| 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 | 47.9 | Very low | 78.5 | Confident | 245 Ų | 245 | 63.1 Ų | 63.1 | 100% | 1.207 | 40% | 0.396 | S | S | * | . | 0 | 119 | 0 | -69.1 | -175.6 | 156.9 | 0 | 0 | 107.1 | |||||
| 2 | A | 56.1 | Low | 79.9 | Confident | 65 Ų | 65 | 62.3 Ų | 62.3 | 54% | 0.537 | 39% | 0.394 | S | S | . | . | trans | -74.9 | 134.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 108.5 | P135 | A2-P135 HydrophobicContact CB-CB 3.38Å; A2-P135 HydrophobicContact CB-CG 3.49Å; A2-P135 VanDerWaalsContact CB-CG 3.49Å | ||
| 3 | S | 61.2 | Low | 81.2 | Confident | 76 Ų | 76 | 60.8 Ų | 60.8 | 53% | 0.531 | 38% | 0.379 | S | S | . | . | trans | -70.3 | 139.9 | -180 | -179.5 | 0 | 0 | 0 | 0 | 110 | A5 P6 | S3-A5 PolarHBondContact O-N 3.27Å; S3-A5 VanDerWaalsContact O-N 3.12Å; S3-A5 VanDerWaalsContact OG-CB 3.29Å; S3-A5 WeakPolarHBondContact OG-CB 3.29Å; S3-A5 PolarHBondContact OG-N 3.39Å; S3-P6 WeakPolarHBondContact O-CD 3.06Å | ||
| 4 | P | 70.4 | Confident | 82.2 | Confident | 64 Ų | 64 | 56.5 Ų | 56.5 | 42% | 0.416 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -67.4 | -4.1 | 171 | 29 | -34.7 | 0 | 0 | 0 | 112.9 | P6 L7 V8 | P4-P6 VanDerWaalsContact C-N 3.34Å; P4-P6 VanDerWaalsContact O-N 3.17Å; P4-L7 PolarHBondContact O-N 3.12Å; P4-L7 VanDerWaalsContact O-N 3.08Å; P4-V8 PolarHBondContact O-N 3.39Å; P4-V8 VanDerWaalsContact O-N 3.17Å |
| 5 | A | 80.7 | Confident | 83.1 | Confident | 53 Ų | 53 | 57.5 Ų | 57.5 | 44% | 0.438 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -47.8 | -40.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | S3 L7 V8 A9 | S3-A5 PolarHBondContact O-N 3.27Å; S3-A5 VanDerWaalsContact O-N 3.12Å; S3-A5 VanDerWaalsContact OG-CB 3.29Å; S3-A5 WeakPolarHBondContact OG-CB 3.29Å; S3-A5 PolarHBondContact OG-N 3.39Å; A5-L7 PolarHBondContact O-N 3.07Å; A5-V8 PolarHBondContact O-N 3.34Å; A5-A9 WeakPolarHBondContact O-CB 3.21Å; A5-A9 PolarHBondContact O-N 3.42Å |
| 6 | P | 86.4 | Confident | 84 | Confident | 54 Ų | 54 | 57.1 Ų | 57.1 | 35% | 0.351 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.8 | -36.8 | 179.5 | -22.1 | 34.8 | 0 | 0 | 0 | 113.5 | S3 P4 S10 I138 | S3-P6 WeakPolarHBondContact O-CD 3.06Å; P4-P6 VanDerWaalsContact C-N 3.34Å; P4-P6 VanDerWaalsContact O-N 3.17Å; P6-S10 PolarHBondContact O-N 3.06Å; P6-I138 HydrophobicContact CB-CB 4.12Å; P6-I138 HydrophobicContact CB-CG1 4.47Å |
| 7 | L | 89.9 | Confident | 84.6 | Confident | 4 Ų | 4 | 53.8 Ų | 53.8 | 2% | 0.021 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -71.7 | -44.4 | 177.5 | 179.7 | 61.8 | 0 | 0 | 0 | 110.5 | P4 A5 A9 S10 I11 E123 L127 Q131 I138 | P4-L7 PolarHBondContact O-N 3.12Å; P4-L7 VanDerWaalsContact O-N 3.08Å; A5-L7 PolarHBondContact O-N 3.07Å; L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 2.81Å; L7-S10 WeakPolarHBondContact O-CB 2.85Å; L7-S10 PolarHBondContact O-N 2.66Å; L7-S10 VanDerWaalsContact O-N 3.1Å; L7-I11 HydrophobicContact CD1-CD1 4.26Å; L7-I11 HydrophobicContact CD1-CG1 4.35Å; L7-I11 HydrophobicContact CG-CD1 3.96Å; L7-I11 HydrophobicContact CG-CG1 4.48Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 3.37Å; L7-E123 HydrophobicContact CD1-CB 4.42Å; L7-L127 HydrophobicContact CD1-CB 4.39Å; L7-L127 HydrophobicContact CD2-CB 4.17Å; L7-L127 WeakPolarHBondContact CD2-O 3.28Å; L7-Q131 HydrophobicContact CB-CG 4.05Å; L7-Q131 HydrophobicContact CD2-CB 3.59Å; L7-Q131 HydrophobicContact CD2-CG 3.88Å; L7-I138 HydrophobicContact CB-CG1 4.15Å; L7-I138 HydrophobicContact CD1-CD1 4Å; L7-I138 HydrophobicContact CD1-CG1 4.44Å |
| 8 | V | 92 | Very high | 85.3 | Confident | 83 Ų | 83 | 51.7 Ų | 51.7 | 50% | 0.503 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.8 | -40.8 | 176.8 | 177.5 | 0 | 0 | 0 | 0 | 111.4 | P4 A5 S12 | P4-V8 PolarHBondContact O-N 3.39Å; P4-V8 VanDerWaalsContact O-N 3.17Å; A5-V8 PolarHBondContact O-N 3.34Å; V8-S12 WeakPolarHBondContact O-CB 3.46Å; V8-S12 PolarHBondContact O-N 3.23Å; V8-S12 PolarHBondContact O-OG 2.87Å |
| 9 | A | 92.5 | Very high | 85.9 | Confident | 29 Ų | 29 | 55.4 Ų | 55.4 | 24% | 0.24 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A5 L7 S12 H13 L140 | A5-A9 WeakPolarHBondContact O-CB 3.21Å; A5-A9 PolarHBondContact O-N 3.42Å; L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 2.81Å; A9-S12 PolarHBondContact O-N 3.27Å; A9-H13 PolarHBondContact O-CD2 2.99Å; A9-H13 PolarHBondContact O-N 3.44Å; A9-L140 HydrophobicContact CB-CD1 3.64Å; A9-L140 HydrophobicContact CB-CD2 4.06Å |
| 10 | S | 93.1 | Very high | 86.3 | Confident | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.007 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -58.1 | -51.7 | 175.1 | -176.5 | 0 | 0 | 0 | 0 | 111.6 | P6 L7 S12 H13 Q14 E123 S143 | P6-S10 PolarHBondContact O-N 3.06Å; L7-S10 WeakPolarHBondContact O-CB 2.85Å; L7-S10 PolarHBondContact O-N 2.66Å; L7-S10 VanDerWaalsContact O-N 3.1Å; S10-S12 VanDerWaalsContact C-N 3.27Å; S10-S12 PolarHBondContact O-N 2.89Å; S10-H13 PolarHBondContact O-N 3.12Å; S10-H13 VanDerWaalsContact O-N 3.12Å; S10-Q14 WeakPolarHBondContact O-CG 3.46Å; S10-Q14 PolarHBondContact O-N 2.83Å; S10-Q14 PolarHBondContact OG-NE2 3.42Å; S10-E123 PolarHBondContact OG-OE2 3.12Å; S10-S143 PolarHBondContact OG-OG 2.84Å |
| 11 | I | 93.8 | Very high | 86.6 | Confident | 20 Ų | 20 | 51.5 Ų | 51.5 | 10% | 0.103 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -56.8 | -43.8 | 178.1 | -66.6 | 167.1 | 0 | 0 | 0 | 110.2 | L7 H13 Q14 M15 E123 Q124 | L7-I11 HydrophobicContact CD1-CD1 4.26Å; L7-I11 HydrophobicContact CD1-CG1 4.35Å; L7-I11 HydrophobicContact CG-CD1 3.96Å; L7-I11 HydrophobicContact CG-CG1 4.48Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 3.37Å; I11-H13 PolarHBondContact O-N 2.92Å; I11-Q14 PolarHBondContact O-N 3.3Å; I11-M15 HydrophobicContact CG2-CE 4.45Å; I11-M15 HydrophobicContact CG2-CG 4.24Å; I11-M15 HydrophobicContact CG2-SD 4.4Å; I11-M15 WeakPolarHBondContact O-CB 3.35Å; I11-M15 WeakPolarHBondContact O-CG 3.39Å; I11-M15 PolarHBondContact O-N 3.43Å; I11-E123 HydrophobicContact CD1-CB 4.07Å; I11-E123 HydrophobicContact CG1-CB 3.68Å; I11-E123 WeakPolarHBondContact CG1-OE2 3.44Å; I11-Q124 HydrophobicContact CD1-CG 4.13Å; I11-Q124 HydrophobicContact CG2-CG 3.99Å |
| 12 | S | 95.1 | Very high | 88.8 | Confident | 53 Ų | 53 | 43.3 Ų | 43.3 | 37% | 0.371 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 179.3 | -59.5 | 0 | 0 | 0 | 0 | 111.8 | V8 A9 S10 M15 V16 | V8-S12 WeakPolarHBondContact O-CB 3.46Å; V8-S12 PolarHBondContact O-N 3.23Å; V8-S12 PolarHBondContact O-OG 2.87Å; A9-S12 PolarHBondContact O-N 3.27Å; S10-S12 VanDerWaalsContact C-N 3.27Å; S10-S12 PolarHBondContact O-N 2.89Å; S12-M15 PolarHBondContact O-N 3.1Å; S12-V16 VanDerWaalsContact O-CG2 3.31Å; S12-V16 WeakPolarHBondContact O-CG2 3.41Å; S12-V16 PolarHBondContact O-N 3.36Å; S12-V16 VanDerWaalsContact O-N 3.13Å |
| 13 | H | 96.3 | Very high | 90.5 | Very high | 44 Ų | 44 | 44.6 Ų | 44.6 | 20% | 0.204 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.2 | -41.3 | 176.2 | -70.8 | -55.9 | 0 | 0 | 0 | 112.5 | A9 S10 I11 V16 A17 V144 R147 | A9-H13 PolarHBondContact O-CD2 2.99Å; A9-H13 PolarHBondContact O-N 3.44Å; S10-H13 PolarHBondContact O-N 3.12Å; S10-H13 VanDerWaalsContact O-N 3.12Å; I11-H13 PolarHBondContact O-N 2.92Å; H13-V16 PolarHBondContact O-N 2.94Å; H13-A17 WeakPolarHBondContact O-CB 3.48Å; H13-A17 PolarHBondContact O-N 3.17Å; H13-V144 WeakPolarHBondContact NE2-CG2 3.33Å; H13-R147 HydrophobicContact CB-CB 4.45Å |
| 14 | Q | 95.5 | Very high | 91.8 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.9 | -37.3 | 177.7 | -68.7 | 176.5 | 4.3 | 0 | 0 | 112.6 | S10 I11 A17 L18 V120 E123 | S10-Q14 WeakPolarHBondContact O-CG 3.46Å; S10-Q14 PolarHBondContact O-N 2.83Å; S10-Q14 PolarHBondContact OG-NE2 3.42Å; I11-Q14 PolarHBondContact O-N 3.3Å; Q14-A17 WeakPolarHBondContact O-CB 3.4Å; Q14-A17 PolarHBondContact O-N 2.9Å; Q14-L18 WeakPolarHBondContact O-CB 3.32Å; Q14-L18 PolarHBondContact O-N 3.02Å; Q14-V120 HydrophobicContact CB-CG2 3.55Å; Q14-E123 VanDerWaalsContact CD-CD 3.46Å; Q14-E123 VanDerWaalsContact CD-OE2 3.32Å; Q14-E123 PolarHBondContact NE2-OE1 3.08Å; Q14-E123 PolarHBondContact NE2-OE2 3.15Å; Q14-E123 PolarHBondContact OE1-OE1 2.94Å; Q14-E123 PolarHBondContact OE1-OE2 3.39Å |
| 15 | M | 96 | Very high | 92.5 | Very high | 71 Ų | 71 | 40.9 Ų | 40.9 | 35% | 0.35 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -64 | -43.4 | 174.3 | -74.4 | -162 | -54 | 0 | 0 | 111.9 | I11 S12 A17 L18 Q19 V120 | I11-M15 HydrophobicContact CG2-CE 4.45Å; I11-M15 HydrophobicContact CG2-CG 4.24Å; I11-M15 HydrophobicContact CG2-SD 4.4Å; I11-M15 WeakPolarHBondContact O-CB 3.35Å; I11-M15 WeakPolarHBondContact O-CG 3.39Å; I11-M15 PolarHBondContact O-N 3.43Å; S12-M15 PolarHBondContact O-N 3.1Å; M15-A17 VanDerWaalsContact C-N 3.32Å; M15-A17 PolarHBondContact O-N 3.47Å; M15-L18 PolarHBondContact O-N 3.02Å; M15-Q19 WeakPolarHBondContact O-CB 3.36Å; M15-Q19 VanDerWaalsContact O-CG 3.28Å; M15-Q19 WeakPolarHBondContact O-CG 2.99Å; M15-Q19 PolarHBondContact O-N 3.15Å; M15-V120 HydrophobicContact CG-CG1 3.9Å; M15-V120 HydrophobicContact CG-CG2 4.47Å |
| 16 | V | 96.6 | Very high | 92.7 | Very high | 52 Ų | 52 | 45 Ų | 45 | 32% | 0.315 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 176 | 175.6 | 0 | 0 | 0 | 0 | 110.6 | S12 H13 Q19 T20 R147 | S12-V16 VanDerWaalsContact O-CG2 3.31Å; S12-V16 WeakPolarHBondContact O-CG2 3.41Å; S12-V16 PolarHBondContact O-N 3.36Å; S12-V16 VanDerWaalsContact O-N 3.13Å; H13-V16 PolarHBondContact O-N 2.94Å; V16-Q19 PolarHBondContact O-N 3.45Å; V16-T20 WeakPolarHBondContact O-CB 3.36Å; V16-T20 PolarHBondContact O-N 2.95Å; V16-T20 PolarHBondContact O-OG1 3.04Å; V16-R147 HydrophobicContact CG1-CG 4.2Å |
| 17 | A | 95.6 | Very high | 92.4 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.7 | -47.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | H13 Q14 M15 Q19 T20 L21 F146 R147 C150 | H13-A17 WeakPolarHBondContact O-CB 3.48Å; H13-A17 PolarHBondContact O-N 3.17Å; Q14-A17 WeakPolarHBondContact O-CB 3.4Å; Q14-A17 PolarHBondContact O-N 2.9Å; M15-A17 VanDerWaalsContact C-N 3.32Å; M15-A17 PolarHBondContact O-N 3.47Å; A17-Q19 PolarHBondContact O-N 3.28Å; A17-T20 WeakPolarHBondContact O-CB 3.19Å; A17-T20 PolarHBondContact O-N 3.34Å; A17-L21 VanDerWaalsContact O-CG 3.29Å; A17-L21 WeakPolarHBondContact O-CG 3.47Å; A17-L21 PolarHBondContact O-N 2.84Å; A17-F146 HydrophobicContact CB-CD1 3.63Å; A17-F146 HydrophobicContact CB-CE1 3.54Å; A17-R147 HydrophobicContact CB-CB 4.29Å; A17-C150 HydrophobicContact CB-CB 4.17Å |
| 18 | L | 96.4 | Very high | 91.6 | Very high | 17 Ų | 17 | 50.6 Ų | 50.6 | 9% | 0.089 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -59.2 | -47.7 | 177.5 | 179.9 | 61.4 | 0 | 0 | 0 | 111.8 | Q14 M15 T20 L21 Q22 V113 T116 | Q14-L18 WeakPolarHBondContact O-CB 3.32Å; Q14-L18 PolarHBondContact O-N 3.02Å; M15-L18 PolarHBondContact O-N 3.02Å; L18-T20 VanDerWaalsContact C-N 3.27Å; L18-T20 PolarHBondContact O-N 3.08Å; L18-L21 PolarHBondContact O-N 3.31Å; L18-Q22 HydrophobicContact CD1-CG 4.16Å; L18-Q22 HydrophobicContact CG-CG 4.37Å; L18-Q22 WeakPolarHBondContact O-CB 3.3Å; L18-Q22 VanDerWaalsContact O-CG 3.29Å; L18-Q22 WeakPolarHBondContact O-CG 3.29Å; L18-Q22 PolarHBondContact O-N 3.08Å; L18-V113 HydrophobicContact CD1-CG1 4.01Å; L18-V113 WeakPolarHBondContact CD1-O 3.47Å; L18-T116 HydrophobicContact CB-CG2 3.97Å; L18-T116 HydrophobicContact CD1-CG2 4.31Å |
| 19 | Q | 95.9 | Very high | 90.2 | Very high | 122 Ų | 122 | 49.5 Ų | 49.5 | 57% | 0.57 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -58.4 | -42.1 | 176.2 | -74.1 | 171.4 | -4.4 | 0 | 0 | 111.5 | M15 V16 A17 Q22 L23 | M15-Q19 WeakPolarHBondContact O-CB 3.36Å; M15-Q19 VanDerWaalsContact O-CG 3.28Å; M15-Q19 WeakPolarHBondContact O-CG 2.99Å; M15-Q19 PolarHBondContact O-N 3.15Å; V16-Q19 PolarHBondContact O-N 3.45Å; A17-Q19 PolarHBondContact O-N 3.28Å; Q19-Q22 PolarHBondContact O-N 3.06Å; Q19-L23 WeakPolarHBondContact O-CB 3.29Å; Q19-L23 PolarHBondContact O-N 3.32Å |
| 20 | T | 94.3 | Very high | 88.7 | Confident | 29 Ų | 29 | 49.8 Ų | 49.8 | 18% | 0.178 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.2 | -46.2 | 177.2 | -55.2 | 0 | 0 | 0 | 0 | 111 | V16 A17 L18 L23 L24 C150 A154 | V16-T20 WeakPolarHBondContact O-CB 3.36Å; V16-T20 PolarHBondContact O-N 2.95Å; V16-T20 PolarHBondContact O-OG1 3.04Å; A17-T20 WeakPolarHBondContact O-CB 3.19Å; A17-T20 PolarHBondContact O-N 3.34Å; L18-T20 VanDerWaalsContact C-N 3.27Å; L18-T20 PolarHBondContact O-N 3.08Å; T20-L23 PolarHBondContact O-N 3.42Å; T20-L24 VanDerWaalsContact O-CB 3.31Å; T20-L24 WeakPolarHBondContact O-CB 3.43Å; T20-L24 PolarHBondContact O-N 3.22Å; T20-C150 HydrophobicContact CG2-CB 4.46Å; T20-C150 WeakPolarHBondContact CG2-O 3.4Å; T20-A154 HydrophobicContact CG2-CB 3.61Å |
| 21 | L | 93.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -68.1 | -36.3 | 178.8 | -63.2 | 166.9 | 0 | 0 | 0 | 112.6 | A17 L18 L24 Q25 L109 V112 V113 F146 C150 L153 | A17-L21 VanDerWaalsContact O-CG 3.29Å; A17-L21 WeakPolarHBondContact O-CG 3.47Å; A17-L21 PolarHBondContact O-N 2.84Å; L18-L21 PolarHBondContact O-N 3.31Å; L21-L24 WeakPolarHBondContact O-CB 3.28Å; L21-L24 PolarHBondContact O-N 2.96Å; L21-Q25 WeakPolarHBondContact O-CB 3.44Å; L21-Q25 PolarHBondContact O-N 3.41Å; L21-L109 HydrophobicContact CD2-CD1 3.62Å; L21-V112 HydrophobicContact CD1-CG1 3.76Å; L21-V113 HydrophobicContact CB-CG2 3.66Å; L21-F146 HydrophobicContact CD1-CZ 4.11Å; L21-C150 HydrophobicContact CD2-CB 4.08Å; L21-C150 HydrophobicContact CG-CB 4.11Å; L21-L153 HydrophobicContact CD2-CD1 3.98Å |
| 22 | Q | 93 | Very high | 84.4 | Confident | 73 Ų | 73 | 58.6 Ų | 58.6 | 34% | 0.341 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -67.9 | -40.2 | 175.9 | -75.7 | 175.2 | -22 | 0 | 0 | 111.8 | L18 Q19 Q25 Q26 V113 | L18-Q22 HydrophobicContact CD1-CG 4.16Å; L18-Q22 HydrophobicContact CG-CG 4.37Å; L18-Q22 WeakPolarHBondContact O-CB 3.3Å; L18-Q22 VanDerWaalsContact O-CG 3.29Å; L18-Q22 WeakPolarHBondContact O-CG 3.29Å; L18-Q22 PolarHBondContact O-N 3.08Å; Q19-Q22 PolarHBondContact O-N 3.06Å; Q22-Q25 PolarHBondContact O-N 3.38Å; Q22-Q26 VanDerWaalsContact O-CG 3.31Å; Q22-Q26 WeakPolarHBondContact O-CG 3.49Å; Q22-Q26 PolarHBondContact O-N 3.05Å; Q22-Q26 VanDerWaalsContact O-N 3.11Å; Q22-Q26 PolarHBondContact O-NE2 3.37Å; Q22-V113 HydrophobicContact CG-CG1 4.03Å |
