| 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 | 92.6 | Very high | 96.4 | Very high | 30 Ų | 30 | 47.5 Ų | 47.5 | 15% | 0.148 | 26% | 0.263 | C | S | . | . | 0 | -62.9 | 0 | -164 | 171.1 | 179.1 | 0 | 0 | 109.8 | L3 I4 L5 L268 R271 I275 F334 V337 M338 | M1-L3 PolarHBondContact O-N 2.91Å; M1-I4 PolarHBondContact O-N 3.41Å; M1-L5 HydrophobicContact CG-CD1 4.27Å; M1-L5 PolarHBondContact O-N 3.14Å; M1-L268 HydrophobicContact CE-CD1 4.21Å; M1-L268 HydrophobicContact CG-CD1 3.83Å; M1-R271 HydrophobicContact CB-CG 4Å; M1-I275 HydrophobicContact SD-CD1 3.79Å; M1-F334 HydrophobicContact CE-CB 3.97Å; M1-F334 HydrophobicContact CE-CD1 3.26Å; M1-F334 HydrophobicContact CE-CE1 4.08Å; M1-F334 HydrophobicContact CE-CG 3.98Å; M1-V337 HydrophobicContact CE-CB 4.08Å; M1-V337 HydrophobicContact CE-CG1 3.9Å; M1-V337 HydrophobicContact SD-CG1 4.04Å; M1-M338 HydrophobicContact CB-CE 4.1Å; M1-M338 HydrophobicContact CG-CE 3.78Å; M1-M338 HydrophobicContact SD-CE 4.14Å; M1-M338 HydrophobicContact SD-CG 3.94Å | |||
| 2 | L | 95.1 | Very high | 96.3 | Very high | 81 Ų | 81 | 43.5 Ų | 43.5 | 42% | 0.424 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -51.6 | -50.6 | 175.7 | -178.9 | 61.6 | 0 | 0 | 0 | 113.3 | I4 L5 L6 M41 M338 | L2-I4 VanDerWaalsContact C-N 3.29Å; L2-I4 PolarHBondContact O-N 3.22Å; L2-L5 WeakPolarHBondContact O-CB 3.43Å; L2-L5 PolarHBondContact O-N 3.28Å; L2-L5 VanDerWaalsContact O-N 3.16Å; L2-L6 HydrophobicContact CD1-CD1 4.33Å; L2-L6 HydrophobicContact CD1-CG 4.25Å; L2-L6 HydrophobicContact CG-CD1 4.13Å; L2-L6 HydrophobicContact CG-CG 4.45Å; L2-L6 WeakPolarHBondContact O-CG 3.47Å; L2-L6 PolarHBondContact O-N 3.13Å; L2-M41 HydrophobicContact CD1-CE 3.42Å; L2-M41 VanDerWaalsContact CD1-CE 3.42Å; L2-M338 HydrophobicContact CB-CE 4.2Å |
| 3 | L | 96.5 | Very high | 96.1 | Very high | 143 Ų | 143 | 41.8 Ų | 41.8 | 75% | 0.749 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -58.5 | -37.8 | 177.4 | -66.2 | 174.7 | 0 | 0 | 0 | 113.5 | M1 L6 A7 | M1-L3 PolarHBondContact O-N 2.91Å; L3-L6 PolarHBondContact O-N 3.42Å; L3-A7 WeakPolarHBondContact O-CB 3.36Å; L3-A7 PolarHBondContact O-N 3.09Å |
| 4 | I | 97.4 | Very high | 95.9 | Very high | 32 Ų | 32 | 44.9 Ų | 44.9 | 16% | 0.164 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -69.6 | -41.1 | 178.7 | -57.2 | 164 | 0 | 0 | 0 | 109.9 | M1 L2 A7 L8 L264 L267 L268 R271 | M1-I4 PolarHBondContact O-N 3.41Å; L2-I4 VanDerWaalsContact C-N 3.29Å; L2-I4 PolarHBondContact O-N 3.22Å; I4-A7 PolarHBondContact O-N 3.28Å; I4-L8 HydrophobicContact CG2-CD1 4.31Å; I4-L8 PolarHBondContact O-N 3.37Å; I4-L264 HydrophobicContact CG2-CD2 4.31Å; I4-L264 WeakPolarHBondContact CG2-O 3.36Å; I4-L267 HydrophobicContact CD1-CB 4Å; I4-L267 HydrophobicContact CG2-CB 4.5Å; I4-L268 HydrophobicContact CG2-CB 3.87Å; I4-L268 HydrophobicContact CG2-CD1 4.46Å; I4-R271 HydrophobicContact CD1-CB 4.47Å |
| 5 | L | 97.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.5 | -44.9 | 174.9 | -70.5 | 170.1 | 0 | 0 | 0 | 111.3 | M1 L2 A7 L8 L9 M41 L268 L319 F334 M338 | M1-L5 HydrophobicContact CG-CD1 4.27Å; M1-L5 PolarHBondContact O-N 3.14Å; L2-L5 WeakPolarHBondContact O-CB 3.43Å; L2-L5 PolarHBondContact O-N 3.28Å; L2-L5 VanDerWaalsContact O-N 3.16Å; L5-A7 VanDerWaalsContact C-N 3.34Å; L5-A7 PolarHBondContact O-N 3.18Å; L5-L8 PolarHBondContact O-N 3.1Å; L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 3.08Å; L5-M41 HydrophobicContact CD1-SD 3.56Å; L5-M41 VanDerWaalsContact CD1-SD 3.56Å; L5-L268 HydrophobicContact CD2-CD1 3.82Å; L5-L268 HydrophobicContact CD2-CD2 3.6Å; L5-L268 HydrophobicContact CD2-CG 4.39Å; L5-L268 HydrophobicContact CG-CD1 3.91Å; L5-L319 HydrophobicContact CD2-CD1 3.67Å; L5-F334 HydrophobicContact CD1-CB 3.95Å; L5-F334 HydrophobicContact CD1-CD2 4.14Å; L5-F334 HydrophobicContact CD1-CG 3.98Å; L5-F334 HydrophobicContact CD2-CD1 4.45Å; L5-F334 HydrophobicContact CD2-CD2 3.65Å; L5-F334 HydrophobicContact CD2-CE1 4.38Å; L5-F334 HydrophobicContact CD2-CE2 3.64Å; L5-F334 HydrophobicContact CD2-CG 4.09Å; L5-F334 HydrophobicContact CD2-CZ 4Å; L5-M338 HydrophobicContact CD1-CE 3.52Å |
| 6 | L | 97.4 | Very high | 95.4 | Very high | 65 Ų | 65 | 39.5 Ų | 39.5 | 34% | 0.34 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.5 | -43.7 | 176.2 | -69.3 | 174.2 | 0 | 0 | 0 | 111.5 | L2 L3 L8 L9 V10 L38 | L2-L6 HydrophobicContact CD1-CD1 4.33Å; L2-L6 HydrophobicContact CD1-CG 4.25Å; L2-L6 HydrophobicContact CG-CD1 4.13Å; L2-L6 HydrophobicContact CG-CG 4.45Å; L2-L6 WeakPolarHBondContact O-CG 3.47Å; L2-L6 PolarHBondContact O-N 3.13Å; L3-L6 PolarHBondContact O-N 3.42Å; L6-L8 PolarHBondContact O-N 3.49Å; L6-L9 PolarHBondContact O-N 3.07Å; L6-V10 WeakPolarHBondContact O-CG2 3.49Å; L6-V10 PolarHBondContact O-N 2.94Å; L6-L38 HydrophobicContact CD2-CD1 4.22Å; L6-L38 HydrophobicContact CD2-CD2 3.88Å |
| 7 | A | 97.7 | Very high | 95.2 | Very high | 44 Ų | 44 | 41.1 Ų | 41.1 | 36% | 0.364 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60 | -44.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L3 I4 L5 L9 Y11 L264 | L3-A7 WeakPolarHBondContact O-CB 3.36Å; L3-A7 PolarHBondContact O-N 3.09Å; I4-A7 PolarHBondContact O-N 3.28Å; L5-A7 VanDerWaalsContact C-N 3.34Å; L5-A7 PolarHBondContact O-N 3.18Å; A7-L9 PolarHBondContact O-N 3.02Å; A7-Y11 VanDerWaalsContact O-CB 3.28Å; A7-Y11 WeakPolarHBondContact O-CB 3.37Å; A7-Y11 PolarHBondContact O-N 2.96Å; A7-L264 HydrophobicContact CB-CD1 4.49Å; A7-L264 HydrophobicContact CB-CD2 4.01Å |
| 8 | L | 97.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63.4 | -37.5 | 175.2 | -81.3 | 167.6 | 0 | 0 | 0 | 113 | I4 L5 L6 S12 L261 L264 Y265 L268 L319 | I4-L8 HydrophobicContact CG2-CD1 4.31Å; I4-L8 PolarHBondContact O-N 3.37Å; L5-L8 PolarHBondContact O-N 3.1Å; L6-L8 PolarHBondContact O-N 3.49Å; L8-S12 WeakPolarHBondContact O-CB 3.44Å; L8-S12 PolarHBondContact O-N 3.05Å; L8-S12 PolarHBondContact O-OG 3.42Å; L8-L261 HydrophobicContact CD2-CD1 4Å; L8-L264 HydrophobicContact CD1-CB 4.25Å; L8-L264 HydrophobicContact CD2-CB 3.51Å; L8-L264 HydrophobicContact CD2-CD1 3.8Å; L8-L264 HydrophobicContact CD2-CG 4.3Å; L8-L264 HydrophobicContact CG-CB 3.75Å; L8-L264 HydrophobicContact CG-CD1 4.07Å; L8-L264 HydrophobicContact CG-CG 4.43Å; L8-Y265 HydrophobicContact CD1-CD1 4.32Å; L8-Y265 HydrophobicContact CD1-CE1 4.44Å; L8-Y265 HydrophobicContact CD2-CE1 4.46Å; L8-L268 HydrophobicContact CD1-CD2 3.72Å; L8-L319 HydrophobicContact CB-CD1 4.5Å; L8-L319 HydrophobicContact CD1-CD1 4.34Å |
| 9 | L | 96.9 | Very high | 94.4 | Very high | 5 Ų | 5 | 36.8 Ų | 36.8 | 3% | 0.026 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -74 | -36.7 | -179.9 | -68.2 | 166.9 | 0 | 0 | 0 | 112.2 | L5 L6 A7 S12 A13 I34 L38 L319 L327 M331 | L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 3.08Å; L6-L9 PolarHBondContact O-N 3.07Å; A7-L9 PolarHBondContact O-N 3.02Å; L9-S12 WeakPolarHBondContact CA-OG 3.33Å; L9-S12 PolarHBondContact O-OG 3.45Å; L9-A13 PolarHBondContact O-N 2.91Å; L9-I34 HydrophobicContact CB-CG2 4.26Å; L9-I34 HydrophobicContact CD1-CG2 4.22Å; L9-I34 HydrophobicContact CD2-CG1 4.11Å; L9-I34 HydrophobicContact CD2-CG2 4.31Å; L9-I34 HydrophobicContact CG-CG2 4.5Å; L9-L38 HydrophobicContact CD1-CD1 4.48Å; L9-L38 HydrophobicContact CD1-CD2 3.85Å; L9-L38 HydrophobicContact CD1-CG 4.15Å; L9-L319 HydrophobicContact CD2-CB 4.42Å; L9-L319 HydrophobicContact CD2-CD2 4.38Å; L9-L327 HydrophobicContact CD2-CD1 4.39Å; L9-M331 HydrophobicContact CD1-CE 3.92Å; L9-M331 HydrophobicContact CD1-SD 4.33Å |
| 10 | V | 96.4 | Very high | 94 | Very high | 92 Ų | 92 | 35.4 Ų | 35.4 | 56% | 0.558 | 19% | 0.193 | S | C | * | . | H | α-helix | trans | -65.9 | -46.4 | 171.5 | 171.6 | 0 | 0 | 0 | 0 | 109.7 | L6 S12 A13 L14 | L6-V10 WeakPolarHBondContact O-CG2 3.49Å; L6-V10 PolarHBondContact O-N 2.94Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 2.86Å; V10-A13 PolarHBondContact O-N 2.91Å; V10-L14 HydrophobicContact CG1-CD1 4.4Å; V10-L14 WeakPolarHBondContact O-CG 3.38Å; V10-L14 PolarHBondContact O-N 3.26Å; V10-L14 VanDerWaalsContact O-N 3.08Å |
| 11 | Y | 96.1 | Very high | 93.5 | Very high | 30 Ų | 30 | 35.4 Ų | 35.4 | 12% | 0.118 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.2 | -39.4 | 177.8 | -169.1 | -129.7 | 0 | 0 | 0 | 112 | A7 A13 L14 V15 L249 L253 G257 L261 | A7-Y11 VanDerWaalsContact O-CB 3.28Å; A7-Y11 WeakPolarHBondContact O-CB 3.37Å; A7-Y11 PolarHBondContact O-N 2.96Å; Y11-A13 PolarHBondContact O-N 3.13Å; Y11-L14 PolarHBondContact O-N 3.22Å; Y11-V15 HydrophobicContact CD2-CG2 4.47Å; Y11-V15 HydrophobicContact CE2-CG2 4.31Å; Y11-V15 VanDerWaalsContact O-CG2 3.27Å; Y11-V15 WeakPolarHBondContact O-CG2 3.26Å; Y11-V15 PolarHBondContact O-N 3.1Å; Y11-V15 VanDerWaalsContact O-N 3.08Å; Y11-L249 HydrophobicContact CE1-CD1 3.67Å; Y11-L253 HydrophobicContact CE2-CD1 3.65Å; Y11-L253 WeakPolarHBondContact OH-CD1 3.47Å; Y11-G257 WeakPolarHBondContact OH-CA 3.38Å; Y11-G257 PolarHBondContact OH-O 3.23Å; Y11-L261 HydrophobicContact CD1-CD1 3.81Å; Y11-L261 HydrophobicContact CE1-CB 3.94Å; Y11-L261 HydrophobicContact CE1-CD1 3.79Å; Y11-L261 HydrophobicContact CE1-CG 4.4Å |
| 12 | S | 94.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.1 | -40 | 174.9 | 71.7 | 0 | 0 | 0 | 0 | 113.3 | L8 L9 V10 V15 I16 L319 | L8-S12 WeakPolarHBondContact O-CB 3.44Å; L8-S12 PolarHBondContact O-N 3.05Å; L8-S12 PolarHBondContact O-OG 3.42Å; L9-S12 WeakPolarHBondContact CA-OG 3.33Å; L9-S12 PolarHBondContact O-OG 3.45Å; V10-S12 VanDerWaalsContact C-N 3.31Å; V10-S12 PolarHBondContact O-N 2.86Å; S12-V15 PolarHBondContact O-N 3.26Å; S12-I16 WeakPolarHBondContact O-CB 3.4Å; S12-I16 WeakPolarHBondContact O-CG1 3.45Å; S12-I16 PolarHBondContact O-N 2.94Å; S12-L319 VanDerWaalsContact CB-O 3.29Å; S12-L319 WeakPolarHBondContact CB-O 3.43Å; S12-L319 PolarHBondContact OG-O 3.45Å |
| 13 | A | 94.6 | Very high | 92.9 | Very high | 22 Ų | 22 | 38.3 Ų | 38.3 | 18% | 0.182 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.1 | -44.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L9 V10 Y11 V15 I16 W17 M27 I34 | L9-A13 PolarHBondContact O-N 2.91Å; V10-A13 PolarHBondContact O-N 2.91Å; Y11-A13 PolarHBondContact O-N 3.13Å; A13-V15 VanDerWaalsContact C-N 3.34Å; A13-V15 PolarHBondContact O-N 2.98Å; A13-I16 PolarHBondContact O-N 3.42Å; A13-W17 PolarHBondContact O-N 3.35Å; A13-M27 WeakPolarHBondContact O-CE 3.46Å; A13-I34 HydrophobicContact CB-CD1 4.38Å |
| 14 | L | 93.3 | Very high | 92.6 | Very high | 84 Ų | 84 | 36.8 Ų | 36.8 | 44% | 0.44 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -61.7 | -40.7 | 177.9 | -66.8 | 174.1 | 0 | 0 | 0 | 112.9 | V10 Y11 S18 W226 | V10-L14 HydrophobicContact CG1-CD1 4.4Å; V10-L14 WeakPolarHBondContact O-CG 3.38Å; V10-L14 PolarHBondContact O-N 3.26Å; V10-L14 VanDerWaalsContact O-N 3.08Å; Y11-L14 PolarHBondContact O-N 3.22Å; L14-S18 PolarHBondContact O-N 3.48Å; L14-W226 HydrophobicContact CD2-CZ2 4.36Å; L14-W226 PolarHBondContact O-NE1 2.79Å |
| 15 | V | 92.5 | Very high | 92.3 | Very high | 4 Ų | 4 | 36.3 Ų | 36.3 | 2% | 0.024 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -72.3 | -40.6 | 178.7 | 178 | 0 | 0 | 0 | 0 | 110.7 | Y11 S12 A13 W17 S18 A19 I245 L249 | Y11-V15 HydrophobicContact CD2-CG2 4.47Å; Y11-V15 HydrophobicContact CE2-CG2 4.31Å; Y11-V15 VanDerWaalsContact O-CG2 3.27Å; Y11-V15 WeakPolarHBondContact O-CG2 3.26Å; Y11-V15 PolarHBondContact O-N 3.1Å; Y11-V15 VanDerWaalsContact O-N 3.08Å; S12-V15 PolarHBondContact O-N 3.26Å; A13-V15 VanDerWaalsContact C-N 3.34Å; A13-V15 PolarHBondContact O-N 2.98Å; V15-W17 VanDerWaalsContact C-N 3.35Å; V15-W17 PolarHBondContact O-N 3.1Å; V15-S18 PolarHBondContact O-N 2.65Å; V15-A19 VanDerWaalsContact O-CB 3.26Å; V15-A19 WeakPolarHBondContact O-CB 3.26Å; V15-A19 PolarHBondContact O-N 2.59Å; V15-I245 HydrophobicContact CG1-CD1 3.97Å; V15-I245 HydrophobicContact CG1-CG1 3.69Å; V15-L249 HydrophobicContact CG1-CB 4.21Å; V15-L249 HydrophobicContact CG1-CD1 4.49Å; V15-L249 HydrophobicContact CG2-CD1 3.98Å; V15-L249 HydrophobicContact CG2-CG 4.39Å |
| 16 | I | 91.4 | Very high | 91.9 | Very high | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -62.9 | -41.1 | 176.6 | -72.5 | -76.6 | 0 | 0 | 0 | 111.2 | S12 A13 S18 A19 S20 M27 K30 I245 V320 | S12-I16 WeakPolarHBondContact O-CB 3.4Å; S12-I16 WeakPolarHBondContact O-CG1 3.45Å; S12-I16 PolarHBondContact O-N 2.94Å; A13-I16 PolarHBondContact O-N 3.42Å; I16-S18 VanDerWaalsContact C-N 3.27Å; I16-S18 PolarHBondContact O-N 3.41Å; I16-A19 PolarHBondContact O-N 3.15Å; I16-S20 WeakPolarHBondContact O-CB 3.45Å; I16-S20 PolarHBondContact O-N 3.37Å; I16-S20 PolarHBondContact O-OG 3.39Å; I16-M27 HydrophobicContact CG2-CE 4.37Å; I16-K30 HydrophobicContact CB-CG 4.45Å; I16-K30 HydrophobicContact CG1-CD 4.16Å; I16-K30 HydrophobicContact CG1-CG 4.4Å; I16-K30 HydrophobicContact CG2-CB 4.23Å; I16-K30 HydrophobicContact CG2-CG 4.13Å; I16-I245 HydrophobicContact CD1-CD1 3.28Å; I16-I245 HydrophobicContact CG1-CD1 3.83Å; I16-V320 WeakPolarHBondContact CG1-O 3.42Å |
| 17 | W | 91.5 | Very high | 91.6 | Very high | 67 Ų | 67 | 36 Ų | 36 | 25% | 0.254 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -54.5 | -46.1 | 176.3 | -177.1 | -110.5 | 0 | 0 | 0 | 112.3 | A13 V15 S20 Q22 I24 M27 W226 | A13-W17 PolarHBondContact O-N 3.35Å; V15-W17 VanDerWaalsContact C-N 3.35Å; V15-W17 PolarHBondContact O-N 3.1Å; W17-S20 PolarHBondContact O-OG 2.96Å; W17-S20 VanDerWaalsContact O-OG 3.12Å; W17-Q22 HydrophobicContact CD2-CB 4.41Å; W17-Q22 HydrophobicContact CH2-CB 3.97Å; W17-Q22 WeakPolarHBondContact CH2-O 3.39Å; W17-Q22 HydrophobicContact CZ2-CB 3.58Å; W17-Q22 HydrophobicContact CZ2-CG 3.98Å; W17-Q22 WeakPolarHBondContact O-CA 3.31Å; W17-Q22 PolarHBondContact O-N 3.11Å; W17-I24 HydrophobicContact CH2-CG1 4.2Å; W17-I24 HydrophobicContact CZ3-CG1 4.43Å; W17-M27 HydrophobicContact CB-CE 3.35Å; W17-M27 HydrophobicContact CD2-CE 4.08Å; W17-M27 HydrophobicContact CE3-CB 3.88Å; W17-M27 HydrophobicContact CE3-CE 3.56Å; W17-M27 HydrophobicContact CE3-CG 3.98Å; W17-M27 HydrophobicContact CG-CE 4.07Å; W17-M27 HydrophobicContact CZ3-CB 3.97Å; W17-M27 HydrophobicContact CZ3-CG 4.25Å; W17-W226 HydrophobicContact CB-CZ2 4.37Å; W17-W226 AromaticContact CD1-CH2 3.72Å; W17-W226 AromaticContact CD1-CZ2 3.39Å; W17-W226 HydrophobicContact CG-CZ2 4.21Å |
| 18 | S | 88.9 | Confident | 91.4 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -73.4 | -47.7 | -179.6 | -168 | 0 | 0 | 0 | 0 | 111.2 | L14 V15 I16 S20 G21 L227 Q233 E252 | L14-S18 PolarHBondContact O-N 3.48Å; V15-S18 PolarHBondContact O-N 2.65Å; I16-S18 VanDerWaalsContact C-N 3.27Å; I16-S18 PolarHBondContact O-N 3.41Å; S18-S20 PolarHBondContact O-N 2.86Å; S18-G21 PolarHBondContact O-N 3.38Å; S18-L227 WeakPolarHBondContact OG-CA 3.1Å; S18-L227 PolarHBondContact OG-N 2.87Å; S18-L227 VanDerWaalsContact OG-N 3.16Å; S18-Q233 PolarHBondContact O-NE2 3Å; S18-Q233 PolarHBondContact OG-NE2 3.14Å; S18-E252 WeakPolarHBondContact CB-OE2 3.42Å; S18-E252 PolarHBondContact OG-OE1 3.29Å; S18-E252 PolarHBondContact OG-OE2 3.11Å |
| 19 | A | 87 | Confident | 91 | Very high | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -54.5 | -43 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | V15 I16 G21 R240 H241 V248 | V15-A19 VanDerWaalsContact O-CB 3.26Å; V15-A19 WeakPolarHBondContact O-CB 3.26Å; V15-A19 PolarHBondContact O-N 2.59Å; I16-A19 PolarHBondContact O-N 3.15Å; A19-G21 PolarHBondContact O-N 3.09Å; A19-R240 PolarHBondContact O-NE 3.49Å; A19-H241 PolarHBondContact O-CE1 3.4Å; A19-H241 PolarHBondContact O-ND1 3.19Å; A19-V248 HydrophobicContact CB-CG1 4.02Å; A19-V248 HydrophobicContact CB-CG2 4.43Å |
