondContact O-CB 3.44Å; L55-A58 PolarHBondContact O-N 2.93Å; A58-L61 PolarHBondContact O-N 3.33Å; A58-F62 VanDerWaalsContact O-CB 3.3Å; A58-F62 WeakPolarHBondContact O-CB 3.48Å; A58-F62 PolarHBondContact O-N 3.45Å; A58-C83 HydrophobicContact CB-CB 3.75Å; A58-T84 WeakPolarHBondContact CB-OG1 3.49Å |
| 59 | L | 83.4 | Confident | 84.2 | Confident | 42 Ų | 42 | 62.7 Ų | 62.7 | 22% | 0.22 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.4 | -44.4 | 176.4 | -175.9 | 62.6 | 0 | 0 | 0 | 112.1 | F15 L55 F56 A57 F62 I63 | F15-L59 HydrophobicContact CD1-CD1 4.49Å; F15-L59 HydrophobicContact CE1-CD1 3.69Å; F15-L59 HydrophobicContact CE1-CD2 4.22Å; F15-L59 HydrophobicContact CE1-CG 4.44Å; F15-L59 HydrophobicContact CZ-CD1 4.34Å; L55-L59 PolarHBondContact O-N 3.43Å; F56-L59 WeakPolarHBondContact O-CB 3.47Å; F56-L59 PolarHBondContact O-N 2.96Å; A57-L59 VanDerWaalsContact C-N 3.31Å; A57-L59 PolarHBondContact O-N 3.48Å; L59-F62 WeakPolarHBondContact O-CB 3.49Å; L59-F62 PolarHBondContact O-N 3.02Å; L59-I63 HydrophobicContact CG-CD1 4.25Å; L59-I63 WeakPolarHBondContact O-CG1 3.45Å; L59-I63 PolarHBondContact O-N 3.21Å |
| 60 | I | 86.3 | Confident | 84 | Confident | 76 Ų | 76 | 66.6 Ų | 66.6 | 39% | 0.39 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -61.6 | -48.3 | 176 | -68.6 | 166.9 | 0 | 0 | 0 | 110.4 | F56 A57 F62 I63 L64 | F56-I60 HydrophobicContact CD1-CD1 3.72Å; F56-I60 HydrophobicContact CE1-CD1 3.43Å; F56-I60 VanDerWaalsContact CE1-CD1 3.43Å; F56-I60 HydrophobicContact CE1-CG1 4.31Å; F56-I60 HydrophobicContact CZ-CD1 4.1Å; F56-I60 WeakPolarHBondContact O-CG1 3.22Å; F56-I60 PolarHBondContact O-N 3.32Å; A57-I60 PolarHBondContact O-N 2.92Å; I60-F62 PolarHBondContact O-N 3.02Å; I60-I63 PolarHBondContact O-N 3.48Å; I60-L64 HydrophobicContact CG2-CD1 3.98Å; I60-L64 HydrophobicContact CG2-CG 4.37Å; I60-L64 WeakPolarHBondContact O-CG 3.34Å; I60-L64 PolarHBondContact O-N 3.14Å |
| 61 | L | 88.3 | Confident | 83.7 | Confident | 42 Ų | 42 | 70.6 Ų | 70.6 | 22% | 0.22 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61 | -35 | 177.9 | -70.5 | 173 | 0 | 0 | 0 | 111.7 | A57 A58 L64 S65 L76 V80 | A57-L61 WeakPolarHBondContact O-CB 3.4Å; A57-L61 VanDerWaalsContact O-CG 3.31Å; A57-L61 WeakPolarHBondContact O-CG 3.48Å; A57-L61 PolarHBondContact O-N 2.78Å; A58-L61 PolarHBondContact O-N 3.33Å; L61-L64 PolarHBondContact O-N 3.13Å; L61-S65 WeakPolarHBondContact O-CB 3.39Å; L61-S65 PolarHBondContact O-N 2.89Å; L61-L76 HydrophobicContact CD2-CD2 4.08Å; L61-V80 VanDerWaalsContact C-CG2 3.45Å; L61-V80 HydrophobicContact CB-CG2 3.48Å; L61-V80 VanDerWaalsContact CB-CG2 3.48Å |
| 62 | F | 83.2 | Confident | 83.6 | Confident | 51 Ų | 51 | 77.4 Ų | 77.4 | 22% | 0.224 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -66.6 | -46.8 | 176.3 | -179.6 | -108.2 | 0 | 0 | 0 | 111.4 | A58 L59 I60 L64 S65 I66 V80 T138 | A58-F62 VanDerWaalsContact O-CB 3.3Å; A58-F62 WeakPolarHBondContact O-CB 3.48Å; A58-F62 PolarHBondContact O-N 3.45Å; L59-F62 WeakPolarHBondContact O-CB 3.49Å; L59-F62 PolarHBondContact O-N 3.02Å; I60-F62 PolarHBondContact O-N 3.02Å; F62-L64 VanDerWaalsContact C-N 3.32Å; F62-L64 PolarHBondContact O-N 2.89Å; F62-S65 WeakPolarHBondContact O-CB 3.47Å; F62-S65 PolarHBondContact O-N 3.27Å; F62-S65 VanDerWaalsContact O-N 3.11Å; F62-S65 PolarHBondContact O-OG 2.92Å; F62-I66 HydrophobicContact CD1-CD1 4.24Å; F62-I66 HydrophobicContact CE1-CD1 3.8Å; F62-I66 HydrophobicContact CZ-CD1 4.11Å; F62-I66 PolarHBondContact O-N 2.92Å; F62-V80 HydrophobicContact CB-CG1 4.14Å; F62-V80 HydrophobicContact CB-CG2 3.99Å; F62-V80 HydrophobicContact CD2-CG1 4.46Å; F62-V80 VanDerWaalsContact N-CG2 3.29Å; F62-T138 HydrophobicContact CD2-CG2 4.5Å; F62-T138 HydrophobicContact CE2-CG2 3.51Å; F62-T138 HydrophobicContact CZ-CG2 4.04Å |
| 63 | I | 82.9 | Confident | 83.4 | Confident | 88 Ų | 88 | 77.2 Ų | 77.2 | 45% | 0.451 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 174.7 | -65.8 | 165.3 | 0 | 0 | 0 | 110.5 | L59 I60 S65 I66 L67 | L59-I63 HydrophobicContact CG-CD1 4.25Å; L59-I63 WeakPolarHBondContact O-CG1 3.45Å; L59-I63 PolarHBondContact O-N 3.21Å; I60-I63 PolarHBondContact O-N 3.48Å; I63-S65 VanDerWaalsContact C-N 3.29Å; I63-S65 PolarHBondContact O-N 3.29Å; I63-I66 WeakPolarHBondContact O-CB 3.28Å; I63-I66 PolarHBondContact O-N 3.01Å; I63-I66 VanDerWaalsContact O-N 3.16Å; I63-L67 PolarHBondContact O-N 2.81Å |
| 64 | L | 85.4 | Confident | 83.2 | Confident | 78 Ų | 78 | 75.8 Ų | 75.8 | 41% | 0.408 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -61.4 | -36.8 | 175.3 | -70.8 | 173.9 | 0 | 0 | 0 | 112.2 | I60 L61 F62 I66 L67 T68 | I60-L64 HydrophobicContact CG2-CD1 3.98Å; I60-L64 HydrophobicContact CG2-CG 4.37Å; I60-L64 WeakPolarHBondContact O-CG 3.34Å; I60-L64 PolarHBondContact O-N 3.14Å; L61-L64 PolarHBondContact O-N 3.13Å; F62-L64 VanDerWaalsContact C-N 3.32Å; F62-L64 PolarHBondContact O-N 2.89Å; L64-I66 PolarHBondContact O-N 3.45Å; L64-L67 PolarHBondContact O-N 2.88Å; L64-L67 VanDerWaalsContact O-N 3.15Å; L64-T68 WeakPolarHBondContact O-CB 3.44Å; L64-T68 PolarHBondContact O-N 3.27Å; L64-T68 PolarHBondContact O-OG1 3.46Å |
| 65 | S | 83.1 | Confident | 83.1 | Confident | 2 Ų | 2 | 80 Ų | 80 | 1% | 0.014 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -64.6 | -29.3 | 177.4 | 83.1 | 0 | 0 | 0 | 0 | 113 | L61 F62 I63 | L61-S65 WeakPolarHBondContact O-CB 3.39Å; L61-S65 PolarHBondContact O-N 2.89Å; F62-S65 WeakPolarHBondContact O-CB 3.47Å; F62-S65 PolarHBondContact O-N 3.27Å; F62-S65 VanDerWaalsContact O-N 3.11Å; F62-S65 PolarHBondContact O-OG 2.92Å; I63-S65 VanDerWaalsContact C-N 3.29Å; I63-S65 PolarHBondContact O-N 3.29Å |
| 66 | I | 80.5 | Confident | 83.2 | Confident | 107 Ų | 107 | 80.8 Ų | 80.8 | 55% | 0.549 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -71.5 | -35.9 | 175.3 | -63.5 | 168.4 | 0 | 0 | 0 | 110.5 | F62 I63 L64 | F62-I66 HydrophobicContact CD1-CD1 4.24Å; F62-I66 HydrophobicContact CE1-CD1 3.8Å; F62-I66 HydrophobicContact CZ-CD1 4.11Å; F62-I66 PolarHBondContact O-N 2.92Å; I63-I66 WeakPolarHBondContact O-CB 3.28Å; I63-I66 PolarHBondContact O-N 3.01Å; I63-I66 VanDerWaalsContact O-N 3.16Å; L64-I66 PolarHBondContact O-N 3.45Å |
| 67 | L | 83.1 | Confident | 83.1 | Confident | 136 Ų | 136 | 76.2 Ų | 76.2 | 71% | 0.712 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -84 | -13.7 | -178.7 | -61.3 | 174 | 0 | 0 | 0 | 113.8 | I63 L64 | I63-L67 PolarHBondContact O-N 2.81Å; L64-L67 PolarHBondContact O-N 2.88Å; L64-L67 VanDerWaalsContact O-N 3.15Å |
| 68 | T | 84.3 | Confident | 83 | Confident | 33 Ų | 33 | 78.6 Ų | 78.6 | 20% | 0.202 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -92 | 136 | -171.2 | -62.5 | 0 | 0 | 0 | 0 | 112 | L64 K72 L76 | L64-T68 WeakPolarHBondContact O-CB 3.44Å; L64-T68 PolarHBondContact O-N 3.27Å; L64-T68 PolarHBondContact O-OG1 3.46Å; T68-K72 HydrophobicContact CG2-CB 3.46Å; T68-K72 VanDerWaalsContact CG2-CB 3.46Å; T68-L76 HydrophobicContact CG2-CD1 3.74Å; T68-L76 WeakPolarHBondContact OG1-CD1 3.33Å |
| 69 | P | 80.5 | Confident | 83.2 | Confident | 97 Ų | 97 | 80.4 Ų | 80.4 | 63% | 0.63 | 41% | 0.41 | S | S | * | . | trans | -59.5 | 146.6 | 175.7 | 23.1 | -33.9 | 0 | 0 | 0 | 112.4 | K71 K72 | P69-K71 PolarHBondContact O-N 2.89Å; P69-K72 PolarHBondContact O-N 3.44Å | ||
| 70 | Y | 76.7 | Confident | 83.2 | Confident | 182 Ų | 182 | 79.1 Ų | 79.1 | 71% | 0.714 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -41.5 | -40.2 | -170.6 | -77.8 | -89 | 0 | 0 | 0 | 115.5 | K72 K73 | Y70-K72 PolarHBondContact O-N 3.23Å; Y70-K72 VanDerWaalsContact O-N 3.14Å; Y70-K73 WeakPolarHBondContact O-CB 3.27Å; Y70-K73 PolarHBondContact O-N 2.9Å; Y70-K73 VanDerWaalsContact O-N 3.13Å |