| 23 | L | 91.7 | Very high | 81.8 | Confident | 91 Ų | 91 | 58.4 Ų | 58.4 | 48% | 0.476 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -63.7 | -46.5 | 173.5 | -178.5 | 65.5 | 0 | 0 | 0 | 110.2 | Q19 T20 Q25 Q26 E27 | Q19-L23 WeakPolarHBondContact O-CB 3.29Å; Q19-L23 PolarHBondContact O-N 3.32Å; T20-L23 PolarHBondContact O-N 3.42Å; L23-Q25 VanDerWaalsContact C-N 3.3Å; L23-Q25 PolarHBondContact O-N 3.39Å; L23-Q26 WeakPolarHBondContact O-CB 3.31Å; L23-Q26 PolarHBondContact O-N 2.83Å; L23-E27 HydrophobicContact CD1-CG 4.33Å; L23-E27 HydrophobicContact CG-CG 4.34Å; L23-E27 PolarHBondContact O-N 3.5Å |
| 24 | L | 88.8 | Confident | 79.3 | Confident | 2 Ų | 2 | 62.4 Ų | 62.4 | 1% | 0.01 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -55.4 | -45.2 | 175.9 | -177.9 | 60.3 | 0 | 0 | 0 | 112 | T20 L21 Q26 E27 W28 L109 L153 F162 | T20-L24 VanDerWaalsContact O-CB 3.31Å; T20-L24 WeakPolarHBondContact O-CB 3.43Å; T20-L24 PolarHBondContact O-N 3.22Å; L21-L24 WeakPolarHBondContact O-CB 3.28Å; L21-L24 PolarHBondContact O-N 2.96Å; L24-Q26 VanDerWaalsContact C-N 3.29Å; L24-Q26 PolarHBondContact O-N 3.46Å; L24-E27 PolarHBondContact O-N 3.38Å; L24-W28 HydrophobicContact CD1-CZ2 4.44Å; L24-W28 PolarHBondContact O-N 2.95Å; L24-W28 VanDerWaalsContact O-N 3.1Å; L24-L109 HydrophobicContact CD2-CD2 3.86Å; L24-L109 HydrophobicContact CG-CD2 4Å; L24-L153 HydrophobicContact CD2-CB 3.83Å; L24-F162 HydrophobicContact CD2-CE2 4.13Å |
| 25 | Q | 86.5 | Confident | 76.8 | Confident | 60 Ų | 60 | 68 Ų | 68 | 28% | 0.28 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.2 | -34.8 | 176.6 | -171.8 | 177.2 | 31.9 | 0 | 0 | 112.8 | L21 Q22 L23 W30 | L21-Q25 WeakPolarHBondContact O-CB 3.44Å; L21-Q25 PolarHBondContact O-N 3.41Å; Q22-Q25 PolarHBondContact O-N 3.38Å; L23-Q25 VanDerWaalsContact C-N 3.3Å; L23-Q25 PolarHBondContact O-N 3.39Å; Q25-W30 HydrophobicContact CG-CE3 4.05Å |
| 26 | Q | 84.1 | Confident | 73.9 | Confident | 140 Ų | 140 | 69 Ų | 69 | 65% | 0.654 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -74.3 | -46.5 | 176.8 | -71.7 | 171.2 | 55 | 0 | 0 | 112.2 | Q22 L23 L24 W28 G29 | Q22-Q26 VanDerWaalsContact O-CG 3.31Å; Q22-Q26 WeakPolarHBondContact O-CG 3.49Å; Q22-Q26 PolarHBondContact O-N 3.05Å; Q22-Q26 VanDerWaalsContact O-N 3.11Å; Q22-Q26 PolarHBondContact O-NE2 3.37Å; L23-Q26 WeakPolarHBondContact O-CB 3.31Å; L23-Q26 PolarHBondContact O-N 2.83Å; L24-Q26 VanDerWaalsContact C-N 3.29Å; L24-Q26 PolarHBondContact O-N 3.46Å; Q26-W28 VanDerWaalsContact C-N 3.27Å; Q26-W28 PolarHBondContact O-N 2.92Å; Q26-G29 WeakPolarHBondContact O-CA 3.38Å; Q26-G29 PolarHBondContact O-N 3.39Å |
| 27 | E | 79.8 | Confident | 71.8 | Confident | 128 Ų | 128 | 72.8 Ų | 72.8 | 60% | 0.598 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -61.7 | -36.9 | -179.3 | -75.5 | -176.5 | 169.8 | 0 | 0 | 112 | L23 L24 G29 | L23-E27 HydrophobicContact CD1-CG 4.33Å; L23-E27 HydrophobicContact CG-CG 4.34Å; L23-E27 PolarHBondContact O-N 3.5Å; L24-E27 PolarHBondContact O-N 3.38Å; E27-G29 PolarHBondContact O-N 3.28Å; E27-G29 VanDerWaalsContact O-N 3.12Å |
| 28 | W | 72.6 | Confident | 69.1 | Low | 48 Ų | 48 | 76.2 Ų | 76.2 | 18% | 0.182 | 48% | 0.48 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.2 | 0.5 | 175.9 | -72.7 | 47.6 | 0 | 0 | 0 | 113.1 | L24 Q26 W30 I157 E158 F162 | L24-W28 HydrophobicContact CD1-CZ2 4.44Å; L24-W28 PolarHBondContact O-N 2.95Å; L24-W28 VanDerWaalsContact O-N 3.1Å; Q26-W28 VanDerWaalsContact C-N 3.27Å; Q26-W28 PolarHBondContact O-N 2.92Å; W28-W30 HydrophobicContact CB-CD2 3.83Å; W28-W30 HydrophobicContact CB-CG 3.98Å; W28-W30 HydrophobicContact CB-CZ2 4.11Å; W28-W30 AromaticContact CD2-CE2 4Å; W28-W30 HydrophobicContact CD2-CH2 4.4Å; W28-W30 AromaticContact CD2-CZ2 3.69Å; W28-W30 HydrophobicContact CD2-CZ2 3.69Å; W28-W30 AromaticContact CE3-CE2 3.51Å; W28-W30 HydrophobicContact CE3-CH2 4.04Å; W28-W30 AromaticContact CE3-CZ2 3.06Å; W28-W30 HydrophobicContact CE3-CZ2 3.06Å; W28-W30 AromaticContact CE3-NE1 3.65Å; W28-W30 HydrophobicContact CG-CZ2 4.18Å; W28-W30 HydrophobicContact CZ3-CH2 4.37Å; W28-W30 AromaticContact CZ3-CZ2 3.56Å; W28-W30 HydrophobicContact CZ3-CZ2 3.56Å; W28-W30 PolarHBondContact O-N 2.96Å; W28-I157 VanDerWaalsContact CH2-O 3.31Å; W28-I157 WeakPolarHBondContact CH2-O 3.46Å; W28-I157 WeakPolarHBondContact CZ2-O 3.03Å; W28-E158 HydrophobicContact CH2-CB 4.48Å; W28-E158 HydrophobicContact CH2-CG 3.67Å; W28-E158 HydrophobicContact CZ3-CG 3.62Å; W28-F162 HydrophobicContact CH2-CD1 4.05Å; W28-F162 AromaticContact CH2-CD2 3.66Å; W28-F162 HydrophobicContact CH2-CD2 3.66Å; W28-F162 AromaticContact CH2-CE1 3.87Å; W28-F162 HydrophobicContact CH2-CE1 3.87Å; W28-F162 AromaticContact CH2-CE2 3.46Å; W28-F162 HydrophobicContact CH2-CE2 3.46Å; W28-F162 VanDerWaalsContact CH2-CE2 3.46Å; W28-F162 AromaticContact CH2-CG 3.95Å; W28-F162 HydrophobicContact CH2-CG 3.95Å; W28-F162 AromaticContact CH2-CZ 3.58Å; W28-F162 HydrophobicContact CH2-CZ 3.58Å; W28-F162 AromaticContact CZ2-CD2 3.61Å; W28-F162 HydrophobicContact CZ2-CD2 3.61Å; W28-F162 AromaticContact CZ2-CE2 3.28Å; W28-F162 HydrophobicContact CZ2-CE2 3.28Å; W28-F162 HydrophobicContact CZ2-CG 4.35Å; W28-F162 AromaticContact CZ2-CZ 3.8Å; W28-F162 HydrophobicContact CZ2-CZ 3.8Å; W28-F162 HydrophobicContact CZ3-CE1 4.42Å; W28-F162 HydrophobicContact CZ3-CZ 4.26Å |
| 29 | G | 62.7 | Low | 66.1 | Low | 59 Ų | 59 | 81 Ų | 81 | 61% | 0.608 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.5 | 31.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q26 E27 G31 | Q26-G29 WeakPolarHBondContact O-CA 3.38Å; Q26-G29 PolarHBondContact O-N 3.39Å; E27-G29 PolarHBondContact O-N 3.28Å; E27-G29 VanDerWaalsContact O-N 3.12Å; G29-G31 PolarHBondContact O-N 3.37Å |
| 30 | W | 62.4 | Low | 63.5 | Low | 35 Ų | 35 | 80.9 Ų | 80.9 | 13% | 0.133 | 53% | 0.525 | C | S | . | . | trans | -80.8 | 4.2 | -177.1 | -67.6 | -9.6 | 0 | 0 | 0 | 114.2 | Q25 W28 D32 R106 L109 F162 | Q25-W30 HydrophobicContact CG-CE3 4.05Å; W28-W30 HydrophobicContact CB-CD2 3.83Å; W28-W30 HydrophobicContact CB-CG 3.98Å; W28-W30 HydrophobicContact CB-CZ2 4.11Å; W28-W30 AromaticContact CD2-CE2 4Å; W28-W30 HydrophobicContact CD2-CH2 4.4Å; W28-W30 AromaticContact CD2-CZ2 3.69Å; W28-W30 HydrophobicContact CD2-CZ2 3.69Å; W28-W30 AromaticContact CE3-CE2 3.51Å; W28-W30 HydrophobicContact CE3-CH2 4.04Å; W28-W30 AromaticContact CE3-CZ2 3.06Å; W28-W30 HydrophobicContact CE3-CZ2 3.06Å; W28-W30 AromaticContact CE3-NE1 3.65Å; W28-W30 HydrophobicContact CG-CZ2 4.18Å; W28-W30 HydrophobicContact CZ3-CH2 4.37Å; W28-W30 AromaticContact CZ3-CZ2 3.56Å; W28-W30 HydrophobicContact CZ3-CZ2 3.56Å; W28-W30 PolarHBondContact O-N 2.96Å; W30-D32 PolarHBondContact O-N 3.18Å; W30-D32 VanDerWaalsContact O-N 3.1Å; W30-R106 HydrophobicContact CB-CG 4.3Å; W30-R106 HydrophobicContact CD2-CB 4.36Å; W30-R106 HydrophobicContact CD2-CG 3.74Å; W30-R106 HydrophobicContact CE3-CB 4.41Å; W30-R106 HydrophobicContact CE3-CG 3.76Å; W30-R106 HydrophobicContact CG-CG 3.99Å; W30-R106 HydrophobicContact CZ2-CB 4.44Å; W30-R106 HydrophobicContact CZ3-CB 4.46Å; W30-R106 HydrophobicContact CZ3-CG 4.24Å; W30-L109 HydrophobicContact CE3-CD2 4.17Å; W30-L109 HydrophobicContact CH2-CB 3.92Å; W30-L109 HydrophobicContact CH2-CD2 3.4Å; W30-L109 VanDerWaalsContact CH2-CD2 3.4Å; W30-L109 HydrophobicContact CH2-CG 4.18Å; W30-L109 HydrophobicContact CZ3-CB 3.62Å; W30-L109 HydrophobicContact CZ3-CD2 3.11Å; W30-L109 HydrophobicContact CZ3-CG 3.69Å; W30-F162 HydrophobicContact CH2-CZ 4.41Å | ||
| 31 | G | 45.8 | Very low | 61.1 | Low | 68 Ų | 68 | 90.9 Ų | 90.9 | 70% | 0.701 | 56% | 0.559 | S | S | * | * | trans | -69.3 | 100.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | G29 G33 | G29-G31 PolarHBondContact O-N 3.37Å; G31-G33 PolarHBondContact O-N 3.29Å | ||
| 32 | D | 50.1 | Low | 58.4 | Low | 138 Ų | 138 | 95.8 Ų | 95.8 | 74% | 0.738 | 59% | 0.594 | S | S | * | * | trans | -71 | 77.5 | 149.8 | -86.5 | -52.6 | 0 | 0 | 0 | 107.8 | W30 R106 | W30-D32 PolarHBondContact O-N 3.18Å; W30-D32 VanDerWaalsContact O-N 3.1Å; D32-R106 IonicContact OD2-CZ 3.8Å; D32-R106 IonicContact OD2-NH1 2.76Å; D32-R106 PolarHBondContact OD2-NH1 2.82Å; D32-R106 VanDerWaalsContact OD2-NH1 3.13Å; D32-R106 IonicContact OD2-NH2 3.45Å; D32-R106 PolarHBondContact OD2-NH2 3.22Å | ||
| 33 | G | 40.7 | Very low | 56.3 | Low | 49 Ų | 49 | 97.9 Ų | 97.9 | 51% | 0.505 | 61% | 0.613 | S | S | . | * | trans | -90.2 | 141.3 | 154.9 | 0 | 0 | 0 | 0 | 0 | 108 | G31 S35 | G31-G33 PolarHBondContact O-N 3.29Å; G33-S35 PolarHBondContact O-N 2.99Å; G33-S35 VanDerWaalsContact O-N 3.07Å | ||
| 34 | P | 42.8 | Very low | 54 | Low | 129 Ų | 129 | 99.2 Ų | 99.2 | 84% | 0.838 | 62% | 0.621 | S | S | * | * | trans | -54.4 | 124.8 | 175.3 | 24.6 | -31.5 | 0 | 0 | 0 | 107.3 | A36 | P34-A36 PolarHBondContact O-N 3.22Š| ||
| 35 | S | 44.5 | Very low | 51.7 | Low | 117 Ų | 117 | 108.3 Ų | 108.3 | 82% | 0.818 | 66% | 0.663 | S | S | * | * | trans | -38.5 | 116.6 | 172.1 | -63.7 | 0 | 0 | 0 | 0 | 108.6 | G33 P37 | G33-S35 PolarHBondContact O-N 2.99Å; G33-S35 VanDerWaalsContact O-N 3.07Å; S35-P37 WeakPolarHBondContact O-CD 3.44Å; S35-P37 VanDerWaalsContact O-N 3.09Å | ||
| 36 | A | 35.5 | Very low | 49.9 | Very low | 93 Ų | 93 | 111.1 Ų | 111.1 | 77% | 0.769 | 68% | 0.684 | S | S | * | * | trans | -48.3 | 122.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | P34 G38 | P34-A36 PolarHBondContact O-N 3.22Å; A36-G38 PolarHBondContact O-N 3.47Å | ||
| 37 | P | 51 | Low | 47.7 | Very low | 130 Ų | 130 | 110.4 Ų | 110.4 | 84% | 0.844 | 69% | 0.692 | S | S | * | * | trans | -76.2 | 125.9 | 175.1 | 29.8 | -28.8 | 0 | 0 | 0 | 107.5 | S35 | S35-P37 WeakPolarHBondContact O-CD 3.44Å; S35-P37 VanDerWaalsContact O-N 3.09Å | ||
| 38 | G | 40.2 | Very low | 45.6 | Very low | 73 Ų | 73 | 111.8 Ų | 111.8 | 75% | 0.753 | 70% | 0.701 | S | S | * | * | trans | 99.6 | 89.5 | 160.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | A36 | A36-G38 PolarHBondContact O-N 3.47Š| ||
| 39 | S | 32.3 | Very low | 43.7 | Very low | 116 Ų | 116 | 113.8 Ų | 113.8 | 81% | 0.811 | 73% | 0.728 | S | S | * | * | trans | -104.8 | 114.9 | 131.3 | -155.4 | 0 | 0 | 0 | 0 | 106.3 | R41 | S39-R41 PolarHBondContact O-N 3.45Å; S39-R41 VanDerWaalsContact O-N 3.11Å | ||
| 40 | P | 41.4 | Very low | 42.3 | Very low | 120 Ų | 120 | 120.1 Ų | 120.1 | 78% | 0.779 | 74% | 0.742 | S | S | * | * | trans | -68.1 | 113.2 | -177.9 | 25.8 | -29 | 0 | 0 | 0 | 108.3 | S42 | P40-S42 PolarHBondContact O-N 2.84Å; P40-S42 VanDerWaalsContact O-N 3.11Å | ||
| 41 | R | 44.2 | Very low | 40.9 | Very low | 240 Ų | 240 | 122.4 Ų | 122.4 | 91% | 0.906 | 77% | 0.768 | S | S | * | * | trans | -60.1 | 115.4 | 161.1 | -89.2 | -179.6 | 173.3 | 174.4 | -2.5 | 107.1 | S39 | S39-R41 PolarHBondContact O-N 3.45Å; S39-R41 VanDerWaalsContact O-N 3.11Å | ||
| 42 | S | 37.3 | Very low | 40.2 | Very low | 103 Ų | 103 | 128.4 Ų | 128.4 | 72% | 0.72 | 77% | 0.77 | S | S | * | * | trans | -46.9 | 127.7 | 168.9 | -155.6 | 0 | 0 | 0 | 0 | 110.1 | P40 D44 | P40-S42 PolarHBondContact O-N 2.84Å; P40-S42 VanDerWaalsContact O-N 3.11Å; S42-D44 PolarHBondContact O-N 2.84Å | ||
| 43 | P | 48.9 | Very low | 39.3 | Very low | 116 Ų | 116 | 131.5 Ų | 131.5 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | -95.5 | 92.3 | 175.6 | 34.4 | -25.7 | 0 | 0 | 0 | 109 | ||||
| 44 | D | 43.6 | Very low | 38.8 | Very low | 120 Ų | 120 | 135.1 Ų | 135.1 | 64% | 0.642 | 79% | 0.788 | S | S | * | * | trans | -143.8 | 94.4 | 163.1 | -87.3 | -63 | 0 | 0 | 0 | 108.2 | S42 | S42-D44 PolarHBondContact O-N 2.84Š| ||
| 45 | H | 40.4 | Very low | 38.3 | Very low | 193 Ų | 193 | 132.1 Ų | 132.1 | 89% | 0.894 | 78% | 0.781 | S | S | * | * | trans | -159.7 | 102.9 | 139.9 | -77 | -49.1 | 0 | 0 | 0 | 107.8 | P47 | H45-P47 WeakPolarHBondContact O-CD 3.43Š| ||
| 46 | V | 47.3 | Very low | 37.7 | Very low | 119 Ų | 119 | 135.7 Ų | 135.7 | 72% | 0.721 | 79% | 0.785 | S | S | * | * | trans | -69.3 | 136.8 | 170.5 | -155.4 | 0 | 0 | 0 | 0 | 108.8 | I48 | V46-I48 HydrophobicContact CG1-CG1 4.01Š| ||
| 47 | P | 37.5 | Very low | 37.5 | Very low | 125 Ų | 125 | 138.9 Ų | 138.9 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -118.5 | 104.3 | 145.4 | 9 | 11.7 | 0 | 0 | 0 | 109.2 | H45 A49 | H45-P47 WeakPolarHBondContact O-CD 3.43Å; P47-A49 PolarHBondContact O-N 3.15Å | ||
| 48 | I | 36 | Very low | 36.8 | Very low | 157 Ų | 157 | 143.2 Ų | 143.2 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | trans | -69.5 | 120.2 | 156.3 | -68.1 | 167.2 | 0 | 0 | 0 | 106.8 | V46 | V46-I48 HydrophobicContact CG1-CG1 4.01Š| ||
| 49 | A | 33.9 | Very low | 36.3 | Very low | 90 Ų | 90 | 145.2 Ų | 145.2 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | 171.3 | 112 | 121.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | P47 | P47-A49 PolarHBondContact O-N 3.15Š| |||
| 50 | Q | 33 | Very low | 36.3 | Very low | 191 Ų | 191 | 150.3 Ų | 150.3 | 89% | 0.893 | 78% | 0.784 | S | S | * | * | trans | -76.6 | 157.4 | 160.1 | -76.7 | -174.4 | -32.9 | 0 | 0 | 110.9 | ||||
| 51 | A | 32.9 | Very low | 35.9 | Very low | 83 Ų | 83 | 155.4 Ų | 155.4 | 69% | 0.686 | 79% | 0.788 | S | S | * | * | trans | 110.2 | 104.2 | 133.5 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 52 | R | 31 | Very low | 35.3 | Very low | 195 Ų | 195 | 147.2 Ų | 147.2 | 74% | 0.736 | 78% | 0.778 | S | S | * | * | 76.7 | 118.8 | 118.8 | -69.9 | -170.7 | 173.3 | -142.2 | -3.5 | 120.1 | |||||
| 53 | R | 32 | Very low | 35.2 | Very low | 203 Ų | 203 | 151 Ų | 151 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | trans | 65.2 | 122 | 131.1 | -64.4 | -167 | -71.4 | -157.1 | 2.7 | 117.6 | ||||
| 54 | S | 30.3 | Very low | 34.3 | Very low | 124 Ų | 124 | 149 Ų | 149 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | 156.4 | 132.9 | 98.4 | -169.1 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 55 | G | 30.4 | Very low | 34 | Very low | 66 Ų | 66 | 155.5 Ų | 155.5 | 68% | 0.68 | 81% | 0.805 | S | S | * | * | trans | 96.7 | 112.2 | 135.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 56 | Q | 33.2 | Very low | 33.5 | Very low | 193 Ų | 193 | 149.8 Ų | 149.8 | 90% | 0.902 | 80% | 0.798 | S | S | * | * | 91.3 | 99.7 | 126.1 | -134.7 | 164.4 | 80.7 | 0 | 0 | 117.7 | |||||
| 57 | M | 30.6 | Very low | 32.9 | Very low | 159 Ų | 159 | 149.7 Ų | 149.7 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | 69.8 | 107.8 | 86.9 | -114 | -77.8 | 166.5 | 0 | 0 | 115.4 | |||||