| 20 | S | 84.9 | Confident | 90.8 | Very high | 9 Ų | 9 | 47.6 Ų | 47.6 | 6% | 0.063 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | 2 | -179.7 | 76.7 | 0 | 0 | 0 | 0 | 115.4 | I16 W17 S18 Q22 D23 M26 H241 | I16-S20 WeakPolarHBondContact O-CB 3.45Å; I16-S20 PolarHBondContact O-N 3.37Å; I16-S20 PolarHBondContact O-OG 3.39Å; W17-S20 PolarHBondContact O-OG 2.96Å; W17-S20 VanDerWaalsContact O-OG 3.12Å; S18-S20 PolarHBondContact O-N 2.86Å; S20-Q22 PolarHBondContact O-N 2.87Å; S20-D23 VanDerWaalsContact O-CB 3.31Å; S20-D23 WeakPolarHBondContact O-CB 3.47Å; S20-D23 PolarHBondContact O-N 3.46Å; S20-D23 VanDerWaalsContact O-N 3.12Å; S20-D23 PolarHBondContact OG-N 3Å; S20-M26 WeakPolarHBondContact CB-SD 3.35Å; S20-H241 WeakPolarHBondContact CA-CE1 3.45Å; S20-H241 VanDerWaalsContact CA-ND1 3.33Å; S20-H241 WeakPolarHBondContact CA-ND1 3.31Å; S20-H241 PolarHBondContact N-CE1 3.31Å; S20-H241 PolarHBondContact N-ND1 2.81Å |
| 21 | G | 85.3 | Confident | 90.8 | Very high | 36 Ų | 36 | 47.8 Ų | 47.8 | 37% | 0.371 | 24% | 0.243 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.8 | 34.9 | -174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S18 A19 D23 | S18-G21 PolarHBondContact O-N 3.38Å; A19-G21 PolarHBondContact O-N 3.09Å; G21-D23 VanDerWaalsContact C-N 3.26Å; G21-D23 PolarHBondContact O-N 3.27Å |
| 22 | Q | 86.2 | Confident | 90.6 | Very high | 95 Ų | 95 | 48.3 Ų | 48.3 | 44% | 0.444 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 65 | 22.3 | -177.8 | -48.7 | -179.8 | -23.8 | 0 | 0 | 114.9 | W17 S20 I24 L227 | W17-Q22 HydrophobicContact CD2-CB 4.41Å; W17-Q22 HydrophobicContact CH2-CB 3.97Å; W17-Q22 WeakPolarHBondContact CH2-O 3.39Å; W17-Q22 HydrophobicContact CZ2-CB 3.58Å; W17-Q22 HydrophobicContact CZ2-CG 3.98Å; W17-Q22 WeakPolarHBondContact O-CA 3.31Å; W17-Q22 PolarHBondContact O-N 3.11Å; S20-Q22 PolarHBondContact O-N 2.87Å; Q22-I24 PolarHBondContact O-N 3.5Å; Q22-L227 HydrophobicContact CG-CD2 3.67Å |
| 23 | D | 87.8 | Confident | 90.5 | Very high | 77 Ų | 77 | 49.6 Ų | 49.6 | 41% | 0.412 | 26% | 0.263 | S | S | . | . | trans | -59.4 | 110.2 | 172.4 | -177.4 | -17.4 | 0 | 0 | 0 | 111.5 | S20 G21 G25 M26 M27 | S20-D23 VanDerWaalsContact O-CB 3.31Å; S20-D23 WeakPolarHBondContact O-CB 3.47Å; S20-D23 PolarHBondContact O-N 3.46Å; S20-D23 VanDerWaalsContact O-N 3.12Å; S20-D23 PolarHBondContact OG-N 3Å; G21-D23 VanDerWaalsContact C-N 3.26Å; G21-D23 PolarHBondContact O-N 3.27Å; D23-G25 PolarHBondContact O-N 3.44Å; D23-G25 WeakPolarHBondContact OD1-CA 3.47Å; D23-G25 PolarHBondContact OD1-N 3.29Å; D23-M26 HydrophobicContact CB-CB 4.02Å; D23-M26 PolarHBondContact O-N 3.08Å; D23-M26 PolarHBondContact OD1-N 3.33Å; D23-M27 PolarHBondContact O-N 2.98Å; D23-M27 VanDerWaalsContact O-N 3.08Å | ||
| 24 | I | 90.9 | Very high | 90.6 | Very high | 110 Ų | 110 | 49.5 Ų | 49.5 | 56% | 0.564 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -61.8 | -42.5 | 178.8 | -60 | 172 | 0 | 0 | 0 | 110.9 | W17 Q22 M26 M27 E28 | W17-I24 HydrophobicContact CH2-CG1 4.2Å; W17-I24 HydrophobicContact CZ3-CG1 4.43Å; Q22-I24 PolarHBondContact O-N 3.5Å; I24-M26 VanDerWaalsContact C-N 3.35Å; I24-M26 PolarHBondContact O-N 2.89Å; I24-M27 WeakPolarHBondContact O-CB 3.38Å; I24-M27 PolarHBondContact O-N 3.32Å; I24-M27 VanDerWaalsContact O-N 3.17Å; I24-E28 HydrophobicContact CG2-CG 4.37Å; I24-E28 WeakPolarHBondContact O-CG 3.43Å; I24-E28 PolarHBondContact O-N 3.32Å |
| 25 | G | 90.8 | Very high | 90.7 | Very high | 22 Ų | 22 | 47.9 Ų | 47.9 | 23% | 0.227 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -66.8 | -35.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | D23 R29 | D23-G25 PolarHBondContact O-N 3.44Å; D23-G25 WeakPolarHBondContact OD1-CA 3.47Å; D23-G25 PolarHBondContact OD1-N 3.29Å; G25-R29 VanDerWaalsContact O-CG 3.28Å; G25-R29 WeakPolarHBondContact O-CG 3.41Å; G25-R29 PolarHBondContact O-N 2.85Å |
| 26 | M | 87.7 | Confident | 90.8 | Very high | 36 Ų | 36 | 52.6 Ų | 52.6 | 18% | 0.177 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -67.7 | -40.7 | 172 | -171.8 | 173.3 | -62.8 | 0 | 0 | 111.6 | S20 D23 I24 R29 K30 H241 Y322 | S20-M26 WeakPolarHBondContact CB-SD 3.35Å; D23-M26 HydrophobicContact CB-CB 4.02Å; D23-M26 PolarHBondContact O-N 3.08Å; D23-M26 PolarHBondContact OD1-N 3.33Å; I24-M26 VanDerWaalsContact C-N 3.35Å; I24-M26 PolarHBondContact O-N 2.89Å; M26-R29 PolarHBondContact O-N 3.27Å; M26-K30 PolarHBondContact O-N 2.91Å; M26-H241 HydrophobicContact SD-CB 3.97Å; M26-Y322 HydrophobicContact CG-CD2 4.25Å; M26-Y322 HydrophobicContact CG-CE2 4.31Å |
| 27 | M | 92 | Very high | 91 | Very high | 22 Ų | 22 | 52.6 Ų | 52.6 | 11% | 0.108 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 177.8 | -175.5 | 52 | 68.1 | 0 | 0 | 112.1 | A13 I16 W17 D23 I24 R29 K30 I31 | A13-M27 WeakPolarHBondContact O-CE 3.46Å; I16-M27 HydrophobicContact CG2-CE 4.37Å; W17-M27 HydrophobicContact CB-CE 3.35Å; W17-M27 HydrophobicContact CD2-CE 4.08Å; W17-M27 HydrophobicContact CE3-CB 3.88Å; W17-M27 HydrophobicContact CE3-CE 3.56Å; W17-M27 HydrophobicContact CE3-CG 3.98Å; W17-M27 HydrophobicContact CG-CE 4.07Å; W17-M27 HydrophobicContact CZ3-CB 3.97Å; W17-M27 HydrophobicContact CZ3-CG 4.25Å; D23-M27 PolarHBondContact O-N 2.98Å; D23-M27 VanDerWaalsContact O-N 3.08Å; I24-M27 WeakPolarHBondContact O-CB 3.38Å; I24-M27 PolarHBondContact O-N 3.32Å; I24-M27 VanDerWaalsContact O-N 3.17Å; M27-R29 VanDerWaalsContact C-N 3.3Å; M27-R29 PolarHBondContact O-N 3.4Å; M27-K30 PolarHBondContact O-N 3.13Å; M27-K30 VanDerWaalsContact O-N 3.12Å; M27-I31 HydrophobicContact CG-CD1 3.77Å; M27-I31 HydrophobicContact CG-CG1 4.29Å; M27-I31 WeakPolarHBondContact O-CG1 3.32Å; M27-I31 PolarHBondContact O-N 2.52Å; M27-I31 HydrophobicContact SD-CD1 3.91Å; M27-I31 HydrophobicContact SD-CG1 3.9Å |
| 28 | E | 92.5 | Very high | 91.3 | Very high | 133 Ų | 133 | 51.4 Ų | 51.4 | 62% | 0.621 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -56.2 | -44.8 | 175.5 | -75.1 | 177.6 | 172.2 | 0 | 0 | 111.6 | I24 I31 G32 | I24-E28 HydrophobicContact CG2-CG 4.37Å; I24-E28 WeakPolarHBondContact O-CG 3.43Å; I24-E28 PolarHBondContact O-N 3.32Å; E28-I31 PolarHBondContact O-N 3.01Å; E28-G32 PolarHBondContact O-N 3.37Å |
| 29 | R | 90.8 | Very high | 91.7 | Very high | 161 Ų | 161 | 55.6 Ų | 55.6 | 61% | 0.608 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -63.4 | -43.4 | 175.7 | -67.4 | 171.8 | -160.1 | -174 | 5 | 111.8 | G25 M26 M27 G32 Q33 Y322 | G25-R29 VanDerWaalsContact O-CG 3.28Å; G25-R29 WeakPolarHBondContact O-CG 3.41Å; G25-R29 PolarHBondContact O-N 2.85Å; M26-R29 PolarHBondContact O-N 3.27Å; M27-R29 VanDerWaalsContact C-N 3.3Å; M27-R29 PolarHBondContact O-N 3.4Å; R29-G32 PolarHBondContact O-N 3.48Å; R29-Q33 WeakPolarHBondContact O-CB 3.38Å; R29-Q33 WeakPolarHBondContact O-CG 3.2Å; R29-Q33 PolarHBondContact O-N 2.96Å; R29-Y322 HydrophobicContact CB-CE2 4.11Å |
| 30 | K | 92.3 | Very high | 92.2 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -63.5 | -45.4 | 178 | -178.5 | 71.1 | -177.1 | -162.7 | 0 | 111 | I16 M26 M27 Q33 I34 L319 V320 S321 | I16-K30 HydrophobicContact CB-CG 4.45Å; I16-K30 HydrophobicContact CG1-CD 4.16Å; I16-K30 HydrophobicContact CG1-CG 4.4Å; I16-K30 HydrophobicContact CG2-CB 4.23Å; I16-K30 HydrophobicContact CG2-CG 4.13Å; M26-K30 PolarHBondContact O-N 2.91Å; M27-K30 PolarHBondContact O-N 3.13Å; M27-K30 VanDerWaalsContact O-N 3.12Å; K30-Q33 PolarHBondContact O-N 2.87Å; K30-I34 HydrophobicContact CD-CD1 4.43Å; K30-I34 HydrophobicContact CG-CD1 4.04Å; K30-I34 VanDerWaalsContact O-CG1 3.27Å; K30-I34 WeakPolarHBondContact O-CG1 3.22Å; K30-I34 PolarHBondContact O-N 3.46Å; K30-L319 PolarHBondContact NZ-O 2.83Å; K30-V320 PolarHBondContact NZ-O 3.28Å; K30-S321 PolarHBondContact NZ-O 2.97Å |
| 31 | I | 94.7 | Very high | 92.8 | Very high | 95 Ų | 95 | 57.5 Ų | 57.5 | 49% | 0.487 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62.5 | -44.8 | 177.2 | -67.8 | 171.3 | 0 | 0 | 0 | 110.4 | M27 E28 Q33 I34 A35 | M27-I31 HydrophobicContact CG-CD1 3.77Å; M27-I31 HydrophobicContact CG-CG1 4.29Å; M27-I31 WeakPolarHBondContact O-CG1 3.32Å; M27-I31 PolarHBondContact O-N 2.52Å; M27-I31 HydrophobicContact SD-CD1 3.91Å; M27-I31 HydrophobicContact SD-CG1 3.9Å; E28-I31 PolarHBondContact O-N 3.01Å; I31-Q33 VanDerWaalsContact C-N 3.34Å; I31-Q33 PolarHBondContact O-N 3.23Å; I31-I34 PolarHBondContact O-N 3.4Å; I31-A35 WeakPolarHBondContact O-CB 3.37Å; I31-A35 PolarHBondContact O-N 3.47Å |
| 32 | G | 93.5 | Very high | 93.4 | Very high | 41 Ų | 41 | 59.4 Ų | 59.4 | 42% | 0.423 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59 | -42.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E28 R29 A35 M36 | E28-G32 PolarHBondContact O-N 3.37Å; R29-G32 PolarHBondContact O-N 3.48Å; G32-A35 PolarHBondContact O-N 2.74Å; G32-M36 WeakPolarHBondContact O-CB 3.24Å; G32-M36 PolarHBondContact O-N 2.99Å |
| 33 | Q | 92.4 | Very high | 93.9 | Very high | 27 Ų | 27 | 58.8 Ų | 58.8 | 13% | 0.126 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 174.5 | -71.2 | 165.6 | 11.8 | 0 | 0 | 112.1 | R29 K30 I31 G37 Y322 L327 | R29-Q33 WeakPolarHBondContact O-CB 3.38Å; R29-Q33 WeakPolarHBondContact O-CG 3.2Å; R29-Q33 PolarHBondContact O-N 2.96Å; K30-Q33 PolarHBondContact O-N 2.87Å; I31-Q33 VanDerWaalsContact C-N 3.34Å; I31-Q33 PolarHBondContact O-N 3.23Å; Q33-G37 PolarHBondContact O-N 2.96Å; Q33-Y322 PolarHBondContact NE2-OH 3.38Å; Q33-L327 WeakPolarHBondContact O-CD2 3.49Å |
| 34 | I | 95.7 | Very high | 94.3 | Very high | 20 Ų | 20 | 57.1 Ų | 57.1 | 10% | 0.103 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -62.1 | -47.4 | 176.7 | -69.9 | 171.9 | 0 | 0 | 0 | 110.3 | L9 A13 K30 I31 G37 L38 L327 | L9-I34 HydrophobicContact CB-CG2 4.26Å; L9-I34 HydrophobicContact CD1-CG2 4.22Å; L9-I34 HydrophobicContact CD2-CG1 4.11Å; L9-I34 HydrophobicContact CD2-CG2 4.31Å; L9-I34 HydrophobicContact CG-CG2 4.5Å; A13-I34 HydrophobicContact CB-CD1 4.38Å; K30-I34 HydrophobicContact CD-CD1 4.43Å; K30-I34 HydrophobicContact CG-CD1 4.04Å; K30-I34 VanDerWaalsContact O-CG1 3.27Å; K30-I34 WeakPolarHBondContact O-CG1 3.22Å; K30-I34 PolarHBondContact O-N 3.46Å; I31-I34 PolarHBondContact O-N 3.4Å; I34-G37 PolarHBondContact O-N 3.12Å; I34-L38 HydrophobicContact CG2-CD1 3.94Å; I34-L38 HydrophobicContact CG2-CG 4.44Å; I34-L38 WeakPolarHBondContact O-CB 3.15Å; I34-L38 WeakPolarHBondContact O-CG 3.47Å; I34-L38 PolarHBondContact O-N 3.04Å; I34-L327 HydrophobicContact CG1-CD1 4.07Å |
| 35 | A | 95.8 | Very high | 94.6 | Very high | 50 Ų | 50 | 52.3 Ų | 52.3 | 41% | 0.413 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -60.9 | -49.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | I31 G32 G37 L38 V39 | I31-A35 WeakPolarHBondContact O-CB 3.37Å; I31-A35 PolarHBondContact O-N 3.47Å; G32-A35 PolarHBondContact O-N 2.74Å; A35-G37 PolarHBondContact O-N 3.19Å; A35-L38 PolarHBondContact O-N 3.32Å; A35-V39 WeakPolarHBondContact O-CG2 3.28Å; A35-V39 PolarHBondContact O-N 3.02Å |
| 36 | M | 94.9 | Very high | 94.9 | Very high | 103 Ų | 103 | 57.1 Ų | 57.1 | 51% | 0.507 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -59.8 | -45 | 176 | -175.7 | 65 | 79.5 | 0 | 0 | 111.7 | G32 L38 V39 I40 I328 | G32-M36 WeakPolarHBondContact O-CB 3.24Å; G32-M36 PolarHBondContact O-N 2.99Å; M36-L38 PolarHBondContact O-N 3.37Å; M36-V39 PolarHBondContact O-N 2.97Å; M36-I40 HydrophobicContact CG-CD1 3.85Å; M36-I40 WeakPolarHBondContact O-CB 3.38Å; M36-I40 WeakPolarHBondContact O-CG1 3.49Å; M36-I40 PolarHBondContact O-N 2.98Å; M36-I40 HydrophobicContact SD-CD1 4.16Å; M36-I328 HydrophobicContact CG-CD1 4.12Å; M36-I328 HydrophobicContact CG-CG1 4.37Å |
| 37 | G | 96.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q33 I34 A35 I40 M41 M331 | Q33-G37 PolarHBondContact O-N 2.96Å; I34-G37 PolarHBondContact O-N 3.12Å; A35-G37 PolarHBondContact O-N 3.19Å; G37-I40 PolarHBondContact O-N 3.49Å; G37-M41 VanDerWaalsContact O-CB 3.3Å; G37-M41 WeakPolarHBondContact O-CB 3.36Å; G37-M41 PolarHBondContact O-N 3.43Å; G37-M331 WeakPolarHBondContact O-CB 3.15Å |
| 38 | L | 97.3 | Very high | 95.3 | Very high | 43 Ų | 43 | 59.1 Ų | 59.1 | 23% | 0.225 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -62.9 | -44.8 | 175.5 | -76.8 | 169.5 | 0 | 0 | 0 | 111.9 | L6 L9 I34 A35 M36 M41 V42 M331 | L6-L38 HydrophobicContact CD2-CD1 4.22Å; L6-L38 HydrophobicContact CD2-CD2 3.88Å; L9-L38 HydrophobicContact CD1-CD1 4.48Å; L9-L38 HydrophobicContact CD1-CD2 3.85Å; L9-L38 HydrophobicContact CD1-CG 4.15Å; I34-L38 HydrophobicContact CG2-CD1 3.94Å; I34-L38 HydrophobicContact CG2-CG 4.44Å; I34-L38 WeakPolarHBondContact O-CB 3.15Å; I34-L38 WeakPolarHBondContact O-CG 3.47Å; I34-L38 PolarHBondContact O-N 3.04Å; A35-L38 PolarHBondContact O-N 3.32Å; M36-L38 PolarHBondContact O-N 3.37Å; L38-M41 HydrophobicContact CD2-CE 3.75Å; L38-M41 PolarHBondContact O-N 3.01Å; L38-V42 WeakPolarHBondContact O-CG2 3.44Å; L38-V42 PolarHBondContact O-N 3.31Å; L38-M331 HydrophobicContact CD2-CE 3.63Å; L38-M331 HydrophobicContact CG-CE 4.06Å |
| 39 | V | 97.7 | Very high | 95.3 | Very high | 88 Ų | 88 | 53.6 Ų | 53.6 | 53% | 0.533 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -58.8 | -50.2 | 175.5 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | A35 M36 M41 V42 V43 | A35-V39 WeakPolarHBondContact O-CG2 3.28Å; A35-V39 PolarHBondContact O-N 3.02Å; M36-V39 PolarHBondContact O-N 2.97Å; V39-M41 PolarHBondContact O-N 3.38Å; V39-V42 PolarHBondContact O-N 3.49Å; V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 WeakPolarHBondContact O-CG2 3.22Å; V39-V43 PolarHBondContact O-N 2.94Å |
| 40 | I | 97 | Very high | 95.3 | Very high | 47 Ų | 47 | 54.3 Ų | 54.3 | 24% | 0.241 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.6 | -44 | 179.5 | -70.5 | 169.7 | 0 | 0 | 0 | 111 | M36 G37 V42 V43 M44 I328 A332 | M36-I40 HydrophobicContact CG-CD1 3.85Å; M36-I40 WeakPolarHBondContact O-CB 3.38Å; M36-I40 WeakPolarHBondContact O-CG1 3.49Å; M36-I40 PolarHBondContact O-N 2.98Å; M36-I40 HydrophobicContact SD-CD1 4.16Å; G37-I40 PolarHBondContact O-N 3.49Å; I40-V42 VanDerWaalsContact C-N 3.34Å; I40-V42 PolarHBondContact O-N 3.49Å; I40-V43 PolarHBondContact O-N 2.82Å; I40-M44 HydrophobicContact CG2-CG 4.13Å; I40-M44 VanDerWaalsContact O-CB 3.28Å; I40-M44 WeakPolarHBondContact O-CB 3.23Å; I40-M44 WeakPolarHBondContact O-CG 3.35Å; I40-M44 PolarHBondContact O-N 2.83Å; I40-I328 HydrophobicContact CD1-CG2 3.44Å; I40-I328 VanDerWaalsContact CD1-CG2 3.44Å; I40-A332 HydrophobicContact CG2-CB 3.76Å |
| 41 | M | 97.6 | Very high | 95.4 | Very high | 2 Ų | 2 | 57.1 Ų | 57.1 | 1% | 0.01 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.1 | -45.1 | 176.2 | 179.5 | -171.2 | 67.7 | 0 | 0 | 111.6 | L2 L5 G37 L38 V39 M44 A45 M331 F334 G335 M338 | L2-M41 HydrophobicContact CD1-CE 3.42Å; L2-M41 VanDerWaalsContact CD1-CE 3.42Å; L5-M41 HydrophobicContact CD1-SD 3.56Å; L5-M41 VanDerWaalsContact CD1-SD 3.56Å; G37-M41 VanDerWaalsContact O-CB 3.3Å; G37-M41 WeakPolarHBondContact O-CB 3.36Å; G37-M41 PolarHBondContact O-N 3.43Å; L38-M41 HydrophobicContact CD2-CE 3.75Å; L38-M41 PolarHBondContact O-N 3.01Å; V39-M41 PolarHBondContact O-N 3.38Å; M41-M44 PolarHBondContact O-N 3.48Å; M41-A45 WeakPolarHBondContact O-CB 3.33Å; M41-A45 PolarHBondContact O-N 2.92Å; M41-M331 HydrophobicContact CB-CB 4.21Å; M41-M331 HydrophobicContact CB-CE 3.97Å; M41-M331 VanDerWaalsContact CB-O 3.29Å; M41-M331 WeakPolarHBondContact CB-O 3.48Å; M41-M331 HydrophobicContact CE-CE 3.89Å; M41-M331 HydrophobicContact CG-CE 4.32Å; M41-M331 WeakPolarHBondContact CG-O 3.34Å; M41-M331 HydrophobicContact SD-CE 3.49Å; M41-M331 WeakPolarHBondContact SD-CE 3.49Å; M41-M331 HydrophobicContact SD-SD 4.38Å; M41-F334 HydrophobicContact CG-CB 4.36Å; M41-F334 HydrophobicContact SD-CB 4.22Å; M41-G335 WeakPolarHBondContact O-CA 3.32Å; M41-M338 HydrophobicContact CE-CE 4.32Å; M41-M338 HydrophobicContact SD-CE 3.67Å; M41-M338 HydrophobicContact SD-SD 4.34Å |