| 71 | K | 79.1 | Confident | 83.1 | Confident | 197 Ų | 197 | 77.9 Ų | 77.9 | 86% | 0.857 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -59 | -26.8 | -177.9 | -65.3 | -173.3 | 178.8 | -177.2 | 0 | 114.5 | P69 | P69-K71 PolarHBondContact O-N 2.89Å |
| 72 | K | 80.6 | Confident | 83 | Confident | 142 Ų | 142 | 80.3 Ų | 80.3 | 62% | 0.617 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -110.5 | -2.3 | 178.9 | -67.6 | -176.5 | -177.7 | -175.9 | 0 | 113.2 | T68 P69 Y70 L76 | T68-K72 HydrophobicContact CG2-CB 3.46Å; T68-K72 VanDerWaalsContact CG2-CB 3.46Å; P69-K72 PolarHBondContact O-N 3.44Å; Y70-K72 PolarHBondContact O-N 3.23Å; Y70-K72 VanDerWaalsContact O-N 3.14Å; K72-L76 PolarHBondContact O-N 2.87Å |
| 73 | K | 79.4 | Confident | 83.2 | Confident | 35 Ų | 35 | 79 Ų | 79 | 15% | 0.152 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -67.8 | -40.8 | -176.1 | -169.2 | 177.5 | -166.8 | -175.3 | 0 | 112.2 | Y70 I75 L76 L77 | Y70-K73 WeakPolarHBondContact O-CB 3.27Å; Y70-K73 PolarHBondContact O-N 2.9Å; Y70-K73 VanDerWaalsContact O-N 3.13Å; K73-I75 PolarHBondContact O-N 2.88Å; K73-L76 PolarHBondContact O-N 3.47Å; K73-L77 HydrophobicContact CG-CD1 4.04Å; K73-L77 HydrophobicContact CG-CG 4.4Å; K73-L77 WeakPolarHBondContact O-CG 3.37Å; K73-L77 PolarHBondContact O-N 3.48Å |
| 74 | S | 82 | Confident | 83.2 | Confident | 73 Ų | 73 | 75.2 Ų | 75.2 | 51% | 0.51 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -59.6 | -45.7 | 179.1 | 56.5 | 0 | 0 | 0 | 0 | 112 | L76 L77 V78 | S74-L76 PolarHBondContact O-N 2.79Å; S74-L77 PolarHBondContact O-N 3.49Å; S74-V78 WeakPolarHBondContact O-CG2 3.43Å; S74-V78 PolarHBondContact O-N 3.47Å |
| 75 | I | 86.5 | Confident | 83.1 | Confident | 113 Ų | 113 | 74.7 Ų | 74.7 | 58% | 0.579 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -61 | -46.9 | 179 | -60.7 | 172 | 0 | 0 | 0 | 110.3 | K73 L77 V78 S79 | K73-I75 PolarHBondContact O-N 2.88Å; I75-L77 PolarHBondContact O-N 3.48Å; I75-V78 PolarHBondContact O-N 3.01Å; I75-S79 PolarHBondContact O-N 2.91Å; I75-S79 PolarHBondContact O-OG 3.3Å; I75-S79 VanDerWaalsContact O-OG 3.13Å |
| 76 | L | 86 | Confident | 83.2 | Confident | 32 Ų | 32 | 78.7 Ų | 78.7 | 17% | 0.168 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -62.5 | -42.7 | 178 | -72.4 | 168.1 | 0 | 0 | 0 | 111.9 | L61 T68 K72 K73 S74 V78 S79 V80 | L61-L76 HydrophobicContact CD2-CD2 4.08Å; T68-L76 HydrophobicContact CG2-CD1 3.74Å; T68-L76 WeakPolarHBondContact OG1-CD1 3.33Å; K72-L76 PolarHBondContact O-N 2.87Å; K73-L76 PolarHBondContact O-N 3.47Å; S74-L76 PolarHBondContact O-N 2.79Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 2.87Å; L76-S79 WeakPolarHBondContact O-CB 3.27Å; L76-S79 PolarHBondContact O-N 2.95Å; L76-V80 VanDerWaalsContact O-CG2 3.27Å; L76-V80 WeakPolarHBondContact O-CG2 3.21Å; L76-V80 PolarHBondContact O-N 3.08Å |
| 77 | L | 84.3 | Confident | 83.3 | Confident | 34 Ų | 34 | 73.6 Ų | 73.6 | 18% | 0.178 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -64.4 | -37.4 | 177.7 | -71.8 | 172.9 | 0 | 0 | 0 | 112.5 | K73 S74 I75 V80 T81 Q142 | K73-L77 HydrophobicContact CG-CD1 4.04Å; K73-L77 HydrophobicContact CG-CG 4.4Å; K73-L77 WeakPolarHBondContact O-CG 3.37Å; K73-L77 PolarHBondContact O-N 3.48Å; S74-L77 PolarHBondContact O-N 3.49Å; I75-L77 PolarHBondContact O-N 3.48Å; L77-V80 PolarHBondContact O-N 2.92Å; L77-T81 WeakPolarHBondContact O-CB 3.26Å; L77-T81 PolarHBondContact O-N 3.2Å; L77-T81 PolarHBondContact O-OG1 2.74Å; L77-Q142 HydrophobicContact CD1-CB 4.12Å; L77-Q142 HydrophobicContact CD1-CG 3.96Å |
| 78 | V | 83.6 | Confident | 83.2 | Confident | 86 Ų | 86 | 68.5 Ų | 68.5 | 52% | 0.521 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.4 | -45.4 | 172.1 | 171.5 | 0 | 0 | 0 | 0 | 110.1 | S74 I75 L76 V80 T81 I82 | S74-V78 WeakPolarHBondContact O-CG2 3.43Å; S74-V78 PolarHBondContact O-N 3.47Å; I75-V78 PolarHBondContact O-N 3.01Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 2.87Å; V78-V80 PolarHBondContact O-N 3.35Å; V78-T81 WeakPolarHBondContact O-CB 3.3Å; V78-T81 PolarHBondContact O-N 2.97Å; V78-I82 HydrophobicContact CG1-CD1 3.79Å; V78-I82 HydrophobicContact CG1-CG1 4.45Å; V78-I82 WeakPolarHBondContact O-CG1 3.44Å; V78-I82 PolarHBondContact O-N 3.44Å |
| 79 | S | 87.8 | Confident | 83.1 | Confident | 42 Ų | 42 | 72.6 Ų | 72.6 | 29% | 0.294 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.5 | -42.5 | 175.9 | -56.8 | 0 | 0 | 0 | 0 | 112.7 | I75 L76 T81 I82 C83 | I75-S79 PolarHBondContact O-N 2.91Å; I75-S79 PolarHBondContact O-OG 3.3Å; I75-S79 VanDerWaalsContact O-OG 3.13Å; L76-S79 WeakPolarHBondContact O-CB 3.27Å; L76-S79 PolarHBondContact O-N 2.95Å; S79-T81 VanDerWaalsContact C-N 3.31Å; S79-T81 PolarHBondContact O-N 3.21Å; S79-I82 PolarHBondContact O-N 3.35Å; S79-C83 WeakPolarHBondContact O-CB 3.37Å; S79-C83 PolarHBondContact O-N 2.94Å; S79-C83 PolarHBondContact O-SG 2.9Å; S79-C83 VanDerWaalsContact O-SG 3.35Å |
| 80 | V | 84.2 | Confident | 83.3 | Confident | 16 Ų | 16 | 68.9 Ų | 68.9 | 10% | 0.097 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -57 | -46.9 | 173.7 | 172.5 | 0 | 0 | 0 | 0 | 110.5 | L61 F62 L76 L77 V78 C83 T84 | L61-V80 VanDerWaalsContact C-CG2 3.45Å; L61-V80 HydrophobicContact CB-CG2 3.48Å; L61-V80 VanDerWaalsContact CB-CG2 3.48Å; F62-V80 HydrophobicContact CB-CG1 4.14Å; F62-V80 HydrophobicContact CB-CG2 3.99Å; F62-V80 HydrophobicContact CD2-CG1 4.46Å; F62-V80 VanDerWaalsContact N-CG2 3.29Å; L76-V80 VanDerWaalsContact O-CG2 3.27Å; L76-V80 WeakPolarHBondContact O-CG2 3.21Å; L76-V80 PolarHBondContact O-N 3.08Å; L77-V80 PolarHBondContact O-N 2.92Å; V78-V80 PolarHBondContact O-N 3.35Å; V80-C83 PolarHBondContact O-N 3.14Å; V80-T84 WeakPolarHBondContact O-CB 3.45Å; V80-T84 PolarHBondContact O-N 3.46Å; V80-T84 PolarHBondContact O-OG1 3.49Å |
| 81 | T | 83.1 | Confident | 83.5 | Confident | 50 Ų | 50 | 60.6 Ų | 60.6 | 31% | 0.307 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -62.2 | -47.5 | -179.1 | -55.5 | 0 | 0 | 0 | 0 | 110.8 | L77 V78 S79 T84 V85 | L77-T81 WeakPolarHBondContact O-CB 3.26Å; L77-T81 PolarHBondContact O-N 3.2Å; L77-T81 PolarHBondContact O-OG1 2.74Å; V78-T81 WeakPolarHBondContact O-CB 3.3Å; V78-T81 PolarHBondContact O-N 2.97Å; S79-T81 VanDerWaalsContact C-N 3.31Å; S79-T81 PolarHBondContact O-N 3.21Å; T81-T84 PolarHBondContact O-N 3.24Å; T81-V85 HydrophobicContact CG2-CG2 4.48Å; T81-V85 VanDerWaalsContact O-CG2 3.3Å; T81-V85 WeakPolarHBondContact O-CG2 3.28Å; T81-V85 PolarHBondContact O-N 3.42Å |
| 82 | I | 86.6 | Confident | 83.7 | Confident | 93 Ų | 93 | 55.3 Ų | 55.3 | 48% | 0.477 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.1 | -50 | 177.9 | -67.4 | 166.1 | 0 | 0 | 0 | 110.9 | V78 S79 T84 V85 L86 | V78-I82 HydrophobicContact CG1-CD1 3.79Å; V78-I82 HydrophobicContact CG1-CG1 4.45Å; V78-I82 WeakPolarHBondContact O-CG1 3.44Å; V78-I82 PolarHBondContact O-N 3.44Å; S79-I82 PolarHBondContact O-N 3.35Å; I82-T84 VanDerWaalsContact C-N 3.26Å; I82-T84 PolarHBondContact O-N 2.85Å; I82-V85 PolarHBondContact O-N 2.92Å; I82-L86 HydrophobicContact CG2-CD1 3.97Å; I82-L86 HydrophobicContact CG2-CG 4.41Å; I82-L86 WeakPolarHBondContact O-CG 3.44Å; I82-L86 PolarHBondContact O-N 3.04Å |
| 83 | C | 87.7 | Confident | 83.6 | Confident | 24 Ų | 24 | 53 Ų | 53 | 16% | 0.162 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60 | -38.2 | 178.9 | -71 | 0 | 0 | 0 | 0 | 111.9 | A58 S79 V80 S87 | A58-C83 HydrophobicContact CB-CB 3.75Å; S79-C83 WeakPolarHBondContact O-CB 3.37Å; S79-C83 PolarHBondContact O-N 2.94Å; S79-C83 PolarHBondContact O-SG 2.9Å; S79-C83 VanDerWaalsContact O-SG 3.35Å; V80-C83 PolarHBondContact O-N 3.14Å; C83-S87 WeakPolarHBondContact O-CB 3.38Å; C83-S87 PolarHBondContact O-N 3.28Å |