| 58 | R | 37.1 | Very low | 32.6 | Very low | 221 Ų | 221 | 150.2 Ų | 150.2 | 83% | 0.834 | 80% | 0.804 | S | S | * | * | 177.2 | 115.8 | 129.9 | -100.1 | 173.9 | -162.3 | 179.4 | 6.5 | 110.4 | |||||
| 59 | T | 29.2 | Very low | 32.3 | Very low | 116 Ų | 116 | 146.3 Ų | 146.3 | 71% | 0.712 | 80% | 0.803 | S | S | * | * | 57.5 | 130.6 | 105 | 65.5 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 60 | R | 33 | Very low | 32.3 | Very low | 222 Ų | 222 | 147.3 Ų | 147.3 | 84% | 0.838 | 81% | 0.81 | S | S | * | * | cis | 178.5 | 132.1 | 36.7 | -173.2 | 170.3 | -162.4 | -171.6 | 4.6 | 108.5 | ||||
| 61 | R | 31.8 | Very low | 32.3 | Very low | 228 Ų | 228 | 150.4 Ų | 150.4 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | 45.7 | 131.6 | 131 | -128.2 | 178.4 | -162.8 | -146.7 | 4.6 | 121.9 | ||||
| 62 | G | 32.1 | Very low | 32.1 | Very low | 67 Ų | 67 | 150 Ų | 150 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | trans | 135.6 | 98.3 | 146.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 63 | L | 35.3 | Very low | 32.2 | Very low | 182 Ų | 182 | 146.6 Ų | 146.6 | 95% | 0.953 | 82% | 0.824 | S | S | * | * | 55.4 | 122.1 | 84.2 | -86.2 | 138.9 | 0 | 0 | 0 | 115.7 | |||||
| 64 | G | 31 | Very low | 32.9 | Very low | 74 Ų | 74 | 142.4 Ų | 142.4 | 76% | 0.763 | 82% | 0.824 | S | S | * | * | trans | 122.7 | 79.9 | 138.5 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 65 | R | 36.2 | Very low | 33 | Very low | 258 Ų | 258 | 146.1 Ų | 146.1 | 97% | 0.974 | 83% | 0.827 | S | S | * | * | trans | -9.3 | 130.8 | 136.3 | 177.8 | 168.7 | 148.1 | -129.5 | 0.5 | 117.2 | ||||
| 66 | G | 29.9 | Very low | 33.4 | Very low | 72 Ų | 72 | 148.1 Ų | 148.1 | 74% | 0.742 | 84% | 0.837 | S | S | * | * | trans | 164.6 | 130.3 | 157.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 67 | S | 34 | Very low | 33.4 | Very low | 117 Ų | 117 | 142.5 Ų | 142.5 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | 84.6 | 108.2 | 159.7 | -74.1 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 68 | T | 32.1 | Very low | 33.4 | Very low | 137 Ų | 137 | 143.7 Ų | 143.7 | 84% | 0.84 | 84% | 0.835 | S | S | * | * | 83.9 | 106.5 | 74.1 | -37.3 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 69 | G | 28.9 | Very low | 33.7 | Very low | 75 Ų | 75 | 141 Ų | 141 | 77% | 0.773 | 84% | 0.836 | S | S | * | * | trans | 74.1 | 117.6 | 141.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 70 | A | 33.9 | Very low | 34.2 | Very low | 110 Ų | 110 | 147.7 Ų | 147.7 | 91% | 0.909 | 85% | 0.848 | S | S | * | * | -180 | 139.5 | 121.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | |||||
| 71 | R | 34.8 | Very low | 34.1 | Very low | 256 Ų | 256 | 140.4 Ų | 140.4 | 97% | 0.966 | 84% | 0.843 | S | S | * | * | trans | -80.4 | 142.8 | -179 | -170.7 | -177.2 | -168.4 | -162 | 3.2 | 109.7 | ||||
| 72 | G | 28.5 | Very low | 34.5 | Very low | 76 Ų | 76 | 134.1 Ų | 134.1 | 78% | 0.784 | 84% | 0.839 | S | S | * | * | trans | 170.4 | 103.5 | 168.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 73 | S | 32.5 | Very low | 34.9 | Very low | 122 Ų | 122 | 140.3 Ų | 140.3 | 85% | 0.853 | 85% | 0.85 | S | S | * | * | trans | -119.4 | 174.7 | 151.5 | -67.9 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 74 | P | 47.5 | Very low | 35.6 | Very low | 116 Ų | 116 | 135.8 Ų | 135.8 | 75% | 0.753 | 85% | 0.848 | S | S | * | * | cis | -117.3 | 177.3 | -27.4 | 35 | -20.2 | 0 | 0 | 0 | 109.8 | ||||
| 75 | E | 31.7 | Very low | 35.9 | Very low | 201 Ų | 201 | 135.7 Ų | 135.7 | 94% | 0.939 | 85% | 0.846 | S | S | * | * | trans | -152.9 | 147.4 | 148 | -78.6 | -135.1 | 102.8 | 0 | 0 | 111.4 | ||||
| 76 | A | 38.5 | Very low | 36.3 | Very low | 108 Ų | 108 | 127.7 Ų | 127.7 | 89% | 0.893 | 84% | 0.836 | S | S | * | * | trans | -76.1 | 156.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 77 | G | 33.8 | Very low | 37.1 | Very low | 75 Ų | 75 | 132.4 Ų | 132.4 | 77% | 0.773 | 84% | 0.838 | S | S | * | * | trans | -150.8 | 116.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 78 | E | 30.8 | Very low | 37.7 | Very low | 184 Ų | 184 | 134.2 Ų | 134.2 | 86% | 0.86 | 84% | 0.838 | S | S | * | * | trans | -58.9 | 144.8 | -171.7 | -74.9 | 146.3 | 101.6 | 0 | 0 | 117.4 | ||||
| 79 | L | 43.2 | Very low | 38.3 | Very low | 164 Ų | 164 | 133.5 Ų | 133.5 | 86% | 0.859 | 83% | 0.829 | S | S | * | * | trans | 14.7 | 116.5 | 133.4 | -59.6 | 165.5 | 0 | 0 | 0 | 119.2 | ||||
| 80 | R | 37.9 | Very low | 39 | Very low | 257 Ų | 257 | 135.6 Ų | 135.6 | 97% | 0.97 | 83% | 0.828 | S | S | * | * | trans | -175.3 | 143.1 | 130.7 | -121.4 | 175 | -166.8 | -101.2 | -2.2 | 114.7 | ||||
| 81 | G | 32.9 | Very low | 39.3 | Very low | 70 Ų | 70 | 139.7 Ų | 139.7 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 104.3 | 93.3 | 153.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 82 | A | 39.2 | Very low | 39.9 | Very low | 96 Ų | 96 | 132.7 Ų | 132.7 | 79% | 0.793 | 81% | 0.814 | S | S | * | * | 88.6 | 134.4 | 74.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 83 | E | 40.8 | Very low | 41 | Very low | 196 Ų | 196 | 140 Ų | 140 | 92% | 0.916 | 82% | 0.818 | S | S | * | * | trans | 93 | 120.6 | 157.4 | -51.1 | -149.1 | 97 | 0 | 0 | 118.2 | ||||
| 84 | G | 49.1 | Very low | 41.7 | Very low | 88 Ų | 88 | 139.8 Ų | 139.8 | 91% | 0.907 | 81% | 0.807 | S | S | * | * | trans | -68 | 131.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 85 | G | 38.7 | Very low | 42.1 | Very low | 71 Ų | 71 | 145.7 Ų | 145.7 | 73% | 0.732 | 81% | 0.814 | S | S | * | * | trans | -112.8 | 124.2 | 156.9 | 0 | 0 | 0 | 0 | 0 | 106.6 | E87 | G85-E87 PolarHBondContact O-N 2.78Š| ||
| 86 | A | 44.5 | Very low | 43.2 | Very low | 90 Ų | 90 | 137 Ų | 137 | 74% | 0.744 | 78% | 0.778 | S | S | * | * | trans | -43.6 | 134.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111 | L88 | A86-L88 PolarHBondContact O-N 3.49Š| ||
| 87 | E | 46 | Very low | 44.1 | Very low | 172 Ų | 172 | 137.5 Ų | 137.5 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -56.5 | 83.6 | 158.4 | -83.5 | -173.3 | 88.5 | 0 | 0 | 108.4 | G85 L89 | G85-E87 PolarHBondContact O-N 2.78Å; E87-L89 PolarHBondContact O-N 3.48Å | ||
| 88 | L | 47 | Very low | 45.6 | Very low | 154 Ų | 154 | 138.3 Ų | 138.3 | 81% | 0.806 | 77% | 0.766 | S | S | * | * | trans | -79.8 | 87.1 | 148.4 | -69.2 | 179.7 | 0 | 0 | 0 | 104.5 | A86 P90 | A86-L88 PolarHBondContact O-N 3.49Å; L88-P90 VanDerWaalsContact O-CD 3.28Å; L88-P90 WeakPolarHBondContact O-CD 3.17Å | ||
| 89 | L | 44.8 | Very low | 47.9 | Very low | 123 Ų | 123 | 133.4 Ų | 133.4 | 64% | 0.644 | 75% | 0.748 | S | S | * | * | trans | -39.8 | 118.3 | 162.5 | -67 | 173.1 | 0 | 0 | 0 | 106.9 | E87 F91 | E87-L89 PolarHBondContact O-N 3.48Å; L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.08Å | ||
| 90 | P | 42.9 | Very low | 49.9 | Very low | 118 Ų | 118 | 132.4 Ų | 132.4 | 77% | 0.766 | 74% | 0.743 | S | S | * | * | trans | -60.6 | 108.9 | 165.7 | -14.6 | 27.9 | 0 | 0 | 0 | 104.8 | L88 P92 | L88-P90 VanDerWaalsContact O-CD 3.28Å; L88-P90 WeakPolarHBondContact O-CD 3.17Å; P90-P92 VanDerWaalsContact O-CD 3.27Å; P90-P92 WeakPolarHBondContact O-CD 3.3Å | ||
| 91 | F | 41.3 | Very low | 52 | Low | 196 Ų | 196 | 123.1 Ų | 123.1 | 86% | 0.86 | 72% | 0.721 | S | S | * | * | trans | -49 | 118.5 | 155.5 | -78.7 | -88.1 | 0 | 0 | 0 | 104.7 | L89 R93 | L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.08Å; F91-R93 PolarHBondContact O-N 3.12Å | ||
| 92 | P | 46.2 | Very low | 54.2 | Low | 109 Ų | 109 | 122.6 Ų | 122.6 | 71% | 0.708 | 70% | 0.697 | S | S | * | * | trans | -70.8 | 88.4 | 176.7 | 29.2 | -30 | 0 | 0 | 0 | 105 | P90 D94 | P90-P92 VanDerWaalsContact O-CD 3.27Å; P90-P92 WeakPolarHBondContact O-CD 3.3Å; P92-D94 HydrophobicContact CB-CB 4.38Å; P92-D94 PolarHBondContact O-N 3.04Å | ||
| 93 | R | 52.6 | Low | 56.4 | Low | 230 Ų | 230 | 122.9 Ų | 122.9 | 87% | 0.868 | 68% | 0.683 | S | S | * | * | trans | -74.6 | 63.9 | 159.5 | -152.7 | 174.4 | -165 | -174.6 | 4.7 | 105.7 | F91 R95 | F91-R93 PolarHBondContact O-N 3.12Å; R93-R95 PolarHBondContact O-N 3.31Å | ||
| 94 | D | 45.6 | Very low | 58.6 | Low | 118 Ų | 118 | 116.1 Ų | 116.1 | 63% | 0.631 | 66% | 0.661 | S | S | * | * | trans | -74 | 80.2 | 180 | -151.8 | -56.9 | 0 | 0 | 0 | 106.4 | P92 G96 | P92-D94 HydrophobicContact CB-CB 4.38Å; P92-D94 PolarHBondContact O-N 3.04Å; D94-G96 PolarHBondContact O-N 3.43Å; D94-G96 WeakPolarHBondContact OD1-CA 3.39Å; D94-G96 PolarHBondContact OD1-N 2.96Å; D94-G96 VanDerWaalsContact OD1-N 3.09Å | ||
| 95 | R | 57.3 | Low | 60.3 | Low | 239 Ų | 239 | 113.4 Ų | 113.4 | 90% | 0.902 | 63% | 0.625 | S | S | * | * | trans | -72.2 | 49.4 | 159.8 | -107.1 | -171.6 | -167.1 | -151.7 | 2.6 | 108.8 | R93 | R93-R95 PolarHBondContact O-N 3.31Š| ||
| 96 | G | 54.7 | Low | 62.6 | Low | 18 Ų | 18 | 114.4 Ų | 114.4 | 19% | 0.186 | 61% | 0.607 | C | S | . | * | trans | -62.7 | 154.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | D94 C98 | D94-G96 PolarHBondContact O-N 3.43Å; D94-G96 WeakPolarHBondContact OD1-CA 3.39Å; D94-G96 PolarHBondContact OD1-N 2.96Å; D94-G96 VanDerWaalsContact OD1-N 3.09Å; G96-C98 PolarHBondContact O-N 3.29Å | ||
| 97 | P | 56.7 | Low | 64.6 | Low | 120 Ų | 120 | 112.7 Ų | 112.7 | 78% | 0.779 | 59% | 0.59 | S | S | * | * | trans | -54.4 | 128.9 | 178.4 | 17.8 | -27.2 | 0 | 0 | 0 | 110.6 | T99 | P97-T99 PolarHBondContact O-N 3Š| ||
| 98 | C | 65.3 | Low | 66.7 | Low | 92 Ų | 92 | 104.9 Ų | 104.9 | 62% | 0.622 | 56% | 0.555 | S | S | * | * | trans | -60.4 | 112.3 | 175.4 | -70.2 | 0 | 0 | 0 | 0 | 109.2 | G96 M103 | G96-C98 PolarHBondContact O-N 3.29Å; C98-M103 HydrophobicContact CB-CG 4.23Å | ||
| 99 | T | 80.3 | Confident | 68.8 | Low | 80 Ų | 80 | 97.6 Ų | 97.6 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | trans | -71.3 | 155.3 | 172.8 | 63.7 | 0 | 0 | 0 | 0 | 109.8 | P97 A101 R102 M103 | P97-T99 PolarHBondContact O-N 3Å; T99-A101 PolarHBondContact O-N 3.02Å; T99-R102 PolarHBondContact O-N 3.44Å; T99-R102 PolarHBondContact OG1-N 3.14Å; T99-M103 PolarHBondContact O-N 3.14Å | ||
| 100 | L | 83.5 | Confident | 71 | Confident | 144 Ų | 144 | 92.8 Ų | 92.8 | 75% | 0.754 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -53.6 | -38 | 174 | -178.9 | 64.7 | 0 | 0 | 0 | 111.4 | M103 A104 | L100-M103 PolarHBondContact O-N 3.48Å; L100-A104 WeakPolarHBondContact O-CB 3.32Å; L100-A104 PolarHBondContact O-N 3.33Å |
| 101 | A | 82.1 | Confident | 73.4 | Confident | 62 Ų | 62 | 91.4 Ų | 91.4 | 51% | 0.512 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.9 | -45 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | T99 M103 A104 M105 | T99-A101 PolarHBondContact O-N 3.02Å; A101-M103 VanDerWaalsContact C-N 3.35Å; A101-M103 PolarHBondContact O-N 2.84Å; A101-A104 PolarHBondContact O-N 2.94Å; A101-M105 WeakPolarHBondContact O-CG 3.49Å; A101-M105 PolarHBondContact O-N 2.78Å |
| 102 | R | 80.7 | Confident | 75.9 | Confident | 58 Ų | 58 | 82.1 Ų | 82.1 | 22% | 0.219 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 175.9 | -171.2 | 177.7 | -84.1 | 149.3 | -3.2 | 112.1 | T99 M105 R106 E158 | T99-R102 PolarHBondContact O-N 3.44Å; T99-R102 PolarHBondContact OG1-N 3.14Å; R102-M105 HydrophobicContact CB-CE 4.29Å; R102-M105 HydrophobicContact CG-CE 4.47Å; R102-M105 PolarHBondContact O-N 3.48Å; R102-R106 WeakPolarHBondContact O-CB 3.49Å; R102-R106 PolarHBondContact O-N 2.94Å; R102-E158 IonicContact CZ-OE1 3.13Å; R102-E158 VanDerWaalsContact CZ-OE1 3.23Å; R102-E158 IonicContact CZ-OE2 2.82Å; R102-E158 IonicContact NE-OE1 3.23Å; R102-E158 PolarHBondContact NE-OE1 3.04Å; R102-E158 IonicContact NH2-OE1 2.79Å; R102-E158 PolarHBondContact NH2-OE1 3.33Å; R102-E158 IonicContact NH2-OE2 2.94Å; R102-E158 PolarHBondContact NH2-OE2 3.34Å |
| 103 | M | 84.1 | Confident | 78.2 | Confident | 102 Ų | 102 | 77.2 Ų | 77.2 | 50% | 0.502 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -65.8 | -40.9 | 173.7 | -67.1 | -177.5 | 68.1 | 0 | 0 | 112.5 | C98 T99 L100 A101 R106 S107 | C98-M103 HydrophobicContact CB-CG 4.23Å; T99-M103 PolarHBondContact O-N 3.14Å; L100-M103 PolarHBondContact O-N 3.48Å; A101-M103 VanDerWaalsContact C-N 3.35Å; A101-M103 PolarHBondContact O-N 2.84Å; M103-R106 WeakPolarHBondContact O-CB 3.5Å; M103-R106 PolarHBondContact O-N 3.4Å; M103-S107 PolarHBondContact O-N 2.9Å |
| 104 | A | 86.4 | Confident | 80.2 | Confident | 55 Ų | 55 | 70.5 Ų | 70.5 | 46% | 0.455 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.2 | -44.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | L100 A101 R106 S107 A108 | L100-A104 WeakPolarHBondContact O-CB 3.32Å; L100-A104 PolarHBondContact O-N 3.33Å; A101-A104 PolarHBondContact O-N 2.94Å; A104-R106 PolarHBondContact O-N 3.3Å; A104-S107 PolarHBondContact O-N 3.44Å; A104-A108 VanDerWaalsContact O-CB 3.29Å; A104-A108 WeakPolarHBondContact O-CB 3.48Å; A104-A108 PolarHBondContact O-N 3.45Å |
| 105 | M | 86.3 | Confident | 82.5 | Confident | 30 Ų | 30 | 64.9 Ų | 64.9 | 15% | 0.148 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.4 | -44.7 | 173.5 | -71.2 | -170.8 | -61.3 | 0 | 0 | 111.7 | A101 R102 S107 A108 L109 F162 | A101-M105 WeakPolarHBondContact O-CG 3.49Å; A101-M105 PolarHBondContact O-N 2.78Å; R102-M105 HydrophobicContact CB-CE 4.29Å; R102-M105 HydrophobicContact CG-CE 4.47Å; R102-M105 PolarHBondContact O-N 3.48Å; M105-S107 PolarHBondContact O-N 3.38Å; M105-A108 PolarHBondContact O-N 2.74Å; M105-L109 PolarHBondContact O-N 3.47Å; M105-F162 HydrophobicContact SD-CD1 4.03Å; M105-F162 HydrophobicContact SD-CE1 4.4Å |
| 106 | R | 85.5 | Confident | 84.4 | Confident | 92 Ų | 92 | 53.5 Ų | 53.5 | 35% | 0.347 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -57.6 | -48.5 | 176 | -174.4 | 176 | 90.5 | 156.9 | 4.1 | 111.5 | W30 D32 R102 M103 A104 A108 A110 | W30-R106 HydrophobicContact CB-CG 4.3Å; W30-R106 HydrophobicContact CD2-CB 4.36Å; W30-R106 HydrophobicContact CD2-CG 3.74Å; W30-R106 HydrophobicContact CE3-CB 4.41Å; W30-R106 HydrophobicContact CE3-CG 3.76Å; W30-R106 HydrophobicContact CG-CG 3.99Å; W30-R106 HydrophobicContact CZ2-CB 4.44Å; W30-R106 HydrophobicContact CZ3-CB 4.46Å; W30-R106 HydrophobicContact CZ3-CG 4.24Å; D32-R106 IonicContact OD2-CZ 3.8Å; D32-R106 IonicContact OD2-NH1 2.76Å; D32-R106 PolarHBondContact OD2-NH1 2.82Å; D32-R106 VanDerWaalsContact OD2-NH1 3.13Å; D32-R106 IonicContact OD2-NH2 3.45Å; D32-R106 PolarHBondContact OD2-NH2 3.22Å; R102-R106 WeakPolarHBondContact O-CB 3.49Å; R102-R106 PolarHBondContact O-N 2.94Å; M103-R106 WeakPolarHBondContact O-CB 3.5Å; M103-R106 PolarHBondContact O-N 3.4Å; A104-R106 PolarHBondContact O-N 3.3Å; R106-A108 VanDerWaalsContact C-N 3.34Å; R106-A110 WeakPolarHBondContact O-CB 3.36Å; R106-A110 PolarHBondContact O-N 2.93Å |