| 42 | V | 97.3 | Very high | 95.4 | Very high | 76 Ų | 76 | 53.3 Ų | 53.3 | 46% | 0.461 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -64.8 | -46.6 | 179.1 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | L38 V39 I40 M44 A45 Q46 | L38-V42 WeakPolarHBondContact O-CG2 3.44Å; L38-V42 PolarHBondContact O-N 3.31Å; V39-V42 PolarHBondContact O-N 3.49Å; I40-V42 VanDerWaalsContact C-N 3.34Å; I40-V42 PolarHBondContact O-N 3.49Å; V42-M44 VanDerWaalsContact C-N 3.35Å; V42-M44 PolarHBondContact O-N 2.89Å; V42-A45 WeakPolarHBondContact O-CB 3.28Å; V42-A45 PolarHBondContact O-N 3.34Å; V42-Q46 WeakPolarHBondContact O-CG 3.36Å; V42-Q46 PolarHBondContact O-N 3.21Å |
| 43 | V | 97.6 | Very high | 95.4 | Very high | 82 Ų | 82 | 53.6 Ų | 53.6 | 50% | 0.497 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -58.5 | -48.2 | 176.6 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | V39 I40 A45 Q46 I47 | V39-V43 HydrophobicContact CG1-CG2 4.44Å; V39-V43 WeakPolarHBondContact O-CG2 3.22Å; V39-V43 PolarHBondContact O-N 2.94Å; I40-V43 PolarHBondContact O-N 2.82Å; V43-A45 VanDerWaalsContact C-N 3.3Å; V43-A45 PolarHBondContact O-N 2.84Å; V43-Q46 PolarHBondContact O-N 3.17Å; V43-Q46 VanDerWaalsContact O-N 3.11Å; V43-I47 HydrophobicContact CG1-CD1 4.46Å |
| 44 | M | 96.4 | Very high | 95.5 | Very high | 42 Ų | 42 | 53.9 Ų | 53.9 | 21% | 0.207 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63.8 | -36.1 | 178.6 | -67.1 | -68 | -83.6 | 0 | 0 | 111.6 | I40 M41 V42 Q46 I47 Y52 A332 I336 | I40-M44 HydrophobicContact CG2-CG 4.13Å; I40-M44 VanDerWaalsContact O-CB 3.28Å; I40-M44 WeakPolarHBondContact O-CB 3.23Å; I40-M44 WeakPolarHBondContact O-CG 3.35Å; I40-M44 PolarHBondContact O-N 2.83Å; M41-M44 PolarHBondContact O-N 3.48Å; V42-M44 VanDerWaalsContact C-N 3.35Å; V42-M44 PolarHBondContact O-N 2.89Å; M44-Q46 PolarHBondContact O-N 2.82Å; M44-Q46 VanDerWaalsContact O-N 3.16Å; M44-I47 PolarHBondContact O-N 2.98Å; M44-I47 HydrophobicContact SD-CD1 4.15Å; M44-Y52 WeakPolarHBondContact CA-OH 3.31Å; M44-Y52 VanDerWaalsContact CB-OH 3.25Å; M44-Y52 WeakPolarHBondContact CB-OH 3.27Å; M44-Y52 HydrophobicContact CE-CD1 4.38Å; M44-Y52 HydrophobicContact CE-CE1 3.42Å; M44-Y52 VanDerWaalsContact CE-CE1 3.42Å; M44-Y52 WeakPolarHBondContact CE-OH 3.42Å; M44-Y52 PolarHBondContact O-OH 3.46Å; M44-Y52 HydrophobicContact SD-CE1 3.89Å; M44-Y52 PolarHBondContact SD-OH 3.16Å; M44-A332 HydrophobicContact CE-CB 4.47Å; M44-A332 HydrophobicContact CG-CB 4.38Å; M44-I336 HydrophobicContact CE-CD1 3.87Å; M44-I336 HydrophobicContact CE-CG1 3.78Å |
| 45 | A | 96.4 | Very high | 95.4 | Very high | 8 Ų | 8 | 60.7 Ų | 60.7 | 7% | 0.066 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -62.2 | -24.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | M41 V42 V43 G335 M338 S339 | M41-A45 WeakPolarHBondContact O-CB 3.33Å; M41-A45 PolarHBondContact O-N 2.92Å; V42-A45 WeakPolarHBondContact O-CB 3.28Å; V42-A45 PolarHBondContact O-N 3.34Å; V43-A45 VanDerWaalsContact C-N 3.3Å; V43-A45 PolarHBondContact O-N 2.84Å; A45-G335 VanDerWaalsContact CA-O 3.32Å; A45-G335 WeakPolarHBondContact CA-O 3.28Å; A45-M338 HydrophobicContact CB-CB 3.86Å; A45-S339 WeakPolarHBondContact O-CA 3.3Å |
| 46 | Q | 95.9 | Very high | 95.4 | Very high | 123 Ų | 123 | 58.3 Ų | 58.3 | 58% | 0.575 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -85.1 | -16.6 | 178.4 | -55.5 | -47.4 | -44.7 | 0 | 0 | 114 | V42 V43 M44 H343 | V42-Q46 WeakPolarHBondContact O-CG 3.36Å; V42-Q46 PolarHBondContact O-N 3.21Å; V43-Q46 PolarHBondContact O-N 3.17Å; V43-Q46 VanDerWaalsContact O-N 3.11Å; M44-Q46 PolarHBondContact O-N 2.82Å; M44-Q46 VanDerWaalsContact O-N 3.16Å; Q46-H343 PolarHBondContact O-CE1 2.93Å; Q46-H343 VanDerWaalsContact O-CE1 3.29Å; Q46-H343 PolarHBondContact O-NE2 3.46Å |
| 47 | I | 95.5 | Very high | 95.5 | Very high | 50 Ų | 50 | 54.6 Ų | 54.6 | 26% | 0.256 | 28% | 0.282 | S | S | . | . | S | Bend | trans | -85.3 | 124.6 | -176.4 | -63.5 | 169.2 | 0 | 0 | 0 | 109.1 | V43 M44 V51 Y52 S339 | V43-I47 HydrophobicContact CG1-CD1 4.46Å; M44-I47 PolarHBondContact O-N 2.98Å; M44-I47 HydrophobicContact SD-CD1 4.15Å; I47-V51 HydrophobicContact CG2-CB 3.65Å; I47-V51 HydrophobicContact CG2-CG1 3.63Å; I47-V51 HydrophobicContact CG2-CG2 4.29Å; I47-Y52 HydrophobicContact CB-CE1 4.3Å; I47-Y52 HydrophobicContact CB-CE2 4.19Å; I47-Y52 HydrophobicContact CG2-CD1 4.5Å; I47-Y52 HydrophobicContact CG2-CE1 3.98Å; I47-Y52 HydrophobicContact CG2-CE2 4.17Å; I47-Y52 VanDerWaalsContact O-CE2 3.32Å; I47-Y52 WeakPolarHBondContact O-CE2 3.29Å; I47-S339 WeakPolarHBondContact O-CB 3.31Å; I47-S339 PolarHBondContact O-OG 3.37Å |
| 48 | P | 94 | Very high | 95.5 | Very high | 50 Ų | 50 | 61.3 Ų | 61.3 | 33% | 0.325 | 31% | 0.309 | S | S | . | . | trans | -66.6 | 147.6 | -174.9 | 23.9 | -32.1 | 0 | 0 | 0 | 112.6 | R50 V51 | P48-R50 PolarHBondContact O-N 3.28Å; P48-V51 HydrophobicContact CG-CG2 3.8Å; P48-V51 WeakPolarHBondContact O-CB 3.34Å; P48-V51 PolarHBondContact O-N 2.9Å | ||
| 49 | P | 92.3 | Very high | 95.4 | Very high | 17 Ų | 17 | 62 Ų | 62 | 11% | 0.11 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -55.7 | -29.5 | -175.2 | -28.7 | 36 | 0 | 0 | 0 | 115.7 | V51 Y52 E53 F283 S339 I340 H343 | P49-V51 VanDerWaalsContact C-N 3.26Å; P49-V51 PolarHBondContact O-N 3.39Å; P49-Y52 WeakPolarHBondContact O-CB 3.37Å; P49-Y52 PolarHBondContact O-N 3.2Å; P49-E53 PolarHBondContact O-N 3.2Å; P49-F283 HydrophobicContact CB-CE1 4.41Å; P49-S339 WeakPolarHBondContact CD-OG 3.36Å; P49-I340 HydrophobicContact CB-CG1 4.28Å; P49-I340 HydrophobicContact CG-CB 4.44Å; P49-I340 HydrophobicContact CG-CG1 3.92Å; P49-H343 HydrophobicContact CG-CB 4.37Å |
| 50 | R | 91.5 | Very high | 95.4 | Very high | 177 Ų | 177 | 58.5 Ų | 58.5 | 67% | 0.668 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -61.8 | -33.3 | 176.5 | -68 | 178.4 | 175.7 | 170 | -6.4 | 112.7 | P48 E53 G54 | P48-R50 PolarHBondContact O-N 3.28Å; R50-E53 PolarHBondContact O-N 3.41Å; R50-G54 PolarHBondContact O-N 2.89Å |
| 51 | V | 94.1 | Very high | 95.3 | Very high | 58 Ų | 58 | 60.8 Ų | 60.8 | 35% | 0.352 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -68.2 | -44 | 177.1 | 173.4 | 0 | 0 | 0 | 0 | 109.2 | I47 P48 P49 E53 G54 W55 | I47-V51 HydrophobicContact CG2-CB 3.65Å; I47-V51 HydrophobicContact CG2-CG1 3.63Å; I47-V51 HydrophobicContact CG2-CG2 4.29Å; P48-V51 HydrophobicContact CG-CG2 3.8Å; P48-V51 WeakPolarHBondContact O-CB 3.34Å; P48-V51 PolarHBondContact O-N 2.9Å; P49-V51 VanDerWaalsContact C-N 3.26Å; P49-V51 PolarHBondContact O-N 3.39Å; V51-E53 VanDerWaalsContact C-N 3.33Å; V51-E53 PolarHBondContact O-N 2.77Å; V51-G54 PolarHBondContact O-N 3.33Å; V51-G54 VanDerWaalsContact O-N 3.16Å; V51-W55 WeakPolarHBondContact O-CB 3.5Å; V51-W55 VanDerWaalsContact O-CD1 3.25Å; V51-W55 PolarHBondContact O-N 3Å |
| 52 | Y | 94.7 | Very high | 95.2 | Very high | 15 Ų | 15 | 64.9 Ų | 64.9 | 6% | 0.059 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 175.2 | -62.4 | -52.5 | 0 | 0 | 0 | 112.9 | M44 I47 P49 G54 W55 A56 I336 | M44-Y52 WeakPolarHBondContact CA-OH 3.31Å; M44-Y52 VanDerWaalsContact CB-OH 3.25Å; M44-Y52 WeakPolarHBondContact CB-OH 3.27Å; M44-Y52 HydrophobicContact CE-CD1 4.38Å; M44-Y52 HydrophobicContact CE-CE1 3.42Å; M44-Y52 VanDerWaalsContact CE-CE1 3.42Å; M44-Y52 WeakPolarHBondContact CE-OH 3.42Å; M44-Y52 PolarHBondContact O-OH 3.46Å; M44-Y52 HydrophobicContact SD-CE1 3.89Å; M44-Y52 PolarHBondContact SD-OH 3.16Å; I47-Y52 HydrophobicContact CB-CE1 4.3Å; I47-Y52 HydrophobicContact CB-CE2 4.19Å; I47-Y52 HydrophobicContact CG2-CD1 4.5Å; I47-Y52 HydrophobicContact CG2-CE1 3.98Å; I47-Y52 HydrophobicContact CG2-CE2 4.17Å; I47-Y52 VanDerWaalsContact O-CE2 3.32Å; I47-Y52 WeakPolarHBondContact O-CE2 3.29Å; P49-Y52 WeakPolarHBondContact O-CB 3.37Å; P49-Y52 PolarHBondContact O-N 3.2Å; Y52-G54 VanDerWaalsContact C-N 3.34Å; Y52-G54 PolarHBondContact O-N 3.44Å; Y52-W55 PolarHBondContact O-N 2.86Å; Y52-A56 PolarHBondContact O-N 3.34Å; Y52-I336 HydrophobicContact CD2-CG1 4.33Å; Y52-I336 HydrophobicContact CD2-CG2 4.23Å; Y52-I336 HydrophobicContact CE1-CG1 4.16Å; Y52-I336 HydrophobicContact CE2-CB 4.42Å; Y52-I336 HydrophobicContact CE2-CG1 3.96Å; Y52-I336 HydrophobicContact CE2-CG2 4.38Å |
| 53 | E | 92.8 | Very high | 95.1 | Very high | 47 Ų | 47 | 61.4 Ų | 61.4 | 22% | 0.22 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 174.6 | -173 | 179.2 | -177.2 | 0 | 0 | 111.8 | P49 R50 V51 R107 N110 F283 | P49-E53 PolarHBondContact O-N 3.2Å; R50-E53 PolarHBondContact O-N 3.41Å; V51-E53 VanDerWaalsContact C-N 3.33Å; V51-E53 PolarHBondContact O-N 2.77Å; E53-R107 HydrophobicContact CG-CB 4.23Å; E53-R107 HydrophobicContact CG-CG 3.97Å; E53-R107 VanDerWaalsContact O-CD 3.24Å; E53-R107 WeakPolarHBondContact O-CD 3.47Å; E53-R107 PolarHBondContact O-NH1 3.26Å; E53-N110 PolarHBondContact OE1-ND2 2.94Å; E53-F283 HydrophobicContact CB-CD1 4.39Å; E53-F283 HydrophobicContact CB-CD2 4.24Å; E53-F283 HydrophobicContact CB-CE1 4.11Å; E53-F283 HydrophobicContact CB-CE2 3.95Å; E53-F283 HydrophobicContact CB-CG 4.44Å; E53-F283 HydrophobicContact CB-CZ 3.87Å; E53-F283 HydrophobicContact CG-CD2 4.09Å; E53-F283 HydrophobicContact CG-CE2 4.13Å; E53-F283 HydrophobicContact CG-CG 4.47Å |
| 54 | G | 93.8 | Very high | 95 | Very high | 34 Ų | 34 | 58.8 Ų | 58.8 | 35% | 0.351 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | R50 V51 Y52 R107 | R50-G54 PolarHBondContact O-N 2.89Å; V51-G54 PolarHBondContact O-N 3.33Å; V51-G54 VanDerWaalsContact O-N 3.16Å; Y52-G54 VanDerWaalsContact C-N 3.34Å; Y52-G54 PolarHBondContact O-N 3.44Å; G54-R107 PolarHBondContact O-NH1 2.94Å |
| 55 | W | 95.2 | Very high | 94.8 | Very high | 162 Ų | 162 | 61.8 Ų | 61.8 | 61% | 0.614 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -84.2 | -13.3 | -175.7 | -81.6 | 81.1 | 0 | 0 | 0 | 115.1 | V51 Y52 P57 Y58 L59 | V51-W55 WeakPolarHBondContact O-CB 3.5Å; V51-W55 VanDerWaalsContact O-CD1 3.25Å; V51-W55 PolarHBondContact O-N 3Å; Y52-W55 PolarHBondContact O-N 2.86Å; W55-P57 VanDerWaalsContact C-CD 3.45Å; W55-Y58 HydrophobicContact CD2-CD2 4.47Å; W55-Y58 HydrophobicContact CE3-CD2 4.23Å; W55-Y58 PolarHBondContact O-N 3.22Å; W55-Y58 VanDerWaalsContact O-N 3.08Å; W55-L59 PolarHBondContact O-N 2.96Å |
| 56 | A | 95.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 63.4 Ų | 63.4 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -51.6 | -43.5 | -173.9 | 0 | 0 | 0 | 0 | 0 | 115.7 | Y52 L59 Y60 L103 R107 | Y52-A56 PolarHBondContact O-N 3.34Å; A56-L59 PolarHBondContact O-N 3.37Å; A56-Y60 VanDerWaalsContact O-CB 3.31Å; A56-Y60 WeakPolarHBondContact O-CB 3.09Å; A56-Y60 PolarHBondContact O-N 3.11Å; A56-L103 HydrophobicContact CB-CB 4.31Å; A56-L103 HydrophobicContact CB-CD2 3.88Å; A56-L103 HydrophobicContact CB-CG 3.74Å; A56-R107 HydrophobicContact CB-CB 4.14Å |
| 57 | P | 95.8 | Very high | 94.4 | Very high | 25 Ų | 25 | 57.6 Ų | 57.6 | 16% | 0.162 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.1 | -36.2 | 179.5 | -14.6 | 27.6 | 0 | 0 | 0 | 112.4 | W55 Y60 I61 M104 R107 | W55-P57 VanDerWaalsContact C-CD 3.45Å; P57-Y60 PolarHBondContact O-N 3.33Å; P57-I61 WeakPolarHBondContact O-CB 3.33Å; P57-I61 VanDerWaalsContact O-CG1 3.25Å; P57-I61 WeakPolarHBondContact O-CG1 3.32Å; P57-I61 PolarHBondContact O-N 2.9Å; P57-M104 HydrophobicContact CB-SD 4.05Å; P57-M104 HydrophobicContact CG-SD 3.97Å; P57-R107 VanDerWaalsContact CD-CZ 3.43Å; P57-R107 VanDerWaalsContact CG-NH2 3.34Å |
| 58 | Y | 96.7 | Very high | 94.1 | Very high | 141 Ų | 141 | 58.9 Ų | 58.9 | 55% | 0.553 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -65.5 | -45.8 | 176.7 | -56 | -70.4 | 0 | 0 | 0 | 109.7 | W55 Y60 I61 I62 | W55-Y58 HydrophobicContact CD2-CD2 4.47Å; W55-Y58 HydrophobicContact CE3-CD2 4.23Å; W55-Y58 PolarHBondContact O-N 3.22Å; W55-Y58 VanDerWaalsContact O-N 3.08Å; Y58-Y60 VanDerWaalsContact C-N 3.29Å; Y58-Y60 PolarHBondContact O-N 3.47Å; Y58-I61 PolarHBondContact O-N 2.89Å; Y58-I62 WeakPolarHBondContact O-CB 3.43Å; Y58-I62 WeakPolarHBondContact O-CD1 3.47Å; Y58-I62 WeakPolarHBondContact O-CG1 3.47Å; Y58-I62 PolarHBondContact O-N 3.41Å |
| 59 | L | 95.3 | Very high | 93.8 | Very high | 57 Ų | 57 | 57.8 Ų | 57.8 | 30% | 0.298 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -61.4 | -39.6 | 176 | -174.6 | 63.2 | 0 | 0 | 0 | 111.8 | W55 A56 C63 I96 A100 L103 | W55-L59 PolarHBondContact O-N 2.96Å; A56-L59 PolarHBondContact O-N 3.37Å; L59-C63 VanDerWaalsContact O-CB 3.23Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 3.47Å; L59-I96 HydrophobicContact CD1-CG2 4.2Å; L59-A100 HydrophobicContact CD2-CB 4.15Å; L59-A100 HydrophobicContact CG-CB 3.87Å; L59-L103 HydrophobicContact CD2-CD2 4.06Å |
| 60 | Y | 97.1 | Very high | 93.4 | Very high | 15 Ų | 15 | 57 Ų | 57 | 6% | 0.059 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.5 | -49.2 | 176.2 | -174.1 | -88.3 | 0 | 0 | 0 | 112.2 | A56 P57 Y58 I62 C63 I64 V101 M104 L127 M130 P131 | A56-Y60 VanDerWaalsContact O-CB 3.31Å; A56-Y60 WeakPolarHBondContact O-CB 3.09Å; A56-Y60 PolarHBondContact O-N 3.11Å; P57-Y60 PolarHBondContact O-N 3.33Å; Y58-Y60 VanDerWaalsContact C-N 3.29Å; Y58-Y60 PolarHBondContact O-N 3.47Å; Y60-I62 PolarHBondContact O-N 3.46Å; Y60-C63 WeakPolarHBondContact O-CB 3.24Å; Y60-C63 PolarHBondContact O-N 3.19Å; Y60-C63 VanDerWaalsContact O-N 3.17Å; Y60-I64 HydrophobicContact CD1-CG1 4.16Å; Y60-I64 HydrophobicContact CE1-CD1 4.34Å; Y60-I64 HydrophobicContact CE1-CG1 3.87Å; Y60-I64 WeakPolarHBondContact O-CG1 3.45Å; Y60-I64 PolarHBondContact O-N 2.67Å; Y60-V101 HydrophobicContact CE2-CG2 4.2Å; Y60-M104 HydrophobicContact CD2-CB 3.59Å; Y60-M104 HydrophobicContact CD2-CG 3.79Å; Y60-M104 HydrophobicContact CE2-CB 4.34Å; Y60-M104 HydrophobicContact CE2-CG 4.35Å; Y60-M104 HydrophobicContact CG-CB 4Å; Y60-M104 HydrophobicContact CG-CG 3.87Å; Y60-L127 HydrophobicContact CE1-CD2 4.07Å; Y60-L127 VanDerWaalsContact CE2-O 3.27Å; Y60-L127 WeakPolarHBondContact CE2-O 3.25Å; Y60-L127 VanDerWaalsContact OH-CA 3.31Å; Y60-L127 WeakPolarHBondContact OH-CA 3.43Å; Y60-L127 PolarHBondContact OH-O 3.16Å; Y60-M130 HydrophobicContact CE1-CE 3.64Å; Y60-M130 WeakPolarHBondContact OH-CE 3.47Å; Y60-P131 HydrophobicContact CE2-CG 4.04Å; Y60-P131 VanDerWaalsContact OH-CD 3.23Å; Y60-P131 WeakPolarHBondContact OH-CD 3.49Å |
| 61 | I | 96.8 | Very high | 92.8 | Very high | 96 Ų | 96 | 53 Ų | 53 | 49% | 0.492 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.1 | -45.2 | 178.3 | -68.7 | 164.8 | 0 | 0 | 0 | 110.5 | P57 Y58 C63 I64 I65 | P57-I61 WeakPolarHBondContact O-CB 3.33Å; P57-I61 VanDerWaalsContact O-CG1 3.25Å; P57-I61 WeakPolarHBondContact O-CG1 3.32Å; P57-I61 PolarHBondContact O-N 2.9Å; Y58-I61 PolarHBondContact O-N 2.89Å; I61-C63 VanDerWaalsContact C-N 3.29Å; I61-C63 PolarHBondContact O-N 3.18Å; I61-I64 PolarHBondContact O-N 3.3Å; I61-I65 HydrophobicContact CG2-CD1 3.82Å; I61-I65 HydrophobicContact CG2-CG1 4.44Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 3.39Å |