| 84 | T | 83.3 | Confident | 83.5 | Confident | 7 Ų | 7 | 51.3 Ų | 51.3 | 4% | 0.043 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -71.7 | -39.6 | 179.7 | -46.9 | 0 | 0 | 0 | 0 | 112 | L55 A58 V80 T81 I82 S87 A88 L131 I135 | L55-T84 HydrophobicContact CD1-CG2 4.46Å; A58-T84 WeakPolarHBondContact CB-OG1 3.49Å; V80-T84 WeakPolarHBondContact O-CB 3.45Å; V80-T84 PolarHBondContact O-N 3.46Å; V80-T84 PolarHBondContact O-OG1 3.49Å; T81-T84 PolarHBondContact O-N 3.24Å; I82-T84 VanDerWaalsContact C-N 3.26Å; I82-T84 PolarHBondContact O-N 2.85Å; T84-S87 WeakPolarHBondContact O-CB 3.35Å; T84-S87 PolarHBondContact O-N 3.27Å; T84-A88 PolarHBondContact O-N 3.47Å; T84-L131 HydrophobicContact CG2-CD1 3.96Å; T84-L131 HydrophobicContact CG2-CD2 3.7Å; T84-L131 HydrophobicContact CG2-CG 3.83Å; T84-I135 HydrophobicContact CG2-CD1 3.26Å; T84-I135 HydrophobicContact CG2-CG1 4.11Å |
| 85 | V | 82.2 | Confident | 83.4 | Confident | 68 Ų | 68 | 49.7 Ų | 49.7 | 41% | 0.412 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 173.6 | 169.3 | 0 | 0 | 0 | 0 | 110.5 | T81 I82 S87 A88 F89 | T81-V85 HydrophobicContact CG2-CG2 4.48Å; T81-V85 VanDerWaalsContact O-CG2 3.3Å; T81-V85 WeakPolarHBondContact O-CG2 3.28Å; T81-V85 PolarHBondContact O-N 3.42Å; I82-V85 PolarHBondContact O-N 2.92Å; V85-S87 VanDerWaalsContact C-N 3.33Å; V85-S87 PolarHBondContact O-N 3.29Å; V85-A88 WeakPolarHBondContact O-CB 3.35Å; V85-A88 PolarHBondContact O-N 3.35Å; V85-A88 VanDerWaalsContact O-N 3.14Å; V85-F89 HydrophobicContact CG1-CD2 3.71Å; V85-F89 HydrophobicContact CG1-CE2 3.52Å; V85-F89 VanDerWaalsContact O-CD2 3.22Å; V85-F89 WeakPolarHBondContact O-CD2 3.22Å; V85-F89 PolarHBondContact O-N 2.93Å |
| 86 | L | 85.6 | Confident | 83.1 | Confident | 85 Ų | 85 | 48.4 Ų | 48.4 | 45% | 0.445 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.6 | -42.9 | 176.1 | -69.9 | 173.9 | 0 | 0 | 0 | 111.6 | L54 I82 A88 F89 C90 | L54-L86 HydrophobicContact CD1-CB 3.76Å; I82-L86 HydrophobicContact CG2-CD1 3.97Å; I82-L86 HydrophobicContact CG2-CG 4.41Å; I82-L86 WeakPolarHBondContact O-CG 3.44Å; I82-L86 PolarHBondContact O-N 3.04Å; L86-A88 VanDerWaalsContact C-N 3.32Å; L86-A88 PolarHBondContact O-N 3.49Å; L86-F89 WeakPolarHBondContact O-CB 3.45Å; L86-F89 PolarHBondContact O-N 2.91Å; L86-C90 PolarHBondContact O-N 3.23Å; L86-C90 PolarHBondContact O-SG 3.32Å |
| 87 | S | 82.3 | Confident | 82.8 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -57.1 | -45.3 | 173.3 | 175.4 | 0 | 0 | 0 | 0 | 111.7 | G51 C83 T84 V85 F89 C90 F91 | G51-S87 PolarHBondContact O-OG 3.35Å; C83-S87 WeakPolarHBondContact O-CB 3.38Å; C83-S87 PolarHBondContact O-N 3.28Å; T84-S87 WeakPolarHBondContact O-CB 3.35Å; T84-S87 PolarHBondContact O-N 3.27Å; V85-S87 VanDerWaalsContact C-N 3.33Å; V85-S87 PolarHBondContact O-N 3.29Å; S87-F89 VanDerWaalsContact C-N 3.34Å; S87-F89 PolarHBondContact O-N 2.94Å; S87-C90 PolarHBondContact O-N 3.33Å; S87-F91 WeakPolarHBondContact O-CD2 3.31Å; S87-F91 PolarHBondContact O-N 3.35Å; S87-F91 VanDerWaalsContact OG-CE2 3.24Å; S87-F91 WeakPolarHBondContact OG-CE2 3.24Å |
| 88 | A | 80.7 | Confident | 82.4 | Confident | 30 Ų | 30 | 49.3 Ų | 49.3 | 25% | 0.248 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63 | -40.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | T84 V85 L86 F91 L92 | T84-A88 PolarHBondContact O-N 3.47Å; V85-A88 WeakPolarHBondContact O-CB 3.35Å; V85-A88 PolarHBondContact O-N 3.35Å; V85-A88 VanDerWaalsContact O-N 3.14Å; L86-A88 VanDerWaalsContact C-N 3.32Å; L86-A88 PolarHBondContact O-N 3.49Å; A88-F91 PolarHBondContact O-N 2.95Å; A88-L92 WeakPolarHBondContact O-CB 3.11Å; A88-L92 PolarHBondContact O-N 3.45Å |
| 89 | F | 83.2 | Confident | 82 | Confident | 119 Ų | 119 | 50.4 Ų | 50.4 | 52% | 0.522 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 173.4 | -84.7 | -70.9 | 0 | 0 | 0 | 112.5 | V85 L86 S87 F91 L92 I93 | V85-F89 HydrophobicContact CG1-CD2 3.71Å; V85-F89 HydrophobicContact CG1-CE2 3.52Å; V85-F89 VanDerWaalsContact O-CD2 3.22Å; V85-F89 WeakPolarHBondContact O-CD2 3.22Å; V85-F89 PolarHBondContact O-N 2.93Å; L86-F89 WeakPolarHBondContact O-CB 3.45Å; L86-F89 PolarHBondContact O-N 2.91Å; S87-F89 VanDerWaalsContact C-N 3.34Å; S87-F89 PolarHBondContact O-N 2.94Å; F89-F91 VanDerWaalsContact C-N 3.3Å; F89-F91 PolarHBondContact O-N 3.48Å; F89-L92 WeakPolarHBondContact O-CB 3.43Å; F89-L92 PolarHBondContact O-N 3.25Å; F89-I93 WeakPolarHBondContact O-CG1 3.41Å; F89-I93 PolarHBondContact O-N 3.48Å |
| 90 | C | 84.3 | Confident | 81.6 | Confident | 18 Ų | 18 | 51.6 Ų | 51.6 | 12% | 0.122 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62 | -40 | 176.9 | -63.6 | 0 | 0 | 0 | 0 | 112.1 | F50 L86 S87 I93 S94 | F50-C90 VanDerWaalsContact CD1-SG 3.51Å; L86-C90 PolarHBondContact O-N 3.23Å; L86-C90 PolarHBondContact O-SG 3.32Å; S87-C90 PolarHBondContact O-N 3.33Å; C90-I93 PolarHBondContact O-N 2.81Å; C90-S94 WeakPolarHBondContact O-CB 3.3Å; C90-S94 PolarHBondContact O-N 3.34Å; C90-S94 PolarHBondContact O-OG 2.9Å |
| 91 | F | 81.7 | Confident | 81.1 | Confident | 8 Ų | 8 | 52.7 Ų | 52.7 | 4% | 0.035 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.7 | -37.7 | 174.4 | -77.5 | -45 | 0 | 0 | 0 | 112.6 | L52 L55 S87 A88 F89 S94 F95 F124 I128 | L52-F91 HydrophobicContact CD2-CZ 3.91Å; L52-F91 HydrophobicContact CG-CE1 4.25Å; L52-F91 HydrophobicContact CG-CZ 3.93Å; L55-F91 HydrophobicContact CD2-CE2 4.49Å; S87-F91 WeakPolarHBondContact O-CD2 3.31Å; S87-F91 PolarHBondContact O-N 3.35Å; S87-F91 VanDerWaalsContact OG-CE2 3.24Å; S87-F91 WeakPolarHBondContact OG-CE2 3.24Å; A88-F91 PolarHBondContact O-N 2.95Å; F89-F91 VanDerWaalsContact C-N 3.3Å; F89-F91 PolarHBondContact O-N 3.48Å; F91-S94 PolarHBondContact O-N 3Å; F91-F95 VanDerWaalsContact O-CB 3.29Å; F91-F95 WeakPolarHBondContact O-CB 3.43Å; F91-F95 PolarHBondContact O-N 3.2Å; F91-F124 HydrophobicContact CB-CE1 4.06Å; F91-F124 HydrophobicContact CB-CE2 4.37Å; F91-F124 HydrophobicContact CB-CZ 3.45Å; F91-F124 VanDerWaalsContact CB-CZ 3.45Å; F91-F124 AromaticContact CD1-CE2 3.64Å; F91-F124 HydrophobicContact CD1-CE2 3.64Å; F91-F124 AromaticContact CD1-CZ 3.42Å; F91-F124 HydrophobicContact CD1-CZ 3.42Å; F91-F124 VanDerWaalsContact CD1-CZ 3.42Å; F91-F124 HydrophobicContact CE1-CE2 4.14Å; F91-F124 HydrophobicContact CE1-CZ 4.36Å; F91-F124 HydrophobicContact CG-CE2 4.08Å; F91-F124 AromaticContact CG-CZ 3.61Å; F91-F124 HydrophobicContact CG-CZ 3.61Å; F91-I128 HydrophobicContact CB-CD1 4.2Å |
| 92 | L | 82 | Confident | 80.7 | Confident | 87 Ų | 87 | 53.1 Ų | 53.1 | 46% | 0.455 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -64.3 | -42.1 | 173.8 | -170.8 | 73.8 | 0 | 0 | 0 | 112 | A88 F89 S94 F95 V96 | A88-L92 WeakPolarHBondContact O-CB 3.11Å; A88-L92 PolarHBondContact O-N 3.45Å; F89-L92 WeakPolarHBondContact O-CB 3.43Å; F89-L92 PolarHBondContact O-N 3.25Å; L92-S94 VanDerWaalsContact C-N 3.35Å; L92-F95 VanDerWaalsContact O-CB 3.32Å; L92-F95 WeakPolarHBondContact O-CB 3.46Å; L92-F95 PolarHBondContact O-N 3.44Å; L92-V96 WeakPolarHBondContact O-CG2 3.46Å; L92-V96 PolarHBondContact O-N 3.13Å |
| 93 | I | 80.2 | Confident | 80.3 | Confident | 92 Ų | 92 | 52 Ų | 52 | 47% | 0.472 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.9 | -46.2 | 175.1 | -67.9 | 165.6 | 0 | 0 | 0 | 110.2 | F89 C90 F95 V96 I97 | F89-I93 WeakPolarHBondContact O-CG1 3.41Å; F89-I93 PolarHBondContact O-N 3.48Å; C90-I93 PolarHBondContact O-N 2.81Å; I93-F95 PolarHBondContact O-N 3.31Å; I93-V96 PolarHBondContact O-N 3.23Å; I93-I97 HydrophobicContact CG2-CD1 4Å; I93-I97 WeakPolarHBondContact O-CG1 3.37Å; I93-I97 PolarHBondContact O-N 3.13Å |