| 107 | S | 87.9 | Confident | 86.3 | Confident | 54 Ų | 54 | 55.2 Ų | 55.2 | 38% | 0.378 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -65.1 | -38.7 | 178 | 177.5 | 0 | 0 | 0 | 0 | 112.1 | M103 A104 M105 R111 | M103-S107 PolarHBondContact O-N 2.9Å; A104-S107 PolarHBondContact O-N 3.44Å; M105-S107 PolarHBondContact O-N 3.38Å; S107-R111 WeakPolarHBondContact O-CG 3.47Å; S107-R111 PolarHBondContact O-N 2.93Å; S107-R111 VanDerWaalsContact O-N 3.07Å; S107-R111 PolarHBondContact O-NE 3.39Å |
| 108 | A | 89.9 | Confident | 88.2 | Confident | 9 Ų | 9 | 52.6 Ų | 52.6 | 7% | 0.074 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.4 | -47.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A104 M105 R106 R111 V112 L166 H170 | A104-A108 VanDerWaalsContact O-CB 3.29Å; A104-A108 WeakPolarHBondContact O-CB 3.48Å; A104-A108 PolarHBondContact O-N 3.45Å; M105-A108 PolarHBondContact O-N 2.74Å; R106-A108 VanDerWaalsContact C-N 3.34Å; A108-R111 PolarHBondContact O-N 2.97Å; A108-V112 WeakPolarHBondContact O-CG2 3.43Å; A108-V112 PolarHBondContact O-N 3.29Å; A108-V112 VanDerWaalsContact O-N 3.11Å; A108-L166 HydrophobicContact CB-CD2 3.76Å; A108-L166 HydrophobicContact CB-CG 4.45Å; A108-H170 PolarHBondContact O-CE1 3.16Å; A108-H170 PolarHBondContact O-NE2 2.88Å; A108-H170 VanDerWaalsContact O-NE2 3.1Å |
| 109 | L | 90.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.8 | -41.5 | 177.2 | 176.6 | 63.1 | 0 | 0 | 0 | 111.9 | L21 L24 W30 M105 R111 V112 V113 F162 L166 | L21-L109 HydrophobicContact CD2-CD1 3.62Å; L24-L109 HydrophobicContact CD2-CD2 3.86Å; L24-L109 HydrophobicContact CG-CD2 4Å; W30-L109 HydrophobicContact CE3-CD2 4.17Å; W30-L109 HydrophobicContact CH2-CB 3.92Å; W30-L109 HydrophobicContact CH2-CD2 3.4Å; W30-L109 VanDerWaalsContact CH2-CD2 3.4Å; W30-L109 HydrophobicContact CH2-CG 4.18Å; W30-L109 HydrophobicContact CZ3-CB 3.62Å; W30-L109 HydrophobicContact CZ3-CD2 3.11Å; W30-L109 HydrophobicContact CZ3-CG 3.69Å; M105-L109 PolarHBondContact O-N 3.47Å; L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 3.06Å; L109-V112 PolarHBondContact O-N 3.48Å; L109-V113 HydrophobicContact CD1-CG2 4.48Å; L109-V113 WeakPolarHBondContact O-CG2 3.5Å; L109-V113 PolarHBondContact O-N 2.92Å; L109-F162 HydrophobicContact CD2-CZ 4.3Å; L109-L166 HydrophobicContact CB-CD1 4.03Å; L109-L166 HydrophobicContact CB-CD2 4.37Å; L109-L166 HydrophobicContact CD1-CD1 3.99Å |
| 110 | A | 91.2 | Very high | 90.5 | Very high | 22 Ų | 22 | 45 Ų | 45 | 18% | 0.182 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -55.6 | -44.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | R106 V112 V113 D114 | R106-A110 WeakPolarHBondContact O-CB 3.36Å; R106-A110 PolarHBondContact O-N 2.93Å; A110-V112 VanDerWaalsContact C-N 3.34Å; A110-V112 PolarHBondContact O-N 2.96Å; A110-V113 WeakPolarHBondContact O-CB 3.33Å; A110-V113 PolarHBondContact O-N 2.95Å; A110-V113 VanDerWaalsContact O-N 3.16Å; A110-D114 VanDerWaalsContact O-CG 3.24Å; A110-D114 PolarHBondContact O-N 3.02Å |
| 111 | R | 92.4 | Very high | 91.1 | Very high | 90 Ų | 90 | 41 Ų | 41 | 34% | 0.34 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.9 | -35.5 | 175.2 | -75.3 | -176.7 | -71.8 | -156 | 1.8 | 113.7 | S107 A108 L109 S115 | S107-R111 WeakPolarHBondContact O-CG 3.47Å; S107-R111 PolarHBondContact O-N 2.93Å; S107-R111 VanDerWaalsContact O-N 3.07Å; S107-R111 PolarHBondContact O-NE 3.39Å; A108-R111 PolarHBondContact O-N 2.97Å; L109-R111 VanDerWaalsContact C-N 3.28Å; L109-R111 PolarHBondContact O-N 3.06Å; R111-S115 WeakPolarHBondContact O-CB 3.34Å; R111-S115 PolarHBondContact O-N 3.26Å; R111-S115 PolarHBondContact O-OG 2.94Å |
| 112 | V | 93.7 | Very high | 91.7 | Very high | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -65 | -44.7 | 173.2 | -178.5 | 0 | 0 | 0 | 0 | 110.2 | L21 A108 L109 A110 S115 T116 F146 L166 A169 H170 L173 | L21-V112 HydrophobicContact CD1-CG1 3.76Å; A108-V112 WeakPolarHBondContact O-CG2 3.43Å; A108-V112 PolarHBondContact O-N 3.29Å; A108-V112 VanDerWaalsContact O-N 3.11Å; L109-V112 PolarHBondContact O-N 3.48Å; A110-V112 VanDerWaalsContact C-N 3.34Å; A110-V112 PolarHBondContact O-N 2.96Å; V112-S115 PolarHBondContact O-N 3.35Å; V112-T116 VanDerWaalsContact O-CB 3.22Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 3.39Å; V112-T116 PolarHBondContact O-OG1 2.97Å; V112-F146 HydrophobicContact CG1-CE2 4.17Å; V112-F146 HydrophobicContact CG1-CZ 4Å; V112-L166 HydrophobicContact CG2-CD1 3.93Å; V112-A169 HydrophobicContact CG1-CB 4.5Å; V112-H170 VanDerWaalsContact CG2-CD2 3.49Å; V112-H170 WeakPolarHBondContact CG2-CD2 3.18Å; V112-H170 WeakPolarHBondContact CG2-CE1 3.41Å; V112-H170 WeakPolarHBondContact CG2-NE2 3.46Å; V112-L173 HydrophobicContact CG1-CD2 4.45Å |
| 113 | V | 94.4 | Very high | 92.3 | Very high | 6 Ų | 6 | 35.9 Ų | 35.9 | 4% | 0.036 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.3 | -51.9 | 177 | 173.2 | 0 | 0 | 0 | 0 | 110.3 | L18 L21 Q22 L109 A110 T116 S117 | L18-V113 HydrophobicContact CD1-CG1 4.01Å; L18-V113 WeakPolarHBondContact CD1-O 3.47Å; L21-V113 HydrophobicContact CB-CG2 3.66Å; Q22-V113 HydrophobicContact CG-CG1 4.03Å; L109-V113 HydrophobicContact CD1-CG2 4.48Å; L109-V113 WeakPolarHBondContact O-CG2 3.5Å; L109-V113 PolarHBondContact O-N 2.92Å; A110-V113 WeakPolarHBondContact O-CB 3.33Å; A110-V113 PolarHBondContact O-N 2.95Å; A110-V113 VanDerWaalsContact O-N 3.16Å; V113-T116 PolarHBondContact O-N 3.48Å; V113-S117 WeakPolarHBondContact O-CB 3.31Å; V113-S117 PolarHBondContact O-N 3.13Å |
| 114 | D | 94.4 | Very high | 92.7 | Very high | 89 Ų | 89 | 35.6 Ų | 35.6 | 48% | 0.476 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -61.1 | -49 | -179 | -64.9 | -24.9 | 0 | 0 | 0 | 111 | A110 T116 S117 E118 | A110-D114 VanDerWaalsContact O-CG 3.24Å; A110-D114 PolarHBondContact O-N 3.02Å; D114-T116 VanDerWaalsContact C-N 3.33Å; D114-T116 PolarHBondContact O-N 3.03Å; D114-S117 WeakPolarHBondContact O-CB 3.48Å; D114-S117 PolarHBondContact O-N 3.48Å; D114-E118 WeakPolarHBondContact O-CG 3.48Å; D114-E118 PolarHBondContact O-N 3.25Å |
| 115 | S | 95.3 | Very high | 93.1 | Very high | 1 Ų | 1 | 36.9 Ų | 36.9 | 1% | 0.007 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -64.8 | -35.8 | 179.8 | -58.1 | 0 | 0 | 0 | 0 | 112.5 | R111 V112 L119 L206 | R111-S115 WeakPolarHBondContact O-CB 3.34Å; R111-S115 PolarHBondContact O-N 3.26Å; R111-S115 PolarHBondContact O-OG 2.94Å; V112-S115 PolarHBondContact O-N 3.35Å; S115-L119 VanDerWaalsContact O-CB 3.26Å; S115-L119 WeakPolarHBondContact O-CB 3.27Å; S115-L119 PolarHBondContact O-N 3.39Å; S115-L206 WeakPolarHBondContact OG-CD2 3.34Å |
| 116 | T | 95.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -69.5 | -40.3 | 175.6 | -55.4 | 0 | 0 | 0 | 0 | 110.6 | L18 V112 V113 D114 L119 V120 F146 | L18-T116 HydrophobicContact CB-CG2 3.97Å; L18-T116 HydrophobicContact CD1-CG2 4.31Å; V112-T116 VanDerWaalsContact O-CB 3.22Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 3.39Å; V112-T116 PolarHBondContact O-OG1 2.97Å; V113-T116 PolarHBondContact O-N 3.48Å; D114-T116 VanDerWaalsContact C-N 3.33Å; D114-T116 PolarHBondContact O-N 3.03Å; T116-L119 PolarHBondContact O-N 3.27Å; T116-V120 WeakPolarHBondContact O-CG2 3.49Å; T116-V120 PolarHBondContact O-N 3.11Å; T116-F146 HydrophobicContact CG2-CE1 3.7Å; T116-F146 HydrophobicContact CG2-CZ 4.13Å; T116-F146 VanDerWaalsContact OG1-CZ 3.28Å; T116-F146 WeakPolarHBondContact OG1-CZ 3.29Å |
| 117 | S | 96.3 | Very high | 93.7 | Very high | 54 Ų | 54 | 33.4 Ų | 33.4 | 38% | 0.378 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -63.8 | -46.1 | 175.3 | -175.6 | 0 | 0 | 0 | 0 | 111.7 | V113 D114 L119 V120 S121 | V113-S117 WeakPolarHBondContact O-CB 3.31Å; V113-S117 PolarHBondContact O-N 3.13Å; D114-S117 WeakPolarHBondContact O-CB 3.48Å; D114-S117 PolarHBondContact O-N 3.48Å; S117-L119 VanDerWaalsContact C-N 3.32Å; S117-L119 PolarHBondContact O-N 3.12Å; S117-V120 PolarHBondContact O-N 2.95Å; S117-S121 WeakPolarHBondContact O-CB 3.33Å; S117-S121 PolarHBondContact O-N 2.81Å |
| 118 | E | 96.5 | Very high | 93.8 | Very high | 65 Ų | 65 | 31.6 Ų | 31.6 | 30% | 0.304 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -60 | -42.8 | 173.6 | -74.4 | -175.5 | -135.4 | 0 | 0 | 111.3 | D114 S121 V122 I202 | D114-E118 WeakPolarHBondContact O-CG 3.48Å; D114-E118 PolarHBondContact O-N 3.25Å; E118-S121 WeakPolarHBondContact O-CB 3.46Å; E118-S121 PolarHBondContact O-N 2.93Å; E118-V122 WeakPolarHBondContact O-CG2 3.14Å; E118-V122 PolarHBondContact O-N 2.93Å; E118-I202 HydrophobicContact CB-CD1 3.9Å; E118-I202 HydrophobicContact CB-CG1 3.8Å |
| 119 | L | 96.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.7 | -51.5 | 177.2 | -179.9 | 59.5 | 0 | 0 | 0 | 111.3 | S115 T116 S117 S121 V122 E123 L173 I176 V177 L180 L199 I202 | S115-L119 VanDerWaalsContact O-CB 3.26Å; S115-L119 WeakPolarHBondContact O-CB 3.27Å; S115-L119 PolarHBondContact O-N 3.39Å; T116-L119 PolarHBondContact O-N 3.27Å; S117-L119 VanDerWaalsContact C-N 3.32Å; S117-L119 PolarHBondContact O-N 3.12Å; L119-S121 PolarHBondContact O-N 3.34Å; L119-V122 PolarHBondContact O-N 2.89Å; L119-V122 VanDerWaalsContact O-N 3.12Å; L119-E123 HydrophobicContact CD1-CG 4.03Å; L119-E123 HydrophobicContact CG-CG 4.26Å; L119-E123 WeakPolarHBondContact O-CG 3.49Å; L119-E123 PolarHBondContact O-N 3.5Å; L119-L173 HydrophobicContact CD2-CD1 3.45Å; L119-L173 VanDerWaalsContact CD2-CD1 3.45Å; L119-I176 HydrophobicContact CD2-CG2 3.95Å; L119-V177 HydrophobicContact CD1-CG2 4.19Å; L119-V177 HydrophobicContact CD2-CG2 4.26Å; L119-L180 HydrophobicContact CD1-CD1 3.84Å; L119-L199 HydrophobicContact CD1-CD2 3.76Å; L119-I202 HydrophobicContact CB-CD1 4.3Å |
| 120 | V | 96.2 | Very high | 93.8 | Very high | 11 Ų | 11 | 34.1 Ų | 34.1 | 7% | 0.067 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -56.2 | -42.2 | 177 | 170.4 | 0 | 0 | 0 | 0 | 111 | Q14 M15 T116 S117 E123 Q124 | Q14-V120 HydrophobicContact CB-CG2 3.55Å; M15-V120 HydrophobicContact CG-CG1 3.9Å; M15-V120 HydrophobicContact CG-CG2 4.47Å; T116-V120 WeakPolarHBondContact O-CG2 3.49Å; T116-V120 PolarHBondContact O-N 3.11Å; S117-V120 PolarHBondContact O-N 2.95Å; V120-E123 PolarHBondContact O-N 3.34Å; V120-Q124 HydrophobicContact CG1-CG 4.46Å; V120-Q124 WeakPolarHBondContact O-CB 3.4Å; V120-Q124 VanDerWaalsContact O-CG 3.28Å; V120-Q124 WeakPolarHBondContact O-CG 3.34Å; V120-Q124 PolarHBondContact O-N 3.13Å |
| 121 | S | 96.3 | Very high | 93.6 | Very high | 60 Ų | 60 | 33.5 Ų | 33.5 | 42% | 0.42 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -61.8 | -47 | 176.7 | -175.3 | 0 | 0 | 0 | 0 | 111.9 | S117 E118 L119 Q124 T125 | S117-S121 WeakPolarHBondContact O-CB 3.33Å; S117-S121 PolarHBondContact O-N 2.81Å; E118-S121 WeakPolarHBondContact O-CB 3.46Å; E118-S121 PolarHBondContact O-N 2.93Å; L119-S121 PolarHBondContact O-N 3.34Å; S121-Q124 PolarHBondContact O-N 3.47Å; S121-T125 WeakPolarHBondContact O-CB 3.21Å; S121-T125 WeakPolarHBondContact O-CG2 3.38Å; S121-T125 PolarHBondContact O-N 3.25Å; S121-T125 PolarHBondContact O-OG1 3.17Å |
| 122 | V | 95.3 | Very high | 93.3 | Very high | 14 Ų | 14 | 36.7 Ų | 36.7 | 9% | 0.085 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.4 | -41.6 | 176.2 | 167.6 | 0 | 0 | 0 | 0 | 111.3 | E118 L119 Q124 L126 L127 L199 I202 | E118-V122 WeakPolarHBondContact O-CG2 3.14Å; E118-V122 PolarHBondContact O-N 2.93Å; L119-V122 PolarHBondContact O-N 2.89Å; L119-V122 VanDerWaalsContact O-N 3.12Å; V122-Q124 VanDerWaalsContact C-N 3.33Å; V122-Q124 PolarHBondContact O-N 2.83Å; V122-L126 HydrophobicContact CG1-CB 4.4Å; V122-L126 HydrophobicContact CG1-CD1 4.27Å; V122-L126 HydrophobicContact CG2-CD1 4.47Å; V122-L126 WeakPolarHBondContact O-CA 3.43Å; V122-L126 WeakPolarHBondContact O-CB 3.31Å; V122-L126 PolarHBondContact O-N 3.35Å; V122-L127 HydrophobicContact CG1-CG 4.28Å; V122-L127 PolarHBondContact O-N 3.14Å; V122-L199 HydrophobicContact CG1-CD2 3.92Å; V122-L199 HydrophobicContact CG1-CG 4.06Å; V122-I202 HydrophobicContact CB-CD1 4.42Å; V122-I202 HydrophobicContact CG2-CD1 3.95Å |
| 123 | E | 93.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 24% | 0.235 | C | C | . | . | I | π-helix | trans | -62.2 | -40.8 | 178 | -68 | -157.7 | 162.1 | 0 | 0 | 111.7 | L7 S10 I11 Q14 L119 V120 L127 G128 | L7-E123 HydrophobicContact CD1-CB 4.42Å; S10-E123 PolarHBondContact OG-OE2 3.12Å; I11-E123 HydrophobicContact CD1-CB 4.07Å; I11-E123 HydrophobicContact CG1-CB 3.68Å; I11-E123 WeakPolarHBondContact CG1-OE2 3.44Å; Q14-E123 VanDerWaalsContact CD-CD 3.46Å; Q14-E123 VanDerWaalsContact CD-OE2 3.32Å; Q14-E123 PolarHBondContact NE2-OE1 3.08Å; Q14-E123 PolarHBondContact NE2-OE2 3.15Å; Q14-E123 PolarHBondContact OE1-OE1 2.94Å; Q14-E123 PolarHBondContact OE1-OE2 3.39Å; L119-E123 HydrophobicContact CD1-CG 4.03Å; L119-E123 HydrophobicContact CG-CG 4.26Å; L119-E123 WeakPolarHBondContact O-CG 3.49Å; L119-E123 PolarHBondContact O-N 3.5Å; V120-E123 PolarHBondContact O-N 3.34Å; E123-L127 HydrophobicContact CG-CD1 4.04Å; E123-L127 CarbonylContact O-C 3.55Å; E123-L127 WeakPolarHBondContact O-CB 3.37Å; E123-G128 PolarHBondContact O-N 3.2Å |
| 124 | Q | 93.3 | Very high | 92.5 | Very high | 96 Ų | 96 | 49.5 Ų | 49.5 | 45% | 0.449 | 26% | 0.259 | S | S | . | . | I | π-helix | trans | -75.7 | -45.1 | 179.9 | -71 | 176.6 | 8.8 | 0 | 0 | 113 | I11 V120 S121 V122 | I11-Q124 HydrophobicContact CD1-CG 4.13Å; I11-Q124 HydrophobicContact CG2-CG 3.99Å; V120-Q124 HydrophobicContact CG1-CG 4.46Å; V120-Q124 WeakPolarHBondContact O-CB 3.4Å; V120-Q124 VanDerWaalsContact O-CG 3.28Å; V120-Q124 WeakPolarHBondContact O-CG 3.34Å; V120-Q124 PolarHBondContact O-N 3.13Å; S121-Q124 PolarHBondContact O-N 3.47Å; V122-Q124 VanDerWaalsContact C-N 3.33Å; V122-Q124 PolarHBondContact O-N 2.83Å |
| 125 | T | 93.9 | Very high | 92.1 | Very high | 82 Ų | 82 | 48.3 Ų | 48.3 | 50% | 0.503 | 26% | 0.256 | S | S | . | . | I | π-helix | trans | -88.8 | -36 | -169.5 | 59.4 | 0 | 0 | 0 | 0 | 113.3 | S121 P129 | S121-T125 WeakPolarHBondContact O-CB 3.21Å; S121-T125 WeakPolarHBondContact O-CG2 3.38Å; S121-T125 PolarHBondContact O-N 3.25Å; S121-T125 PolarHBondContact O-OG1 3.17Å; T125-P129 WeakPolarHBondContact O-CD 3.49Å; T125-P129 WeakPolarHBondContact O-CG 3.45Å |