| 62 | I | 95.1 | Very high | 92.1 | Very high | 88 Ų | 88 | 53.2 Ų | 53.2 | 45% | 0.451 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.7 | -44 | 174.9 | -69.5 | 165.8 | 0 | 0 | 0 | 110.2 | Y58 Y60 I64 I65 L66 | Y58-I62 WeakPolarHBondContact O-CB 3.43Å; Y58-I62 WeakPolarHBondContact O-CD1 3.47Å; Y58-I62 WeakPolarHBondContact O-CG1 3.47Å; Y58-I62 PolarHBondContact O-N 3.41Å; Y60-I62 PolarHBondContact O-N 3.46Å; I62-I64 VanDerWaalsContact C-N 3.34Å; I62-I64 PolarHBondContact O-N 3.21Å; I62-I65 PolarHBondContact O-N 3.41Å; I62-L66 HydrophobicContact CG2-CD1 3.87Å; I62-L66 HydrophobicContact CG2-CG 4.23Å; I62-L66 WeakPolarHBondContact O-CB 3.14Å; I62-L66 VanDerWaalsContact O-CG 3.27Å; I62-L66 WeakPolarHBondContact O-CG 3.35Å; I62-L66 PolarHBondContact O-N 3.16Å |
| 63 | C | 94.7 | Very high | 91.2 | Very high | 2 Ų | 2 | 60.9 Ų | 60.9 | 1% | 0.014 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -60 | -43 | 177.3 | -173.6 | 0 | 0 | 0 | 0 | 112 | L59 Y60 I61 L66 L67 I96 A97 A100 | L59-C63 VanDerWaalsContact O-CB 3.23Å; L59-C63 WeakPolarHBondContact O-CB 3.44Å; L59-C63 PolarHBondContact O-N 3.47Å; Y60-C63 WeakPolarHBondContact O-CB 3.24Å; Y60-C63 PolarHBondContact O-N 3.19Å; Y60-C63 VanDerWaalsContact O-N 3.17Å; I61-C63 VanDerWaalsContact C-N 3.29Å; I61-C63 PolarHBondContact O-N 3.18Å; C63-L66 PolarHBondContact O-N 3.35Å; C63-L67 WeakPolarHBondContact O-CB 3.38Å; C63-L67 VanDerWaalsContact O-CG 3.27Å; C63-L67 WeakPolarHBondContact O-CG 3.34Å; C63-L67 PolarHBondContact O-N 2.85Å; C63-I96 HydrophobicContact CB-CG2 4.09Å; C63-A97 VanDerWaalsContact SG-CA 3.52Å; C63-A100 HydrophobicContact CB-CB 3.91Å |
| 64 | I | 94.8 | Very high | 90.2 | Very high | 28 Ų | 28 | 58.9 Ų | 58.9 | 14% | 0.144 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64 | -45.9 | 176.7 | -65.3 | -64.6 | 0 | 0 | 0 | 110.9 | Y60 I61 I62 L66 L67 V68 M130 P131 L134 | Y60-I64 HydrophobicContact CD1-CG1 4.16Å; Y60-I64 HydrophobicContact CE1-CD1 4.34Å; Y60-I64 HydrophobicContact CE1-CG1 3.87Å; Y60-I64 WeakPolarHBondContact O-CG1 3.45Å; Y60-I64 PolarHBondContact O-N 2.67Å; I61-I64 PolarHBondContact O-N 3.3Å; I62-I64 VanDerWaalsContact C-N 3.34Å; I62-I64 PolarHBondContact O-N 3.21Å; I64-L66 VanDerWaalsContact C-N 3.3Å; I64-L66 PolarHBondContact O-N 2.94Å; I64-L67 PolarHBondContact O-N 2.98Å; I64-V68 WeakPolarHBondContact O-CG2 3.23Å; I64-V68 PolarHBondContact O-N 3.47Å; I64-M130 HydrophobicContact CB-CE 4.43Å; I64-M130 HydrophobicContact CD1-CE 3.36Å; I64-M130 HydrophobicContact CG1-CE 3.48Å; I64-M130 VanDerWaalsContact CG1-CE 3.48Å; I64-M130 HydrophobicContact CG2-CE 4.15Å; I64-P131 HydrophobicContact CD1-CB 3.71Å; I64-P131 HydrophobicContact CD1-CG 4.24Å; I64-L134 HydrophobicContact CD1-CD1 3.9Å; I64-L134 HydrophobicContact CG2-CD1 4.17Å |
| 65 | I | 93.2 | Very high | 88.7 | Confident | 104 Ų | 104 | 58.9 Ų | 58.9 | 53% | 0.533 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.2 | -45 | 176.5 | -68 | 167 | 0 | 0 | 0 | 110.3 | I61 I62 V68 A69 | I61-I65 HydrophobicContact CG2-CD1 3.82Å; I61-I65 HydrophobicContact CG2-CG1 4.44Å; I61-I65 WeakPolarHBondContact O-CG1 3.33Å; I61-I65 PolarHBondContact O-N 3.39Å; I62-I65 PolarHBondContact O-N 3.41Å; I65-V68 PolarHBondContact O-N 2.85Å; I65-A69 WeakPolarHBondContact O-CB 3.48Å; I65-A69 PolarHBondContact O-N 3.16Å |
| 66 | L | 91.4 | Very high | 87.5 | Confident | 43 Ų | 43 | 57.1 Ų | 57.1 | 23% | 0.225 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -66 | -38.2 | 178.5 | -69.2 | 173.7 | 0 | 0 | 0 | 112.6 | I62 C63 I64 A69 V70 L84 P93 I96 | I62-L66 HydrophobicContact CG2-CD1 3.87Å; I62-L66 HydrophobicContact CG2-CG 4.23Å; I62-L66 WeakPolarHBondContact O-CB 3.14Å; I62-L66 VanDerWaalsContact O-CG 3.27Å; I62-L66 WeakPolarHBondContact O-CG 3.35Å; I62-L66 PolarHBondContact O-N 3.16Å; C63-L66 PolarHBondContact O-N 3.35Å; I64-L66 VanDerWaalsContact C-N 3.3Å; I64-L66 PolarHBondContact O-N 2.94Å; L66-A69 PolarHBondContact O-N 3.3Å; L66-V70 VanDerWaalsContact O-CG2 3.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.37Å; L66-V70 PolarHBondContact O-N 3.06Å; L66-L84 HydrophobicContact CD2-CD1 3.82Å; L66-P93 HydrophobicContact CB-CB 3.76Å; L66-P93 HydrophobicContact CB-CG 3.98Å; L66-I96 HydrophobicContact CD1-CD1 4.43Å |
| 67 | L | 91.8 | Very high | 85.7 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.005 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 175.8 | -73.8 | 171.8 | 0 | 0 | 0 | 111.7 | C63 I64 D71 P93 P131 L134 V135 Q138 | C63-L67 WeakPolarHBondContact O-CB 3.38Å; C63-L67 VanDerWaalsContact O-CG 3.27Å; C63-L67 WeakPolarHBondContact O-CG 3.34Å; C63-L67 PolarHBondContact O-N 2.85Å; I64-L67 PolarHBondContact O-N 2.98Å; L67-D71 PolarHBondContact O-N 3.25Å; L67-P93 HydrophobicContact CD2-CB 4.21Å; L67-P131 HydrophobicContact CD1-CB 4.02Å; L67-L134 HydrophobicContact CB-CB 4.21Å; L67-L134 HydrophobicContact CB-CD1 4.15Å; L67-L134 HydrophobicContact CD1-CB 4.25Å; L67-L134 HydrophobicContact CD1-CD1 4.43Å; L67-V135 HydrophobicContact CD1-CG2 4.09Å; L67-V135 HydrophobicContact CD2-CG2 3.72Å; L67-Q138 PolarHBondContact O-NE2 3.27Å |
| 68 | V | 89.9 | Confident | 83.9 | Confident | 76 Ų | 76 | 66.5 Ų | 66.5 | 46% | 0.461 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -68.2 | -39.6 | 174.3 | 175.8 | 0 | 0 | 0 | 0 | 111 | I64 I65 V70 D71 A72 L134 | I64-V68 WeakPolarHBondContact O-CG2 3.23Å; I64-V68 PolarHBondContact O-N 3.47Å; I65-V68 PolarHBondContact O-N 2.85Å; V68-V70 VanDerWaalsContact C-N 3.31Å; V68-V70 PolarHBondContact O-N 3.43Å; V68-D71 WeakPolarHBondContact O-CB 3.48Å; V68-D71 PolarHBondContact O-N 3.45Å; V68-D71 VanDerWaalsContact O-N 3.16Å; V68-A72 PolarHBondContact O-N 2.86Å; V68-A72 VanDerWaalsContact O-N 3.08Å; V68-L134 HydrophobicContact CG2-CD1 4.17Å; V68-L134 HydrophobicContact CG2-CD2 4.3Å |
| 69 | A | 86.4 | Confident | 82.1 | Confident | 27 Ų | 27 | 63.1 Ų | 63.1 | 22% | 0.223 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -65.1 | -33.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | I65 L66 D71 A72 F73 | I65-A69 WeakPolarHBondContact O-CB 3.48Å; I65-A69 PolarHBondContact O-N 3.16Å; L66-A69 PolarHBondContact O-N 3.3Å; A69-D71 VanDerWaalsContact C-N 3.33Å; A69-A72 PolarHBondContact O-N 2.93Å; A69-F73 WeakPolarHBondContact O-CA 3.29Å; A69-F73 WeakPolarHBondContact O-CB 3.46Å; A69-F73 PolarHBondContact O-N 3.15Å |
| 70 | V | 85.4 | Confident | 80.2 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.1 | -39.4 | 172.7 | 167.3 | 0 | 0 | 0 | 0 | 111.7 | L66 V68 A72 G74 Q81 L84 P93 | L66-V70 VanDerWaalsContact O-CG2 3.31Å; L66-V70 WeakPolarHBondContact O-CG2 3.37Å; L66-V70 PolarHBondContact O-N 3.06Å; V68-V70 VanDerWaalsContact C-N 3.31Å; V68-V70 PolarHBondContact O-N 3.43Å; V70-A72 VanDerWaalsContact C-N 3.34Å; V70-G74 WeakPolarHBondContact O-CA 3.22Å; V70-G74 PolarHBondContact O-N 3.02Å; V70-Q81 WeakPolarHBondContact CG1-O 3.47Å; V70-L84 HydrophobicContact CB-CD2 4.38Å; V70-L84 HydrophobicContact CG2-CD1 4.08Å; V70-L84 HydrophobicContact CG2-CD2 3.54Å; V70-L84 HydrophobicContact CG2-CG 3.5Å; V70-L84 VanDerWaalsContact CG2-CG 3.5Å; V70-P93 HydrophobicContact CG2-CB 4.27Å; V70-P93 HydrophobicContact CG2-CG 3.45Å; V70-P93 VanDerWaalsContact CG2-CG 3.45Å |
| 71 | D | 79 | Confident | 78.9 | Confident | 93 Ų | 93 | 63.3 Ų | 63.3 | 50% | 0.497 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -69.1 | -36.7 | 179.2 | -158.9 | 47.6 | 0 | 0 | 0 | 111.2 | L67 V68 A69 | L67-D71 PolarHBondContact O-N 3.25Å; V68-D71 WeakPolarHBondContact O-CB 3.48Å; V68-D71 PolarHBondContact O-N 3.45Å; V68-D71 VanDerWaalsContact O-N 3.16Å; A69-D71 VanDerWaalsContact C-N 3.33Å |
| 72 | A | 78.3 | Confident | 77.6 | Confident | 64 Ų | 64 | 62 Ų | 62 | 53% | 0.529 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -81.1 | -37 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | V68 A69 V70 | V68-A72 PolarHBondContact O-N 2.86Å; V68-A72 VanDerWaalsContact O-N 3.08Å; A69-A72 PolarHBondContact O-N 2.93Å; V70-A72 VanDerWaalsContact C-N 3.34Å |
| 73 | F | 76.8 | Confident | 76.7 | Confident | 175 Ų | 175 | 61.3 Ų | 61.3 | 77% | 0.768 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -132.6 | 1.1 | -168.5 | -54.2 | -75.6 | 0 | 0 | 0 | 114.1 | A69 | A69-F73 WeakPolarHBondContact O-CA 3.29Å; A69-F73 WeakPolarHBondContact O-CB 3.46Å; A69-F73 PolarHBondContact O-N 3.15Å |
| 74 | G | 70.6 | Confident | 75.7 | Confident | 6 Ų | 6 | 62.6 Ų | 62.6 | 6% | 0.062 | 35% | 0.346 | C | S | . | . | P | Polyproline II helix | trans | -68.6 | 150.8 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | V70 Q81 | V70-G74 WeakPolarHBondContact O-CA 3.22Å; V70-G74 PolarHBondContact O-N 3.02Å; G74-Q81 PolarHBondContact O-NE2 3.2Å |
| 75 | A | 63.9 | Low | 74.6 | Confident | 34 Ų | 34 | 64.7 Ų | 64.7 | 28% | 0.281 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72.9 | 129.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | S77 W83 D85 | A75-S77 PolarHBondContact O-N 2.97Å; A75-W83 PolarHBondContact N-O 3.21Å; A75-D85 HydrophobicContact CB-CB 4.44Å |
| 76 | I | 68.9 | Low | 73.4 | Confident | 124 Ų | 124 | 65.9 Ų | 65.9 | 64% | 0.636 | 36% | 0.364 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73 | 119.6 | 172.9 | -59 | 165.1 | 0 | 0 | 0 | 108.2 | Q81 | I76-Q81 HydrophobicContact CB-CG 4.19Å; I76-Q81 HydrophobicContact CD1-CG 4.46Å; I76-Q81 HydrophobicContact CG1-CG 3.32Å |
| 77 | S | 56.9 | Low | 71.9 | Confident | 47 Ų | 47 | 67.1 Ų | 67.1 | 33% | 0.329 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128 | 128.6 | 171 | -169.8 | 0 | 0 | 0 | 0 | 109.4 | A75 G79 A80 | A75-S77 PolarHBondContact O-N 2.97Å; S77-G79 PolarHBondContact O-N 2.98Å; S77-G79 VanDerWaalsContact O-N 3.14Å; S77-A80 PolarHBondContact N-O 2.81Å; S77-A80 PolarHBondContact O-N 3.32Å |
| 78 | K | 59.3 | Low | 70.7 | Confident | 175 Ų | 175 | 74.9 Ų | 74.9 | 76% | 0.761 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.5 | 36.9 | -175.7 | -61.6 | -175.5 | 175.4 | -179.5 | 0 | 113.8 | E239 | K78-E239 IonicContact NZ-OE1 2.54Å; K78-E239 PolarHBondContact NZ-OE1 3.38Å |
| 79 | G | 58.5 | Low | 69.7 | Low | 70 Ų | 70 | 75.4 Ų | 75.4 | 72% | 0.722 | 43% | 0.43 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.3 | 4.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | S77 | S77-G79 PolarHBondContact O-N 2.98Å; S77-G79 VanDerWaalsContact O-N 3.14Å |
| 80 | A | 55.9 | Low | 69.2 | Low | 12 Ų | 12 | 80.8 Ų | 80.8 | 10% | 0.099 | 45% | 0.445 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.1 | 139.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S77 R82 P139 | S77-A80 PolarHBondContact N-O 2.81Å; S77-A80 PolarHBondContact O-N 3.32Å; A80-R82 HydrophobicContact CB-CG 4.07Å; A80-R82 PolarHBondContact O-N 2.81Å; A80-P139 HydrophobicContact CB-CG 4.1Å |
| 81 | Q | 68.6 | Low | 69 | Low | 64 Ų | 64 | 82.9 Ų | 82.9 | 30% | 0.299 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.7 | 97.3 | 173.1 | -66.9 | 177 | -61.7 | 0 | 0 | 109.4 | V70 G74 I76 | V70-Q81 WeakPolarHBondContact CG1-O 3.47Å; G74-Q81 PolarHBondContact O-NE2 3.2Å; I76-Q81 HydrophobicContact CB-CG 4.19Å; I76-Q81 HydrophobicContact CD1-CG 4.46Å; I76-Q81 HydrophobicContact CG1-CG 3.32Å |
| 82 | R | 71.1 | Confident | 69.4 | Low | 70 Ų | 70 | 79.3 Ų | 79.3 | 26% | 0.264 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | -11.5 | -178 | -61.3 | -175 | -174.4 | 164.2 | 6.3 | 114 | A80 Q138 P139 | A80-R82 HydrophobicContact CB-CG 4.07Å; A80-R82 PolarHBondContact O-N 2.81Å; R82-Q138 HydrophobicContact CG-CB 4.44Å; R82-Q138 PolarHBondContact NE-O 3.48Å; R82-P139 VanDerWaalsContact NH2-C 3.3Å; R82-P139 PolarHBondContact NH2-O 2.97Å |
| 83 | W | 75.6 | Confident | 69.9 | Low | 72 Ų | 72 | 76.3 Ų | 76.3 | 27% | 0.273 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 132.2 | -168.4 | -61.3 | 85.9 | 0 | 0 | 0 | 110.3 | A75 R90 Q92 | A75-W83 PolarHBondContact N-O 3.21Å; W83-R90 HydrophobicContact CD2-CB 4.37Å; W83-R90 HydrophobicContact CE3-CB 3.62Å; W83-R90 HydrophobicContact CZ3-CB 4.16Å; W83-R90 WeakPolarHBondContact CZ3-O 3.09Å; W83-Q92 HydrophobicContact CD2-CB 4.39Å; W83-Q92 HydrophobicContact CE3-CB 4.05Å; W83-Q92 HydrophobicContact CH2-CB 4.45Å; W83-Q92 HydrophobicContact CZ3-CB 4.11Å |
| 84 | L | 72.8 | Confident | 70.6 | Confident | 30 Ų | 30 | 68 Ų | 68 | 16% | 0.157 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 117.2 | 160.9 | -63.8 | 178.3 | 0 | 0 | 0 | 107.2 | L66 V70 F91 P93 | L66-L84 HydrophobicContact CD2-CD1 3.82Å; V70-L84 HydrophobicContact CB-CD2 4.38Å; V70-L84 HydrophobicContact CG2-CD1 4.08Å; V70-L84 HydrophobicContact CG2-CD2 3.54Å; V70-L84 HydrophobicContact CG2-CG 3.5Å; V70-L84 VanDerWaalsContact CG2-CG 3.5Å; L84-F91 PolarHBondContact N-O 3.21Å; L84-F91 PolarHBondContact O-N 3.02Å; L84-P93 HydrophobicContact CD1-CG 3.68Å; L84-P93 HydrophobicContact CG-CG 3.99Å |
| 85 | D | 73.2 | Confident | 71.6 | Confident | 72 Ų | 72 | 68 Ų | 68 | 39% | 0.385 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.6 | 106.7 | 175.1 | -156.9 | -27.2 | 0 | 0 | 0 | 108.8 | A75 G87 R90 | A75-D85 HydrophobicContact CB-CB 4.44Å; D85-G87 PolarHBondContact O-N 3.19Å; D85-G87 WeakPolarHBondContact OD1-CA 3.38Å; D85-G87 PolarHBondContact OD1-N 3.46Å; D85-R90 HydrophobicContact CB-CG 4.39Å; D85-R90 IonicContact OD2-CZ 3.46Å; D85-R90 IonicContact OD2-NE 2.85Å; D85-R90 PolarHBondContact OD2-NE 3.36Å; D85-R90 IonicContact OD2-NH2 3.18Å; D85-R90 PolarHBondContact OD2-NH2 2.99Å |
| 86 | L | 67.6 | Low | 73 | Confident | 129 Ų | 129 | 68.2 Ų | 68.2 | 68% | 0.675 | 37% | 0.367 | S | S | * | . | trans | -87.5 | 13.4 | 175.4 | -59.3 | 173.1 | 0 | 0 | 0 | 111.6 | I88 V89 | L86-I88 PolarHBondContact O-N 3.26Å; L86-V89 WeakPolarHBondContact CB-O 3.19Å; L86-V89 PolarHBondContact N-O 3.01Å; L86-V89 VanDerWaalsContact N-O 3.15Å | ||
| 87 | G | 60.4 | Low | 74.2 | Confident | 69 Ų | 69 | 62.3 Ų | 62.3 | 71% | 0.711 | 34% | 0.337 | S | S | * | . | S | Bend | trans | 82.8 | -45.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | D85 | D85-G87 PolarHBondContact O-N 3.19Å; D85-G87 WeakPolarHBondContact OD1-CA 3.38Å; D85-G87 PolarHBondContact OD1-N 3.46Å |
| 88 | I | 65.9 | Low | 75.9 | Confident | 164 Ų | 164 | 60.8 Ų | 60.8 | 84% | 0.841 | 32% | 0.324 | S | S | * | . | S | Bend | trans | -95.2 | -38.9 | 179 | -54.2 | 173.8 | 0 | 0 | 0 | 111.1 | L86 | L86-I88 PolarHBondContact O-N 3.26Š|
| 89 | V | 68.3 | Low | 77.6 | Confident | 86 Ų | 86 | 53.2 Ų | 53.2 | 52% | 0.521 | 29% | 0.292 | S | S | . | . | trans | -132.6 | 129.4 | -174.5 | -175.1 | 0 | 0 | 0 | 0 | 109 | L86 | L86-V89 WeakPolarHBondContact CB-O 3.19Å; L86-V89 PolarHBondContact N-O 3.01Å; L86-V89 VanDerWaalsContact N-O 3.15Å | ||
| 90 | R | 75.5 | Confident | 79.5 | Confident | 140 Ų | 140 | 49.9 Ų | 49.9 | 53% | 0.528 | 26% | 0.258 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 120.4 | 166.7 | -68.2 | -174.4 | 174.1 | 172.2 | 0.6 | 108.8 | W83 D85 | W83-R90 HydrophobicContact CD2-CB 4.37Å; W83-R90 HydrophobicContact CE3-CB 3.62Å; W83-R90 HydrophobicContact CZ3-CB 4.16Å; W83-R90 WeakPolarHBondContact CZ3-O 3.09Å; D85-R90 HydrophobicContact CB-CG 4.39Å; D85-R90 IonicContact OD2-CZ 3.46Å; D85-R90 IonicContact OD2-NE 2.85Å; D85-R90 PolarHBondContact OD2-NE 3.36Å; D85-R90 IonicContact OD2-NH2 3.18Å; D85-R90 PolarHBondContact OD2-NH2 2.99Å |
| 91 | F | 82.9 | Confident | 81.4 | Confident | 44 Ų | 44 | 49.3 Ų | 49.3 | 19% | 0.193 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 139.8 | -177.3 | 173.7 | -102.6 | 0 | 0 | 0 | 109.9 | L84 P93 I96 | L84-F91 PolarHBondContact N-O 3.21Å; L84-F91 PolarHBondContact O-N 3.02Å; F91-P93 HydrophobicContact CD1-CG 4.06Å; F91-P93 HydrophobicContact CE1-CB 4.13Å; F91-P93 HydrophobicContact CE1-CG 3.76Å; F91-P93 WeakPolarHBondContact O-CD 3.28Å; F91-I96 HydrophobicContact CE1-CD1 3.62Å; F91-I96 HydrophobicContact CE1-CG1 4.38Å; F91-I96 HydrophobicContact CE2-CD1 3.96Å; F91-I96 HydrophobicContact CE2-CG1 4.14Å; F91-I96 HydrophobicContact CZ-CB 4.31Å; F91-I96 HydrophobicContact CZ-CD1 3.1Å; F91-I96 HydrophobicContact CZ-CG1 3.46Å; F91-I96 VanDerWaalsContact CZ-CG1 3.46Å |