| 94 | S | 77 | Confident | 79.6 | Confident | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -59.9 | -39.7 | 177.4 | -55.9 | 0 | 0 | 0 | 0 | 111.2 | Y44 S47 S48 C90 F91 L92 H98 | Y44-S94 WeakPolarHBondContact CD2-O 3.34Å; S47-S94 VanDerWaalsContact CB-OG 3.23Å; S47-S94 WeakPolarHBondContact CB-OG 3.28Å; S48-S94 PolarHBondContact N-OG 2.87Å; S48-S94 WeakPolarHBondContact OG-CB 3.43Å; S48-S94 PolarHBondContact OG-OG 3.26Å; C90-S94 WeakPolarHBondContact O-CB 3.3Å; C90-S94 PolarHBondContact O-N 3.34Å; C90-S94 PolarHBondContact O-OG 2.9Å; F91-S94 PolarHBondContact O-N 3Å; L92-S94 VanDerWaalsContact C-N 3.35Å; S94-H98 WeakPolarHBondContact O-CB 3.29Å; S94-H98 PolarHBondContact O-N 3.36Å |
| 95 | F | 79.4 | Confident | 79.2 | Confident | 39 Ų | 39 | 56.8 Ų | 56.8 | 17% | 0.171 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.7 | -46.5 | 173.9 | 170.9 | -83.5 | 0 | 0 | 0 | 112.7 | F91 L92 I93 I97 H98 Y99 F121 F124 W125 | F91-F95 VanDerWaalsContact O-CB 3.29Å; F91-F95 WeakPolarHBondContact O-CB 3.43Å; F91-F95 PolarHBondContact O-N 3.2Å; L92-F95 VanDerWaalsContact O-CB 3.32Å; L92-F95 WeakPolarHBondContact O-CB 3.46Å; L92-F95 PolarHBondContact O-N 3.44Å; I93-F95 PolarHBondContact O-N 3.31Å; F95-I97 VanDerWaalsContact C-N 3.31Å; F95-I97 PolarHBondContact O-N 3.35Å; F95-H98 PolarHBondContact O-N 2.94Å; F95-Y99 VanDerWaalsContact O-CB 3.3Å; F95-Y99 WeakPolarHBondContact O-CB 3.26Å; F95-Y99 PolarHBondContact O-N 2.91Å; F95-F121 AromaticContact CD2-CD2 3.91Å; F95-F121 HydrophobicContact CD2-CD2 3.91Å; F95-F121 AromaticContact CD2-CE2 3.44Å; F95-F121 HydrophobicContact CD2-CE2 3.44Å; F95-F121 VanDerWaalsContact CD2-CE2 3.44Å; F95-F121 AromaticContact CD2-CZ 3.87Å; F95-F121 HydrophobicContact CD2-CZ 3.87Å; F95-F121 HydrophobicContact CE1-CE2 4.16Å; F95-F121 AromaticContact CE1-CZ 3.94Å; F95-F121 HydrophobicContact CE1-CZ 3.94Å; F95-F121 HydrophobicContact CE2-CD1 4.04Å; F95-F121 AromaticContact CE2-CD2 3.65Å; F95-F121 HydrophobicContact CE2-CD2 3.65Å; F95-F121 AromaticContact CE2-CE1 3.42Å; F95-F121 HydrophobicContact CE2-CE1 3.42Å; F95-F121 VanDerWaalsContact CE2-CE1 3.42Å; F95-F121 AromaticContact CE2-CE2 2.98Å; F95-F121 HydrophobicContact CE2-CE2 2.98Å; F95-F121 HydrophobicContact CE2-CG 4.17Å; F95-F121 AromaticContact CE2-CZ 2.9Å; F95-F121 HydrophobicContact CE2-CZ 2.9Å; F95-F121 HydrophobicContact CG-CE2 4.25Å; F95-F121 HydrophobicContact CZ-CD2 4.45Å; F95-F121 AromaticContact CZ-CE1 3.65Å; F95-F121 HydrophobicContact CZ-CE1 3.65Å; F95-F121 AromaticContact CZ-CE2 3.4Å; F95-F121 HydrophobicContact CZ-CE2 3.4Å; F95-F121 AromaticContact CZ-CZ 2.94Å; F95-F121 HydrophobicContact CZ-CZ 2.94Å; F95-F124 HydrophobicContact CB-CE1 4.31Å; F95-F124 HydrophobicContact CD2-CD1 4.44Å; F95-W125 AromaticContact CE2-CD1 3.9Å |
| 96 | V | 80.7 | Confident | 78.8 | Confident | 86 Ų | 86 | 56.1 Ų | 56.1 | 52% | 0.521 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 179.3 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | L92 I93 Y99 S100 | L92-V96 WeakPolarHBondContact O-CG2 3.46Å; L92-V96 PolarHBondContact O-N 3.13Å; I93-V96 PolarHBondContact O-N 3.23Å; V96-Y99 PolarHBondContact O-N 2.99Å; V96-S100 WeakPolarHBondContact O-CB 3.37Å; V96-S100 PolarHBondContact O-N 3.25Å |
| 97 | I | 78.3 | Confident | 78.4 | Confident | 35 Ų | 35 | 60.3 Ų | 60.3 | 18% | 0.179 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -62.1 | -48.6 | 176.1 | -65.2 | 167.2 | 0 | 0 | 0 | 110.1 | A40 V43 I93 F95 Y99 S100 Q101 | A40-I97 HydrophobicContact CB-CG2 4.19Å; V43-I97 HydrophobicContact CB-CD1 4.37Å; V43-I97 HydrophobicContact CG1-CD1 3.69Å; I93-I97 HydrophobicContact CG2-CD1 4Å; I93-I97 WeakPolarHBondContact O-CG1 3.37Å; I93-I97 PolarHBondContact O-N 3.13Å; F95-I97 VanDerWaalsContact C-N 3.31Å; F95-I97 PolarHBondContact O-N 3.35Å; I97-Y99 PolarHBondContact O-N 2.89Å; I97-S100 WeakPolarHBondContact O-CB 3.35Å; I97-S100 PolarHBondContact O-N 3.35Å; I97-Q101 WeakPolarHBondContact O-CG 3.22Å; I97-Q101 PolarHBondContact O-N 3.46Å |
| 98 | H | 76.3 | Confident | 78 | Confident | 51 Ų | 51 | 67.8 Ų | 67.8 | 24% | 0.236 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -64.1 | -42.4 | -179.8 | -172 | 65.7 | 0 | 0 | 0 | 112.2 | Y44 S94 F95 S100 Q101 W102 | Y44-H98 HydrophobicContact CD2-CB 4.4Å; Y44-H98 HydrophobicContact CE2-CB 4.17Å; S94-H98 WeakPolarHBondContact O-CB 3.29Å; S94-H98 PolarHBondContact O-N 3.36Å; F95-H98 PolarHBondContact O-N 2.94Å; H98-S100 VanDerWaalsContact C-N 3.32Å; H98-S100 PolarHBondContact O-N 2.92Å; H98-Q101 PolarHBondContact O-N 3.13Å; H98-W102 VanDerWaalsContact O-CB 3.27Å; H98-W102 WeakPolarHBondContact O-CB 3.31Å; H98-W102 PolarHBondContact O-N 2.93Å |
| 99 | Y | 75.7 | Confident | 77.4 | Confident | 108 Ų | 108 | 73.5 Ų | 73.5 | 42% | 0.424 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.7 | -38.9 | 176.3 | -174.6 | -99.2 | 0 | 0 | 0 | 111.9 | F95 V96 I97 W102 N103 F121 | F95-Y99 VanDerWaalsContact O-CB 3.3Å; F95-Y99 WeakPolarHBondContact O-CB 3.26Å; F95-Y99 PolarHBondContact O-N 2.91Å; V96-Y99 PolarHBondContact O-N 2.99Å; I97-Y99 PolarHBondContact O-N 2.89Å; Y99-W102 AromaticContact CD2-CE3 3.87Å; Y99-W102 HydrophobicContact CD2-CE3 3.87Å; Y99-W102 HydrophobicContact CD2-CZ3 4.22Å; Y99-W102 AromaticContact CE2-CE3 3.76Å; Y99-W102 HydrophobicContact CE2-CE3 3.76Å; Y99-W102 AromaticContact CE2-CZ3 3.66Å; Y99-W102 HydrophobicContact CE2-CZ3 3.66Å; Y99-W102 PolarHBondContact O-N 3.33Å; Y99-N103 VanDerWaalsContact O-CB 3.3Å; Y99-N103 WeakPolarHBondContact O-CB 3.41Å; Y99-N103 PolarHBondContact O-N 3.49Å; Y99-F121 AromaticContact CD2-CE2 3.9Å; Y99-F121 HydrophobicContact CD2-CE2 3.9Å; Y99-F121 AromaticContact CD2-CZ 3.79Å; Y99-F121 HydrophobicContact CD2-CZ 3.79Å; Y99-F121 HydrophobicContact CE2-CZ 4.39Å |
| 100 | S | 79 | Confident | 76.5 | Confident | 68 Ų | 68 | 72.5 Ų | 72.5 | 48% | 0.476 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.9 | -40.5 | 174.6 | -178.2 | 0 | 0 | 0 | 0 | 112.3 | V96 I97 H98 S104 | V96-S100 WeakPolarHBondContact O-CB 3.37Å; V96-S100 PolarHBondContact O-N 3.25Å; I97-S100 WeakPolarHBondContact O-CB 3.35Å; I97-S100 PolarHBondContact O-N 3.35Å; H98-S100 VanDerWaalsContact C-N 3.32Å; H98-S100 PolarHBondContact O-N 2.92Å; S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 3.19Å; S100-S104 VanDerWaalsContact O-N 3.07Å; S100-S104 PolarHBondContact O-OG 3.45Å |
| 101 | Q | 74.6 | Confident | 75.5 | Confident | 39 Ų | 39 | 78.6 Ų | 78.6 | 18% | 0.182 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65.5 | -49.9 | 174.8 | -71 | 176.1 | -37.3 | 0 | 0 | 111.1 | I97 H98 N103 S104 D105 | I97-Q101 WeakPolarHBondContact O-CG 3.22Å; I97-Q101 PolarHBondContact O-N 3.46Å; H98-Q101 PolarHBondContact O-N 3.13Å; Q101-N103 VanDerWaalsContact C-N 3.33Å; Q101-N103 PolarHBondContact O-N 3.28Å; Q101-S104 CarbonylContact O-C 3.57Å; Q101-S104 WeakPolarHBondContact O-CA 3.23Å; Q101-S104 WeakPolarHBondContact O-CB 3.4Å; Q101-S104 PolarHBondContact O-N 3.47Å; Q101-D105 PolarHBondContact O-N 3.07Å |