| 126 | L | 92.6 | Very high | 91.7 | Very high | 48 Ų | 48 | 48.8 Ų | 48.8 | 25% | 0.251 | 26% | 0.258 | S | S | . | . | I | π-helix | trans | -107.2 | -50.1 | -176.2 | -57.1 | -178.7 | 0 | 0 | 0 | 111.3 | V122 P129 L130 V194 A195 | V122-L126 HydrophobicContact CG1-CB 4.4Å; V122-L126 HydrophobicContact CG1-CD1 4.27Å; V122-L126 HydrophobicContact CG2-CD1 4.47Å; V122-L126 WeakPolarHBondContact O-CA 3.43Å; V122-L126 WeakPolarHBondContact O-CB 3.31Å; V122-L126 PolarHBondContact O-N 3.35Å; L126-P129 WeakPolarHBondContact O-CD 3.32Å; L126-L130 WeakPolarHBondContact O-CG 3.32Å; L126-L130 PolarHBondContact O-N 3.22Å; L126-V194 HydrophobicContact CD1-CG1 4.38Å; L126-A195 HydrophobicContact CB-CB 4.1Å; L126-A195 HydrophobicContact CD1-CB 4.37Å |
| 127 | L | 91.8 | Very high | 91.4 | Very high | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 28% | 0.282 | C | S | . | . | I | π-helix | trans | -75.9 | -31.9 | -175.4 | -55 | -166.6 | 0 | 0 | 0 | 112.9 | L7 V122 E123 L130 Q131 F136 L180 L184 A195 | L7-L127 HydrophobicContact CD1-CB 4.39Å; L7-L127 HydrophobicContact CD2-CB 4.17Å; L7-L127 WeakPolarHBondContact CD2-O 3.28Å; V122-L127 HydrophobicContact CG1-CG 4.28Å; V122-L127 PolarHBondContact O-N 3.14Å; E123-L127 HydrophobicContact CG-CD1 4.04Å; E123-L127 CarbonylContact O-C 3.55Å; E123-L127 WeakPolarHBondContact O-CB 3.37Å; L127-L130 HydrophobicContact CD2-CD1 4.32Å; L127-L130 PolarHBondContact O-N 2.94Å; L127-Q131 VanDerWaalsContact O-CB 3.29Å; L127-Q131 WeakPolarHBondContact O-CB 3.45Å; L127-Q131 PolarHBondContact O-N 2.89Å; L127-F136 HydrophobicContact CB-CZ 4.06Å; L127-F136 HydrophobicContact CD1-CZ 4.42Å; L127-F136 HydrophobicContact CD2-CZ 4.22Å; L127-F136 HydrophobicContact CG-CZ 4.47Å; L127-L180 HydrophobicContact CD1-CD1 4.12Å; L127-L180 HydrophobicContact CD1-CD2 4.03Å; L127-L184 HydrophobicContact CD2-CD1 3.81Å; L127-L184 HydrophobicContact CD2-CD2 4.26Å; L127-A195 HydrophobicContact CD2-CB 3.87Å |
| 128 | G | 90.8 | Very high | 91.1 | Very high | 16 Ų | 16 | 51 Ų | 51 | 17% | 0.165 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -54.4 | -57.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | E123 Q131 Q132 | E123-G128 PolarHBondContact O-N 3.2Å; G128-Q131 PolarHBondContact O-N 2.8Å; G128-Q132 PolarHBondContact O-N 3.42Å |
| 129 | P | 90.3 | Very high | 90.8 | Very high | 57 Ų | 57 | 52.3 Ų | 52.3 | 37% | 0.37 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -60.2 | -44.2 | 174.4 | -25.5 | 35.1 | 0 | 0 | 0 | 112.9 | T125 L126 Q131 Q132 E133 | T125-P129 WeakPolarHBondContact O-CD 3.49Å; T125-P129 WeakPolarHBondContact O-CG 3.45Å; L126-P129 WeakPolarHBondContact O-CD 3.32Å; P129-Q131 VanDerWaalsContact C-N 3.3Å; P129-Q131 PolarHBondContact O-N 2.91Å; P129-Q132 WeakPolarHBondContact O-CB 3.36Å; P129-Q132 PolarHBondContact O-N 3.33Å; P129-E133 PolarHBondContact O-N 3.35Å |
| 130 | L | 89.1 | Confident | 90.6 | Very high | 5 Ų | 5 | 55 Ų | 55 | 3% | 0.026 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60 | -39.6 | 179.8 | -71.1 | 178.4 | 0 | 0 | 0 | 112.4 | L126 L127 Q132 E133 R134 F136 L184 A191 A195 | L126-L130 WeakPolarHBondContact O-CG 3.32Å; L126-L130 PolarHBondContact O-N 3.22Å; L127-L130 HydrophobicContact CD2-CD1 4.32Å; L127-L130 PolarHBondContact O-N 2.94Å; L130-Q132 VanDerWaalsContact C-N 3.27Å; L130-Q132 PolarHBondContact O-N 2.88Å; L130-E133 PolarHBondContact O-N 2.97Å; L130-R134 CarbonylContact O-C 3.44Å; L130-R134 PolarHBondContact O-N 3.44Å; L130-F136 HydrophobicContact CB-CE1 4.03Å; L130-L184 HydrophobicContact CD1-CD2 4.3Å; L130-A191 HydrophobicContact CD2-CB 3.72Å; L130-A195 HydrophobicContact CD1-CB 3.82Å |
| 131 | Q | 87.1 | Confident | 90.5 | Very high | 9 Ų | 9 | 61.4 Ų | 61.4 | 4% | 0.042 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -66 | -29.5 | 177.7 | -169.3 | 78.4 | -18 | 0 | 0 | 112.3 | L7 L127 G128 P129 F136 | L7-Q131 HydrophobicContact CB-CG 4.05Å; L7-Q131 HydrophobicContact CD2-CB 3.59Å; L7-Q131 HydrophobicContact CD2-CG 3.88Å; L127-Q131 VanDerWaalsContact O-CB 3.29Å; L127-Q131 WeakPolarHBondContact O-CB 3.45Å; L127-Q131 PolarHBondContact O-N 2.89Å; G128-Q131 PolarHBondContact O-N 2.8Å; P129-Q131 VanDerWaalsContact C-N 3.3Å; P129-Q131 PolarHBondContact O-N 2.91Å; Q131-F136 HydrophobicContact CB-CE1 4.22Å; Q131-F136 PolarHBondContact NE2-O 2.79Å; Q131-F136 VanDerWaalsContact OE1-N 3.13Å; Q131-F136 PolarHBondContact OE1-O 2.67Å |
| 132 | Q | 85.9 | Confident | 90.5 | Very high | 158 Ų | 158 | 59.1 Ų | 59.1 | 74% | 0.738 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -74.8 | -40.1 | 174.6 | -65.2 | 176.5 | 28.4 | 0 | 0 | 111.5 | G128 P129 L130 | G128-Q132 PolarHBondContact O-N 3.42Å; P129-Q132 WeakPolarHBondContact O-CB 3.36Å; P129-Q132 PolarHBondContact O-N 3.33Å; L130-Q132 VanDerWaalsContact C-N 3.27Å; L130-Q132 PolarHBondContact O-N 2.88Å |
| 133 | E | 86.7 | Confident | 90.4 | Very high | 134 Ų | 134 | 58.6 Ų | 58.6 | 63% | 0.626 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -69.7 | -50.9 | 177.1 | -69.1 | -179.4 | -166.4 | 0 | 0 | 111.8 | P129 L130 | P129-E133 PolarHBondContact O-N 3.35Å; L130-E133 PolarHBondContact O-N 2.97Å |
| 134 | R | 84.7 | Confident | 90.6 | Very high | 140 Ų | 140 | 60.7 Ų | 60.7 | 53% | 0.528 | 31% | 0.31 | S | S | . | . | S | Bend | trans | -143.6 | 113.1 | 179.6 | -70.6 | -167 | -175.5 | 177.1 | 3.9 | 110.2 | L130 F136 | L130-R134 CarbonylContact O-C 3.44Å; L130-R134 PolarHBondContact O-N 3.44Å; R134-F136 WeakPolarHBondContact O-CD1 3.35Å; R134-F136 PolarHBondContact O-N 3.37Å |
| 135 | P | 85.8 | Confident | 90.7 | Very high | 65 Ų | 65 | 60 Ų | 60 | 42% | 0.422 | 31% | 0.306 | S | S | . | . | trans | -69.5 | 134.5 | 179.5 | 28.8 | -34.2 | 0 | 0 | 0 | 111 | A2 | A2-P135 HydrophobicContact CB-CB 3.38Å; A2-P135 HydrophobicContact CB-CG 3.49Å; A2-P135 VanDerWaalsContact CB-CG 3.49Å | ||
| 136 | F | 87.6 | Confident | 90.9 | Very high | 10 Ų | 10 | 56 Ų | 56 | 4% | 0.044 | 28% | 0.282 | C | S | . | . | trans | -124.7 | 158.5 | 174.2 | 56.5 | -92.5 | 0 | 0 | 0 | 110.6 | L127 L130 Q131 R134 I138 L180 L184 L187 | L127-F136 HydrophobicContact CB-CZ 4.06Å; L127-F136 HydrophobicContact CD1-CZ 4.42Å; L127-F136 HydrophobicContact CD2-CZ 4.22Å; L127-F136 HydrophobicContact CG-CZ 4.47Å; L130-F136 HydrophobicContact CB-CE1 4.03Å; Q131-F136 HydrophobicContact CB-CE1 4.22Å; Q131-F136 PolarHBondContact NE2-O 2.79Å; Q131-F136 VanDerWaalsContact OE1-N 3.13Å; Q131-F136 PolarHBondContact OE1-O 2.67Å; R134-F136 WeakPolarHBondContact O-CD1 3.35Å; R134-F136 PolarHBondContact O-N 3.37Å; F136-I138 HydrophobicContact CD2-CD1 3.73Å; F136-I138 HydrophobicContact CE2-CD1 3.3Å; F136-I138 HydrophobicContact CZ-CD1 4.15Å; F136-I138 PolarHBondContact O-N 2.99Å; F136-L180 HydrophobicContact CE2-CD2 4.48Å; F136-L184 HydrophobicContact CD1-CD2 4.14Å; F136-L184 HydrophobicContact CD2-CD2 4.39Å; F136-L184 HydrophobicContact CE1-CD2 3.9Å; F136-L184 HydrophobicContact CE2-CD2 4.11Å; F136-L184 HydrophobicContact CG-CD2 4.39Å; F136-L184 HydrophobicContact CZ-CD2 3.88Å; F136-L187 HydrophobicContact CB-CD1 3.83Å | ||
| 137 | P | 89.1 | Confident | 91.1 | Very high | 79 Ų | 79 | 58 Ų | 58 | 51% | 0.513 | 29% | 0.286 | S | S | . | . | trans | -67.8 | 128.5 | -176.9 | 24 | -30.8 | 0 | 0 | 0 | 111.3 | S183 | P137-S183 PolarHBondContact O-OG 3.22Š| ||
| 138 | I | 90.9 | Very high | 91.4 | Very high | 23 Ų | 23 | 61.3 Ų | 61.3 | 12% | 0.118 | 30% | 0.304 | C | S | . | . | trans | -109.2 | 125.2 | 172.7 | -55.4 | -62.6 | 0 | 0 | 0 | 108.5 | P6 L7 F136 L140 L180 | P6-I138 HydrophobicContact CB-CB 4.12Å; P6-I138 HydrophobicContact CB-CG1 4.47Å; L7-I138 HydrophobicContact CB-CG1 4.15Å; L7-I138 HydrophobicContact CD1-CD1 4Å; L7-I138 HydrophobicContact CD1-CG1 4.44Å; F136-I138 HydrophobicContact CD2-CD1 3.73Å; F136-I138 HydrophobicContact CE2-CD1 3.3Å; F136-I138 HydrophobicContact CZ-CD1 4.15Å; F136-I138 PolarHBondContact O-N 2.99Å; I138-L140 VanDerWaalsContact C-N 3.34Å; I138-L140 PolarHBondContact O-N 3.28Å; I138-L140 VanDerWaalsContact O-N 3.07Å; I138-L180 HydrophobicContact CD1-CD2 3.86Å | ||
| 139 | H | 91 | Very high | 91.6 | Very high | 91 Ų | 91 | 62 Ų | 62 | 42% | 0.421 | 30% | 0.303 | S | S | . | . | trans | -85.8 | 75.3 | 179.1 | -70.9 | -83.6 | 0 | 0 | 0 | 111.3 | K141 D142 K179 | H139-K141 PolarHBondContact O-N 3.06Å; H139-K141 VanDerWaalsContact O-N 3.08Å; H139-D142 WeakPolarHBondContact CB-OD2 3.38Å; H139-D142 PolarHBondContact O-N 2.84Å; H139-K179 HydrophobicContact CB-CD 4.03Å | ||
| 140 | L | 91.5 | Very high | 91.8 | Very high | 58 Ų | 58 | 59.2 Ų | 59.2 | 30% | 0.304 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -54.8 | -32.2 | -176.3 | -172.8 | 64.2 | 0 | 0 | 0 | 113.8 | A9 I138 D142 S143 V144 | A9-L140 HydrophobicContact CB-CD1 3.64Å; A9-L140 HydrophobicContact CB-CD2 4.06Å; I138-L140 VanDerWaalsContact C-N 3.34Å; I138-L140 PolarHBondContact O-N 3.28Å; I138-L140 VanDerWaalsContact O-N 3.07Å; L140-D142 PolarHBondContact O-N 3.46Å; L140-S143 PolarHBondContact O-N 3.37Å; L140-S143 VanDerWaalsContact O-N 3.15Å; L140-V144 HydrophobicContact CG-CG2 4.4Å; L140-V144 WeakPolarHBondContact O-CG2 3.28Å; L140-V144 PolarHBondContact O-N 3.28Å |
| 141 | K | 94.6 | Very high | 92.1 | Very high | 145 Ų | 145 | 60.8 Ų | 60.8 | 63% | 0.63 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -53.2 | -43.2 | 177.9 | -179.3 | -179.9 | 167.3 | -176.6 | 0 | 111.7 | H139 V144 E145 | H139-K141 PolarHBondContact O-N 3.06Å; H139-K141 VanDerWaalsContact O-N 3.08Å; K141-V144 PolarHBondContact O-N 3.33Å; K141-E145 WeakPolarHBondContact CE-OE1 3.44Å; K141-E145 IonicContact NZ-OE1 3.79Å; K141-E145 WeakPolarHBondContact O-CG 3.26Å; K141-E145 PolarHBondContact O-N 2.91Å |
| 142 | D | 94.8 | Very high | 92.4 | Very high | 12 Ų | 12 | 65 Ų | 65 | 6% | 0.064 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -69.9 | -38 | -177.4 | -52.4 | -42.2 | 0 | 0 | 0 | 110.8 | H139 L140 V144 E145 F146 C172 I176 K179 | H139-D142 WeakPolarHBondContact CB-OD2 3.38Å; H139-D142 PolarHBondContact O-N 2.84Å; L140-D142 PolarHBondContact O-N 3.46Å; D142-V144 VanDerWaalsContact C-N 3.33Å; D142-V144 PolarHBondContact O-N 3.35Å; D142-E145 PolarHBondContact O-N 3.4Å; D142-F146 WeakPolarHBondContact O-CB 3.39Å; D142-F146 PolarHBondContact O-N 3.12Å; D142-C172 PolarHBondContact O-SG 3.22Å; D142-I176 HydrophobicContact CB-CD1 4.27Å; D142-I176 HydrophobicContact CB-CG1 3.51Å; D142-K179 IonicContact OD1-NZ 2.89Å; D142-K179 PolarHBondContact OD1-NZ 3.11Å; D142-K179 WeakPolarHBondContact OD2-CD 3.42Å; D142-K179 WeakPolarHBondContact OD2-CE 3.14Å; D142-K179 IonicContact OD2-NZ 2.66Å; D142-K179 PolarHBondContact OD2-NZ 3.44Å |
| 143 | S | 94.8 | Very high | 92.7 | Very high | 2 Ų | 2 | 57.5 Ų | 57.5 | 1% | 0.014 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.1 | -35.3 | 175.7 | -52.8 | 0 | 0 | 0 | 0 | 112.5 | S10 L140 R147 | S10-S143 PolarHBondContact OG-OG 2.84Å; L140-S143 PolarHBondContact O-N 3.37Å; L140-S143 VanDerWaalsContact O-N 3.15Å; S143-R147 PolarHBondContact O-N 2.85Å; S143-R147 VanDerWaalsContact O-N 3.14Å |
| 144 | V | 96.3 | Very high | 92.9 | Very high | 45 Ų | 45 | 53 Ų | 53 | 27% | 0.273 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -68.6 | -45.8 | 173.3 | 175.1 | 0 | 0 | 0 | 0 | 111 | H13 L140 K141 D142 F146 R147 N148 | H13-V144 WeakPolarHBondContact NE2-CG2 3.33Å; L140-V144 HydrophobicContact CG-CG2 4.4Å; L140-V144 WeakPolarHBondContact O-CG2 3.28Å; L140-V144 PolarHBondContact O-N 3.28Å; K141-V144 PolarHBondContact O-N 3.33Å; D142-V144 VanDerWaalsContact C-N 3.33Å; D142-V144 PolarHBondContact O-N 3.35Å; V144-F146 VanDerWaalsContact C-N 3.33Å; V144-F146 PolarHBondContact O-N 2.88Å; V144-R147 PolarHBondContact O-N 3.39Å; V144-N148 VanDerWaalsContact O-CG 3.24Å; V144-N148 PolarHBondContact O-N 3.33Å; V144-N148 PolarHBondContact O-ND2 3.24Å; V144-N148 PolarHBondContact O-OD1 3.48Å |
| 145 | E | 96.6 | Very high | 93.1 | Very high | 80 Ų | 80 | 52.8 Ų | 52.8 | 37% | 0.374 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -58.9 | -45.4 | 176.1 | -75.8 | 179.4 | 179.8 | 0 | 0 | 111.2 | K141 D142 R147 N148 I149 | K141-E145 WeakPolarHBondContact CE-OE1 3.44Å; K141-E145 IonicContact NZ-OE1 3.79Å; K141-E145 WeakPolarHBondContact O-CG 3.26Å; K141-E145 PolarHBondContact O-N 2.91Å; D142-E145 PolarHBondContact O-N 3.4Å; E145-R147 PolarHBondContact O-N 3.49Å; E145-N148 PolarHBondContact O-N 2.99Å; E145-N148 VanDerWaalsContact O-N 3.14Å; E145-I149 VanDerWaalsContact O-CG1 3.3Å; E145-I149 WeakPolarHBondContact O-CG1 3.4Å; E145-I149 PolarHBondContact O-N 2.89Å |
| 146 | F | 97.4 | Very high | 93 | Very high | 0 Ų | 0 | 52.9 Ų | 52.9 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -56.7 | -50 | 176.3 | -178 | -111 | 0 | 0 | 0 | 111.8 | A17 L21 V112 T116 D142 V144 N148 I149 C150 A169 C172 L173 I176 | A17-F146 HydrophobicContact CB-CD1 3.63Å; A17-F146 HydrophobicContact CB-CE1 3.54Å; L21-F146 HydrophobicContact CD1-CZ 4.11Å; V112-F146 HydrophobicContact CG1-CE2 4.17Å; V112-F146 HydrophobicContact CG1-CZ 4Å; T116-F146 HydrophobicContact CG2-CE1 3.7Å; T116-F146 HydrophobicContact CG2-CZ 4.13Å; T116-F146 VanDerWaalsContact OG1-CZ 3.28Å; T116-F146 WeakPolarHBondContact OG1-CZ 3.29Å; D142-F146 WeakPolarHBondContact O-CB 3.39Å; D142-F146 PolarHBondContact O-N 3.12Å; V144-F146 VanDerWaalsContact C-N 3.33Å; V144-F146 PolarHBondContact O-N 2.88Å; F146-N148 VanDerWaalsContact C-N 3.29Å; F146-N148 PolarHBondContact O-N 2.91Å; F146-I149 PolarHBondContact O-N 3.17Å; F146-C150 PolarHBondContact O-N 3.36Å; F146-C150 PolarHBondContact O-SG 3.06Å; F146-A169 HydrophobicContact CE2-CB 4.1Å; F146-C172 HydrophobicContact CD2-CB 4.26Å; F146-L173 HydrophobicContact CD2-CB 4.37Å; F146-L173 HydrophobicContact CE2-CB 4.01Å; F146-L173 HydrophobicContact CE2-CD1 4.43Å; F146-L173 HydrophobicContact CZ-CD1 4.34Å; F146-I176 HydrophobicContact CB-CD1 3.84Å; F146-I176 HydrophobicContact CG-CD1 4.24Å |