| 92 | Q | 87 | Confident | 82.8 | Confident | 19 Ų | 19 | 46.3 Ų | 46.3 | 9% | 0.089 | 24% | 0.239 | C | C | . | . | trans | -111 | 103.8 | -178.5 | -177.7 | 173 | 8.3 | 0 | 0 | 109.6 | W83 S94 E95 D140 S325 | W83-Q92 HydrophobicContact CD2-CB 4.39Å; W83-Q92 HydrophobicContact CE3-CB 4.05Å; W83-Q92 HydrophobicContact CH2-CB 4.45Å; W83-Q92 HydrophobicContact CZ3-CB 4.11Å; Q92-S94 VanDerWaalsContact C-N 3.25Å; Q92-S94 VanDerWaalsContact CG-OG 3.27Å; Q92-S94 WeakPolarHBondContact CG-OG 3.41Å; Q92-S94 PolarHBondContact NE2-OG 3.49Å; Q92-S94 VanDerWaalsContact NE2-OG 3.08Å; Q92-S94 PolarHBondContact O-N 3.44Å; Q92-E95 HydrophobicContact CB-CG 4.05Å; Q92-E95 HydrophobicContact CG-CG 4.16Å; Q92-E95 VanDerWaalsContact O-CB 3.29Å; Q92-E95 WeakPolarHBondContact O-CB 3.42Å; Q92-E95 PolarHBondContact O-N 2.88Å; Q92-D140 PolarHBondContact NE2-OD2 3.38Å; Q92-D140 VanDerWaalsContact NE2-OD2 3.15Å; Q92-S325 PolarHBondContact N-OG 2.62Å | ||
| 93 | P | 89 | Confident | 84 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -59.7 | -29 | -177.6 | -31.9 | 41.3 | 0 | 0 | 0 | 115.6 | L66 L67 V70 L84 F91 E95 I96 A97 | L66-P93 HydrophobicContact CB-CB 3.76Å; L66-P93 HydrophobicContact CB-CG 3.98Å; L67-P93 HydrophobicContact CD2-CB 4.21Å; V70-P93 HydrophobicContact CG2-CB 4.27Å; V70-P93 HydrophobicContact CG2-CG 3.45Å; V70-P93 VanDerWaalsContact CG2-CG 3.45Å; L84-P93 HydrophobicContact CD1-CG 3.68Å; L84-P93 HydrophobicContact CG-CG 3.99Å; F91-P93 HydrophobicContact CD1-CG 4.06Å; F91-P93 HydrophobicContact CE1-CB 4.13Å; F91-P93 HydrophobicContact CE1-CG 3.76Å; F91-P93 WeakPolarHBondContact O-CD 3.28Å; P93-E95 PolarHBondContact O-N 3.46Å; P93-I96 PolarHBondContact O-N 2.85Å; P93-A97 PolarHBondContact O-N 3.3Å |
| 94 | S | 90.4 | Very high | 84.9 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.6 | -20.7 | 175.3 | 66.9 | 0 | 0 | 0 | 0 | 112.9 | Q92 A97 | Q92-S94 VanDerWaalsContact C-N 3.25Å; Q92-S94 VanDerWaalsContact CG-OG 3.27Å; Q92-S94 WeakPolarHBondContact CG-OG 3.41Å; Q92-S94 PolarHBondContact NE2-OG 3.49Å; Q92-S94 VanDerWaalsContact NE2-OG 3.08Å; Q92-S94 PolarHBondContact O-N 3.44Å; S94-A97 WeakPolarHBondContact O-CB 3.43Å |
| 95 | E | 91.5 | Very high | 86 | Confident | 7 Ų | 7 | 39.5 Ų | 39.5 | 3% | 0.033 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -68 | -45 | 170.1 | -64.8 | -65.3 | 150.6 | 0 | 0 | 111.3 | Q92 P93 A97 K98 A326 V329 | Q92-E95 HydrophobicContact CB-CG 4.05Å; Q92-E95 HydrophobicContact CG-CG 4.16Å; Q92-E95 VanDerWaalsContact O-CB 3.29Å; Q92-E95 WeakPolarHBondContact O-CB 3.42Å; Q92-E95 PolarHBondContact O-N 2.88Å; P93-E95 PolarHBondContact O-N 3.46Å; E95-A97 PolarHBondContact O-N 3.01Å; E95-K98 VanDerWaalsContact O-CB 3.28Å; E95-K98 WeakPolarHBondContact O-CB 3.2Å; E95-K98 WeakPolarHBondContact O-CG 3.33Å; E95-K98 PolarHBondContact O-N 3.39Å; E95-K98 VanDerWaalsContact O-N 3.09Å; E95-K98 IonicContact OE1-NZ 2.71Å; E95-K98 PolarHBondContact OE1-NZ 3.36Å; E95-K98 VanDerWaalsContact OE2-CD 3.24Å; E95-K98 WeakPolarHBondContact OE2-CD 3.44Å; E95-K98 WeakPolarHBondContact OE2-CE 3.47Å; E95-K98 IonicContact OE2-NZ 2.7Å; E95-K98 PolarHBondContact OE2-NZ 3Å; E95-A326 HydrophobicContact CG-CB 4.47Å; E95-A326 WeakPolarHBondContact OE2-CA 3.37Å; E95-V329 HydrophobicContact CB-CB 4.35Å; E95-V329 HydrophobicContact CB-CG2 3.83Å; E95-V329 WeakPolarHBondContact O-CG1 3.26Å |
| 96 | I | 92.9 | Very high | 86.9 | Confident | 39 Ų | 39 | 36.1 Ų | 36.1 | 20% | 0.2 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59.6 | -35 | 176.7 | -79 | 169.5 | 0 | 0 | 0 | 111.4 | L59 C63 L66 F91 P93 K98 I99 A100 V329 | L59-I96 HydrophobicContact CD1-CG2 4.2Å; C63-I96 HydrophobicContact CB-CG2 4.09Å; L66-I96 HydrophobicContact CD1-CD1 4.43Å; F91-I96 HydrophobicContact CE1-CD1 3.62Å; F91-I96 HydrophobicContact CE1-CG1 4.38Å; F91-I96 HydrophobicContact CE2-CD1 3.96Å; F91-I96 HydrophobicContact CE2-CG1 4.14Å; F91-I96 HydrophobicContact CZ-CB 4.31Å; F91-I96 HydrophobicContact CZ-CD1 3.1Å; F91-I96 HydrophobicContact CZ-CG1 3.46Å; F91-I96 VanDerWaalsContact CZ-CG1 3.46Å; P93-I96 PolarHBondContact O-N 2.85Å; I96-K98 PolarHBondContact O-N 2.87Å; I96-K98 VanDerWaalsContact O-N 3.12Å; I96-I99 PolarHBondContact O-N 3.39Å; I96-A100 HydrophobicContact CG2-CB 4.14Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 2.95Å; I96-V329 HydrophobicContact CG1-CG2 4.42Å |
| 97 | A | 94.9 | Very high | 88.1 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -55.4 | -31.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | C63 P93 S94 E95 I99 A100 V101 V147 | C63-A97 VanDerWaalsContact SG-CA 3.52Å; P93-A97 PolarHBondContact O-N 3.3Å; S94-A97 WeakPolarHBondContact O-CB 3.43Å; E95-A97 PolarHBondContact O-N 3.01Å; A97-I99 PolarHBondContact O-N 3.17Å; A97-A100 PolarHBondContact O-N 3.3Å; A97-V101 HydrophobicContact CB-CG2 4.4Å; A97-V101 VanDerWaalsContact O-CB 3.27Å; A97-V101 WeakPolarHBondContact O-CB 3.5Å; A97-V101 VanDerWaalsContact O-CG2 3.24Å; A97-V101 WeakPolarHBondContact O-CG2 3.21Å; A97-V101 PolarHBondContact O-N 3.37Å; A97-V147 HydrophobicContact CB-CG1 4.08Å; A97-V147 HydrophobicContact CB-CG2 3.78Å |
| 98 | K | 93.3 | Very high | 89.6 | Confident | 14 Ų | 14 | 30.4 Ų | 30.4 | 6% | 0.061 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.6 | -18.6 | 178.4 | -58.7 | 161.6 | -177.6 | -164.5 | 0 | 113.6 | E95 I96 P102 V147 Y298 | E95-K98 VanDerWaalsContact O-CB 3.28Å; E95-K98 WeakPolarHBondContact O-CB 3.2Å; E95-K98 WeakPolarHBondContact O-CG 3.33Å; E95-K98 PolarHBondContact O-N 3.39Å; E95-K98 VanDerWaalsContact O-N 3.09Å; E95-K98 IonicContact OE1-NZ 2.71Å; E95-K98 PolarHBondContact OE1-NZ 3.36Å; E95-K98 VanDerWaalsContact OE2-CD 3.24Å; E95-K98 WeakPolarHBondContact OE2-CD 3.44Å; E95-K98 WeakPolarHBondContact OE2-CE 3.47Å; E95-K98 IonicContact OE2-NZ 2.7Å; E95-K98 PolarHBondContact OE2-NZ 3Å; I96-K98 PolarHBondContact O-N 2.87Å; I96-K98 VanDerWaalsContact O-N 3.12Å; K98-P102 WeakPolarHBondContact O-CD 3.25Å; K98-P102 WeakPolarHBondContact O-CG 3.33Å; K98-V147 HydrophobicContact CG-CG2 3.88Å; K98-Y298 WeakPolarHBondContact CD-OH 3.37Å; K98-Y298 WeakPolarHBondContact CE-OH 3.12Å; K98-Y298 PolarHBondContact NZ-OH 3.29Å |
| 99 | I | 95.4 | Very high | 90.5 | Very high | 16 Ų | 16 | 22.9 Ų | 22.9 | 8% | 0.082 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -106.8 | -44.9 | 172.3 | -66.7 | -176.1 | 0 | 0 | 0 | 110.7 | I96 A97 V101 P102 L103 M287 V329 A332 I336 | I96-I99 PolarHBondContact O-N 3.39Å; A97-I99 PolarHBondContact O-N 3.17Å; I99-V101 VanDerWaalsContact C-N 3.34Å; I99-V101 PolarHBondContact O-N 2.93Å; I99-P102 VanDerWaalsContact O-CD 3.29Å; I99-P102 WeakPolarHBondContact O-CD 3.3Å; I99-P102 WeakPolarHBondContact O-CG 3.27Å; I99-L103 WeakPolarHBondContact O-CB 3.33Å; I99-L103 PolarHBondContact O-N 3.36Å; I99-M287 HydrophobicContact CG2-CE 4.42Å; I99-V329 HydrophobicContact CD1-CG1 3.6Å; I99-V329 WeakPolarHBondContact CD1-O 3.48Å; I99-V329 HydrophobicContact CG1-CG1 3.8Å; I99-A332 HydrophobicContact CD1-CB 4.14Å; I99-I336 HydrophobicContact CG2-CD1 3.77Å |
| 100 | A | 96.7 | Very high | 91 | Very high | 0 Ų | 0 | 21 Ų | 21 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -60.4 | -42.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L59 C63 I96 A97 M104 | L59-A100 HydrophobicContact CD2-CB 4.15Å; L59-A100 HydrophobicContact CG-CB 3.87Å; C63-A100 HydrophobicContact CB-CB 3.91Å; I96-A100 HydrophobicContact CG2-CB 4.14Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 2.95Å; A97-A100 PolarHBondContact O-N 3.3Å; A100-M104 WeakPolarHBondContact O-CB 3.35Å; A100-M104 PolarHBondContact O-N 2.86Å |
| 101 | V | 97.4 | Very high | 90.8 | Very high | 1 Ų | 1 | 22.5 Ų | 22.5 | 1% | 0.006 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -64.6 | -58.2 | 179.2 | 176.8 | 0 | 0 | 0 | 0 | 112.1 | Y60 A97 I99 L103 M104 V105 I128 P131 V147 | Y60-V101 HydrophobicContact CE2-CG2 4.2Å; A97-V101 HydrophobicContact CB-CG2 4.4Å; A97-V101 VanDerWaalsContact O-CB 3.27Å; A97-V101 WeakPolarHBondContact O-CB 3.5Å; A97-V101 VanDerWaalsContact O-CG2 3.24Å; A97-V101 WeakPolarHBondContact O-CG2 3.21Å; A97-V101 PolarHBondContact O-N 3.37Å; I99-V101 VanDerWaalsContact C-N 3.34Å; I99-V101 PolarHBondContact O-N 2.93Å; V101-L103 PolarHBondContact O-N 3.03Å; V101-M104 PolarHBondContact O-N 3.34Å; V101-V105 HydrophobicContact CG1-CG2 4.36Å; V101-V105 VanDerWaalsContact O-CG2 3.28Å; V101-V105 WeakPolarHBondContact O-CG2 3.4Å; V101-V105 PolarHBondContact O-N 2.91Å; V101-I128 HydrophobicContact CG1-CB 4.47Å; V101-I128 HydrophobicContact CG1-CG1 4.2Å; V101-P131 HydrophobicContact CG2-CB 3.94Å; V101-P131 HydrophobicContact CG2-CG 3.37Å; V101-V147 HydrophobicContact CB-CG1 4.3Å; V101-V147 HydrophobicContact CG2-CG1 3.79Å |
| 102 | P | 96.6 | Very high | 89.9 | Confident | 1 Ų | 1 | 23.5 Ų | 23.5 | 1% | 0.006 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -62.3 | -32.2 | 179.5 | 21.5 | -31.2 | 0 | 0 | 0 | 112.3 | K98 I99 A106 S150 V154 M287 | K98-P102 WeakPolarHBondContact O-CD 3.25Å; K98-P102 WeakPolarHBondContact O-CG 3.33Å; I99-P102 VanDerWaalsContact O-CD 3.29Å; I99-P102 WeakPolarHBondContact O-CD 3.3Å; I99-P102 WeakPolarHBondContact O-CG 3.27Å; P102-A106 WeakPolarHBondContact O-CB 3.49Å; P102-A106 PolarHBondContact O-N 3.33Å; P102-S150 WeakPolarHBondContact CD-OG 3.28Å; P102-V154 HydrophobicContact CB-CG2 3.55Å; P102-M287 HydrophobicContact CB-CE 4.34Å; P102-M287 HydrophobicContact CB-SD 4.23Å; P102-M287 HydrophobicContact CG-CE 4.22Å |
| 103 | L | 96 | Very high | 88.9 | Confident | 3 Ų | 3 | 28.8 Ų | 28.8 | 2% | 0.016 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.4 | -44.1 | 176.5 | -162.2 | 72.4 | 0 | 0 | 0 | 112.2 | A56 L59 I99 V101 A106 R107 F283 M287 | A56-L103 HydrophobicContact CB-CB 4.31Å; A56-L103 HydrophobicContact CB-CD2 3.88Å; A56-L103 HydrophobicContact CB-CG 3.74Å; L59-L103 HydrophobicContact CD2-CD2 4.06Å; I99-L103 WeakPolarHBondContact O-CB 3.33Å; I99-L103 PolarHBondContact O-N 3.36Å; V101-L103 PolarHBondContact O-N 3.03Å; L103-A106 PolarHBondContact O-N 3.43Å; L103-R107 WeakPolarHBondContact O-CB 3.39Å; L103-R107 PolarHBondContact O-N 3.27Å; L103-F283 HydrophobicContact CD1-CE2 4.11Å; L103-F283 HydrophobicContact CD1-CZ 3.56Å; L103-F283 HydrophobicContact CG-CZ 4.4Å; L103-M287 HydrophobicContact CB-CE 4.13Å; L103-M287 HydrophobicContact CB-SD 4.3Å; L103-M287 HydrophobicContact CD1-CE 3.8Å; L103-M287 HydrophobicContact CD1-CG 4.22Å; L103-M287 HydrophobicContact CD1-SD 3.78Å |
| 104 | M | 96.1 | Very high | 87.8 | Confident | 26 Ų | 26 | 31.7 Ų | 31.7 | 13% | 0.128 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -67.4 | -42.4 | 177.7 | -176.6 | 57.9 | -156.6 | 0 | 0 | 111.6 | P57 Y60 A100 V101 R107 F108 L127 | P57-M104 HydrophobicContact CB-SD 4.05Å; P57-M104 HydrophobicContact CG-SD 3.97Å; Y60-M104 HydrophobicContact CD2-CB 3.59Å; Y60-M104 HydrophobicContact CD2-CG 3.79Å; Y60-M104 HydrophobicContact CE2-CB 4.34Å; Y60-M104 HydrophobicContact CE2-CG 4.35Å; Y60-M104 HydrophobicContact CG-CB 4Å; Y60-M104 HydrophobicContact CG-CG 3.87Å; A100-M104 WeakPolarHBondContact O-CB 3.35Å; A100-M104 PolarHBondContact O-N 2.86Å; V101-M104 PolarHBondContact O-N 3.34Å; M104-R107 PolarHBondContact O-N 2.9Å; M104-F108 VanDerWaalsContact O-CB 3.31Å; M104-F108 WeakPolarHBondContact O-CB 3.33Å; M104-F108 PolarHBondContact O-N 3.17Å; M104-L127 HydrophobicContact CE-CD1 4.1Å; M104-L127 HydrophobicContact CG-CD1 4.22Å; M104-L127 HydrophobicContact CG-CD2 4.39Å |
| 105 | V | 94.5 | Very high | 87.2 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.7 | -43.4 | 175.7 | 176.4 | 0 | 0 | 0 | 0 | 110.6 | V101 R107 F108 I109 A124 L127 I128 V154 | V101-V105 HydrophobicContact CG1-CG2 4.36Å; V101-V105 VanDerWaalsContact O-CG2 3.28Å; V101-V105 WeakPolarHBondContact O-CG2 3.4Å; V101-V105 PolarHBondContact O-N 2.91Å; V105-R107 PolarHBondContact O-N 2.99Å; V105-F108 PolarHBondContact O-N 3.43Å; V105-I109 HydrophobicContact CG1-CD1 3.6Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CB 3.3Å; V105-I109 VanDerWaalsContact O-CG1 3.28Å; V105-I109 WeakPolarHBondContact O-CG1 3.29Å; V105-I109 PolarHBondContact O-N 3.26Å; V105-A124 HydrophobicContact CG1-CB 4.49Å; V105-L127 HydrophobicContact CG2-CB 4.38Å; V105-I128 HydrophobicContact CG2-CD1 4.16Å; V105-I128 HydrophobicContact CG2-CG1 3.6Å; V105-V154 HydrophobicContact CB-CG1 4.27Å; V105-V154 HydrophobicContact CG1-CB 4.17Å; V105-V154 HydrophobicContact CG1-CG1 3.86Å |
| 106 | A | 93.5 | Very high | 86.5 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.8 | -45.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | P102 L103 N110 V154 F283 V286 M287 | P102-A106 WeakPolarHBondContact O-CB 3.49Å; P102-A106 PolarHBondContact O-N 3.33Å; L103-A106 PolarHBondContact O-N 3.43Å; A106-N110 VanDerWaalsContact O-CB 3.26Å; A106-N110 WeakPolarHBondContact O-CB 3.12Å; A106-N110 PolarHBondContact O-N 3.42Å; A106-V154 HydrophobicContact CB-CG1 3.74Å; A106-F283 HydrophobicContact CB-CD2 3.78Å; A106-F283 HydrophobicContact CB-CE2 3.85Å; A106-V286 HydrophobicContact CB-CG2 3.8Å; A106-M287 HydrophobicContact CB-CB 4.45Å; A106-M287 HydrophobicContact CB-SD 4.38Å |
| 107 | R | 92.7 | Very high | 86.1 | Confident | 39 Ų | 39 | 37.1 Ų | 37.1 | 15% | 0.147 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61 | -47.8 | 174.4 | 174.7 | -160.7 | 168.1 | 129.2 | -15.9 | 111.3 | E53 G54 A56 P57 L103 M104 V105 I109 N110 F283 | E53-R107 HydrophobicContact CG-CB 4.23Å; E53-R107 HydrophobicContact CG-CG 3.97Å; E53-R107 VanDerWaalsContact O-CD 3.24Å; E53-R107 WeakPolarHBondContact O-CD 3.47Å; E53-R107 PolarHBondContact O-NH1 3.26Å; G54-R107 PolarHBondContact O-NH1 2.94Å; A56-R107 HydrophobicContact CB-CB 4.14Å; P57-R107 VanDerWaalsContact CD-CZ 3.43Å; P57-R107 VanDerWaalsContact CG-NH2 3.34Å; L103-R107 WeakPolarHBondContact O-CB 3.39Å; L103-R107 PolarHBondContact O-N 3.27Å; M104-R107 PolarHBondContact O-N 2.9Å; V105-R107 PolarHBondContact O-N 2.99Å; R107-I109 VanDerWaalsContact C-N 3.34Å; R107-I109 PolarHBondContact O-N 3.22Å; R107-N110 PolarHBondContact O-N 3.5Å; R107-F283 HydrophobicContact CB-CE2 4.41Å |
| 108 | F | 90.9 | Very high | 85.5 | Confident | 39 Ų | 39 | 43.3 Ų | 43.3 | 17% | 0.171 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -60 | -47 | -176.5 | 177.5 | -100.3 | 0 | 0 | 0 | 111 | M104 V105 R111 N120 I123 A124 L127 | M104-F108 VanDerWaalsContact O-CB 3.31Å; M104-F108 WeakPolarHBondContact O-CB 3.33Å; M104-F108 PolarHBondContact O-N 3.17Å; V105-F108 PolarHBondContact O-N 3.43Å; F108-R111 PolarHBondContact O-N 3Å; F108-N120 HydrophobicContact CE1-CB 3.88Å; F108-N120 WeakPolarHBondContact CE1-O 3.16Å; F108-N120 HydrophobicContact CZ-CB 4.11Å; F108-I123 HydrophobicContact CD2-CG2 4.46Å; F108-I123 HydrophobicContact CE1-CB 4.06Å; F108-I123 HydrophobicContact CE1-CG2 4.02Å; F108-I123 HydrophobicContact CE2-CB 4.43Å; F108-I123 HydrophobicContact CE2-CG2 3.73Å; F108-I123 HydrophobicContact CZ-CB 3.7Å; F108-I123 HydrophobicContact CZ-CD1 4.03Å; F108-I123 HydrophobicContact CZ-CG1 4.48Å; F108-I123 HydrophobicContact CZ-CG2 3.48Å; F108-I123 VanDerWaalsContact CZ-CG2 3.48Å; F108-A124 HydrophobicContact CD1-CB 4.31Å; F108-A124 HydrophobicContact CE1-CB 4.45Å; F108-L127 HydrophobicContact CB-CD1 4.18Å; F108-L127 HydrophobicContact CD2-CD1 4.38Å; F108-L127 HydrophobicContact CG-CD1 4.09Å |