| 102 | W | 74 | Confident | 74.5 | Confident | 59 Ų | 59 | 83.9 Ų | 83.9 | 22% | 0.223 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -55.8 | -44.7 | 177.4 | -176.4 | 74.4 | 0 | 0 | 0 | 112.3 | H98 Y99 S104 D105 F106 M114 | H98-W102 VanDerWaalsContact O-CB 3.27Å; H98-W102 WeakPolarHBondContact O-CB 3.31Å; H98-W102 PolarHBondContact O-N 2.93Å; Y99-W102 AromaticContact CD2-CE3 3.87Å; Y99-W102 HydrophobicContact CD2-CE3 3.87Å; Y99-W102 HydrophobicContact CD2-CZ3 4.22Å; Y99-W102 AromaticContact CE2-CE3 3.76Å; Y99-W102 HydrophobicContact CE2-CE3 3.76Å; Y99-W102 AromaticContact CE2-CZ3 3.66Å; Y99-W102 HydrophobicContact CE2-CZ3 3.66Å; Y99-W102 PolarHBondContact O-N 3.33Å; W102-S104 VanDerWaalsContact C-N 3.31Å; W102-S104 PolarHBondContact O-N 2.97Å; W102-D105 PolarHBondContact O-N 2.9Å; W102-F106 AromaticContact CD1-CE2 3.9Å; W102-F106 AromaticContact CD1-CZ 3.9Å; W102-F106 HydrophobicContact CD2-CD2 4.02Å; W102-F106 AromaticContact CD2-CE2 3.15Å; W102-F106 HydrophobicContact CD2-CE2 3.15Å; W102-F106 AromaticContact CD2-CZ 3.8Å; W102-F106 HydrophobicContact CD2-CZ 3.8Å; W102-F106 AromaticContact CE2-CE2 2.96Å; W102-F106 AromaticContact CE2-CZ 3.14Å; W102-F106 HydrophobicContact CE3-CD2 4.03Å; W102-F106 AromaticContact CE3-CE2 3.41Å; W102-F106 HydrophobicContact CE3-CE2 3.41Å; W102-F106 VanDerWaalsContact CE3-CE2 3.41Å; W102-F106 HydrophobicContact CE3-CZ 4.41Å; W102-F106 AromaticContact CG-CE2 3.8Å; W102-F106 HydrophobicContact CG-CE2 3.8Å; W102-F106 HydrophobicContact CG-CZ 4.26Å; W102-F106 HydrophobicContact CH2-CD2 4.29Å; W102-F106 AromaticContact CH2-CE2 3.31Å; W102-F106 HydrophobicContact CH2-CE2 3.31Å; W102-F106 AromaticContact CH2-CZ 3.88Å; W102-F106 HydrophobicContact CH2-CZ 3.88Å; W102-F106 HydrophobicContact CZ2-CD2 4.34Å; W102-F106 AromaticContact CZ2-CE2 3.09Å; W102-F106 HydrophobicContact CZ2-CE2 3.09Å; W102-F106 AromaticContact CZ2-CZ 3.22Å; W102-F106 HydrophobicContact CZ2-CZ 3.22Å; W102-F106 HydrophobicContact CZ3-CD2 4.13Å; W102-F106 AromaticContact CZ3-CE2 3.47Å; W102-F106 HydrophobicContact CZ3-CE2 3.47Å; W102-F106 VanDerWaalsContact CZ3-CE2 3.47Å; W102-F106 HydrophobicContact CZ3-CZ 4.43Å; W102-F106 AromaticContact NE1-CE2 3.45Å; W102-F106 AromaticContact NE1-CZ 3.21Å; W102-F106 WeakPolarHBondContact O-CD2 3.32Å; W102-F106 PolarHBondContact O-N 3.14Å; W102-M114 HydrophobicContact CH2-CE 3.94Å; W102-M114 HydrophobicContact CZ2-CE 3.77Å |
| 103 | N | 77.8 | Confident | 73.4 | Confident | 70 Ų | 70 | 83.2 Ų | 83.2 | 37% | 0.374 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -66.8 | -32 | 176 | -164.2 | 27 | 0 | 0 | 0 | 112.9 | Y99 Q101 | Y99-N103 VanDerWaalsContact O-CB 3.3Å; Y99-N103 WeakPolarHBondContact O-CB 3.41Å; Y99-N103 PolarHBondContact O-N 3.49Å; Q101-N103 VanDerWaalsContact C-N 3.33Å; Q101-N103 PolarHBondContact O-N 3.28Å |
| 104 | S | 74.4 | Confident | 72.4 | Confident | 58 Ų | 58 | 82.2 Ų | 82.2 | 41% | 0.406 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -72 | -37.5 | 174.7 | -58.5 | 0 | 0 | 0 | 0 | 111.6 | S100 Q101 W102 K107 | S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 3.19Å; S100-S104 VanDerWaalsContact O-N 3.07Å; S100-S104 PolarHBondContact O-OG 3.45Å; Q101-S104 CarbonylContact O-C 3.57Å; Q101-S104 WeakPolarHBondContact O-CA 3.23Å; Q101-S104 WeakPolarHBondContact O-CB 3.4Å; Q101-S104 PolarHBondContact O-N 3.47Å; W102-S104 VanDerWaalsContact C-N 3.31Å; W102-S104 PolarHBondContact O-N 2.97Å; S104-K107 PolarHBondContact O-N 3.32Å |
| 105 | D | 73.5 | Confident | 71.6 | Confident | 73 Ų | 73 | 87.5 Ų | 87.5 | 39% | 0.39 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -70.7 | -34.9 | 177.6 | -70.6 | -24.8 | 0 | 0 | 0 | 111.5 | Q101 W102 K107 K108 Y109 | Q101-D105 PolarHBondContact O-N 3.07Å; W102-D105 PolarHBondContact O-N 2.9Å; D105-K107 PolarHBondContact O-N 2.8Å; D105-K108 CarbonylContact O-C 3.58Å; D105-K108 WeakPolarHBondContact O-CA 3.47Å; D105-K108 PolarHBondContact O-N 3.37Å; D105-Y109 HydrophobicContact CB-CD2 3.94Å; D105-Y109 HydrophobicContact CB-CE2 4.21Å; D105-Y109 WeakPolarHBondContact O-CD2 3.41Å; D105-Y109 PolarHBondContact O-N 3.2Å |
| 106 | F | 73.7 | Confident | 70.9 | Confident | 53 Ų | 53 | 89.5 Ų | 89.5 | 23% | 0.232 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -59.5 | -35 | 172.1 | -81.9 | -51 | 0 | 0 | 0 | 115.4 | W102 K108 M114 | W102-F106 AromaticContact CD1-CE2 3.9Å; W102-F106 AromaticContact CD1-CZ 3.9Å; W102-F106 HydrophobicContact CD2-CD2 4.02Å; W102-F106 AromaticContact CD2-CE2 3.15Å; W102-F106 HydrophobicContact CD2-CE2 3.15Å; W102-F106 AromaticContact CD2-CZ 3.8Å; W102-F106 HydrophobicContact CD2-CZ 3.8Å; W102-F106 AromaticContact CE2-CE2 2.96Å; W102-F106 AromaticContact CE2-CZ 3.14Å; W102-F106 HydrophobicContact CE3-CD2 4.03Å; W102-F106 AromaticContact CE3-CE2 3.41Å; W102-F106 HydrophobicContact CE3-CE2 3.41Å; W102-F106 VanDerWaalsContact CE3-CE2 3.41Å; W102-F106 HydrophobicContact CE3-CZ 4.41Å; W102-F106 AromaticContact CG-CE2 3.8Å; W102-F106 HydrophobicContact CG-CE2 3.8Å; W102-F106 HydrophobicContact CG-CZ 4.26Å; W102-F106 HydrophobicContact CH2-CD2 4.29Å; W102-F106 AromaticContact CH2-CE2 3.31Å; W102-F106 HydrophobicContact CH2-CE2 3.31Å; W102-F106 AromaticContact CH2-CZ 3.88Å; W102-F106 HydrophobicContact CH2-CZ 3.88Å; W102-F106 HydrophobicContact CZ2-CD2 4.34Å; W102-F106 AromaticContact CZ2-CE2 3.09Å; W102-F106 HydrophobicContact CZ2-CE2 3.09Å; W102-F106 AromaticContact CZ2-CZ 3.22Å; W102-F106 HydrophobicContact CZ2-CZ 3.22Å; W102-F106 HydrophobicContact CZ3-CD2 4.13Å; W102-F106 AromaticContact CZ3-CE2 3.47Å; W102-F106 HydrophobicContact CZ3-CE2 3.47Å; W102-F106 VanDerWaalsContact CZ3-CE2 3.47Å; W102-F106 HydrophobicContact CZ3-CZ 4.43Å; W102-F106 AromaticContact NE1-CE2 3.45Å; W102-F106 AromaticContact NE1-CZ 3.21Å; W102-F106 WeakPolarHBondContact O-CD2 3.32Å; W102-F106 PolarHBondContact O-N 3.14Å; F106-K108 PolarHBondContact O-N 3.05Å; F106-M114 HydrophobicContact CD1-CE 3.91Å; F106-M114 HydrophobicContact CD1-CG 4.34Å; F106-M114 HydrophobicContact CD1-SD 3.7Å; F106-M114 HydrophobicContact CD2-CE 4.25Å; F106-M114 HydrophobicContact CE1-CB 3.76Å; F106-M114 HydrophobicContact CE1-CE 3.27Å; F106-M114 HydrophobicContact CE1-CG 3.18Å; F106-M114 HydrophobicContact CE1-SD 3.02Å; F106-M114 WeakPolarHBondContact CE1-SD 3.46Å; F106-M114 HydrophobicContact CE2-CE 3.49Å; F106-M114 VanDerWaalsContact CE2-CE 3.49Å; F106-M114 HydrophobicContact CE2-SD 4.38Å; F106-M114 HydrophobicContact CG-CE 4.41Å; F106-M114 HydrophobicContact CZ-CB 4.33Å; F106-M114 HydrophobicContact CZ-CE 3Å; F106-M114 HydrophobicContact CZ-CG 3.38Å; F106-M114 HydrophobicContact CZ-SD 3.44Å; F106-M114 WeakPolarHBondContact CZ-SD 3.48Å |
| 107 | K | 77.7 | Confident | 70.2 | Confident | 174 Ų | 174 | 86.9 Ų | 86.9 | 76% | 0.757 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.3 | -19.3 | 177.9 | -66.3 | 179.3 | -178.4 | -175.6 | 0 | 111.2 | S104 D105 | S104-K107 PolarHBondContact O-N 3.32Å; D105-K107 PolarHBondContact O-N 2.8Å |
| 108 | K | 74.2 | Confident | 69.6 | Low | 157 Ų | 157 | 87.1 Ų | 87.1 | 68% | 0.683 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.2 | -34.7 | -176.9 | -65.7 | -179.4 | -179.3 | 177.6 | 0 | 113.8 | D105 F106 | D105-K108 CarbonylContact O-C 3.58Å; D105-K108 WeakPolarHBondContact O-CA 3.47Å; D105-K108 PolarHBondContact O-N 3.37Å; F106-K108 PolarHBondContact O-N 3.05Å |
| 109 | Y | 67 | Low | 69.2 | Low | 149 Ų | 149 | 92.9 Ų | 92.9 | 58% | 0.584 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -110.4 | 131.4 | -172.3 | -60.5 | -74.2 | 0 | 0 | 0 | 111.2 | D105 | D105-Y109 HydrophobicContact CB-CD2 3.94Å; D105-Y109 HydrophobicContact CB-CE2 4.21Å; D105-Y109 WeakPolarHBondContact O-CD2 3.41Å; D105-Y109 PolarHBondContact O-N 3.2Å |
| 110 | S | 64.2 | Low | 68.9 | Low | 98 Ų | 98 | 90.4 Ų | 90.4 | 69% | 0.685 | 48% | 0.482 | S | S | * | . | trans | -60.9 | 150.3 | 176.1 | 65.7 | 0 | 0 | 0 | 0 | 111.1 | S112 A113 | S110-S112 PolarHBondContact O-N 2.85Å; S110-A113 PolarHBondContact O-N 2.86Å | ||
| 111 | I | 63.3 | Low | 68.3 | Low | 146 Ų | 146 | 89.8 Ų | 89.8 | 75% | 0.749 | 47% | 0.47 | S | S | * | . | G | 310 helix | trans | -46.7 | -19.3 | -170.8 | -65.9 | 159.2 | 0 | 0 | 0 | 114.8 | A113 M114 | I111-A113 PolarHBondContact O-N 3.42Å; I111-M114 VanDerWaalsContact O-CB 3.26Å; I111-M114 WeakPolarHBondContact O-CB 3.29Å |