| 147 | R | 96.9 | Very high | 91.9 | Very high | 90 Ų | 90 | 59.4 Ų | 59.4 | 34% | 0.34 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -56.6 | -43.1 | 175.8 | 176.5 | -172.9 | 168.1 | -118.8 | 0.2 | 112.3 | H13 V16 A17 S143 V144 E145 C150 S151 | H13-R147 HydrophobicContact CB-CB 4.45Å; V16-R147 HydrophobicContact CG1-CG 4.2Å; A17-R147 HydrophobicContact CB-CB 4.29Å; S143-R147 PolarHBondContact O-N 2.85Å; S143-R147 VanDerWaalsContact O-N 3.14Å; V144-R147 PolarHBondContact O-N 3.39Å; E145-R147 PolarHBondContact O-N 3.49Å; R147-C150 PolarHBondContact O-N 2.98Å; R147-S151 PolarHBondContact O-N 2.99Å; R147-S151 PolarHBondContact O-OG 3.2Å |
| 148 | N | 96.7 | Very high | 90.9 | Very high | 68 Ų | 68 | 59.8 Ų | 59.8 | 36% | 0.364 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | -179.6 | -67.4 | -14.1 | 0 | 0 | 0 | 111.2 | V144 E145 F146 S151 H152 | V144-N148 VanDerWaalsContact O-CG 3.24Å; V144-N148 PolarHBondContact O-N 3.33Å; V144-N148 PolarHBondContact O-ND2 3.24Å; V144-N148 PolarHBondContact O-OD1 3.48Å; E145-N148 PolarHBondContact O-N 2.99Å; E145-N148 VanDerWaalsContact O-N 3.14Å; F146-N148 VanDerWaalsContact C-N 3.29Å; F146-N148 PolarHBondContact O-N 2.91Å; N148-S151 WeakPolarHBondContact O-CB 3.42Å; N148-S151 PolarHBondContact O-N 3.48Å; N148-H152 PolarHBondContact O-N 2.85Å |
| 149 | I | 96.1 | Very high | 90.2 | Very high | 30 Ų | 30 | 60.6 Ų | 60.6 | 15% | 0.154 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.5 | -45.1 | 174.3 | -64.1 | 162.3 | 0 | 0 | 0 | 110.6 | E145 F146 S151 H152 L153 D165 A168 A169 C172 | E145-I149 VanDerWaalsContact O-CG1 3.3Å; E145-I149 WeakPolarHBondContact O-CG1 3.4Å; E145-I149 PolarHBondContact O-N 2.89Å; F146-I149 PolarHBondContact O-N 3.17Å; I149-S151 VanDerWaalsContact C-N 3.25Å; I149-S151 PolarHBondContact O-N 3.14Å; I149-H152 WeakPolarHBondContact O-CB 3.47Å; I149-H152 PolarHBondContact O-N 3.32Å; I149-H152 VanDerWaalsContact O-N 3.11Å; I149-L153 PolarHBondContact O-N 3.33Å; I149-D165 HydrophobicContact CG2-CB 4.4Å; I149-D165 WeakPolarHBondContact CG2-O 3.34Å; I149-A168 HydrophobicContact CD1-CB 4.15Å; I149-A168 HydrophobicContact CG2-CB 4.23Å; I149-A169 HydrophobicContact CG2-CB 3.81Å; I149-C172 HydrophobicContact CD1-CB 3.97Å |
| 150 | C | 95.3 | Very high | 89.8 | Confident | 0 Ų | 0 | 62.9 Ų | 62.9 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -61.2 | -35.3 | 175.2 | -61.3 | 0 | 0 | 0 | 0 | 112.5 | A17 T20 L21 F146 R147 L153 A154 | A17-C150 HydrophobicContact CB-CB 4.17Å; T20-C150 HydrophobicContact CG2-CB 4.46Å; T20-C150 WeakPolarHBondContact CG2-O 3.4Å; L21-C150 HydrophobicContact CD2-CB 4.08Å; L21-C150 HydrophobicContact CG-CB 4.11Å; F146-C150 PolarHBondContact O-N 3.36Å; F146-C150 PolarHBondContact O-SG 3.06Å; R147-C150 PolarHBondContact O-N 2.98Å; C150-L153 WeakPolarHBondContact O-CB 3.46Å; C150-L153 PolarHBondContact O-N 3.46Å; C150-A154 PolarHBondContact O-N 3.07Å; C150-A154 VanDerWaalsContact O-N 3.11Å |
| 151 | S | 94.8 | Very high | 89.6 | Confident | 38 Ų | 38 | 63.8 Ų | 63.8 | 27% | 0.266 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66.3 | -40.5 | 174.7 | -52.8 | 0 | 0 | 0 | 0 | 111.1 | R147 N148 I149 A154 L155 | R147-S151 PolarHBondContact O-N 2.99Å; R147-S151 PolarHBondContact O-OG 3.2Å; N148-S151 WeakPolarHBondContact O-CB 3.42Å; N148-S151 PolarHBondContact O-N 3.48Å; I149-S151 VanDerWaalsContact C-N 3.25Å; I149-S151 PolarHBondContact O-N 3.14Å; S151-A154 PolarHBondContact O-N 3.43Å; S151-L155 WeakPolarHBondContact O-CG 3.47Å; S151-L155 PolarHBondContact O-N 3.13Å |
| 152 | H | 93.7 | Very high | 89.4 | Confident | 98 Ų | 98 | 56.9 Ų | 56.9 | 45% | 0.454 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.8 | -44.3 | 173.3 | -67.1 | 175.2 | 0 | 0 | 0 | 111.7 | N148 I149 A154 L155 Q156 | N148-H152 PolarHBondContact O-N 2.85Å; I149-H152 WeakPolarHBondContact O-CB 3.47Å; I149-H152 PolarHBondContact O-N 3.32Å; I149-H152 VanDerWaalsContact O-N 3.11Å; H152-A154 PolarHBondContact O-N 2.79Å; H152-L155 PolarHBondContact O-N 3.32Å; H152-Q156 WeakPolarHBondContact O-CG 3.37Å; H152-Q156 PolarHBondContact O-N 3.14Å |
| 153 | L | 92.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 59.4 Ų | 59.4 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -53.2 | -39.9 | 174.7 | -80.5 | 170 | 0 | 0 | 0 | 112.2 | L21 L24 I149 C150 L155 Q156 F162 D165 L166 A169 | L21-L153 HydrophobicContact CD2-CD1 3.98Å; L24-L153 HydrophobicContact CD2-CB 3.83Å; I149-L153 PolarHBondContact O-N 3.33Å; C150-L153 WeakPolarHBondContact O-CB 3.46Å; C150-L153 PolarHBondContact O-N 3.46Å; L153-L155 VanDerWaalsContact C-N 3.31Å; L153-L155 PolarHBondContact O-N 3.47Å; L153-Q156 PolarHBondContact O-N 2.94Å; L153-F162 HydrophobicContact CD2-CD2 3.7Å; L153-F162 HydrophobicContact CD2-CE2 3.67Å; L153-F162 HydrophobicContact CD2-CG 4.17Å; L153-F162 HydrophobicContact CD2-CZ 4.12Å; L153-D165 HydrophobicContact CD2-CB 3.76Å; L153-D165 HydrophobicContact CG-CB 3.93Å; L153-L166 HydrophobicContact CD1-CD1 4.42Å; L153-L166 HydrophobicContact CD2-CB 4.04Å; L153-A169 HydrophobicContact CD1-CB 4.05Å |
| 154 | A | 90.3 | Very high | 89 | Confident | 38 Ų | 38 | 65.6 Ų | 65.6 | 31% | 0.314 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -69.7 | -25.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | T20 C150 S151 H152 | T20-A154 HydrophobicContact CG2-CB 3.61Å; C150-A154 PolarHBondContact O-N 3.07Å; C150-A154 VanDerWaalsContact O-N 3.11Å; S151-A154 PolarHBondContact O-N 3.43Å; H152-A154 PolarHBondContact O-N 2.79Å |
| 155 | L | 88.7 | Confident | 88.9 | Confident | 136 Ų | 136 | 64.2 Ų | 64.2 | 71% | 0.712 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -84.8 | -16.1 | 177 | -63.2 | 172.8 | 0 | 0 | 0 | 112.7 | S151 H152 L153 | S151-L155 WeakPolarHBondContact O-CG 3.47Å; S151-L155 PolarHBondContact O-N 3.13Å; H152-L155 PolarHBondContact O-N 3.32Å; L153-L155 VanDerWaalsContact C-N 3.31Å; L153-L155 PolarHBondContact O-N 3.47Å |
| 156 | Q | 83.9 | Confident | 88.7 | Confident | 67 Ų | 67 | 60.5 Ų | 60.5 | 31% | 0.313 | 31% | 0.307 | S | S | . | . | trans | -93.4 | 127.4 | -179.3 | -61.2 | -62.3 | -23.7 | 0 | 0 | 110.2 | H152 L153 Q161 F162 | H152-Q156 WeakPolarHBondContact O-CG 3.37Å; H152-Q156 PolarHBondContact O-N 3.14Å; L153-Q156 PolarHBondContact O-N 2.94Å; Q156-Q161 HydrophobicContact CG-CG 4.33Å; Q156-F162 HydrophobicContact CB-CB 4.23Å; Q156-F162 HydrophobicContact CB-CD2 4.17Å | ||
| 157 | I | 64.6 | Low | 88.4 | Confident | 147 Ų | 147 | 62.5 Ų | 62.5 | 75% | 0.754 | 32% | 0.318 | S | S | * | . | trans | -88.6 | -32.5 | -175.6 | -63.5 | 172.3 | 0 | 0 | 0 | 112.1 | W28 | W28-I157 VanDerWaalsContact CH2-O 3.31Å; W28-I157 WeakPolarHBondContact CH2-O 3.46Å; W28-I157 WeakPolarHBondContact CZ2-O 3.03Å | ||
| 158 | E | 67.7 | Low | 88.3 | Confident | 88 Ų | 88 | 60 Ų | 60 | 41% | 0.411 | 32% | 0.316 | S | S | . | . | S | Bend | trans | 179.5 | 160.2 | 171.7 | -106.6 | 171.4 | -177.4 | 0 | 0 | 109.5 | W28 R102 | W28-E158 HydrophobicContact CH2-CB 4.48Å; W28-E158 HydrophobicContact CH2-CG 3.67Å; W28-E158 HydrophobicContact CZ3-CG 3.62Å; R102-E158 IonicContact CZ-OE1 3.13Å; R102-E158 VanDerWaalsContact CZ-OE1 3.23Å; R102-E158 IonicContact CZ-OE2 2.82Å; R102-E158 IonicContact NE-OE1 3.23Å; R102-E158 PolarHBondContact NE-OE1 3.04Å; R102-E158 IonicContact NH2-OE1 2.79Å; R102-E158 PolarHBondContact NH2-OE1 3.33Å; R102-E158 IonicContact NH2-OE2 2.94Å; R102-E158 PolarHBondContact NH2-OE2 3.34Å |
| 159 | G | 76.4 | Confident | 88.3 | Confident | 40 Ų | 40 | 56.8 Ų | 56.8 | 41% | 0.412 | 30% | 0.299 | S | S | . | . | S | Bend | trans | 123.8 | -172.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | Q161 F162 D163 | G159-Q161 PolarHBondContact O-N 2.98Å; G159-F162 WeakPolarHBondContact O-CB 3.48Å; G159-F162 PolarHBondContact O-N 3Å; G159-F162 VanDerWaalsContact O-N 3.13Å; G159-D163 PolarHBondContact O-N 3.37Å |
| 160 | Q | 82.2 | Confident | 88.1 | Confident | 138 Ų | 138 | 55.4 Ų | 55.4 | 65% | 0.645 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -61.1 | -30.3 | -174.8 | -166.7 | -178.7 | 19.1 | 0 | 0 | 112.8 | R164 | Q160-R164 VanDerWaalsContact CD-NH2 3.33Å; Q160-R164 VanDerWaalsContact NE2-NH2 3.16Å; Q160-R164 VanDerWaalsContact O-CG 3.29Å; Q160-R164 WeakPolarHBondContact O-CG 3.44Å; Q160-R164 PolarHBondContact O-N 3.45Å; Q160-R164 VanDerWaalsContact O-N 3.1Å |
| 161 | Q | 87.9 | Confident | 88.1 | Confident | 77 Ų | 77 | 59.5 Ų | 59.5 | 36% | 0.36 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -70 | -40 | 177.8 | -171 | 55.5 | 39.7 | 0 | 0 | 111.9 | Q156 G159 D163 R164 D165 | Q156-Q161 HydrophobicContact CG-CG 4.33Å; G159-Q161 PolarHBondContact O-N 2.98Å; Q161-D163 VanDerWaalsContact C-N 3.34Å; Q161-D163 PolarHBondContact O-N 3.48Å; Q161-R164 PolarHBondContact O-N 3.31Å; Q161-D165 PolarHBondContact NE2-OD1 2.74Å; Q161-D165 PolarHBondContact NE2-OD2 3.4Å; Q161-D165 VanDerWaalsContact NE2-OD2 3.14Å; Q161-D165 PolarHBondContact O-N 3.33Å |
| 162 | F | 89.6 | Confident | 88.1 | Confident | 0 Ų | 0 | 58.3 Ų | 58.3 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.8 | -45 | 174 | -178.9 | -88.7 | 0 | 0 | 0 | 111.5 | L24 W28 W30 M105 L109 L153 Q156 G159 R164 D165 L166 | L24-F162 HydrophobicContact CD2-CE2 4.13Å; W28-F162 HydrophobicContact CH2-CD1 4.05Å; W28-F162 AromaticContact CH2-CD2 3.66Å; W28-F162 HydrophobicContact CH2-CD2 3.66Å; W28-F162 AromaticContact CH2-CE1 3.87Å; W28-F162 HydrophobicContact CH2-CE1 3.87Å; W28-F162 AromaticContact CH2-CE2 3.46Å; W28-F162 HydrophobicContact CH2-CE2 3.46Å; W28-F162 VanDerWaalsContact CH2-CE2 3.46Å; W28-F162 AromaticContact CH2-CG 3.95Å; W28-F162 HydrophobicContact CH2-CG 3.95Å; W28-F162 AromaticContact CH2-CZ 3.58Å; W28-F162 HydrophobicContact CH2-CZ 3.58Å; W28-F162 AromaticContact CZ2-CD2 3.61Å; W28-F162 HydrophobicContact CZ2-CD2 3.61Å; W28-F162 AromaticContact CZ2-CE2 3.28Å; W28-F162 HydrophobicContact CZ2-CE2 3.28Å; W28-F162 HydrophobicContact CZ2-CG 4.35Å; W28-F162 AromaticContact CZ2-CZ 3.8Å; W28-F162 HydrophobicContact CZ2-CZ 3.8Å; W28-F162 HydrophobicContact CZ3-CE1 4.42Å; W28-F162 HydrophobicContact CZ3-CZ 4.26Å; W30-F162 HydrophobicContact CH2-CZ 4.41Å; M105-F162 HydrophobicContact SD-CD1 4.03Å; M105-F162 HydrophobicContact SD-CE1 4.4Å; L109-F162 HydrophobicContact CD2-CZ 4.3Å; L153-F162 HydrophobicContact CD2-CD2 3.7Å; L153-F162 HydrophobicContact CD2-CE2 3.67Å; L153-F162 HydrophobicContact CD2-CG 4.17Å; L153-F162 HydrophobicContact CD2-CZ 4.12Å; Q156-F162 HydrophobicContact CB-CB 4.23Å; Q156-F162 HydrophobicContact CB-CD2 4.17Å; G159-F162 WeakPolarHBondContact O-CB 3.48Å; G159-F162 PolarHBondContact O-N 3Å; G159-F162 VanDerWaalsContact O-N 3.13Å; F162-R164 PolarHBondContact O-N 3.17Å; F162-D165 PolarHBondContact O-N 3.34Å; F162-L166 HydrophobicContact CE1-CD2 4.02Å; F162-L166 VanDerWaalsContact O-CB 3.25Å; F162-L166 WeakPolarHBondContact O-CB 3.33Å; F162-L166 PolarHBondContact O-N 3.22Å |
| 163 | D | 89.6 | Confident | 88.2 | Confident | 66 Ų | 66 | 53.6 Ų | 53.6 | 35% | 0.353 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 177.2 | -175.8 | -87.4 | 0 | 0 | 0 | 111.9 | G159 Q161 L166 N167 | G159-D163 PolarHBondContact O-N 3.37Å; Q161-D163 VanDerWaalsContact C-N 3.34Å; Q161-D163 PolarHBondContact O-N 3.48Å; D163-L166 PolarHBondContact O-N 3.11Å; D163-N167 WeakPolarHBondContact O-CB 3.44Å; D163-N167 VanDerWaalsContact O-CG 3.26Å; D163-N167 PolarHBondContact O-N 2.83Å; D163-N167 PolarHBondContact O-ND2 3.48Å; D163-N167 VanDerWaalsContact O-ND2 3.1Å; D163-N167 PolarHBondContact OD1-ND2 3.13Å |
| 164 | R | 91.8 | Very high | 88.4 | Confident | 131 Ų | 131 | 54 Ų | 54 | 49% | 0.494 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.8 | -47 | 175.4 | -72.5 | 172.6 | -176.4 | 177.9 | 3.6 | 112.2 | Q160 Q161 F162 L166 N167 A168 | Q160-R164 VanDerWaalsContact CD-NH2 3.33Å; Q160-R164 VanDerWaalsContact NE2-NH2 3.16Å; Q160-R164 VanDerWaalsContact O-CG 3.29Å; Q160-R164 WeakPolarHBondContact O-CG 3.44Å; Q160-R164 PolarHBondContact O-N 3.45Å; Q160-R164 VanDerWaalsContact O-N 3.1Å; Q161-R164 PolarHBondContact O-N 3.31Å; F162-R164 PolarHBondContact O-N 3.17Å; R164-L166 VanDerWaalsContact C-N 3.31Å; R164-L166 PolarHBondContact O-N 2.91Å; R164-N167 PolarHBondContact O-N 2.9Å; R164-A168 WeakPolarHBondContact O-CB 3.28Å; R164-A168 PolarHBondContact O-N 3.48Å |
| 165 | D | 93.6 | Very high | 88.6 | Confident | 17 Ų | 17 | 54.6 Ų | 54.6 | 9% | 0.091 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -68.1 | -33.9 | -179.9 | -68.2 | -29.5 | 0 | 0 | 0 | 111 | I149 L153 Q161 F162 A168 A169 | I149-D165 HydrophobicContact CG2-CB 4.4Å; I149-D165 WeakPolarHBondContact CG2-O 3.34Å; L153-D165 HydrophobicContact CD2-CB 3.76Å; L153-D165 HydrophobicContact CG-CB 3.93Å; Q161-D165 PolarHBondContact NE2-OD1 2.74Å; Q161-D165 PolarHBondContact NE2-OD2 3.4Å; Q161-D165 VanDerWaalsContact NE2-OD2 3.14Å; Q161-D165 PolarHBondContact O-N 3.33Å; F162-D165 PolarHBondContact O-N 3.34Å; D165-A168 PolarHBondContact O-N 3.21Å; D165-A169 WeakPolarHBondContact O-CB 3.47Å; D165-A169 PolarHBondContact O-N 3.32Å |
| 166 | L | 92.6 | Very high | 88.9 | Confident | 1 Ų | 1 | 48.5 Ų | 48.5 | 1% | 0.005 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -67.4 | -44.2 | 175.9 | -177.4 | 58.7 | 0 | 0 | 0 | 110.8 | A108 L109 V112 L153 F162 D163 R164 A168 A169 H170 | A108-L166 HydrophobicContact CB-CD2 3.76Å; A108-L166 HydrophobicContact CB-CG 4.45Å; L109-L166 HydrophobicContact CB-CD1 4.03Å; L109-L166 HydrophobicContact CB-CD2 4.37Å; L109-L166 HydrophobicContact CD1-CD1 3.99Å; V112-L166 HydrophobicContact CG2-CD1 3.93Å; L153-L166 HydrophobicContact CD1-CD1 4.42Å; L153-L166 HydrophobicContact CD2-CB 4.04Å; F162-L166 HydrophobicContact CE1-CD2 4.02Å; F162-L166 VanDerWaalsContact O-CB 3.25Å; F162-L166 WeakPolarHBondContact O-CB 3.33Å; F162-L166 PolarHBondContact O-N 3.22Å; D163-L166 PolarHBondContact O-N 3.11Å; R164-L166 VanDerWaalsContact C-N 3.31Å; R164-L166 PolarHBondContact O-N 2.91Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A169 WeakPolarHBondContact O-CB 3.37Å; L166-A169 PolarHBondContact O-N 3.49Å; L166-H170 PolarHBondContact O-CD2 3.21Å; L166-H170 VanDerWaalsContact O-CD2 3.24Å; L166-H170 PolarHBondContact O-N 3.29Å |
| 167 | N | 92.4 | Very high | 89.5 | Confident | 43 Ų | 43 | 45.3 Ų | 45.3 | 23% | 0.23 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.6 | -40.5 | 173.8 | -71.9 | -31.3 | 0 | 0 | 0 | 111.6 | D163 R164 A169 H170 Q171 V209 | D163-N167 WeakPolarHBondContact O-CB 3.44Å; D163-N167 VanDerWaalsContact O-CG 3.26Å; D163-N167 PolarHBondContact O-N 2.83Å; D163-N167 PolarHBondContact O-ND2 3.48Å; D163-N167 VanDerWaalsContact O-ND2 3.1Å; D163-N167 PolarHBondContact OD1-ND2 3.13Å; R164-N167 PolarHBondContact O-N 2.9Å; N167-A169 VanDerWaalsContact C-N 3.32Å; N167-A169 PolarHBondContact O-N 3.47Å; N167-H170 PolarHBondContact O-N 2.94Å; N167-Q171 WeakPolarHBondContact O-CG 3.29Å; N167-Q171 PolarHBondContact O-N 3.18Å; N167-V209 WeakPolarHBondContact OD1-CG1 3.37Å |