| 109 | I | 84.6 | Confident | 85.2 | Confident | 6 Ų | 6 | 50.3 Ų | 50.3 | 3% | 0.031 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -68.2 | -35.3 | 178.9 | -67.5 | 170.1 | 0 | 0 | 0 | 112.2 | V105 R107 R111 D112 V154 L155 S158 | V105-I109 HydrophobicContact CG1-CD1 3.6Å; V105-I109 HydrophobicContact CG1-CG1 4.39Å; V105-I109 WeakPolarHBondContact O-CB 3.3Å; V105-I109 VanDerWaalsContact O-CG1 3.28Å; V105-I109 WeakPolarHBondContact O-CG1 3.29Å; V105-I109 PolarHBondContact O-N 3.26Å; R107-I109 VanDerWaalsContact C-N 3.34Å; R107-I109 PolarHBondContact O-N 3.22Å; I109-R111 PolarHBondContact O-N 3.46Å; I109-R111 VanDerWaalsContact O-N 3.1Å; I109-D112 PolarHBondContact O-N 3.03Å; I109-D112 VanDerWaalsContact O-N 3.11Å; I109-V154 HydrophobicContact CD1-CG1 4.44Å; I109-L155 HydrophobicContact CD1-CB 4.34Å; I109-L155 HydrophobicContact CD1-CD1 3.64Å; I109-L155 HydrophobicContact CG1-CD1 4.45Å; I109-S158 VanDerWaalsContact CG2-CB 3.4Å |
| 110 | N | 80.3 | Confident | 84.9 | Confident | 48 Ų | 48 | 50.9 Ų | 50.9 | 26% | 0.257 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -63.1 | -17.2 | -179.5 | -167.6 | 58.7 | 0 | 0 | 0 | 113.5 | E53 A106 R107 T282 F283 | E53-N110 PolarHBondContact OE1-ND2 2.94Å; A106-N110 VanDerWaalsContact O-CB 3.26Å; A106-N110 WeakPolarHBondContact O-CB 3.12Å; A106-N110 PolarHBondContact O-N 3.42Å; R107-N110 PolarHBondContact O-N 3.5Å; N110-T282 WeakPolarHBondContact OD1-CB 3.47Å; N110-F283 HydrophobicContact CB-CB 4.22Å; N110-F283 PolarHBondContact OD1-N 3.47Å |
| 111 | R | 71.1 | Confident | 84.5 | Confident | 171 Ų | 171 | 51.3 Ų | 51.3 | 65% | 0.645 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.5 | -14.9 | 177.5 | -69.2 | 178.4 | 168.7 | -160.5 | -11 | 113.8 | F108 I109 | F108-R111 PolarHBondContact O-N 3Å; I109-R111 PolarHBondContact O-N 3.46Å; I109-R111 VanDerWaalsContact O-N 3.1Å |
| 112 | D | 63.4 | Low | 84.1 | Confident | 65 Ų | 65 | 52.9 Ų | 52.9 | 35% | 0.348 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -112.7 | 164.8 | -176.3 | -71.8 | -51.3 | 0 | 0 | 0 | 112.4 | I109 N120 | I109-D112 PolarHBondContact O-N 3.03Å; I109-D112 VanDerWaalsContact O-N 3.11Å; D112-N120 PolarHBondContact OD1-ND2 3.49Å; D112-N120 PolarHBondContact OD2-ND2 3.32Å |
| 113 | V | 65.4 | Low | 83.9 | Confident | 130 Ų | 130 | 55.9 Ų | 55.9 | 79% | 0.788 | 30% | 0.298 | S | S | * | . | P | Polyproline II helix | trans | -66.7 | 132.3 | 170.1 | -150.2 | 0 | 0 | 0 | 0 | 108.8 | P115 | V113-P115 CarbonylContact O-C 3.41Å; V113-P115 VanDerWaalsContact O-C 3.31Å |
| 114 | C | 67.2 | Low | 83.8 | Confident | 61 Ų | 61 | 55.8 Ų | 55.8 | 41% | 0.412 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -78.1 | 132.4 | 167.9 | -59.2 | 0 | 0 | 0 | 0 | 109 | ||
| 115 | P | 77.3 | Confident | 83.7 | Confident | 89 Ų | 89 | 57.3 Ų | 57.3 | 58% | 0.578 | 31% | 0.306 | S | S | * | . | S | Bend | cis | -83.1 | 154.5 | 5.2 | 34.1 | -36.3 | 0 | 0 | 0 | 114.1 | V113 G159 | V113-P115 CarbonylContact O-C 3.41Å; V113-P115 VanDerWaalsContact O-C 3.31Å; P115-G159 VanDerWaalsContact CB-O 3.3Å; P115-G159 WeakPolarHBondContact CB-O 3.28Å |
| 116 | P | 76.5 | Confident | 83.7 | Confident | 17 Ų | 17 | 61.7 Ų | 61.7 | 11% | 0.11 | 33% | 0.333 | C | S | . | . | P | Polyproline II helix | trans | -63 | 140.6 | -178.7 | 26.8 | -34.5 | 0 | 0 | 0 | 112 | L155 L160 | P116-L155 HydrophobicContact CG-CD1 4.25Å; P116-L160 HydrophobicContact CG-CD1 4.28Å |
| 117 | S | 83.7 | Confident | 83.8 | Confident | 54 Ų | 54 | 63 Ų | 63 | 38% | 0.378 | 34% | 0.339 | S | S | . | . | P | Polyproline II helix | trans | -63.5 | 160.7 | 173.3 | 73 | 0 | 0 | 0 | 0 | 111.6 | K119 N120 T121 | S117-K119 VanDerWaalsContact C-N 3.26Å; S117-K119 PolarHBondContact O-N 2.87Å; S117-N120 PolarHBondContact O-N 2.91Å; S117-N120 VanDerWaalsContact O-N 3.16Å; S117-N120 WeakPolarHBondContact OG-CB 3.41Å; S117-N120 PolarHBondContact OG-N 3.32Å; S117-N120 PolarHBondContact OG-ND2 3.44Å; S117-N120 VanDerWaalsContact OG-ND2 3.15Å; S117-N120 PolarHBondContact OG-OD1 2.89Å; S117-T121 WeakPolarHBondContact O-CB 3.28Å; S117-T121 PolarHBondContact O-N 3.43Å; S117-T121 PolarHBondContact O-OG1 3.5Å |
| 118 | L | 83.6 | Confident | 84 | Confident | 129 Ų | 129 | 61.1 Ų | 61.1 | 68% | 0.675 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -57.2 | -40.1 | 176 | -71.7 | 175 | 0 | 0 | 0 | 112.2 | T121 G122 L164 | L118-T121 PolarHBondContact O-N 2.91Å; L118-G122 PolarHBondContact O-N 3.38Å; L118-L164 HydrophobicContact CD2-CD1 3.67Å; L118-L164 HydrophobicContact CD2-CD2 3.68Å; L118-L164 HydrophobicContact CD2-CG 4.28Å |
| 119 | K | 87 | Confident | 84.2 | Confident | 161 Ų | 161 | 63.5 Ų | 63.5 | 70% | 0.7 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -61.1 | -47.4 | 176.2 | -176.7 | -178.1 | 178.3 | -177.8 | 0 | 111.2 | S117 T121 G122 I123 | S117-K119 VanDerWaalsContact C-N 3.26Å; S117-K119 PolarHBondContact O-N 2.87Å; K119-T121 VanDerWaalsContact C-N 3.35Å; K119-G122 PolarHBondContact O-N 2.94Å; K119-I123 HydrophobicContact CG-CD1 4.28Å; K119-I123 WeakPolarHBondContact O-CG1 3.07Å; K119-I123 PolarHBondContact O-N 3.44Å |
| 120 | N | 87.4 | Confident | 84.7 | Confident | 28 Ų | 28 | 67 Ų | 67 | 15% | 0.15 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -72.9 | -33 | -177.2 | -60.7 | -9.9 | 0 | 0 | 0 | 111 | F108 D112 S117 G122 I123 A124 | F108-N120 HydrophobicContact CE1-CB 3.88Å; F108-N120 WeakPolarHBondContact CE1-O 3.16Å; F108-N120 HydrophobicContact CZ-CB 4.11Å; D112-N120 PolarHBondContact OD1-ND2 3.49Å; D112-N120 PolarHBondContact OD2-ND2 3.32Å; S117-N120 PolarHBondContact O-N 2.91Å; S117-N120 VanDerWaalsContact O-N 3.16Å; S117-N120 WeakPolarHBondContact OG-CB 3.41Å; S117-N120 PolarHBondContact OG-N 3.32Å; S117-N120 PolarHBondContact OG-ND2 3.44Å; S117-N120 VanDerWaalsContact OG-ND2 3.15Å; S117-N120 PolarHBondContact OG-OD1 2.89Å; N120-G122 VanDerWaalsContact C-N 3.34Å; N120-I123 PolarHBondContact O-N 2.81Å; N120-A124 WeakPolarHBondContact O-CB 3.47Å; N120-A124 PolarHBondContact O-N 3.22Å |
| 121 | T | 89 | Confident | 85.4 | Confident | 10 Ų | 10 | 64.8 Ų | 64.8 | 6% | 0.061 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -58.9 | -46.8 | 168.6 | -56.2 | 0 | 0 | 0 | 0 | 110.5 | S117 L118 K119 I123 A124 L125 L155 L160 | S117-T121 WeakPolarHBondContact O-CB 3.28Å; S117-T121 PolarHBondContact O-N 3.43Å; S117-T121 PolarHBondContact O-OG1 3.5Å; L118-T121 PolarHBondContact O-N 2.91Å; K119-T121 VanDerWaalsContact C-N 3.35Å; T121-I123 PolarHBondContact O-N 3.46Å; T121-A124 PolarHBondContact O-N 2.87Å; T121-L125 HydrophobicContact CG2-CD1 4.33Å; T121-L125 VanDerWaalsContact O-CG 3.29Å; T121-L125 WeakPolarHBondContact O-CG 3.4Å; T121-L125 PolarHBondContact O-N 3.21Å; T121-L155 HydrophobicContact CG2-CD2 4.25Å; T121-L160 HydrophobicContact CG2-CD1 3.65Å |
| 122 | G | 90.1 | Very high | 86.5 | Confident | 33 Ų | 33 | 57.2 Ų | 57.2 | 34% | 0.34 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -58.2 | -45.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | L118 K119 N120 L125 V126 | L118-G122 PolarHBondContact O-N 3.38Å; K119-G122 PolarHBondContact O-N 2.94Å; N120-G122 VanDerWaalsContact C-N 3.34Å; G122-L125 PolarHBondContact O-N 2.95Å; G122-V126 WeakPolarHBondContact O-CG2 3.39Å; G122-V126 PolarHBondContact O-N 3.4Å |
| 123 | I | 92.3 | Very high | 87.9 | Confident | 65 Ų | 65 | 59.7 Ų | 59.7 | 33% | 0.333 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.9 | -43 | 176.6 | -64 | 165.2 | 0 | 0 | 0 | 111.1 | F108 K119 N120 T121 L125 V126 L127 | F108-I123 HydrophobicContact CD2-CG2 4.46Å; F108-I123 HydrophobicContact CE1-CB 4.06Å; F108-I123 HydrophobicContact CE1-CG2 4.02Å; F108-I123 HydrophobicContact CE2-CB 4.43Å; F108-I123 HydrophobicContact CE2-CG2 3.73Å; F108-I123 HydrophobicContact CZ-CB 3.7Å; F108-I123 HydrophobicContact CZ-CD1 4.03Å; F108-I123 HydrophobicContact CZ-CG1 4.48Å; F108-I123 HydrophobicContact CZ-CG2 3.48Å; F108-I123 VanDerWaalsContact CZ-CG2 3.48Å; K119-I123 HydrophobicContact CG-CD1 4.28Å; K119-I123 WeakPolarHBondContact O-CG1 3.07Å; K119-I123 PolarHBondContact O-N 3.44Å; N120-I123 PolarHBondContact O-N 2.81Å; T121-I123 PolarHBondContact O-N 3.46Å; I123-L125 VanDerWaalsContact C-N 3.3Å; I123-L125 PolarHBondContact O-N 3.45Å; I123-V126 PolarHBondContact O-N 3.37Å; I123-L127 HydrophobicContact CG2-CD1 4.35Å; I123-L127 WeakPolarHBondContact O-CG 3.36Å; I123-L127 PolarHBondContact O-N 2.84Å |
| 124 | A | 92.9 | Very high | 89.2 | Confident | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.7 | -40.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | V105 F108 N120 T121 V126 L127 I128 L155 | V105-A124 HydrophobicContact CG1-CB 4.49Å; F108-A124 HydrophobicContact CD1-CB 4.31Å; F108-A124 HydrophobicContact CE1-CB 4.45Å; N120-A124 WeakPolarHBondContact O-CB 3.47Å; N120-A124 PolarHBondContact O-N 3.22Å; T121-A124 PolarHBondContact O-N 2.87Å; A124-V126 PolarHBondContact O-N 2.95Å; A124-L127 PolarHBondContact O-N 3.49Å; A124-I128 WeakPolarHBondContact O-CD1 3.36Å; A124-I128 WeakPolarHBondContact O-CG1 3.25Å; A124-I128 PolarHBondContact O-N 3.48Å; A124-L155 HydrophobicContact CB-CD1 4.02Å |
| 125 | L | 93.3 | Very high | 90.3 | Very high | 59 Ų | 59 | 53 Ų | 53 | 31% | 0.309 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.8 | -41.1 | 174.7 | -68.3 | 171.6 | 0 | 0 | 0 | 111.7 | T121 G122 I123 L127 I128 F129 L152 L155 | T121-L125 HydrophobicContact CG2-CD1 4.33Å; T121-L125 VanDerWaalsContact O-CG 3.29Å; T121-L125 WeakPolarHBondContact O-CG 3.4Å; T121-L125 PolarHBondContact O-N 3.21Å; G122-L125 PolarHBondContact O-N 2.95Å; I123-L125 VanDerWaalsContact C-N 3.3Å; I123-L125 PolarHBondContact O-N 3.45Å; L125-L127 VanDerWaalsContact C-N 3.34Å; L125-L127 PolarHBondContact O-N 3.25Å; L125-I128 PolarHBondContact O-N 2.84Å; L125-F129 HydrophobicContact CB-CD2 4.29Å; L125-F129 HydrophobicContact CD2-CD2 4.48Å; L125-F129 HydrophobicContact CD2-CE2 4.01Å; L125-F129 WeakPolarHBondContact O-CB 3.36Å; L125-F129 VanDerWaalsContact O-CD2 3.29Å; L125-F129 WeakPolarHBondContact O-CD2 3.45Å; L125-F129 PolarHBondContact O-N 2.89Å; L125-L152 HydrophobicContact CD2-CD2 3.89Å; L125-L155 HydrophobicContact CD2-CD2 4.09Å; L125-L155 HydrophobicContact CG-CD2 4.47Å |
| 126 | V | 95.3 | Very high | 90.8 | Very high | 92 Ų | 92 | 50.8 Ų | 50.8 | 56% | 0.558 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -61.1 | -44.2 | 173.4 | 175.7 | 0 | 0 | 0 | 0 | 110.9 | G122 I123 A124 I128 F129 M130 | G122-V126 WeakPolarHBondContact O-CG2 3.39Å; G122-V126 PolarHBondContact O-N 3.4Å; I123-V126 PolarHBondContact O-N 3.37Å; A124-V126 PolarHBondContact O-N 2.95Å; V126-I128 PolarHBondContact O-N 3.31Å; V126-F129 PolarHBondContact O-N 3.35Å; V126-M130 WeakPolarHBondContact O-CB 3.48Å; V126-M130 PolarHBondContact O-N 2.9Å |
| 127 | L | 96 | Very high | 91.2 | Very high | 26 Ų | 26 | 53 Ų | 53 | 14% | 0.136 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.8 | -29.4 | 177.4 | -68.5 | 173.6 | 0 | 0 | 0 | 112.7 | Y60 M104 V105 F108 I123 A124 L125 P131 | Y60-L127 HydrophobicContact CE1-CD2 4.07Å; Y60-L127 VanDerWaalsContact CE2-O 3.27Å; Y60-L127 WeakPolarHBondContact CE2-O 3.25Å; Y60-L127 VanDerWaalsContact OH-CA 3.31Å; Y60-L127 WeakPolarHBondContact OH-CA 3.43Å; Y60-L127 PolarHBondContact OH-O 3.16Å; M104-L127 HydrophobicContact CE-CD1 4.1Å; M104-L127 HydrophobicContact CG-CD1 4.22Å; M104-L127 HydrophobicContact CG-CD2 4.39Å; V105-L127 HydrophobicContact CG2-CB 4.38Å; F108-L127 HydrophobicContact CB-CD1 4.18Å; F108-L127 HydrophobicContact CD2-CD1 4.38Å; F108-L127 HydrophobicContact CG-CD1 4.09Å; I123-L127 HydrophobicContact CG2-CD1 4.35Å; I123-L127 WeakPolarHBondContact O-CG 3.36Å; I123-L127 PolarHBondContact O-N 2.84Å; A124-L127 PolarHBondContact O-N 3.49Å; L125-L127 VanDerWaalsContact C-N 3.34Å; L125-L127 PolarHBondContact O-N 3.25Å; L127-P131 VanDerWaalsContact O-CD 3.23Å; L127-P131 WeakPolarHBondContact O-CD 3.29Å; L127-P131 WeakPolarHBondContact O-CG 3.2Å |
| 128 | I | 96.2 | Very high | 91.3 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -80.4 | -51.4 | 176.4 | -64.9 | 165.6 | 0 | 0 | 0 | 110.8 | V101 V105 A124 L125 V126 P131 T132 A148 G151 L152 | V101-I128 HydrophobicContact CG1-CB 4.47Å; V101-I128 HydrophobicContact CG1-CG1 4.2Å; V105-I128 HydrophobicContact CG2-CD1 4.16Å; V105-I128 HydrophobicContact CG2-CG1 3.6Å; A124-I128 WeakPolarHBondContact O-CD1 3.36Å; A124-I128 WeakPolarHBondContact O-CG1 3.25Å; A124-I128 PolarHBondContact O-N 3.48Å; L125-I128 PolarHBondContact O-N 2.84Å; V126-I128 PolarHBondContact O-N 3.31Å; I128-P131 WeakPolarHBondContact O-CD 3.31Å; I128-P131 WeakPolarHBondContact O-CG 3.48Å; I128-T132 WeakPolarHBondContact O-CB 3.45Å; I128-T132 PolarHBondContact O-N 2.9Å; I128-T132 PolarHBondContact O-OG1 3.47Å; I128-A148 HydrophobicContact CG2-CB 4.42Å; I128-G151 VanDerWaalsContact CD1-C 3.45Å; I128-L152 HydrophobicContact CD1-CD2 4.15Å; I128-L152 HydrophobicContact CD1-CG 4.41Å |
| 129 | F | 95.2 | Very high | 91.2 | Very high | 90 Ų | 90 | 47.4 Ų | 47.4 | 40% | 0.395 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -77.5 | -28.3 | -169.8 | -78.4 | -67.4 | 0 | 0 | 0 | 113.5 | L125 V126 T132 L133 | L125-F129 HydrophobicContact CB-CD2 4.29Å; L125-F129 HydrophobicContact CD2-CD2 4.48Å; L125-F129 HydrophobicContact CD2-CE2 4.01Å; L125-F129 WeakPolarHBondContact O-CB 3.36Å; L125-F129 VanDerWaalsContact O-CD2 3.29Å; L125-F129 WeakPolarHBondContact O-CD2 3.45Å; L125-F129 PolarHBondContact O-N 2.89Å; V126-F129 PolarHBondContact O-N 3.35Å; F129-T132 HydrophobicContact CD1-CG2 4.3Å; F129-T132 WeakPolarHBondContact O-CB 3.24Å; F129-T132 PolarHBondContact O-N 2.87Å; F129-L133 WeakPolarHBondContact O-CB 3.43Å; F129-L133 VanDerWaalsContact O-CG 3.24Å; F129-L133 WeakPolarHBondContact O-CG 3.45Å; F129-L133 PolarHBondContact O-N 3.42Å |
| 130 | M | 95.4 | Very high | 91 | Very high | 80 Ų | 80 | 40 Ų | 40 | 39% | 0.394 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -55.9 | -56 | 176.5 | -174.6 | -178.2 | 89.5 | 0 | 0 | 112.7 | Y60 I64 V126 L133 L134 | Y60-M130 HydrophobicContact CE1-CE 3.64Å; Y60-M130 WeakPolarHBondContact OH-CE 3.47Å; I64-M130 HydrophobicContact CB-CE 4.43Å; I64-M130 HydrophobicContact CD1-CE 3.36Å; I64-M130 HydrophobicContact CG1-CE 3.48Å; I64-M130 VanDerWaalsContact CG1-CE 3.48Å; I64-M130 HydrophobicContact CG2-CE 4.15Å; V126-M130 WeakPolarHBondContact O-CB 3.48Å; V126-M130 PolarHBondContact O-N 2.9Å; M130-L133 PolarHBondContact O-N 3.08Å; M130-L134 WeakPolarHBondContact O-CG 3.32Å; M130-L134 PolarHBondContact O-N 3.32Å |
| 131 | P | 95.4 | Very high | 90.7 | Very high | 1 Ų | 1 | 41.4 Ų | 41.4 | 1% | 0.006 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -68.4 | -33.6 | 174.5 | 21.2 | -29 | 0 | 0 | 0 | 112.7 | Y60 I64 L67 V101 L127 I128 L133 L134 V135 | Y60-P131 HydrophobicContact CE2-CG 4.04Å; Y60-P131 VanDerWaalsContact OH-CD 3.23Å; Y60-P131 WeakPolarHBondContact OH-CD 3.49Å; I64-P131 HydrophobicContact CD1-CB 3.71Å; I64-P131 HydrophobicContact CD1-CG 4.24Å; L67-P131 HydrophobicContact CD1-CB 4.02Å; V101-P131 HydrophobicContact CG2-CB 3.94Å; V101-P131 HydrophobicContact CG2-CG 3.37Å; L127-P131 VanDerWaalsContact O-CD 3.23Å; L127-P131 WeakPolarHBondContact O-CD 3.29Å; L127-P131 WeakPolarHBondContact O-CG 3.2Å; I128-P131 WeakPolarHBondContact O-CD 3.31Å; I128-P131 WeakPolarHBondContact O-CG 3.48Å; P131-L133 VanDerWaalsContact C-N 3.31Å; P131-L133 PolarHBondContact O-N 2.88Å; P131-L134 PolarHBondContact O-N 2.87Å; P131-V135 WeakPolarHBondContact O-CG2 3.41Å; P131-V135 PolarHBondContact O-N 3.16Å |
| 132 | T | 93.7 | Very high | 90.5 | Very high | 11 Ų | 11 | 41 Ų | 41 | 7% | 0.067 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.7 | -44.1 | 177 | -62.3 | 0 | 0 | 0 | 0 | 111.4 | I128 F129 V135 A136 A148 | I128-T132 WeakPolarHBondContact O-CB 3.45Å; I128-T132 PolarHBondContact O-N 2.9Å; I128-T132 PolarHBondContact O-OG1 3.47Å; F129-T132 HydrophobicContact CD1-CG2 4.3Å; F129-T132 WeakPolarHBondContact O-CB 3.24Å; F129-T132 PolarHBondContact O-N 2.87Å; T132-V135 PolarHBondContact O-N 3.13Å; T132-A136 WeakPolarHBondContact O-CB 3.27Å; T132-A136 PolarHBondContact O-N 3.04Å; T132-A148 HydrophobicContact CG2-CB 3.84Å |