| 112 | S | 61.6 | Low | 68.2 | Low | 120 Ų | 120 | 90.2 Ų | 90.2 | 84% | 0.839 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -71.5 | -21.9 | -176 | -168.5 | 0 | 0 | 0 | 0 | 115 | S110 | S110-S112 PolarHBondContact O-N 2.85Š|
| 113 | A | 59.9 | Low | 68 | Low | 73 Ų | 73 | 91.9 Ų | 91.9 | 60% | 0.603 | 49% | 0.493 | S | S | * | . | G | 310 helix | trans | -90.2 | 3.4 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | S110 I111 N115 | S110-A113 PolarHBondContact O-N 2.86Å; I111-A113 PolarHBondContact O-N 3.42Å; A113-N115 PolarHBondContact O-N 3.34Å |
| 114 | M | 57.7 | Low | 67.7 | Low | 71 Ų | 71 | 90.2 Ų | 90.2 | 35% | 0.35 | 48% | 0.483 | S | S | . | . | trans | -79.3 | -9.5 | -159.4 | -176.7 | 155.8 | -169.8 | 0 | 0 | 116.5 | W102 F106 I111 | W102-M114 HydrophobicContact CH2-CE 3.94Å; W102-M114 HydrophobicContact CZ2-CE 3.77Å; F106-M114 HydrophobicContact CD1-CE 3.91Å; F106-M114 HydrophobicContact CD1-CG 4.34Å; F106-M114 HydrophobicContact CD1-SD 3.7Å; F106-M114 HydrophobicContact CD2-CE 4.25Å; F106-M114 HydrophobicContact CE1-CB 3.76Å; F106-M114 HydrophobicContact CE1-CE 3.27Å; F106-M114 HydrophobicContact CE1-CG 3.18Å; F106-M114 HydrophobicContact CE1-SD 3.02Å; F106-M114 WeakPolarHBondContact CE1-SD 3.46Å; F106-M114 HydrophobicContact CE2-CE 3.49Å; F106-M114 VanDerWaalsContact CE2-CE 3.49Å; F106-M114 HydrophobicContact CE2-SD 4.38Å; F106-M114 HydrophobicContact CG-CE 4.41Å; F106-M114 HydrophobicContact CZ-CB 4.33Å; F106-M114 HydrophobicContact CZ-CE 3Å; F106-M114 HydrophobicContact CZ-CG 3.38Å; F106-M114 HydrophobicContact CZ-SD 3.44Å; F106-M114 WeakPolarHBondContact CZ-SD 3.48Å; I111-M114 VanDerWaalsContact O-CB 3.26Å; I111-M114 WeakPolarHBondContact O-CB 3.29Å | ||
| 115 | N | 60.3 | Low | 67.6 | Low | 110 Ų | 110 | 93.5 Ų | 93.5 | 59% | 0.588 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -82.3 | -46.1 | -156.6 | -140.9 | -36.4 | 0 | 0 | 0 | 116.5 | A113 A117 W119 | A113-N115 PolarHBondContact O-N 3.34Å; N115-A117 PolarHBondContact O-N 2.88Å; N115-W119 VanDerWaalsContact O-CD1 3.28Å; N115-W119 PolarHBondContact OD1-NE1 3.48Å |
| 116 | P | 65.7 | Low | 67.6 | Low | 82 Ų | 82 | 95.4 Ų | 95.4 | 53% | 0.532 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -72.8 | -32.3 | -167.3 | 26.3 | -32.8 | 0 | 0 | 0 | 114.2 | A118 W119 Y120 | P116-A118 PolarHBondContact O-N 2.92Å; P116-W119 PolarHBondContact O-N 2.97Å; P116-Y120 HydrophobicContact CB-CE2 4.27Å; P116-Y120 WeakPolarHBondContact O-CD2 3.39Å; P116-Y120 WeakPolarHBondContact O-CE2 3.01Å; P116-Y120 PolarHBondContact O-N 3.04Å |
| 117 | A | 64.5 | Low | 67.5 | Low | 30 Ų | 30 | 94 Ų | 94 | 25% | 0.248 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -66.4 | -38.4 | -177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | N115 W119 Y120 F121 | N115-A117 PolarHBondContact O-N 2.88Å; A117-W119 VanDerWaalsContact C-N 3.29Å; A117-W119 PolarHBondContact O-N 3.08Å; A117-Y120 PolarHBondContact O-N 3.08Å; A117-F121 WeakPolarHBondContact O-CB 3.34Å; A117-F121 PolarHBondContact O-N 2.94Å; A117-F121 VanDerWaalsContact O-N 3.08Å |
| 118 | A | 66.4 | Low | 67.2 | Low | 41 Ų | 41 | 87.3 Ų | 87.3 | 34% | 0.339 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.3 | -34.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | P116 F121 A122 | P116-A118 PolarHBondContact O-N 2.92Å; A118-F121 WeakPolarHBondContact O-CB 3.49Å; A118-F121 PolarHBondContact O-N 3.06Å; A118-A122 PolarHBondContact O-N 3.34Å |
| 119 | W | 68.7 | Low | 67.1 | Low | 172 Ų | 172 | 82.6 Ų | 82.6 | 65% | 0.652 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -68.1 | -45.1 | 176.3 | -76.4 | 95.4 | 0 | 0 | 0 | 112.5 | N115 P116 A117 F121 A122 L123 | N115-W119 VanDerWaalsContact O-CD1 3.28Å; N115-W119 PolarHBondContact OD1-NE1 3.48Å; P116-W119 PolarHBondContact O-N 2.97Å; A117-W119 VanDerWaalsContact C-N 3.29Å; A117-W119 PolarHBondContact O-N 3.08Å; W119-F121 PolarHBondContact O-N 3.35Å; W119-A122 PolarHBondContact O-N 3.42Å; W119-L123 WeakPolarHBondContact O-CG 3.42Å; W119-L123 PolarHBondContact O-N 3.34Å |
| 120 | Y | 69.1 | Low | 67.4 | Low | 56 Ų | 56 | 77.5 Ų | 77.5 | 22% | 0.22 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -62.1 | -35.2 | 176.1 | -62.1 | -61.9 | 0 | 0 | 0 | 111.6 | S25 K28 P116 A117 F124 | S25-Y120 VanDerWaalsContact OG-CD1 3.26Å; S25-Y120 WeakPolarHBondContact OG-CD1 3.47Å; K28-Y120 WeakPolarHBondContact CD-OH 3.48Å; K28-Y120 VanDerWaalsContact CE-OH 3.31Å; K28-Y120 WeakPolarHBondContact CE-OH 3.3Å; K28-Y120 PolarHBondContact NZ-OH 3.47Å; P116-Y120 HydrophobicContact CB-CE2 4.27Å; P116-Y120 WeakPolarHBondContact O-CD2 3.39Å; P116-Y120 WeakPolarHBondContact O-CE2 3.01Å; P116-Y120 PolarHBondContact O-N 3.04Å; A117-Y120 PolarHBondContact O-N 3.08Å; Y120-F124 VanDerWaalsContact O-CB 3.28Å; Y120-F124 WeakPolarHBondContact O-CB 3.28Å; Y120-F124 PolarHBondContact O-N 2.94Å |
| 121 | F | 66.9 | Low | 67.7 | Low | 55 Ų | 55 | 73.9 Ų | 73.9 | 24% | 0.241 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -64.1 | -47.6 | 175.9 | -172.2 | -89.5 | 0 | 0 | 0 | 112.5 | F95 Y99 A117 A118 W119 F124 W125 | F95-F121 AromaticContact CD2-CD2 3.91Å; F95-F121 HydrophobicContact CD2-CD2 3.91Å; F95-F121 AromaticContact CD2-CE2 3.44Å; F95-F121 HydrophobicContact CD2-CE2 3.44Å; F95-F121 VanDerWaalsContact CD2-CE2 3.44Å; F95-F121 AromaticContact CD2-CZ 3.87Å; F95-F121 HydrophobicContact CD2-CZ 3.87Å; F95-F121 HydrophobicContact CE1-CE2 4.16Å; F95-F121 AromaticContact CE1-CZ 3.94Å; F95-F121 HydrophobicContact CE1-CZ 3.94Å; F95-F121 HydrophobicContact CE2-CD1 4.04Å; F95-F121 AromaticContact CE2-CD2 3.65Å; F95-F121 HydrophobicContact CE2-CD2 3.65Å; F95-F121 AromaticContact CE2-CE1 3.42Å; F95-F121 HydrophobicContact CE2-CE1 3.42Å; F95-F121 VanDerWaalsContact CE2-CE1 3.42Å; F95-F121 AromaticContact CE2-CE2 2.98Å; F95-F121 HydrophobicContact CE2-CE2 2.98Å; F95-F121 HydrophobicContact CE2-CG 4.17Å; F95-F121 AromaticContact CE2-CZ 2.9Å; F95-F121 HydrophobicContact CE2-CZ 2.9Å; F95-F121 HydrophobicContact CG-CE2 4.25Å; F95-F121 HydrophobicContact CZ-CD2 4.45Å; F95-F121 AromaticContact CZ-CE1 3.65Å; F95-F121 HydrophobicContact CZ-CE1 3.65Å; F95-F121 AromaticContact CZ-CE2 3.4Å; F95-F121 HydrophobicContact CZ-CE2 3.4Å; F95-F121 AromaticContact CZ-CZ 2.94Å; F95-F121 HydrophobicContact CZ-CZ 2.94Å; Y99-F121 AromaticContact CD2-CE2 3.9Å; Y99-F121 HydrophobicContact CD2-CE2 3.9Å; Y99-F121 AromaticContact CD2-CZ 3.79Å; Y99-F121 HydrophobicContact CD2-CZ 3.79Å; Y99-F121 HydrophobicContact CE2-CZ 4.39Å; A117-F121 WeakPolarHBondContact O-CB 3.34Å; A117-F121 PolarHBondContact O-N 2.94Å; A117-F121 VanDerWaalsContact O-N 3.08Å; A118-F121 WeakPolarHBondContact O-CB 3.49Å; A118-F121 PolarHBondContact O-N 3.06Å; W119-F121 PolarHBondContact O-N 3.35Å; F121-F124 PolarHBondContact O-N 2.89Å; F121-W125 PolarHBondContact O-N 3.4Å |
| 122 | A | 72 | Confident | 67.9 | Low | 47 Ų | 47 | 69 Ų | 69 | 39% | 0.388 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | A118 W119 F124 W125 L126 | A118-A122 PolarHBondContact O-N 3.34Å; W119-A122 PolarHBondContact O-N 3.42Å; A122-F124 VanDerWaalsContact C-N 3.33Å; A122-F124 PolarHBondContact O-N 3.49Å; A122-W125 PolarHBondContact O-N 3.46Å; A122-L126 WeakPolarHBondContact O-CG 3.37Å; A122-L126 PolarHBondContact O-N 2.99Å |
| 123 | L | 69.8 | Low | 68.6 | Low | 95 Ų | 95 | 67.8 Ų | 67.8 | 50% | 0.497 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.7 | -41.1 | 177 | -72.5 | 172.7 | 0 | 0 | 0 | 112.1 | W119 L126 C127 | W119-L123 WeakPolarHBondContact O-CG 3.42Å; W119-L123 PolarHBondContact O-N 3.34Å; L123-L126 PolarHBondContact O-N 3.44Å; L123-C127 PolarHBondContact O-N 3.3Å; L123-C127 PolarHBondContact O-SG 3.09Å |