| 168 | A | 94.5 | Very high | 90.9 | Very high | 37 Ų | 37 | 43.9 Ų | 43.9 | 31% | 0.306 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.7 | -40.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I149 R164 D165 L166 Q171 C172 | I149-A168 HydrophobicContact CD1-CB 4.15Å; I149-A168 HydrophobicContact CG2-CB 4.23Å; R164-A168 WeakPolarHBondContact O-CB 3.28Å; R164-A168 PolarHBondContact O-N 3.48Å; D165-A168 PolarHBondContact O-N 3.21Å; L166-A168 VanDerWaalsContact C-N 3.34Å; A168-Q171 PolarHBondContact O-N 3.2Å; A168-C172 WeakPolarHBondContact O-CB 3.49Å; A168-C172 PolarHBondContact O-N 2.83Å |
| 169 | A | 95.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.5 | -45.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V112 F146 I149 L153 D165 L166 N167 Q171 C172 L173 | V112-A169 HydrophobicContact CG1-CB 4.5Å; F146-A169 HydrophobicContact CE2-CB 4.1Å; I149-A169 HydrophobicContact CG2-CB 3.81Å; L153-A169 HydrophobicContact CD1-CB 4.05Å; D165-A169 WeakPolarHBondContact O-CB 3.47Å; D165-A169 PolarHBondContact O-N 3.32Å; L166-A169 WeakPolarHBondContact O-CB 3.37Å; L166-A169 PolarHBondContact O-N 3.49Å; N167-A169 VanDerWaalsContact C-N 3.32Å; N167-A169 PolarHBondContact O-N 3.47Å; A169-Q171 PolarHBondContact O-N 3.24Å; A169-C172 PolarHBondContact O-N 3.47Å; A169-L173 WeakPolarHBondContact O-CB 3.39Å; A169-L173 PolarHBondContact O-N 3.38Å |
| 170 | H | 93.9 | Very high | 93 | Very high | 2 Ų | 2 | 41.4 Ų | 41.4 | 1% | 0.009 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -56.5 | -49.9 | 174.1 | -87 | -75.4 | 0 | 0 | 0 | 112 | A108 V112 L166 N167 L173 K174 L206 | A108-H170 PolarHBondContact O-CE1 3.16Å; A108-H170 PolarHBondContact O-NE2 2.88Å; A108-H170 VanDerWaalsContact O-NE2 3.1Å; V112-H170 VanDerWaalsContact CG2-CD2 3.49Å; V112-H170 WeakPolarHBondContact CG2-CD2 3.18Å; V112-H170 WeakPolarHBondContact CG2-CE1 3.41Å; V112-H170 WeakPolarHBondContact CG2-NE2 3.46Å; L166-H170 PolarHBondContact O-CD2 3.21Å; L166-H170 VanDerWaalsContact O-CD2 3.24Å; L166-H170 PolarHBondContact O-N 3.29Å; N167-H170 PolarHBondContact O-N 2.94Å; H170-L173 PolarHBondContact O-N 3.49Å; H170-K174 WeakPolarHBondContact O-CB 3.45Å; H170-K174 WeakPolarHBondContact O-CG 3.46Å; H170-K174 PolarHBondContact O-N 2.9Å; H170-L206 WeakPolarHBondContact ND1-CD2 3.28Å |
| 171 | Q | 94.6 | Very high | 93.5 | Very high | 85 Ų | 85 | 35.8 Ų | 35.8 | 40% | 0.397 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -68.3 | -37.3 | -178.2 | -66 | -61.8 | -18.1 | 0 | 0 | 112.5 | N167 A168 A169 T175 | N167-Q171 WeakPolarHBondContact O-CG 3.29Å; N167-Q171 PolarHBondContact O-N 3.18Å; A168-Q171 PolarHBondContact O-N 3.2Å; A169-Q171 PolarHBondContact O-N 3.24Å; Q171-T175 WeakPolarHBondContact O-CB 3.47Å; Q171-T175 PolarHBondContact O-N 3.1Å; Q171-T175 PolarHBondContact O-OG1 3.44Å |
| 172 | C | 95.5 | Very high | 93.7 | Very high | 13 Ų | 13 | 37.8 Ų | 37.8 | 9% | 0.088 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64 | -46.8 | 174.9 | -170.3 | 0 | 0 | 0 | 0 | 110.6 | D142 F146 I149 A168 A169 K174 T175 I176 | D142-C172 PolarHBondContact O-SG 3.22Å; F146-C172 HydrophobicContact CD2-CB 4.26Å; I149-C172 HydrophobicContact CD1-CB 3.97Å; A168-C172 WeakPolarHBondContact O-CB 3.49Å; A168-C172 PolarHBondContact O-N 2.83Å; A169-C172 PolarHBondContact O-N 3.47Å; C172-K174 PolarHBondContact O-N 2.64Å; C172-T175 WeakPolarHBondContact O-CA 3.29Å; C172-T175 WeakPolarHBondContact O-CB 3.45Å; C172-T175 PolarHBondContact O-N 3.31Å; C172-I176 WeakPolarHBondContact O-CG1 3.46Å; C172-I176 PolarHBondContact O-N 2.85Å |
| 173 | L | 95.3 | Very high | 93.8 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.1 | -44.8 | 177 | -170.8 | 61.7 | 0 | 0 | 0 | 112 | V112 L119 F146 A169 H170 T175 I176 V177 L206 | V112-L173 HydrophobicContact CG1-CD2 4.45Å; L119-L173 HydrophobicContact CD2-CD1 3.45Å; L119-L173 VanDerWaalsContact CD2-CD1 3.45Å; F146-L173 HydrophobicContact CD2-CB 4.37Å; F146-L173 HydrophobicContact CE2-CB 4.01Å; F146-L173 HydrophobicContact CE2-CD1 4.43Å; F146-L173 HydrophobicContact CZ-CD1 4.34Å; A169-L173 WeakPolarHBondContact O-CB 3.39Å; A169-L173 PolarHBondContact O-N 3.38Å; H170-L173 PolarHBondContact O-N 3.49Å; L173-T175 PolarHBondContact O-N 2.93Å; L173-I176 PolarHBondContact O-N 3.11Å; L173-V177 WeakPolarHBondContact O-CG2 3.28Å; L173-V177 PolarHBondContact O-N 3.44Å; L173-L206 HydrophobicContact CB-CD1 4.41Å; L173-L206 HydrophobicContact CD2-CD1 4.07Å; L173-L206 HydrophobicContact CD2-CD2 3.99Å; L173-L206 HydrophobicContact CG-CD1 4.03Å |
| 174 | K | 95.2 | Very high | 93.8 | Very high | 7 Ų | 7 | 35 Ų | 35 | 3% | 0.03 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -54.7 | -41.8 | 171.6 | -79 | -174.5 | 173.7 | 177 | 0 | 111.7 | H170 C172 K178 L203 L206 P207 D208 | H170-K174 WeakPolarHBondContact O-CB 3.45Å; H170-K174 WeakPolarHBondContact O-CG 3.46Å; H170-K174 PolarHBondContact O-N 2.9Å; C172-K174 PolarHBondContact O-N 2.64Å; K174-K178 WeakPolarHBondContact O-CB 3.25Å; K174-K178 VanDerWaalsContact O-CG 3.27Å; K174-K178 WeakPolarHBondContact O-CG 3.43Å; K174-K178 PolarHBondContact O-N 2.95Å; K174-L203 HydrophobicContact CB-CD1 4.05Å; K174-L203 HydrophobicContact CG-CD1 3.94Å; K174-L206 HydrophobicContact CD-CB 4.45Å; K174-L206 WeakPolarHBondContact CE-O 3.27Å; K174-L206 HydrophobicContact CG-CB 3.97Å; K174-L206 HydrophobicContact CG-CD1 3.82Å; K174-L206 PolarHBondContact NZ-O 3.11Å; K174-P207 WeakPolarHBondContact CE-O 3.44Å; K174-P207 VanDerWaalsContact NZ-C 3.28Å; K174-P207 PolarHBondContact NZ-O 3.48Å; K174-D208 IonicContact NZ-OD2 3.7Å; K174-D208 PolarHBondContact NZ-OD2 2.84Å |
| 175 | T | 95.7 | Very high | 93.5 | Very high | 52 Ų | 52 | 31.7 Ų | 31.7 | 32% | 0.319 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -67.1 | -44.5 | -179.6 | -61.5 | 0 | 0 | 0 | 0 | 111.8 | Q171 C172 L173 V177 K178 K179 | Q171-T175 WeakPolarHBondContact O-CB 3.47Å; Q171-T175 PolarHBondContact O-N 3.1Å; Q171-T175 PolarHBondContact O-OG1 3.44Å; C172-T175 WeakPolarHBondContact O-CA 3.29Å; C172-T175 WeakPolarHBondContact O-CB 3.45Å; C172-T175 PolarHBondContact O-N 3.31Å; L173-T175 PolarHBondContact O-N 2.93Å; T175-V177 PolarHBondContact O-N 3.1Å; T175-K178 PolarHBondContact O-N 3.1Å; T175-K179 HydrophobicContact CG2-CD 4Å; T175-K179 WeakPolarHBondContact O-CB 3.49Å; T175-K179 WeakPolarHBondContact O-CG 3.22Å; T175-K179 PolarHBondContact O-N 3.43Å |
| 176 | I | 95.1 | Very high | 92.7 | Very high | 7 Ų | 7 | 36.4 Ų | 36.4 | 4% | 0.036 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -55.4 | -53.8 | 174.7 | -67.5 | 166.4 | 0 | 0 | 0 | 109.6 | L119 D142 F146 C172 L173 K178 K179 L180 | L119-I176 HydrophobicContact CD2-CG2 3.95Å; D142-I176 HydrophobicContact CB-CD1 4.27Å; D142-I176 HydrophobicContact CB-CG1 3.51Å; F146-I176 HydrophobicContact CB-CD1 3.84Å; F146-I176 HydrophobicContact CG-CD1 4.24Å; C172-I176 WeakPolarHBondContact O-CG1 3.46Å; C172-I176 PolarHBondContact O-N 2.85Å; L173-I176 PolarHBondContact O-N 3.11Å; I176-K178 PolarHBondContact O-N 2.73Å; I176-K179 PolarHBondContact O-N 2.93Å; I176-L180 HydrophobicContact CG2-CD1 3.96Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.1Å; I176-L180 PolarHBondContact O-N 3.36Å |
| 177 | V | 95.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.9 | -44.7 | -178 | 176 | 0 | 0 | 0 | 0 | 111.6 | L119 L173 T175 K179 L180 I181 L199 I202 L203 | L119-V177 HydrophobicContact CD1-CG2 4.19Å; L119-V177 HydrophobicContact CD2-CG2 4.26Å; L173-V177 WeakPolarHBondContact O-CG2 3.28Å; L173-V177 PolarHBondContact O-N 3.44Å; T175-V177 PolarHBondContact O-N 3.1Å; V177-K179 PolarHBondContact O-N 3.31Å; V177-L180 PolarHBondContact O-N 3.41Å; V177-I181 HydrophobicContact CG1-CD1 3.98Å; V177-I181 WeakPolarHBondContact O-CG1 3.21Å; V177-I181 PolarHBondContact O-N 2.91Å; V177-L199 HydrophobicContact CG1-CB 4.08Å; V177-L199 HydrophobicContact CG1-CD2 4.3Å; V177-L199 WeakPolarHBondContact CG1-O 3.13Å; V177-I202 HydrophobicContact CG2-CG2 4.07Å; V177-L203 HydrophobicContact CB-CD1 4.44Å; V177-L203 HydrophobicContact CG1-CB 4.01Å; V177-L203 HydrophobicContact CG1-CD1 4.32Å |
| 178 | K | 94.8 | Very high | 90.9 | Very high | 118 Ų | 118 | 41.6 Ų | 41.6 | 51% | 0.513 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.2 | -44.3 | 176.7 | -78.4 | 175.6 | -179.8 | 177.5 | 0 | 112.2 | K174 T175 I176 I181 Q182 L203 | K174-K178 WeakPolarHBondContact O-CB 3.25Å; K174-K178 VanDerWaalsContact O-CG 3.27Å; K174-K178 WeakPolarHBondContact O-CG 3.43Å; K174-K178 PolarHBondContact O-N 2.95Å; T175-K178 PolarHBondContact O-N 3.1Å; I176-K178 PolarHBondContact O-N 2.73Å; K178-I181 PolarHBondContact O-N 2.98Å; K178-Q182 WeakPolarHBondContact O-CB 3.41Å; K178-Q182 PolarHBondContact O-N 3.34Å; K178-L203 HydrophobicContact CG-CD1 4.11Å; K178-L203 HydrophobicContact CG-CD2 4.05Å |
| 179 | K | 94.6 | Very high | 90.4 | Very high | 68 Ų | 68 | 42.2 Ų | 42.2 | 30% | 0.296 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.3 | -38.6 | 178.4 | -76 | 174.3 | 178.3 | -179.4 | 0 | 111.6 | H139 D142 T175 I176 V177 Q182 S183 | H139-K179 HydrophobicContact CB-CD 4.03Å; D142-K179 IonicContact OD1-NZ 2.89Å; D142-K179 PolarHBondContact OD1-NZ 3.11Å; D142-K179 WeakPolarHBondContact OD2-CD 3.42Å; D142-K179 WeakPolarHBondContact OD2-CE 3.14Å; D142-K179 IonicContact OD2-NZ 2.66Å; D142-K179 PolarHBondContact OD2-NZ 3.44Å; T175-K179 HydrophobicContact CG2-CD 4Å; T175-K179 WeakPolarHBondContact O-CB 3.49Å; T175-K179 WeakPolarHBondContact O-CG 3.22Å; T175-K179 PolarHBondContact O-N 3.43Å; I176-K179 PolarHBondContact O-N 2.93Å; V177-K179 PolarHBondContact O-N 3.31Å; K179-Q182 PolarHBondContact O-N 3.05Å; K179-S183 PolarHBondContact O-N 3.45Å; K179-S183 PolarHBondContact O-OG 3.49Å; K179-S183 VanDerWaalsContact O-OG 3.12Å |
| 180 | L | 93.1 | Very high | 89.9 | Confident | 7 Ų | 7 | 49 Ų | 49 | 4% | 0.037 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 173.2 | -70.2 | 171.9 | 0 | 0 | 0 | 111.8 | L119 L127 F136 I138 I176 V177 Q182 S183 L184 L199 | L119-L180 HydrophobicContact CD1-CD1 3.84Å; L127-L180 HydrophobicContact CD1-CD1 4.12Å; L127-L180 HydrophobicContact CD1-CD2 4.03Å; F136-L180 HydrophobicContact CE2-CD2 4.48Å; I138-L180 HydrophobicContact CD1-CD2 3.86Å; I176-L180 HydrophobicContact CG2-CD1 3.96Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.1Å; I176-L180 PolarHBondContact O-N 3.36Å; V177-L180 PolarHBondContact O-N 3.41Å; L180-Q182 VanDerWaalsContact C-N 3.3Å; L180-Q182 PolarHBondContact O-N 2.88Å; L180-S183 PolarHBondContact O-N 2.87Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.48Å; L180-L184 PolarHBondContact O-N 2.89Å; L180-L199 HydrophobicContact CB-CD1 3.82Å; L180-L199 HydrophobicContact CB-CD2 4.46Å; L180-L199 HydrophobicContact CD1-CD2 4.13Å |
| 181 | I | 93.3 | Very high | 89.6 | Confident | 20 Ų | 20 | 51.1 Ų | 51.1 | 10% | 0.103 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.3 | -44.1 | 175 | -65.9 | 163.2 | 0 | 0 | 0 | 110.7 | V177 K178 L184 A185 L199 R200 | V177-I181 HydrophobicContact CG1-CD1 3.98Å; V177-I181 WeakPolarHBondContact O-CG1 3.21Å; V177-I181 PolarHBondContact O-N 2.91Å; K178-I181 PolarHBondContact O-N 2.98Å; I181-L184 PolarHBondContact O-N 3.29Å; I181-A185 WeakPolarHBondContact O-CB 3.18Å; I181-A185 PolarHBondContact O-N 2.81Å; I181-L199 HydrophobicContact CD1-CB 3.97Å; I181-L199 HydrophobicContact CG1-CB 3.58Å; I181-L199 HydrophobicContact CG1-CD1 4.06Å; I181-L199 HydrophobicContact CG1-CG 4.47Å; I181-R200 HydrophobicContact CD1-CG 3.8Å |
| 182 | Q | 92.8 | Very high | 89.2 | Confident | 120 Ų | 120 | 47.3 Ų | 47.3 | 56% | 0.561 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -65.2 | -38.5 | 179.2 | -175.1 | 59.5 | 65 | 0 | 0 | 112.5 | K178 K179 L180 L184 A185 N186 | K178-Q182 WeakPolarHBondContact O-CB 3.41Å; K178-Q182 PolarHBondContact O-N 3.34Å; K179-Q182 PolarHBondContact O-N 3.05Å; L180-Q182 VanDerWaalsContact C-N 3.3Å; L180-Q182 PolarHBondContact O-N 2.88Å; Q182-L184 VanDerWaalsContact C-N 3.34Å; Q182-A185 PolarHBondContact O-N 3.39Å; Q182-N186 PolarHBondContact O-ND2 3.07Å |
| 183 | S | 91 | Very high | 88.9 | Confident | 6 Ų | 6 | 50.9 Ų | 50.9 | 4% | 0.042 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 174.6 | -68.1 | 0 | 0 | 0 | 0 | 111.7 | P137 K179 L180 | P137-S183 PolarHBondContact O-OG 3.22Å; K179-S183 PolarHBondContact O-N 3.45Å; K179-S183 PolarHBondContact O-OG 3.49Å; K179-S183 VanDerWaalsContact O-OG 3.12Å; L180-S183 PolarHBondContact O-N 2.87Å |
| 184 | L | 89.2 | Confident | 88.8 | Confident | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -74.4 | -28.7 | 179.1 | -65.2 | 171.4 | 0 | 0 | 0 | 113.1 | L127 L130 F136 L180 I181 Q182 N186 L187 A195 C196 L199 | L127-L184 HydrophobicContact CD2-CD1 3.81Å; L127-L184 HydrophobicContact CD2-CD2 4.26Å; L130-L184 HydrophobicContact CD1-CD2 4.3Å; F136-L184 HydrophobicContact CD1-CD2 4.14Å; F136-L184 HydrophobicContact CD2-CD2 4.39Å; F136-L184 HydrophobicContact CE1-CD2 3.9Å; F136-L184 HydrophobicContact CE2-CD2 4.11Å; F136-L184 HydrophobicContact CG-CD2 4.39Å; F136-L184 HydrophobicContact CZ-CD2 3.88Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.48Å; L180-L184 PolarHBondContact O-N 2.89Å; I181-L184 PolarHBondContact O-N 3.29Å; Q182-L184 VanDerWaalsContact C-N 3.34Å; L184-N186 PolarHBondContact O-N 3.32Å; L184-N186 VanDerWaalsContact O-N 3.12Å; L184-L187 PolarHBondContact O-N 3.47Å; L184-A195 HydrophobicContact CD1-CB 4.08Å; L184-C196 WeakPolarHBondContact CB-SG 3.44Å; L184-L199 HydrophobicContact CD1-CD1 3.57Å |
| 185 | A | 85.5 | Confident | 88.6 | Confident | 61 Ų | 61 | 54.5 Ų | 54.5 | 50% | 0.504 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -60 | -24.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | I181 Q182 L187 | I181-A185 WeakPolarHBondContact O-CB 3.18Å; I181-A185 PolarHBondContact O-N 2.81Å; Q182-A185 PolarHBondContact O-N 3.39Å; A185-L187 VanDerWaalsContact C-N 3.25Å; A185-L187 PolarHBondContact O-N 3.4Å |
| 186 | N | 77.4 | Confident | 88.4 | Confident | 116 Ų | 116 | 53 Ų | 53 | 62% | 0.62 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -4 | 178.2 | -61.3 | -39 | 0 | 0 | 0 | 113.3 | Q182 L184 | Q182-N186 PolarHBondContact O-ND2 3.07Å; L184-N186 PolarHBondContact O-N 3.32Å; L184-N186 VanDerWaalsContact O-N 3.12Å |