| 133 | L | 92.1 | Very high | 90.4 | Very high | 117 Ų | 117 | 39.8 Ų | 39.8 | 61% | 0.613 | 23% | 0.227 | S | C | * | . | H | α-helix | trans | -69.2 | -37.4 | 179.3 | -70 | 173.5 | 0 | 0 | 0 | 111.8 | F129 M130 P131 V135 A136 A137 | F129-L133 WeakPolarHBondContact O-CB 3.43Å; F129-L133 VanDerWaalsContact O-CG 3.24Å; F129-L133 WeakPolarHBondContact O-CG 3.45Å; F129-L133 PolarHBondContact O-N 3.42Å; M130-L133 PolarHBondContact O-N 3.08Å; P131-L133 VanDerWaalsContact C-N 3.31Å; P131-L133 PolarHBondContact O-N 2.88Å; L133-V135 VanDerWaalsContact C-N 3.33Å; L133-V135 PolarHBondContact O-N 2.96Å; L133-A136 PolarHBondContact O-N 2.87Å; L133-A137 WeakPolarHBondContact O-CB 3.5Å; L133-A137 PolarHBondContact O-N 3.03Å |
| 134 | L | 92.6 | Very high | 90.4 | Very high | 51 Ų | 51 | 36.9 Ų | 36.9 | 27% | 0.267 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -61.6 | -40.6 | 172.5 | -68.7 | 174.5 | 0 | 0 | 0 | 111.9 | I64 L67 V68 M130 P131 A137 Q138 | I64-L134 HydrophobicContact CD1-CD1 3.9Å; I64-L134 HydrophobicContact CG2-CD1 4.17Å; L67-L134 HydrophobicContact CB-CB 4.21Å; L67-L134 HydrophobicContact CB-CD1 4.15Å; L67-L134 HydrophobicContact CD1-CB 4.25Å; L67-L134 HydrophobicContact CD1-CD1 4.43Å; V68-L134 HydrophobicContact CG2-CD1 4.17Å; V68-L134 HydrophobicContact CG2-CD2 4.3Å; M130-L134 WeakPolarHBondContact O-CG 3.32Å; M130-L134 PolarHBondContact O-N 3.32Å; P131-L134 PolarHBondContact O-N 2.87Å; L134-A137 PolarHBondContact O-N 3.44Å; L134-Q138 PolarHBondContact O-N 3.37Å |
| 135 | V | 91.4 | Very high | 90.3 | Very high | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -69.4 | -39.3 | 175.2 | 177.1 | 0 | 0 | 0 | 0 | 111.3 | L67 P131 T132 L133 A137 Q138 D140 T143 | L67-V135 HydrophobicContact CD1-CG2 4.09Å; L67-V135 HydrophobicContact CD2-CG2 3.72Å; P131-V135 WeakPolarHBondContact O-CG2 3.41Å; P131-V135 PolarHBondContact O-N 3.16Å; T132-V135 PolarHBondContact O-N 3.13Å; L133-V135 VanDerWaalsContact C-N 3.33Å; L133-V135 PolarHBondContact O-N 2.96Å; V135-A137 VanDerWaalsContact C-N 3.26Å; V135-A137 PolarHBondContact O-N 3.17Å; V135-Q138 WeakPolarHBondContact O-CB 3.23Å; V135-Q138 PolarHBondContact O-N 3.36Å; V135-D140 HydrophobicContact CG1-CB 4.04Å; V135-D140 PolarHBondContact O-N 2.89Å; V135-T143 HydrophobicContact CG1-CG2 3.96Å |
| 136 | A | 87.5 | Confident | 90.3 | Very high | 42 Ų | 42 | 37.8 Ų | 37.8 | 35% | 0.347 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64.1 | -33 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T132 L133 Q138 | T132-A136 WeakPolarHBondContact O-CB 3.27Å; T132-A136 PolarHBondContact O-N 3.04Å; L133-A136 PolarHBondContact O-N 2.87Å; A136-Q138 PolarHBondContact O-N 3.41Å |
| 137 | A | 86.2 | Confident | 90.2 | Very high | 63 Ų | 63 | 33.4 Ų | 33.4 | 52% | 0.521 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -66 | -20.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L133 L134 V135 P139 | L133-A137 WeakPolarHBondContact O-CB 3.5Å; L133-A137 PolarHBondContact O-N 3.03Å; L134-A137 PolarHBondContact O-N 3.44Å; V135-A137 VanDerWaalsContact C-N 3.26Å; V135-A137 PolarHBondContact O-N 3.17Å; A137-P139 VanDerWaalsContact C-CD 3.44Å; A137-P139 VanDerWaalsContact C-N 3.26Å; A137-P139 WeakPolarHBondContact O-CD 3.31Å |
| 138 | Q | 84.1 | Confident | 90.2 | Very high | 4 Ų | 4 | 32.7 Ų | 32.7 | 2% | 0.019 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.4 | 39.1 | 176 | -63.6 | 173.9 | 9.2 | 0 | 0 | 113.2 | L67 R82 L134 V135 A136 D140 | L67-Q138 PolarHBondContact O-NE2 3.27Å; R82-Q138 HydrophobicContact CG-CB 4.44Å; R82-Q138 PolarHBondContact NE-O 3.48Å; L134-Q138 PolarHBondContact O-N 3.37Å; V135-Q138 WeakPolarHBondContact O-CB 3.23Å; V135-Q138 PolarHBondContact O-N 3.36Å; A136-Q138 PolarHBondContact O-N 3.41Å; Q138-D140 PolarHBondContact O-N 3.45Å |
| 139 | P | 81.4 | Confident | 90.1 | Very high | 63 Ų | 63 | 35.1 Ų | 35.1 | 41% | 0.409 | 20% | 0.2 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 23.1 | 30.1 | -157.2 | -0.3 | -23.6 | 0 | 0 | 0 | 118.6 | A80 R82 A137 L141 | A80-P139 HydrophobicContact CB-CG 4.1Å; R82-P139 VanDerWaalsContact NH2-C 3.3Å; R82-P139 PolarHBondContact NH2-O 2.97Å; A137-P139 VanDerWaalsContact C-CD 3.44Å; A137-P139 VanDerWaalsContact C-N 3.26Å; A137-P139 WeakPolarHBondContact O-CD 3.31Å; P139-L141 PolarHBondContact O-N 3.15Å |
| 140 | D | 83.3 | Confident | 90.1 | Very high | 6 Ų | 6 | 30.8 Ų | 30.8 | 3% | 0.032 | 18% | 0.182 | C | C | . | . | trans | -103.4 | 72.6 | -172.4 | -167 | -10.4 | 0 | 0 | 0 | 111.2 | Q92 V135 Q138 G142 T143 S144 | Q92-D140 PolarHBondContact NE2-OD2 3.38Å; Q92-D140 VanDerWaalsContact NE2-OD2 3.15Å; V135-D140 HydrophobicContact CG1-CB 4.04Å; V135-D140 PolarHBondContact O-N 2.89Å; Q138-D140 PolarHBondContact O-N 3.45Å; D140-G142 VanDerWaalsContact C-N 3.33Å; D140-G142 PolarHBondContact O-N 2.88Å; D140-T143 PolarHBondContact O-N 3.26Å; D140-T143 VanDerWaalsContact OD1-CB 3.29Å; D140-T143 WeakPolarHBondContact OD1-CB 3.45Å; D140-T143 PolarHBondContact OD1-N 3.49Å; D140-T143 PolarHBondContact OD1-OG1 2.65Å; D140-T143 WeakPolarHBondContact OD2-CB 3.29Å; D140-T143 PolarHBondContact OD2-OG1 3Å; D140-S144 WeakPolarHBondContact O-CB 3.27Å; D140-S144 PolarHBondContact O-N 2.65Å; D140-S144 PolarHBondContact O-OG 3.08Å | ||
| 141 | L | 81.7 | Confident | 90 | Very high | 56 Ų | 56 | 27 Ų | 27 | 29% | 0.293 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -62.6 | -38.5 | -178 | -174.8 | 64.9 | 0 | 0 | 0 | 112.6 | P139 S144 I145 V313 | P139-L141 PolarHBondContact O-N 3.15Å; L141-S144 WeakPolarHBondContact CA-OG 3.49Å; L141-S144 PolarHBondContact O-OG 2.9Å; L141-I145 HydrophobicContact CD1-CD1 4.09Å; L141-I145 HydrophobicContact CD1-CG1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.95Å; L141-I145 VanDerWaalsContact O-CG1 3.28Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 PolarHBondContact O-N 2.88Å; L141-I145 VanDerWaalsContact O-N 3.15Å; L141-V313 HydrophobicContact CD2-CG1 4.47Å |
| 142 | G | 84.9 | Confident | 90 | Very high | 1 Ų | 1 | 29.6 Ų | 29.6 | 1% | 0.01 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.9 | -51.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111 | D140 L146 | D140-G142 VanDerWaalsContact C-N 3.33Å; D140-G142 PolarHBondContact O-N 2.88Å; G142-L146 WeakPolarHBondContact O-CD1 3.39Å; G142-L146 VanDerWaalsContact O-CG 3.23Å; G142-L146 WeakPolarHBondContact O-CG 3.27Å; G142-L146 PolarHBondContact O-N 3.3Å |
| 143 | T | 88.5 | Confident | 90 | Very high | 8 Ų | 8 | 31.1 Ų | 31.1 | 5% | 0.049 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.4 | -37.7 | 179.6 | -57.5 | 0 | 0 | 0 | 0 | 112.4 | V135 D140 I145 L146 V147 | V135-T143 HydrophobicContact CG1-CG2 3.96Å; D140-T143 PolarHBondContact O-N 3.26Å; D140-T143 VanDerWaalsContact OD1-CB 3.29Å; D140-T143 WeakPolarHBondContact OD1-CB 3.45Å; D140-T143 PolarHBondContact OD1-N 3.49Å; D140-T143 PolarHBondContact OD1-OG1 2.65Å; D140-T143 WeakPolarHBondContact OD2-CB 3.29Å; D140-T143 PolarHBondContact OD2-OG1 3Å; T143-I145 PolarHBondContact O-N 3.12Å; T143-L146 PolarHBondContact O-N 3.17Å; T143-V147 HydrophobicContact CG2-CG2 4.11Å; T143-V147 WeakPolarHBondContact O-CG2 3.34Å; T143-V147 PolarHBondContact O-N 3.4Å |
| 144 | S | 91.1 | Very high | 90.1 | Very high | 5 Ų | 5 | 25.6 Ų | 25.6 | 4% | 0.035 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.7 | -44.3 | -179.7 | 67.9 | 0 | 0 | 0 | 0 | 112.1 | D140 L141 L146 V147 A148 | D140-S144 WeakPolarHBondContact O-CB 3.27Å; D140-S144 PolarHBondContact O-N 2.65Å; D140-S144 PolarHBondContact O-OG 3.08Å; L141-S144 WeakPolarHBondContact CA-OG 3.49Å; L141-S144 PolarHBondContact O-OG 2.9Å; S144-L146 VanDerWaalsContact C-N 3.27Å; S144-L146 PolarHBondContact O-N 3.29Å; S144-V147 PolarHBondContact O-N 2.97Å; S144-A148 PolarHBondContact O-N 3.29Å |
| 145 | I | 90.6 | Very high | 90 | Very high | 76 Ų | 76 | 23.2 Ų | 23.2 | 39% | 0.39 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -58.1 | -43.1 | 174.9 | -69.7 | 168.7 | 0 | 0 | 0 | 110.5 | L141 T143 A148 L149 | L141-I145 HydrophobicContact CD1-CD1 4.09Å; L141-I145 HydrophobicContact CD1-CG1 4.33Å; L141-I145 HydrophobicContact CG-CD1 3.95Å; L141-I145 VanDerWaalsContact O-CG1 3.28Å; L141-I145 WeakPolarHBondContact O-CG1 3.39Å; L141-I145 PolarHBondContact O-N 2.88Å; L141-I145 VanDerWaalsContact O-N 3.15Å; T143-I145 PolarHBondContact O-N 3.12Å; I145-A148 PolarHBondContact O-N 3.48Å; I145-L149 HydrophobicContact CG2-CD1 3.86Å; I145-L149 HydrophobicContact CG2-CG 4.32Å; I145-L149 WeakPolarHBondContact O-CB 3.19Å; I145-L149 VanDerWaalsContact O-CG 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.3Å; I145-L149 PolarHBondContact O-N 3.4Å |
| 146 | L | 93.1 | Very high | 90 | Very high | 2 Ų | 2 | 27 Ų | 27 | 1% | 0.01 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -70.1 | -37.3 | -178.5 | -65.4 | 171.5 | 0 | 0 | 0 | 112.5 | G142 T143 S144 S150 I294 V297 Y298 V315 | G142-L146 WeakPolarHBondContact O-CD1 3.39Å; G142-L146 VanDerWaalsContact O-CG 3.23Å; G142-L146 WeakPolarHBondContact O-CG 3.27Å; G142-L146 PolarHBondContact O-N 3.3Å; T143-L146 PolarHBondContact O-N 3.17Å; S144-L146 VanDerWaalsContact C-N 3.27Å; S144-L146 PolarHBondContact O-N 3.29Å; L146-S150 WeakPolarHBondContact O-CB 3.42Å; L146-S150 PolarHBondContact O-N 2.89Å; L146-I294 HydrophobicContact CB-CD1 4.29Å; L146-I294 HydrophobicContact CD2-CD1 4.01Å; L146-I294 VanDerWaalsContact O-CD1 3.3Å; L146-I294 WeakPolarHBondContact O-CD1 3.31Å; L146-V297 HydrophobicContact CD2-CG1 3.77Å; L146-Y298 HydrophobicContact CB-CE2 3.6Å; L146-Y298 WeakPolarHBondContact CB-OH 3.15Å; L146-Y298 HydrophobicContact CD1-CD1 4.14Å; L146-Y298 HydrophobicContact CD1-CD2 3.91Å; L146-Y298 HydrophobicContact CD1-CE1 3.66Å; L146-Y298 HydrophobicContact CD1-CE2 3.42Å; L146-Y298 VanDerWaalsContact CD1-CE2 3.42Å; L146-Y298 HydrophobicContact CD1-CG 4.25Å; L146-Y298 VanDerWaalsContact CD1-OH 3.31Å; L146-Y298 WeakPolarHBondContact CD1-OH 3.26Å; L146-Y298 HydrophobicContact CD2-CD2 3.62Å; L146-Y298 HydrophobicContact CD2-CE2 3.53Å; L146-Y298 HydrophobicContact CD2-CG 4.46Å; L146-Y298 HydrophobicContact CG-CD2 4.19Å; L146-Y298 HydrophobicContact CG-CE2 3.65Å; L146-V315 HydrophobicContact CD1-CB 4.27Å; L146-V315 HydrophobicContact CD1-CG1 3.49Å; L146-V315 VanDerWaalsContact CD1-CG1 3.49Å; L146-V315 HydrophobicContact CD1-CG2 3.72Å |
| 147 | V | 94.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.7 | -46 | 172 | 171.9 | 0 | 0 | 0 | 0 | 110.1 | A97 K98 V101 T143 S144 S150 G151 | A97-V147 HydrophobicContact CB-CG1 4.08Å; A97-V147 HydrophobicContact CB-CG2 3.78Å; K98-V147 HydrophobicContact CG-CG2 3.88Å; V101-V147 HydrophobicContact CB-CG1 4.3Å; V101-V147 HydrophobicContact CG2-CG1 3.79Å; T143-V147 HydrophobicContact CG2-CG2 4.11Å; T143-V147 WeakPolarHBondContact O-CG2 3.34Å; T143-V147 PolarHBondContact O-N 3.4Å; S144-V147 PolarHBondContact O-N 2.97Å; V147-S150 PolarHBondContact O-N 2.91Å; V147-S150 PolarHBondContact O-OG 3.1Å; V147-G151 PolarHBondContact O-N 2.91Å |
| 148 | A | 94.8 | Very high | 90.2 | Very high | 10 Ų | 10 | 25.6 Ų | 25.6 | 8% | 0.083 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -58.7 | -52 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I128 T132 S144 I145 S150 G151 L152 | I128-A148 HydrophobicContact CG2-CB 4.42Å; T132-A148 HydrophobicContact CG2-CB 3.84Å; S144-A148 PolarHBondContact O-N 3.29Å; I145-A148 PolarHBondContact O-N 3.48Å; A148-S150 VanDerWaalsContact C-N 3.29Å; A148-S150 PolarHBondContact O-N 2.79Å; A148-G151 PolarHBondContact O-N 3.35Å; A148-L152 WeakPolarHBondContact O-CB 3.18Å; A148-L152 VanDerWaalsContact O-CG 3.28Å; A148-L152 WeakPolarHBondContact O-CG 3.25Å; A148-L152 PolarHBondContact O-N 2.88Å |
| 149 | L | 94.8 | Very high | 90.3 | Very high | 51 Ų | 51 | 27.5 Ų | 27.5 | 27% | 0.267 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -62 | -35.8 | 179.8 | -71.7 | 177.5 | 0 | 0 | 0 | 112.3 | I145 G151 L152 F153 I294 V297 | I145-L149 HydrophobicContact CG2-CD1 3.86Å; I145-L149 HydrophobicContact CG2-CG 4.32Å; I145-L149 WeakPolarHBondContact O-CB 3.19Å; I145-L149 VanDerWaalsContact O-CG 3.31Å; I145-L149 WeakPolarHBondContact O-CG 3.3Å; I145-L149 PolarHBondContact O-N 3.4Å; L149-G151 VanDerWaalsContact C-N 3.35Å; L149-G151 PolarHBondContact O-N 3.31Å; L149-L152 HydrophobicContact CD2-CD1 4.47Å; L149-L152 PolarHBondContact O-N 2.92Å; L149-F153 HydrophobicContact CB-CE2 4.24Å; L149-F153 WeakPolarHBondContact O-CB 3.41Å; L149-F153 WeakPolarHBondContact O-CD2 3.41Å; L149-F153 WeakPolarHBondContact O-CG 3.43Å; L149-F153 PolarHBondContact O-N 3.35Å; L149-I294 HydrophobicContact CB-CD1 3.92Å; L149-V297 HydrophobicContact CD1-CG1 3.8Å |
| 150 | S | 94.7 | Very high | 90.4 | Very high | 0 Ų | 0 | 25.7 Ų | 25.7 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59.6 | -44.8 | 177.6 | 75.1 | 0 | 0 | 0 | 0 | 112 | P102 L146 V147 A148 | P102-S150 WeakPolarHBondContact CD-OG 3.28Å; L146-S150 WeakPolarHBondContact O-CB 3.42Å; L146-S150 PolarHBondContact O-N 2.89Å; V147-S150 PolarHBondContact O-N 2.91Å; V147-S150 PolarHBondContact O-OG 3.1Å; A148-S150 VanDerWaalsContact C-N 3.29Å; A148-S150 PolarHBondContact O-N 2.79Å |
| 151 | G | 94.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -74.3 | -39.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I128 V147 A148 L149 F153 V154 L155 | I128-G151 VanDerWaalsContact CD1-C 3.45Å; V147-G151 PolarHBondContact O-N 2.91Å; A148-G151 PolarHBondContact O-N 3.35Å; L149-G151 VanDerWaalsContact C-N 3.35Å; L149-G151 PolarHBondContact O-N 3.31Å; G151-F153 VanDerWaalsContact C-N 3.32Å; G151-F153 PolarHBondContact O-N 2.82Å; G151-V154 PolarHBondContact O-N 3.39Å; G151-L155 PolarHBondContact O-N 2.7Å |
| 152 | L | 93.8 | Very high | 90.4 | Very high | 56 Ų | 56 | 34.5 Ų | 34.5 | 29% | 0.293 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63.8 | -35.8 | 177.5 | -72.2 | 172.7 | 0 | 0 | 0 | 112.2 | L125 I128 A148 L149 L155 F156 | L125-L152 HydrophobicContact CD2-CD2 3.89Å; I128-L152 HydrophobicContact CD1-CD2 4.15Å; I128-L152 HydrophobicContact CD1-CG 4.41Å; A148-L152 WeakPolarHBondContact O-CB 3.18Å; A148-L152 VanDerWaalsContact O-CG 3.28Å; A148-L152 WeakPolarHBondContact O-CG 3.25Å; A148-L152 PolarHBondContact O-N 2.88Å; L149-L152 HydrophobicContact CD2-CD1 4.47Å; L149-L152 PolarHBondContact O-N 2.92Å; L152-L155 PolarHBondContact O-N 3.32Å; L152-F156 VanDerWaalsContact O-CB 3.28Å; L152-F156 WeakPolarHBondContact O-CB 3.44Å; L152-F156 PolarHBondContact O-N 3.26Å |
| 153 | F | 94.6 | Very high | 90.5 | Very high | 43 Ų | 43 | 44.8 Ų | 44.8 | 19% | 0.189 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.4 | -37.3 | 174.3 | -74.5 | -39.3 | 0 | 0 | 0 | 112.8 | L149 G151 L155 F156 L157 L293 I294 V297 | L149-F153 HydrophobicContact CB-CE2 4.24Å; L149-F153 WeakPolarHBondContact O-CB 3.41Å; L149-F153 WeakPolarHBondContact O-CD2 3.41Å; L149-F153 WeakPolarHBondContact O-CG 3.43Å; L149-F153 PolarHBondContact O-N 3.35Å; G151-F153 VanDerWaalsContact C-N 3.32Å; G151-F153 PolarHBondContact O-N 2.82Å; F153-L155 VanDerWaalsContact C-N 3.35Å; F153-F156 PolarHBondContact O-N 3.19Å; F153-L157 WeakPolarHBondContact O-CB 3.23Å; F153-L157 VanDerWaalsContact O-CG 3.23Å; F153-L157 WeakPolarHBondContact O-CG 3.38Å; F153-L157 PolarHBondContact O-N 3.48Å; F153-L293 HydrophobicContact CB-CB 4.31Å; F153-L293 HydrophobicContact CB-CD1 4.14Å; F153-L293 HydrophobicContact CD1-CB 4.27Å; F153-L293 HydrophobicContact CD1-CD1 3.98Å; F153-L293 HydrophobicContact CD2-CB 3.59Å; F153-L293 HydrophobicContact CE2-CB 3.86Å; F153-L293 HydrophobicContact CG-CB 3.83Å; F153-L293 HydrophobicContact CG-CD1 4.03Å; F153-L293 HydrophobicContact CZ-CB 4.33Å; F153-I294 HydrophobicContact CD2-CB 4.4Å; F153-V297 HydrophobicContact CE2-CB 4.48Å; F153-V297 HydrophobicContact CE2-CG2 3.55Å; F153-V297 HydrophobicContact CZ-CG2 3.57Å |