| 124 | F | 71.8 | Confident | 69.1 | Low | 34 Ų | 34 | 65.9 Ų | 65.9 | 15% | 0.149 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.8 | -41.9 | 178.3 | -176.6 | -102.5 | 0 | 0 | 0 | 112.4 | F91 F95 Y120 F121 A122 C127 I128 | F91-F124 HydrophobicContact CB-CE1 4.06Å; F91-F124 HydrophobicContact CB-CE2 4.37Å; F91-F124 HydrophobicContact CB-CZ 3.45Å; F91-F124 VanDerWaalsContact CB-CZ 3.45Å; F91-F124 AromaticContact CD1-CE2 3.64Å; F91-F124 HydrophobicContact CD1-CE2 3.64Å; F91-F124 AromaticContact CD1-CZ 3.42Å; F91-F124 HydrophobicContact CD1-CZ 3.42Å; F91-F124 VanDerWaalsContact CD1-CZ 3.42Å; F91-F124 HydrophobicContact CE1-CE2 4.14Å; F91-F124 HydrophobicContact CE1-CZ 4.36Å; F91-F124 HydrophobicContact CG-CE2 4.08Å; F91-F124 AromaticContact CG-CZ 3.61Å; F91-F124 HydrophobicContact CG-CZ 3.61Å; F95-F124 HydrophobicContact CB-CE1 4.31Å; F95-F124 HydrophobicContact CD2-CD1 4.44Å; Y120-F124 VanDerWaalsContact O-CB 3.28Å; Y120-F124 WeakPolarHBondContact O-CB 3.28Å; Y120-F124 PolarHBondContact O-N 2.94Å; F121-F124 PolarHBondContact O-N 2.89Å; A122-F124 VanDerWaalsContact C-N 3.33Å; A122-F124 PolarHBondContact O-N 3.49Å; F124-C127 WeakPolarHBondContact O-CB 3.48Å; F124-C127 PolarHBondContact O-N 3.01Å; F124-I128 HydrophobicContact CD1-CD1 3.89Å; F124-I128 HydrophobicContact CE1-CD1 3.53Å; F124-I128 HydrophobicContact CE1-CG1 4.49Å; F124-I128 HydrophobicContact CZ-CD1 4.13Å; F124-I128 PolarHBondContact O-N 2.96Å; F124-I128 VanDerWaalsContact O-N 3.13Å |
| 125 | W | 71.9 | Confident | 69.6 | Low | 127 Ų | 127 | 64.5 Ų | 64.5 | 48% | 0.481 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -64.3 | -46.3 | 174 | -134.5 | 136.3 | 0 | 0 | 0 | 110.4 | F95 F121 A122 C127 I128 V129 | F95-W125 AromaticContact CE2-CD1 3.9Å; F121-W125 PolarHBondContact O-N 3.4Å; A122-W125 PolarHBondContact O-N 3.46Å; W125-C127 PolarHBondContact O-N 3.21Å; W125-C127 VanDerWaalsContact O-N 3.13Å; W125-I128 HydrophobicContact CE3-CB 4.06Å; W125-I128 HydrophobicContact CE3-CG2 4.22Å; W125-I128 HydrophobicContact CZ3-CB 4.43Å; W125-I128 HydrophobicContact CZ3-CG2 4.11Å; W125-I128 PolarHBondContact O-N 3.47Å; W125-V129 HydrophobicContact CD2-CG2 4.38Å; W125-V129 HydrophobicContact CE3-CG2 3.32Å; W125-V129 HydrophobicContact CH2-CG2 4.35Å; W125-V129 HydrophobicContact CZ3-CB 4.46Å; W125-V129 HydrophobicContact CZ3-CG2 3.29Å; W125-V129 PolarHBondContact O-N 3.49Å |
| 126 | L | 73.3 | Confident | 70.2 | Confident | 113 Ų | 113 | 63.7 Ų | 63.7 | 59% | 0.592 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -55 | -36.7 | 175.6 | -72.1 | 172.2 | 0 | 0 | 0 | 112.2 | A122 L123 A130 | A122-L126 WeakPolarHBondContact O-CG 3.37Å; A122-L126 PolarHBondContact O-N 2.99Å; L123-L126 PolarHBondContact O-N 3.44Å; L126-A130 VanDerWaalsContact O-CB 3.22Å; L126-A130 WeakPolarHBondContact O-CB 3.36Å; L126-A130 PolarHBondContact O-N 3.04Å |
| 127 | C | 72.2 | Confident | 70.4 | Confident | 25 Ų | 25 | 61.7 Ų | 61.7 | 17% | 0.169 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.1 | -44 | 173.1 | -64.4 | 0 | 0 | 0 | 0 | 112.6 | N18 L123 F124 W125 A130 L131 | N18-C127 HydrophobicContact CB-CB 4.5Å; N18-C127 PolarHBondContact OD1-SG 3.4Å; L123-C127 PolarHBondContact O-N 3.3Å; L123-C127 PolarHBondContact O-SG 3.09Å; F124-C127 WeakPolarHBondContact O-CB 3.48Å; F124-C127 PolarHBondContact O-N 3.01Å; W125-C127 PolarHBondContact O-N 3.21Å; W125-C127 VanDerWaalsContact O-N 3.13Å; C127-A130 PolarHBondContact O-N 3.42Å; C127-L131 VanDerWaalsContact O-CB 3.3Å; C127-L131 WeakPolarHBondContact O-CB 3.41Å; C127-L131 PolarHBondContact O-N 3.19Å |
| 128 | I | 69.7 | Low | 70.7 | Confident | 32 Ų | 32 | 61.9 Ų | 61.9 | 16% | 0.164 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.9 | -42.8 | 178.7 | -65.2 | 171.3 | 0 | 0 | 0 | 111.3 | F91 F124 W125 L131 A132 | F91-I128 HydrophobicContact CB-CD1 4.2Å; F124-I128 HydrophobicContact CD1-CD1 3.89Å; F124-I128 HydrophobicContact CE1-CD1 3.53Å; F124-I128 HydrophobicContact CE1-CG1 4.49Å; F124-I128 HydrophobicContact CZ-CD1 4.13Å; F124-I128 PolarHBondContact O-N 2.96Å; F124-I128 VanDerWaalsContact O-N 3.13Å; W125-I128 HydrophobicContact CE3-CB 4.06Å; W125-I128 HydrophobicContact CE3-CG2 4.22Å; W125-I128 HydrophobicContact CZ3-CB 4.43Å; W125-I128 HydrophobicContact CZ3-CG2 4.11Å; W125-I128 PolarHBondContact O-N 3.47Å; I128-L131 WeakPolarHBondContact O-CB 3.36Å; I128-L131 PolarHBondContact O-N 3.02Å; I128-A132 PolarHBondContact O-N 3.27Å |
| 129 | V | 72.6 | Confident | 70.8 | Confident | 59 Ų | 59 | 62.4 Ų | 62.4 | 36% | 0.358 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61 | -48.5 | 175.2 | 178.8 | 0 | 0 | 0 | 0 | 109.9 | W125 L131 A132 L133 | W125-V129 HydrophobicContact CD2-CG2 4.38Å; W125-V129 HydrophobicContact CE3-CG2 3.32Å; W125-V129 HydrophobicContact CH2-CG2 4.35Å; W125-V129 HydrophobicContact CZ3-CB 4.46Å; W125-V129 HydrophobicContact CZ3-CG2 3.29Å; W125-V129 PolarHBondContact O-N 3.49Å; V129-L131 VanDerWaalsContact C-N 3.26Å; V129-L131 PolarHBondContact O-N 2.89Å; V129-A132 PolarHBondContact O-N 2.99Å; V129-L133 HydrophobicContact CG1-CD1 3.91Å; V129-L133 HydrophobicContact CG1-CG 4.27Å; V129-L133 WeakPolarHBondContact O-CG 3.27Å; V129-L133 PolarHBondContact O-N 3.23Å |
| 130 | A | 73.4 | Confident | 71.1 | Confident | 41 Ų | 41 | 59.7 Ų | 59.7 | 34% | 0.339 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.4 | -38.8 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | L126 C127 C134 | L126-A130 VanDerWaalsContact O-CB 3.22Å; L126-A130 WeakPolarHBondContact O-CB 3.36Å; L126-A130 PolarHBondContact O-N 3.04Å; C127-A130 PolarHBondContact O-N 3.42Å; A130-C134 VanDerWaalsContact O-CB 3.26Å; A130-C134 WeakPolarHBondContact O-CB 3.3Å; A130-C134 PolarHBondContact O-N 3.44Å |
| 131 | L | 69.9 | Low | 70.9 | Confident | 22 Ų | 22 | 58.2 Ų | 58.2 | 12% | 0.115 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61 | -50.5 | 174.5 | -176.3 | 68 | 0 | 0 | 0 | 111.3 | F15 L55 T84 C127 I128 V129 L133 C134 I135 | F15-L131 HydrophobicContact CD2-CD1 4.09Å; F15-L131 HydrophobicContact CE2-CD1 3.52Å; L55-L131 HydrophobicContact CD1-CD1 3.97Å; L55-L131 HydrophobicContact CD1-CD2 4.03Å; T84-L131 HydrophobicContact CG2-CD1 3.96Å; T84-L131 HydrophobicContact CG2-CD2 3.7Å; T84-L131 HydrophobicContact CG2-CG 3.83Å; C127-L131 VanDerWaalsContact O-CB 3.3Å; C127-L131 WeakPolarHBondContact O-CB 3.41Å; C127-L131 PolarHBondContact O-N 3.19Å; I128-L131 WeakPolarHBondContact O-CB 3.36Å; I128-L131 PolarHBondContact O-N 3.02Å; V129-L131 VanDerWaalsContact C-N 3.26Å; V129-L131 PolarHBondContact O-N 2.89Å; L131-L133 PolarHBondContact O-N 3.36Å; L131-C134 PolarHBondContact O-N 3.26Å; L131-I135 HydrophobicContact CG-CD1 4.33Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.47Å; L131-I135 PolarHBondContact O-N 2.79Å |
| 132 | A | 69 | Low | 70.7 | Confident | 45 Ų | 45 | 58.5 Ų | 58.5 | 37% | 0.372 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60 | -45.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I128 V129 C134 I135 I136 | I128-A132 PolarHBondContact O-N 3.27Å; V129-A132 PolarHBondContact O-N 2.99Å; A132-C134 PolarHBondContact O-N 2.85Å; A132-I135 PolarHBondContact O-N 3.24Å; A132-I136 VanDerWaalsContact O-CG1 3.29Å; A132-I136 WeakPolarHBondContact O-CG1 3.32Å; A132-I136 PolarHBondContact O-N 3.32Å |