| 187 | L | 74.8 | Confident | 88.3 | Confident | 40 Ų | 40 | 55.3 Ų | 55.3 | 21% | 0.209 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -137.9 | 66.5 | -171.6 | -65.9 | 164.8 | 0 | 0 | 0 | 111.7 | F136 L184 A185 S189 H192 | F136-L187 HydrophobicContact CB-CD1 3.83Å; L184-L187 PolarHBondContact O-N 3.47Å; A185-L187 VanDerWaalsContact C-N 3.25Å; A185-L187 PolarHBondContact O-N 3.4Å; L187-S189 PolarHBondContact O-N 3.12Å; L187-S189 VanDerWaalsContact O-N 3.15Å; L187-H192 WeakPolarHBondContact O-CB 3.31Å; L187-H192 PolarHBondContact O-CD2 3.44Å; L187-H192 PolarHBondContact O-ND1 2.86Å |
| 188 | P | 72.8 | Confident | 88.2 | Confident | 112 Ų | 112 | 57 Ų | 57 | 73% | 0.727 | 33% | 0.334 | S | S | * | . | trans | -69.1 | 116.4 | -176.3 | 27.7 | -33.3 | 0 | 0 | 0 | 111.8 | ||||
| 189 | S | 83.3 | Confident | 88.2 | Confident | 50 Ų | 50 | 51.3 Ų | 51.3 | 35% | 0.35 | 31% | 0.31 | S | S | . | . | trans | -142.7 | 158.1 | 162.9 | 127.2 | 0 | 0 | 0 | 0 | 107.6 | L187 A191 H192 V193 | L187-S189 PolarHBondContact O-N 3.12Å; L187-S189 VanDerWaalsContact O-N 3.15Å; S189-A191 PolarHBondContact O-N 2.94Å; S189-A191 VanDerWaalsContact O-N 3.15Å; S189-H192 VanDerWaalsContact CB-ND1 3.29Å; S189-H192 WeakPolarHBondContact CB-ND1 3.45Å; S189-H192 WeakPolarHBondContact O-CA 3.41Å; S189-H192 VanDerWaalsContact O-CB 3.31Å; S189-H192 WeakPolarHBondContact O-CB 3.16Å; S189-H192 PolarHBondContact O-N 3.38Å; S189-H192 PolarHBondContact OG-ND1 3.38Å; S189-V193 PolarHBondContact O-N 2.76Å | ||
| 190 | D | 85.7 | Confident | 88.2 | Confident | 143 Ų | 143 | 55.2 Ų | 55.2 | 77% | 0.765 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -54.6 | -38 | -175.5 | -66.5 | -30.5 | 0 | 0 | 0 | 112.6 | H192 V193 V194 | D190-H192 VanDerWaalsContact C-N 3.34Å; D190-H192 PolarHBondContact O-N 3.03Å; D190-V193 WeakPolarHBondContact O-CB 3.31Å; D190-V193 PolarHBondContact O-N 2.94Å; D190-V194 WeakPolarHBondContact O-CG2 3.36Å; D190-V194 PolarHBondContact O-N 2.82Å; D190-V194 VanDerWaalsContact O-N 3.12Å |
| 191 | A | 86.2 | Confident | 88.3 | Confident | 46 Ų | 46 | 60.1 Ų | 60.1 | 38% | 0.38 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -65.8 | -34.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | L130 S189 V194 A195 | L130-A191 HydrophobicContact CD2-CB 3.72Å; S189-A191 PolarHBondContact O-N 2.94Å; S189-A191 VanDerWaalsContact O-N 3.15Å; A191-V194 PolarHBondContact O-N 3.2Å; A191-A195 PolarHBondContact O-N 2.97Å |
| 192 | H | 87.5 | Confident | 88.2 | Confident | 5 Ų | 5 | 59.2 Ų | 59.2 | 2% | 0.023 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -70.8 | -33.1 | 174.7 | -61.1 | 73.7 | 0 | 0 | 0 | 111.5 | L187 S189 D190 A195 C196 | L187-H192 WeakPolarHBondContact O-CB 3.31Å; L187-H192 PolarHBondContact O-CD2 3.44Å; L187-H192 PolarHBondContact O-ND1 2.86Å; S189-H192 VanDerWaalsContact CB-ND1 3.29Å; S189-H192 WeakPolarHBondContact CB-ND1 3.45Å; S189-H192 WeakPolarHBondContact O-CA 3.41Å; S189-H192 VanDerWaalsContact O-CB 3.31Å; S189-H192 WeakPolarHBondContact O-CB 3.16Å; S189-H192 PolarHBondContact O-N 3.38Å; S189-H192 PolarHBondContact OG-ND1 3.38Å; D190-H192 VanDerWaalsContact C-N 3.34Å; D190-H192 PolarHBondContact O-N 3.03Å; H192-A195 PolarHBondContact O-N 3.34Å; H192-C196 VanDerWaalsContact O-CB 3.28Å; H192-C196 WeakPolarHBondContact O-CB 3.31Å; H192-C196 PolarHBondContact O-N 3.1Å; H192-C196 PolarHBondContact O-SG 2.85Å |
| 193 | V | 89.4 | Confident | 88.1 | Confident | 89 Ų | 89 | 55.6 Ų | 55.6 | 54% | 0.539 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -64.7 | -44.7 | 175.2 | 177.3 | 0 | 0 | 0 | 0 | 110.3 | S189 D190 C196 A197 | S189-V193 PolarHBondContact O-N 2.76Å; D190-V193 WeakPolarHBondContact O-CB 3.31Å; D190-V193 PolarHBondContact O-N 2.94Å; V193-C196 PolarHBondContact O-N 2.96Å; V193-A197 WeakPolarHBondContact O-CB 3.37Å; V193-A197 PolarHBondContact O-N 3.22Å |
| 194 | V | 91.6 | Very high | 88 | Confident | 82 Ų | 82 | 62.7 Ų | 62.7 | 50% | 0.497 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.3 | -49.1 | 175.3 | 177.2 | 0 | 0 | 0 | 0 | 110.7 | L126 D190 A191 C196 A197 S198 | L126-V194 HydrophobicContact CD1-CG1 4.38Å; D190-V194 WeakPolarHBondContact O-CG2 3.36Å; D190-V194 PolarHBondContact O-N 2.82Å; D190-V194 VanDerWaalsContact O-N 3.12Å; A191-V194 PolarHBondContact O-N 3.2Å; V194-C196 VanDerWaalsContact C-N 3.34Å; V194-C196 PolarHBondContact O-N 3.2Å; V194-A197 WeakPolarHBondContact O-CB 3.46Å; V194-A197 PolarHBondContact O-N 3.46Å; V194-A197 VanDerWaalsContact O-N 3.13Å; V194-S198 PolarHBondContact O-N 2.98Å; V194-S198 PolarHBondContact O-OG 3.3Å |
| 195 | A | 91.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -58.8 | -43 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L126 L127 L130 L184 A191 H192 A197 S198 L199 | L126-A195 HydrophobicContact CB-CB 4.1Å; L126-A195 HydrophobicContact CD1-CB 4.37Å; L127-A195 HydrophobicContact CD2-CB 3.87Å; L130-A195 HydrophobicContact CD1-CB 3.82Å; L184-A195 HydrophobicContact CD1-CB 4.08Å; A191-A195 PolarHBondContact O-N 2.97Å; H192-A195 PolarHBondContact O-N 3.34Å; A195-A197 PolarHBondContact O-N 3.25Å; A195-S198 PolarHBondContact O-N 2.94Å; A195-L199 WeakPolarHBondContact O-CB 3.29Å; A195-L199 VanDerWaalsContact O-CG 3.31Å; A195-L199 WeakPolarHBondContact O-CG 3.41Å; A195-L199 PolarHBondContact O-N 3.32Å |
| 196 | C | 91.6 | Very high | 87.7 | Confident | 20 Ų | 20 | 63.2 Ų | 63.2 | 14% | 0.135 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63 | -39.5 | 175.2 | -76.2 | 0 | 0 | 0 | 0 | 112.5 | L184 H192 V193 V194 R200 | L184-C196 WeakPolarHBondContact CB-SG 3.44Å; H192-C196 VanDerWaalsContact O-CB 3.28Å; H192-C196 WeakPolarHBondContact O-CB 3.31Å; H192-C196 PolarHBondContact O-N 3.1Å; H192-C196 PolarHBondContact O-SG 2.85Å; V193-C196 PolarHBondContact O-N 2.96Å; V194-C196 VanDerWaalsContact C-N 3.34Å; V194-C196 PolarHBondContact O-N 3.2Å; C196-R200 WeakPolarHBondContact O-CB 3.38Å; C196-R200 WeakPolarHBondContact O-CG 3.42Å; C196-R200 PolarHBondContact O-N 3.09Å |
| 197 | A | 92.6 | Very high | 87.3 | Confident | 57 Ų | 57 | 59.5 Ų | 59.5 | 47% | 0.471 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64.2 | -45.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111 | V193 V194 A195 R200 Q201 | V193-A197 WeakPolarHBondContact O-CB 3.37Å; V193-A197 PolarHBondContact O-N 3.22Å; V194-A197 WeakPolarHBondContact O-CB 3.46Å; V194-A197 PolarHBondContact O-N 3.46Å; V194-A197 VanDerWaalsContact O-N 3.13Å; A195-A197 PolarHBondContact O-N 3.25Å; A197-R200 PolarHBondContact O-N 2.92Å; A197-Q201 PolarHBondContact O-N 3.45Å |
| 198 | S | 94 | Very high | 86.6 | Confident | 34 Ų | 34 | 64.4 Ų | 64.4 | 24% | 0.238 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -61.2 | -44.8 | 175.3 | -59.4 | 0 | 0 | 0 | 0 | 112.2 | V194 A195 R200 Q201 I202 | V194-S198 PolarHBondContact O-N 2.98Å; V194-S198 PolarHBondContact O-OG 3.3Å; A195-S198 PolarHBondContact O-N 2.94Å; S198-R200 VanDerWaalsContact C-N 3.34Å; S198-R200 PolarHBondContact O-N 2.89Å; S198-Q201 WeakPolarHBondContact O-CB 3.36Å; S198-Q201 PolarHBondContact O-N 2.83Å; S198-Q201 VanDerWaalsContact O-N 3.14Å; S198-I202 WeakPolarHBondContact O-CG1 3.5Å; S198-I202 PolarHBondContact O-N 3.06Å |
| 199 | L | 94.5 | Very high | 85.7 | Confident | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -63.3 | -38.2 | 175.8 | -71.8 | 169.9 | 0 | 0 | 0 | 112.3 | L119 V122 V177 L180 I181 L184 A195 Q201 I202 L203 | L119-L199 HydrophobicContact CD1-CD2 3.76Å; V122-L199 HydrophobicContact CG1-CD2 3.92Å; V122-L199 HydrophobicContact CG1-CG 4.06Å; V177-L199 HydrophobicContact CG1-CB 4.08Å; V177-L199 HydrophobicContact CG1-CD2 4.3Å; V177-L199 WeakPolarHBondContact CG1-O 3.13Å; L180-L199 HydrophobicContact CB-CD1 3.82Å; L180-L199 HydrophobicContact CB-CD2 4.46Å; L180-L199 HydrophobicContact CD1-CD2 4.13Å; I181-L199 HydrophobicContact CD1-CB 3.97Å; I181-L199 HydrophobicContact CG1-CB 3.58Å; I181-L199 HydrophobicContact CG1-CD1 4.06Å; I181-L199 HydrophobicContact CG1-CG 4.47Å; L184-L199 HydrophobicContact CD1-CD1 3.57Å; A195-L199 WeakPolarHBondContact O-CB 3.29Å; A195-L199 VanDerWaalsContact O-CG 3.31Å; A195-L199 WeakPolarHBondContact O-CG 3.41Å; A195-L199 PolarHBondContact O-N 3.32Å; L199-Q201 VanDerWaalsContact C-N 3.3Å; L199-Q201 PolarHBondContact O-N 3.23Å; L199-I202 HydrophobicContact CD2-CD1 4.47Å; L199-I202 PolarHBondContact O-N 3.4Å; L199-L203 PolarHBondContact O-N 3.32Å |
| 200 | R | 94.3 | Very high | 85.8 | Confident | 149 Ų | 149 | 65.5 Ų | 65.5 | 56% | 0.562 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -66.6 | -32 | 174.2 | -75.4 | 172 | -175.4 | -111.9 | 2.8 | 112.3 | I181 C196 A197 S198 L203 Q204 | I181-R200 HydrophobicContact CD1-CG 3.8Å; C196-R200 WeakPolarHBondContact O-CB 3.38Å; C196-R200 WeakPolarHBondContact O-CG 3.42Å; C196-R200 PolarHBondContact O-N 3.09Å; A197-R200 PolarHBondContact O-N 2.92Å; S198-R200 VanDerWaalsContact C-N 3.34Å; S198-R200 PolarHBondContact O-N 2.89Å; R200-L203 PolarHBondContact O-N 3.07Å; R200-Q204 WeakPolarHBondContact O-CG 3.47Å; R200-Q204 PolarHBondContact O-N 2.96Å; R200-Q204 VanDerWaalsContact O-N 3.13Å; R200-Q204 PolarHBondContact O-NE2 3.13Å |
| 201 | Q | 94.1 | Very high | 85.8 | Confident | 110 Ų | 110 | 61.4 Ų | 61.4 | 51% | 0.514 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65.8 | -46.8 | 173.6 | -175.5 | 178.6 | -44.7 | 0 | 0 | 110.8 | A197 S198 L199 L203 Q204 N205 | A197-Q201 PolarHBondContact O-N 3.45Å; S198-Q201 WeakPolarHBondContact O-CB 3.36Å; S198-Q201 PolarHBondContact O-N 2.83Å; S198-Q201 VanDerWaalsContact O-N 3.14Å; L199-Q201 VanDerWaalsContact C-N 3.3Å; L199-Q201 PolarHBondContact O-N 3.23Å; Q201-L203 VanDerWaalsContact C-N 3.27Å; Q201-L203 PolarHBondContact O-N 3.01Å; Q201-Q204 WeakPolarHBondContact O-CB 3.47Å; Q201-Q204 PolarHBondContact O-N 3.42Å; Q201-N205 PolarHBondContact O-N 3.1Å; Q201-N205 VanDerWaalsContact O-N 3.14Å |
| 202 | I | 93 | Very high | 85.8 | Confident | 1 Ų | 1 | 62.2 Ų | 62.2 | 1% | 0.005 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -56.9 | -43.6 | 174.4 | -63.2 | 166.4 | 0 | 0 | 0 | 110.6 | E118 L119 V122 V177 S198 L199 Q204 N205 L206 | E118-I202 HydrophobicContact CB-CD1 3.9Å; E118-I202 HydrophobicContact CB-CG1 3.8Å; L119-I202 HydrophobicContact CB-CD1 4.3Å; V122-I202 HydrophobicContact CB-CD1 4.42Å; V122-I202 HydrophobicContact CG2-CD1 3.95Å; V177-I202 HydrophobicContact CG2-CG2 4.07Å; S198-I202 WeakPolarHBondContact O-CG1 3.5Å; S198-I202 PolarHBondContact O-N 3.06Å; L199-I202 HydrophobicContact CD2-CD1 4.47Å; L199-I202 PolarHBondContact O-N 3.4Å; I202-Q204 VanDerWaalsContact C-N 3.28Å; I202-Q204 PolarHBondContact O-N 2.72Å; I202-N205 PolarHBondContact O-N 2.7Å; I202-L206 PolarHBondContact O-N 2.84Å |
| 203 | L | 90.8 | Very high | 85.7 | Confident | 44 Ų | 44 | 65.6 Ų | 65.6 | 23% | 0.23 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62.2 | -34.1 | 178.7 | -167.9 | 68.6 | 0 | 0 | 0 | 113 | K174 V177 K178 L199 R200 Q201 L206 | K174-L203 HydrophobicContact CB-CD1 4.05Å; K174-L203 HydrophobicContact CG-CD1 3.94Å; V177-L203 HydrophobicContact CB-CD1 4.44Å; V177-L203 HydrophobicContact CG1-CB 4.01Å; V177-L203 HydrophobicContact CG1-CD1 4.32Å; K178-L203 HydrophobicContact CG-CD1 4.11Å; K178-L203 HydrophobicContact CG-CD2 4.05Å; L199-L203 PolarHBondContact O-N 3.32Å; R200-L203 PolarHBondContact O-N 3.07Å; Q201-L203 VanDerWaalsContact C-N 3.27Å; Q201-L203 PolarHBondContact O-N 3.01Å; L203-L206 PolarHBondContact O-N 3.24Å |
| 204 | Q | 88.2 | Confident | 85.4 | Confident | 155 Ų | 155 | 64.1 Ų | 64.1 | 72% | 0.724 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -73.4 | -28.8 | 177.4 | -74.9 | 170.5 | 89.3 | 0 | 0 | 112.8 | R200 Q201 I202 L206 | R200-Q204 WeakPolarHBondContact O-CG 3.47Å; R200-Q204 PolarHBondContact O-N 2.96Å; R200-Q204 VanDerWaalsContact O-N 3.13Å; R200-Q204 PolarHBondContact O-NE2 3.13Å; Q201-Q204 WeakPolarHBondContact O-CB 3.47Å; Q201-Q204 PolarHBondContact O-N 3.42Å; I202-Q204 VanDerWaalsContact C-N 3.28Å; I202-Q204 PolarHBondContact O-N 2.72Å; Q204-L206 PolarHBondContact O-N 3.11Å |
| 205 | N | 85.1 | Confident | 85 | Confident | 69 Ų | 69 | 62.9 Ų | 62.9 | 37% | 0.369 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -72.9 | -14 | 176.8 | -67.6 | -18.7 | 0 | 0 | 0 | 112.7 | Q201 I202 P207 | Q201-N205 PolarHBondContact O-N 3.1Å; Q201-N205 VanDerWaalsContact O-N 3.14Å; I202-N205 PolarHBondContact O-N 2.7Å; N205-P207 WeakPolarHBondContact O-CD 3.48Å |
| 206 | L | 82.1 | Confident | 84.5 | Confident | 5 Ų | 5 | 67.4 Ų | 67.4 | 3% | 0.026 | 36% | 0.358 | C | S | . | . | S | Bend | trans | -93.7 | 98.4 | 176.2 | -66 | 165.6 | 0 | 0 | 0 | 110 | S115 H170 L173 K174 I202 L203 Q204 | S115-L206 WeakPolarHBondContact OG-CD2 3.34Å; H170-L206 WeakPolarHBondContact ND1-CD2 3.28Å; L173-L206 HydrophobicContact CB-CD1 4.41Å; L173-L206 HydrophobicContact CD2-CD1 4.07Å; L173-L206 HydrophobicContact CD2-CD2 3.99Å; L173-L206 HydrophobicContact CG-CD1 4.03Å; K174-L206 HydrophobicContact CD-CB 4.45Å; K174-L206 WeakPolarHBondContact CE-O 3.27Å; K174-L206 HydrophobicContact CG-CB 3.97Å; K174-L206 HydrophobicContact CG-CD1 3.82Å; K174-L206 PolarHBondContact NZ-O 3.11Å; I202-L206 PolarHBondContact O-N 2.84Å; L203-L206 PolarHBondContact O-N 3.24Å; Q204-L206 PolarHBondContact O-N 3.11Å |
| 207 | P | 69.4 | Low | 84 | Confident | 39 Ų | 39 | 71.1 Ų | 71.1 | 25% | 0.253 | 38% | 0.375 | S | S | . | . | trans | -62.6 | 155.1 | 179.2 | 29.3 | -37.8 | 0 | 0 | 0 | 111.7 | K174 N205 V209 | K174-P207 WeakPolarHBondContact CE-O 3.44Å; K174-P207 VanDerWaalsContact NZ-C 3.28Å; K174-P207 PolarHBondContact NZ-O 3.48Å; N205-P207 WeakPolarHBondContact O-CD 3.48Å; P207-V209 HydrophobicContact CG-CG2 4.48Å; P207-V209 PolarHBondContact O-N 3.49Å | ||
| 208 | D | 60.5 | Low | 83.3 | Confident | 142 Ų | 142 | 72.3 Ų | 72.3 | 76% | 0.759 | 37% | 0.367 | S | S | * | . | trans | -72.8 | 101 | 160.9 | -97.4 | -103.4 | 0 | 0 | 0 | 107.5 | K174 | K174-D208 IonicContact NZ-OD2 3.7Å; K174-D208 PolarHBondContact NZ-OD2 2.84Å | ||
| 209 | V | 53.2 | Low | 82.3 | Confident | 119 Ų | 119 | 75.7 Ų | 75.7 | 72% | 0.721 | 38% | 0.379 | S | S | * | . | trans | -77.1 | 0 | 165.3 | 169.9 | 0 | 0 | 0 | 0 | 108.9 | N167 P207 | N167-V209 WeakPolarHBondContact OD1-CG1 3.37Å; P207-V209 HydrophobicContact CG-CG2 4.48Å; P207-V209 PolarHBondContact O-N 3.49Å |
Retrieved 209 of 209 residues in 38.2 ms
(Link to these results)