| 133 | L | 75.2 | Confident | 70.2 | Confident | 93 Ų | 93 | 63.6 Ų | 63.6 | 49% | 0.487 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.2 | -40.7 | 176.9 | -69.2 | 175.5 | 0 | 0 | 0 | 112.2 | V129 L131 I135 I136 I137 | V129-L133 HydrophobicContact CG1-CD1 3.91Å; V129-L133 HydrophobicContact CG1-CG 4.27Å; V129-L133 WeakPolarHBondContact O-CG 3.27Å; V129-L133 PolarHBondContact O-N 3.23Å; L131-L133 PolarHBondContact O-N 3.36Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 3.37Å; L133-I136 PolarHBondContact O-N 3.4Å; L133-I137 WeakPolarHBondContact O-CB 3.39Å; L133-I137 VanDerWaalsContact O-CG1 3.28Å; L133-I137 WeakPolarHBondContact O-CG1 3.35Å; L133-I137 PolarHBondContact O-N 3.18Å |
| 134 | C | 70.9 | Confident | 69.8 | Low | 33 Ų | 33 | 63.1 Ų | 63.1 | 22% | 0.223 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 177.5 | -173.5 | 0 | 0 | 0 | 0 | 111.6 | A130 L131 A132 T138 | A130-C134 VanDerWaalsContact O-CB 3.26Å; A130-C134 WeakPolarHBondContact O-CB 3.3Å; A130-C134 PolarHBondContact O-N 3.44Å; L131-C134 PolarHBondContact O-N 3.26Å; A132-C134 PolarHBondContact O-N 2.85Å; C134-T138 WeakPolarHBondContact O-CB 3.44Å; C134-T138 PolarHBondContact O-N 3.34Å; C134-T138 PolarHBondContact O-OG1 2.8Å |
| 135 | I | 68.7 | Low | 68.9 | Low | 42 Ų | 42 | 66.5 Ų | 66.5 | 22% | 0.215 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.5 | -49.1 | 174.3 | -62.2 | 161.6 | 0 | 0 | 0 | 110.1 | T84 L131 A132 L133 I137 T138 C139 | T84-I135 HydrophobicContact CG2-CD1 3.26Å; T84-I135 HydrophobicContact CG2-CG1 4.11Å; L131-I135 HydrophobicContact CG-CD1 4.33Å; L131-I135 VanDerWaalsContact O-CG1 3.28Å; L131-I135 WeakPolarHBondContact O-CG1 3.47Å; L131-I135 PolarHBondContact O-N 2.79Å; A132-I135 PolarHBondContact O-N 3.24Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 3.37Å; I135-I137 PolarHBondContact O-N 2.95Å; I135-T138 CarbonylContact O-C 3.57Å; I135-T138 WeakPolarHBondContact O-CB 3.35Å; I135-T138 PolarHBondContact O-N 2.89Å; I135-T138 VanDerWaalsContact O-N 3.13Å; I135-C139 WeakPolarHBondContact O-CB 3.47Å; I135-C139 PolarHBondContact O-N 3.07Å; I135-C139 PolarHBondContact O-SG 3.41Å |
| 136 | I | 72 | Confident | 68.8 | Low | 93 Ų | 93 | 63.5 Ų | 63.5 | 48% | 0.477 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.7 | -51 | -179.3 | -68 | 163.7 | 0 | 0 | 0 | 110.6 | A132 L133 T138 C139 E140 | A132-I136 VanDerWaalsContact O-CG1 3.29Å; A132-I136 WeakPolarHBondContact O-CG1 3.32Å; A132-I136 PolarHBondContact O-N 3.32Å; L133-I136 PolarHBondContact O-N 3.4Å; I136-T138 VanDerWaalsContact C-N 3.26Å; I136-T138 PolarHBondContact O-N 3.47Å; I136-C139 WeakPolarHBondContact O-CB 3.3Å; I136-C139 PolarHBondContact O-N 2.95Å; I136-C139 VanDerWaalsContact O-N 3.14Å; I136-E140 PolarHBondContact O-N 3.34Å |
| 137 | I | 70.4 | Confident | 68.6 | Low | 40 Ų | 40 | 60.8 Ų | 60.8 | 21% | 0.205 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -60.7 | -38.9 | 178.1 | -68.9 | 166.9 | 0 | 0 | 0 | 110.8 | F3 L11 L133 I135 N141 | F3-I137 HydrophobicContact CD2-CG2 3.86Å; F3-I137 HydrophobicContact CE2-CG2 3.57Å; F3-I137 HydrophobicContact CZ-CG2 4.02Å; L11-I137 HydrophobicContact CD1-CG2 4.5Å; L133-I137 WeakPolarHBondContact O-CB 3.39Å; L133-I137 VanDerWaalsContact O-CG1 3.28Å; L133-I137 WeakPolarHBondContact O-CG1 3.35Å; L133-I137 PolarHBondContact O-N 3.18Å; I135-I137 PolarHBondContact O-N 2.95Å; I137-N141 WeakPolarHBondContact CG2-ND2 3.44Å; I137-N141 WeakPolarHBondContact O-CB 3.17Å; I137-N141 PolarHBondContact O-N 3.43Å; I137-N141 VanDerWaalsContact O-N 3.11Å; I137-N141 PolarHBondContact O-ND2 3.49Å |
| 138 | T | 71.9 | Confident | 68.4 | Low | 34 Ų | 34 | 62.8 Ų | 62.8 | 21% | 0.209 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.9 | -43.8 | 176.7 | -61.6 | 0 | 0 | 0 | 0 | 110.9 | F62 C134 I135 I136 N141 Q142 | F62-T138 HydrophobicContact CD2-CG2 4.5Å; F62-T138 HydrophobicContact CE2-CG2 3.51Å; F62-T138 HydrophobicContact CZ-CG2 4.04Å; C134-T138 WeakPolarHBondContact O-CB 3.44Å; C134-T138 PolarHBondContact O-N 3.34Å; C134-T138 PolarHBondContact O-OG1 2.8Å; I135-T138 CarbonylContact O-C 3.57Å; I135-T138 WeakPolarHBondContact O-CB 3.35Å; I135-T138 PolarHBondContact O-N 2.89Å; I135-T138 VanDerWaalsContact O-N 3.13Å; I136-T138 VanDerWaalsContact C-N 3.26Å; I136-T138 PolarHBondContact O-N 3.47Å; T138-N141 PolarHBondContact O-N 2.99Å; T138-Q142 VanDerWaalsContact O-CG 3.29Å; T138-Q142 WeakPolarHBondContact O-CG 3.47Å; T138-Q142 PolarHBondContact O-N 2.84Å; T138-Q142 VanDerWaalsContact O-N 3.17Å |
| 139 | C | 68.2 | Low | 68.3 | Low | 52 Ų | 52 | 64.6 Ų | 64.6 | 35% | 0.351 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -61.7 | -47.2 | 177 | -70.3 | 0 | 0 | 0 | 0 | 111.8 | I135 I136 N141 Q142 L143 | I135-C139 WeakPolarHBondContact O-CB 3.47Å; I135-C139 PolarHBondContact O-N 3.07Å; I135-C139 PolarHBondContact O-SG 3.41Å; I136-C139 WeakPolarHBondContact O-CB 3.3Å; I136-C139 PolarHBondContact O-N 2.95Å; I136-C139 VanDerWaalsContact O-N 3.14Å; C139-N141 VanDerWaalsContact C-N 3.33Å; C139-N141 PolarHBondContact O-N 2.83Å; C139-Q142 PolarHBondContact O-N 2.92Å; C139-L143 PolarHBondContact O-N 2.76Å; C139-L143 VanDerWaalsContact O-N 3.11Å |
| 140 | E | 73.5 | Confident | 68 | Low | 115 Ų | 115 | 65 Ų | 65 | 54% | 0.537 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -61.1 | -41.2 | 177.9 | -72.4 | -169 | 132.7 | 0 | 0 | 112.4 | I136 Q142 L143 S144 | I136-E140 PolarHBondContact O-N 3.34Å; E140-Q142 VanDerWaalsContact C-N 3.27Å; E140-Q142 PolarHBondContact O-N 3.26Å; E140-L143 PolarHBondContact O-N 3.28Å; E140-S144 WeakPolarHBondContact O-CB 3.21Å; E140-S144 PolarHBondContact O-N 3.27Å; E140-S144 PolarHBondContact O-OG 3.39Å |
| 141 | N | 66.2 | Low | 67.7 | Low | 26 Ų | 26 | 66.6 Ų | 66.6 | 14% | 0.139 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -67.2 | -26.8 | 178.5 | -80.5 | -53.9 | 0 | 0 | 0 | 113.3 | F3 I137 T138 C139 | F3-N141 VanDerWaalsContact CD2-ND2 3.28Å; F3-N141 WeakPolarHBondContact CD2-ND2 3.26Å; F3-N141 WeakPolarHBondContact CD2-OD1 3.02Å; F3-N141 PolarHBondContact N-OD1 3.25Å; I137-N141 WeakPolarHBondContact CG2-ND2 3.44Å; I137-N141 WeakPolarHBondContact O-CB 3.17Å; I137-N141 PolarHBondContact O-N 3.43Å; I137-N141 VanDerWaalsContact O-N 3.11Å; I137-N141 PolarHBondContact O-ND2 3.49Å; T138-N141 PolarHBondContact O-N 2.99Å; C139-N141 VanDerWaalsContact C-N 3.33Å; C139-N141 PolarHBondContact O-N 2.83Å |
| 142 | Q | 62.4 | Low | 67.5 | Low | 61 Ų | 61 | 69.8 Ų | 69.8 | 29% | 0.285 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -87 | -25.6 | 178.7 | -64.3 | -62.1 | -35.7 | 0 | 0 | 112.9 | L77 T138 C139 E140 | L77-Q142 HydrophobicContact CD1-CB 4.12Å; L77-Q142 HydrophobicContact CD1-CG 3.96Å; T138-Q142 VanDerWaalsContact O-CG 3.29Å; T138-Q142 WeakPolarHBondContact O-CG 3.47Å; T138-Q142 PolarHBondContact O-N 2.84Å; T138-Q142 VanDerWaalsContact O-N 3.17Å; C139-Q142 PolarHBondContact O-N 2.92Å; E140-Q142 VanDerWaalsContact C-N 3.27Å; E140-Q142 PolarHBondContact O-N 3.26Å |
| 143 | L | 62.4 | Low | 67.4 | Low | 154 Ų | 154 | 71.7 Ų | 71.7 | 81% | 0.806 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -79.1 | -23.4 | 174.3 | -71.9 | 169 | 0 | 0 | 0 | 112.9 | C139 E140 G145 | C139-L143 PolarHBondContact O-N 2.76Å; C139-L143 VanDerWaalsContact O-N 3.11Å; E140-L143 PolarHBondContact O-N 3.28Å; L143-G145 VanDerWaalsContact C-N 3.34Å |
| 144 | S | 61.2 | Low | 66.7 | Low | 84 Ų | 84 | 69.9 Ų | 69.9 | 59% | 0.587 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.7 | 2.2 | -178.8 | -55.5 | 0 | 0 | 0 | 0 | 114.2 | E140 | E140-S144 WeakPolarHBondContact O-CB 3.21Å; E140-S144 PolarHBondContact O-N 3.27Å; E140-S144 PolarHBondContact O-OG 3.39Å |
| 145 | G | 53 | Low | 66.3 | Low | 105 Ų | 105 | 73.3 Ų | 73.3 | 100% | 1.082 | 45% | 0.445 | S | S | * | . | trans | -120.6 | 0 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L143 | L143-G145 VanDerWaalsContact C-N 3.34Š|
Retrieved 145 of 145 residues in 578.6 ms
(Link to these results)