| 154 | V | 93.2 | Very high | 90.2 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 173.2 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | P102 V105 A106 I109 G151 L157 S158 V286 | P102-V154 HydrophobicContact CB-CG2 3.55Å; V105-V154 HydrophobicContact CB-CG1 4.27Å; V105-V154 HydrophobicContact CG1-CB 4.17Å; V105-V154 HydrophobicContact CG1-CG1 3.86Å; A106-V154 HydrophobicContact CB-CG1 3.74Å; I109-V154 HydrophobicContact CD1-CG1 4.44Å; G151-V154 PolarHBondContact O-N 3.39Å; V154-L157 PolarHBondContact O-N 2.94Å; V154-S158 PolarHBondContact O-N 2.85Å; V154-S158 VanDerWaalsContact O-N 3.11Å; V154-V286 HydrophobicContact CG1-CB 4.13Å; V154-V286 HydrophobicContact CG1-CG2 3.88Å |
| 155 | L | 91 | Very high | 90 | Very high | 1 Ų | 1 | 48.8 Ų | 48.8 | 1% | 0.005 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.8 | -42.1 | 176 | -174.9 | 64.2 | 0 | 0 | 0 | 111.7 | I109 P116 T121 A124 L125 G151 L152 F153 S158 L160 | I109-L155 HydrophobicContact CD1-CB 4.34Å; I109-L155 HydrophobicContact CD1-CD1 3.64Å; I109-L155 HydrophobicContact CG1-CD1 4.45Å; P116-L155 HydrophobicContact CG-CD1 4.25Å; T121-L155 HydrophobicContact CG2-CD2 4.25Å; A124-L155 HydrophobicContact CB-CD1 4.02Å; L125-L155 HydrophobicContact CD2-CD2 4.09Å; L125-L155 HydrophobicContact CG-CD2 4.47Å; G151-L155 PolarHBondContact O-N 2.7Å; L152-L155 PolarHBondContact O-N 3.32Å; F153-L155 VanDerWaalsContact C-N 3.35Å; L155-S158 WeakPolarHBondContact O-CB 3.22Å; L155-S158 PolarHBondContact O-N 3.36Å; L155-S158 PolarHBondContact O-OG 3.48Å; L155-L160 HydrophobicContact CD2-CD2 4.13Å; L155-L160 HydrophobicContact CG-CD2 4.14Å |
| 156 | F | 91.2 | Very high | 89.7 | Confident | 81 Ų | 81 | 46.6 Ų | 46.6 | 36% | 0.355 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -59.2 | -51.6 | 174.4 | 173.3 | -112.7 | 0 | 0 | 0 | 112.2 | L152 F153 S158 G159 W162 I165 | L152-F156 VanDerWaalsContact O-CB 3.28Å; L152-F156 WeakPolarHBondContact O-CB 3.44Å; L152-F156 PolarHBondContact O-N 3.26Å; F153-F156 PolarHBondContact O-N 3.19Å; F156-S158 PolarHBondContact O-N 3.13Å; F156-S158 VanDerWaalsContact O-N 3.14Å; F156-G159 PolarHBondContact O-N 3.1Å; F156-W162 HydrophobicContact CE2-CE3 4.11Å; F156-W162 AromaticContact CE2-CZ3 3.58Å; F156-W162 HydrophobicContact CE2-CZ3 3.58Å; F156-W162 AromaticContact CZ-CZ3 3.91Å; F156-W162 HydrophobicContact CZ-CZ3 3.91Å; F156-I165 HydrophobicContact CD2-CD1 3.49Å; F156-I165 VanDerWaalsContact CD2-CD1 3.49Å; F156-I165 HydrophobicContact CE2-CD1 3.8Å |
| 157 | L | 90.8 | Very high | 89.4 | Confident | 68 Ų | 68 | 50.5 Ų | 50.5 | 36% | 0.356 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66.1 | -15.8 | -179.3 | -71.4 | 174.2 | 0 | 0 | 0 | 113.3 | F153 V154 G159 V286 G290 L293 | F153-L157 WeakPolarHBondContact O-CB 3.23Å; F153-L157 VanDerWaalsContact O-CG 3.23Å; F153-L157 WeakPolarHBondContact O-CG 3.38Å; F153-L157 PolarHBondContact O-N 3.48Å; V154-L157 PolarHBondContact O-N 2.94Å; L157-G159 PolarHBondContact O-N 2.97Å; L157-V286 HydrophobicContact CB-CB 4.28Å; L157-V286 HydrophobicContact CB-CG1 4.07Å; L157-G290 VanDerWaalsContact CD1-N 3.31Å; L157-L293 HydrophobicContact CD1-CD1 3.89Å; L157-L293 HydrophobicContact CD2-CD1 4.2Å; L157-L293 HydrophobicContact CG-CD1 4.11Å |
| 158 | S | 87.7 | Confident | 88.9 | Confident | 6 Ų | 6 | 52.8 Ų | 52.8 | 4% | 0.042 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -74.9 | -4.2 | 171.9 | 79.4 | 0 | 0 | 0 | 0 | 114.6 | I109 V154 L155 F156 | I109-S158 VanDerWaalsContact CG2-CB 3.4Å; V154-S158 PolarHBondContact O-N 2.85Å; V154-S158 VanDerWaalsContact O-N 3.11Å; L155-S158 WeakPolarHBondContact O-CB 3.22Å; L155-S158 PolarHBondContact O-N 3.36Å; L155-S158 PolarHBondContact O-OG 3.48Å; F156-S158 PolarHBondContact O-N 3.13Å; F156-S158 VanDerWaalsContact O-N 3.14Å |
| 159 | G | 84.9 | Confident | 88.6 | Confident | 44 Ų | 44 | 56.8 Ų | 56.8 | 45% | 0.454 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.1 | 31.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | P115 F156 L157 S161 | P115-G159 VanDerWaalsContact CB-O 3.3Å; P115-G159 WeakPolarHBondContact CB-O 3.28Å; F156-G159 PolarHBondContact O-N 3.1Å; L157-G159 PolarHBondContact O-N 2.97Å; G159-S161 PolarHBondContact O-N 3.22Å |
| 160 | L | 84.5 | Confident | 88.3 | Confident | 26 Ų | 26 | 59 Ų | 59 | 14% | 0.136 | 32% | 0.317 | C | S | . | . | trans | -53.8 | 134 | 171.6 | -174 | 67.9 | 0 | 0 | 0 | 110.1 | P116 T121 L155 W162 L164 I165 | P116-L160 HydrophobicContact CG-CD1 4.28Å; T121-L160 HydrophobicContact CG2-CD1 3.65Å; L155-L160 HydrophobicContact CD2-CD2 4.13Å; L155-L160 HydrophobicContact CG-CD2 4.14Å; L160-W162 PolarHBondContact O-N 3.4Å; L160-L164 HydrophobicContact CD1-CB 4.42Å; L160-L164 HydrophobicContact CD1-CD1 3.76Å; L160-L164 HydrophobicContact CG-CB 4.41Å; L160-I165 HydrophobicContact CB-CD1 4.49Å; L160-I165 HydrophobicContact CD2-CD1 4.45Å; L160-I165 HydrophobicContact CD2-CG1 3.78Å; L160-I165 HydrophobicContact CG-CG1 4.22Å | ||
| 161 | S | 83 | Confident | 88 | Confident | 54 Ų | 54 | 64.6 Ų | 64.6 | 38% | 0.378 | 35% | 0.346 | S | S | . | . | trans | -60.7 | 135.2 | -176.9 | 74 | 0 | 0 | 0 | 0 | 111.8 | G159 R163 L164 I165 | G159-S161 PolarHBondContact O-N 3.22Å; S161-R163 PolarHBondContact O-N 3.42Å; S161-R163 VanDerWaalsContact O-N 3.09Å; S161-L164 PolarHBondContact O-N 3Å; S161-L164 WeakPolarHBondContact OG-CD1 3.31Å; S161-L164 VanDerWaalsContact OG-CG 3.31Å; S161-L164 WeakPolarHBondContact OG-CG 3.44Å; S161-L164 PolarHBondContact OG-N 3.47Å; S161-I165 PolarHBondContact O-N 3.34Å | ||
| 162 | W | 82.8 | Confident | 87.6 | Confident | 192 Ų | 192 | 69.1 Ų | 69.1 | 73% | 0.727 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -59.1 | -25.2 | 179.3 | -157.7 | -97.7 | 0 | 0 | 0 | 112.9 | F156 L160 I165 G166 | F156-W162 HydrophobicContact CE2-CE3 4.11Å; F156-W162 AromaticContact CE2-CZ3 3.58Å; F156-W162 HydrophobicContact CE2-CZ3 3.58Å; F156-W162 AromaticContact CZ-CZ3 3.91Å; F156-W162 HydrophobicContact CZ-CZ3 3.91Å; L160-W162 PolarHBondContact O-N 3.4Å; W162-I165 HydrophobicContact CE3-CD1 4.17Å; W162-I165 PolarHBondContact O-N 2.86Å; W162-G166 PolarHBondContact O-N 3.34Å |
| 163 | R | 85.6 | Confident | 87.3 | Confident | 217 Ų | 217 | 68.9 Ų | 68.9 | 82% | 0.819 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -63 | -46.8 | 173.3 | -63.1 | -178.5 | -173.7 | 165.3 | 1.4 | 111.7 | S161 I165 G166 V167 | S161-R163 PolarHBondContact O-N 3.42Å; S161-R163 VanDerWaalsContact O-N 3.09Å; R163-I165 VanDerWaalsContact C-N 3.35Å; R163-G166 PolarHBondContact O-N 2.92Å; R163-V167 VanDerWaalsContact O-CG2 3.31Å; R163-V167 WeakPolarHBondContact O-CG2 3.29Å; R163-V167 PolarHBondContact O-N 3.31Å |
| 164 | L | 83.5 | Confident | 87 | Confident | 58 Ų | 58 | 70.1 Ų | 70.1 | 30% | 0.304 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -66.5 | -38.9 | 178.6 | -70.3 | 170.7 | 0 | 0 | 0 | 111.8 | L118 L160 S161 V167 A168 | L118-L164 HydrophobicContact CD2-CD1 3.67Å; L118-L164 HydrophobicContact CD2-CD2 3.68Å; L118-L164 HydrophobicContact CD2-CG 4.28Å; L160-L164 HydrophobicContact CD1-CB 4.42Å; L160-L164 HydrophobicContact CD1-CD1 3.76Å; L160-L164 HydrophobicContact CG-CB 4.41Å; S161-L164 PolarHBondContact O-N 3Å; S161-L164 WeakPolarHBondContact OG-CD1 3.31Å; S161-L164 VanDerWaalsContact OG-CG 3.31Å; S161-L164 WeakPolarHBondContact OG-CG 3.44Å; S161-L164 PolarHBondContact OG-N 3.47Å; L164-V167 PolarHBondContact O-N 3.27Å; L164-A168 WeakPolarHBondContact O-CB 3.44Å; L164-A168 PolarHBondContact O-N 3.45Å |
| 165 | I | 85.2 | Confident | 86.7 | Confident | 39 Ų | 39 | 74.4 Ų | 74.4 | 20% | 0.2 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.1 | -47.5 | 174.6 | -60.4 | 167.3 | 0 | 0 | 0 | 109.8 | F156 L160 S161 W162 R163 V167 A168 V169 | F156-I165 HydrophobicContact CD2-CD1 3.49Å; F156-I165 VanDerWaalsContact CD2-CD1 3.49Å; F156-I165 HydrophobicContact CE2-CD1 3.8Å; L160-I165 HydrophobicContact CB-CD1 4.49Å; L160-I165 HydrophobicContact CD2-CD1 4.45Å; L160-I165 HydrophobicContact CD2-CG1 3.78Å; L160-I165 HydrophobicContact CG-CG1 4.22Å; S161-I165 PolarHBondContact O-N 3.34Å; W162-I165 HydrophobicContact CE3-CD1 4.17Å; W162-I165 PolarHBondContact O-N 2.86Å; R163-I165 VanDerWaalsContact C-N 3.35Å; I165-V167 PolarHBondContact O-N 2.84Å; I165-A168 PolarHBondContact O-N 3.08Å; I165-V169 HydrophobicContact CG2-CG2 4.41Å; I165-V169 WeakPolarHBondContact O-CG2 3.3Å; I165-V169 PolarHBondContact O-N 3.22Å |
| 166 | G | 85.7 | Confident | 86.5 | Confident | 31 Ų | 31 | 78.9 Ų | 78.9 | 32% | 0.32 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -57.8 | -47 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | W162 R163 A168 V169 V170 | W162-G166 PolarHBondContact O-N 3.34Å; R163-G166 PolarHBondContact O-N 2.92Å; G166-A168 PolarHBondContact O-N 3.4Å; G166-V169 PolarHBondContact O-N 3.06Å; G166-V170 WeakPolarHBondContact O-CB 3.4Å; G166-V170 VanDerWaalsContact O-CG2 3.27Å; G166-V170 WeakPolarHBondContact O-CG2 3.42Å; G166-V170 PolarHBondContact O-N 2.87Å |
| 167 | V | 87.2 | Confident | 86.2 | Confident | 83 Ų | 83 | 78.3 Ų | 78.3 | 50% | 0.503 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60 | -45.4 | 175.5 | 171 | 0 | 0 | 0 | 0 | 111.1 | R163 L164 I165 V169 V170 L171 | R163-V167 VanDerWaalsContact O-CG2 3.31Å; R163-V167 WeakPolarHBondContact O-CG2 3.29Å; R163-V167 PolarHBondContact O-N 3.31Å; L164-V167 PolarHBondContact O-N 3.27Å; I165-V167 PolarHBondContact O-N 2.84Å; V167-V169 PolarHBondContact O-N 3.42Å; V167-V170 PolarHBondContact O-N 2.97Å; V167-L171 HydrophobicContact CG1-CD1 3.91Å; V167-L171 HydrophobicContact CG1-CG 4.31Å; V167-L171 WeakPolarHBondContact O-CB 3.45Å; V167-L171 VanDerWaalsContact O-CG 3.3Å; V167-L171 WeakPolarHBondContact O-CG 3.33Å; V167-L171 PolarHBondContact O-N 3.4Å |
| 168 | A | 84.2 | Confident | 85.9 | Confident | 49 Ų | 49 | 78.6 Ų | 78.6 | 41% | 0.405 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -62.7 | -44.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L164 I165 G166 V170 L171 V172 | L164-A168 WeakPolarHBondContact O-CB 3.44Å; L164-A168 PolarHBondContact O-N 3.45Å; I165-A168 PolarHBondContact O-N 3.08Å; G166-A168 PolarHBondContact O-N 3.4Å; A168-V170 VanDerWaalsContact C-N 3.35Å; A168-V170 PolarHBondContact O-N 2.89Å; A168-L171 PolarHBondContact O-N 3.08Å; A168-V172 WeakPolarHBondContact O-CG2 3.36Å; A168-V172 PolarHBondContact O-N 2.97Å |
| 169 | V | 86.8 | Confident | 85.6 | Confident | 94 Ų | 94 | 81.2 Ų | 81.2 | 57% | 0.57 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -62.3 | -43.1 | 176.7 | 171.4 | 0 | 0 | 0 | 0 | 110.9 | I165 G166 V167 V172 A173 | I165-V169 HydrophobicContact CG2-CG2 4.41Å; I165-V169 WeakPolarHBondContact O-CG2 3.3Å; I165-V169 PolarHBondContact O-N 3.22Å; G166-V169 PolarHBondContact O-N 3.06Å; V167-V169 PolarHBondContact O-N 3.42Å; V169-V172 PolarHBondContact O-N 3.32Å; V169-A173 VanDerWaalsContact O-CB 3.27Å; V169-A173 WeakPolarHBondContact O-CB 3.34Å; V169-A173 PolarHBondContact O-N 3.42Å |
| 170 | V | 90.2 | Very high | 85.5 | Confident | 98 Ų | 98 | 82.4 Ų | 82.4 | 59% | 0.594 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63.7 | -43.1 | 176.8 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | G166 V167 A168 A173 A174 | G166-V170 WeakPolarHBondContact O-CB 3.4Å; G166-V170 VanDerWaalsContact O-CG2 3.27Å; G166-V170 WeakPolarHBondContact O-CG2 3.42Å; G166-V170 PolarHBondContact O-N 2.87Å; V167-V170 PolarHBondContact O-N 2.97Å; A168-V170 VanDerWaalsContact C-N 3.35Å; A168-V170 PolarHBondContact O-N 2.89Å; V170-A173 PolarHBondContact O-N 2.96Å; V170-A174 VanDerWaalsContact O-CB 3.25Å; V170-A174 WeakPolarHBondContact O-CB 3.35Å; V170-A174 PolarHBondContact O-N 3.35Å |
| 171 | L | 88.5 | Confident | 85.4 | Confident | 116 Ų | 116 | 88.1 Ų | 88.1 | 61% | 0.607 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.8 | -44.8 | 177.3 | -72.7 | 174.2 | 0 | 0 | 0 | 111.8 | V167 A168 A174 F175 | V167-L171 HydrophobicContact CG1-CD1 3.91Å; V167-L171 HydrophobicContact CG1-CG 4.31Å; V167-L171 WeakPolarHBondContact O-CB 3.45Å; V167-L171 VanDerWaalsContact O-CG 3.3Å; V167-L171 WeakPolarHBondContact O-CG 3.33Å; V167-L171 PolarHBondContact O-N 3.4Å; A168-L171 PolarHBondContact O-N 3.08Å; L171-A174 PolarHBondContact O-N 3.45Å; L171-F175 VanDerWaalsContact O-CB 3.3Å; L171-F175 WeakPolarHBondContact O-CB 3.44Å; L171-F175 PolarHBondContact O-N 3.25Å |
| 172 | V | 85.6 | Confident | 85.4 | Confident | 95 Ų | 95 | 93.6 Ų | 93.6 | 58% | 0.576 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.8 | -47 | 175.4 | 171.5 | 0 | 0 | 0 | 0 | 110 | A168 V169 A174 F175 I176 | A168-V172 WeakPolarHBondContact O-CG2 3.36Å; A168-V172 PolarHBondContact O-N 2.97Å; V169-V172 PolarHBondContact O-N 3.32Å; V172-A174 PolarHBondContact O-N 2.83Å; V172-F175 PolarHBondContact O-N 2.87Å; V172-F175 VanDerWaalsContact O-N 3.1Å; V172-I176 WeakPolarHBondContact O-CG1 3.16Å; V172-I176 PolarHBondContact O-N 3.21Å; V172-I176 VanDerWaalsContact O-N 3.13Å |
| 173 | A | 86.9 | Confident | 85.2 | Confident | 51 Ų | 51 | 89 Ų | 89 | 42% | 0.421 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.7 | -43.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V169 V170 F175 I176 | V169-A173 VanDerWaalsContact O-CB 3.27Å; V169-A173 WeakPolarHBondContact O-CB 3.34Å; V169-A173 PolarHBondContact O-N 3.42Å; V170-A173 PolarHBondContact O-N 2.96Å; A173-F175 PolarHBondContact O-N 3.34Å; A173-I176 WeakPolarHBondContact O-CB 3.33Å; A173-I176 PolarHBondContact O-N 2.92Å |
| 174 | A | 89.3 | Confident | 84.8 | Confident | 69 Ų | 69 | 80.7 Ų | 80.7 | 57% | 0.57 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -65.8 | -25.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V170 L171 V172 P177 | V170-A174 VanDerWaalsContact O-CB 3.25Å; V170-A174 WeakPolarHBondContact O-CB 3.35Å; V170-A174 PolarHBondContact O-N 3.35Å; L171-A174 PolarHBondContact O-N 3.45Å; V172-A174 PolarHBondContact O-N 2.83Å; A174-P177 WeakPolarHBondContact O-CD 3.49Å |
| 175 | F | 86.7 | Confident | 84.6 | Confident | 90 Ų | 90 | 83.6 Ų | 83.6 | 40% | 0.395 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -85.3 | -13.7 | 177.4 | -160.7 | -114.2 | 0 | 0 | 0 | 113.4 | L171 V172 A173 I178 L179 L183 | L171-F175 VanDerWaalsContact O-CB 3.3Å; L171-F175 WeakPolarHBondContact O-CB 3.44Å; L171-F175 PolarHBondContact O-N 3.25Å; V172-F175 PolarHBondContact O-N 2.87Å; V172-F175 VanDerWaalsContact O-N 3.1Å; A173-F175 PolarHBondContact O-N 3.34Å; F175-I178 HydrophobicContact CD2-CB 4.02Å; F175-I178 HydrophobicContact CD2-CD1 3.82Å; F175-I178 HydrophobicContact CD2-CG1 4.47Å; F175-I178 HydrophobicContact CD2-CG2 4.26Å; F175-I178 HydrophobicContact CE2-CB 3.95Å; F175-I178 HydrophobicContact CE2-CD1 3.99Å; F175-I178 HydrophobicContact CE2-CG2 3.66Å; F175-I178 HydrophobicContact CZ-CB 4.45Å; F175-I178 HydrophobicContact CZ-CG2 3.96Å; F175-I178 PolarHBondContact O-N 3.01Å; F175-I178 VanDerWaalsContact O-N 3.1Å; F175-L179 HydrophobicContact CD1-CD1 3.77Å; F175-L179 HydrophobicContact CD1-CD2 3.86Å; F175-L179 HydrophobicContact CD1-CG 3.45Å; F175-L179 VanDerWaalsContact CD1-CG 3.45Å; F175-L179 HydrophobicContact CE1-CD1 4.31Å; F175-L179 HydrophobicContact CE1-CD2 3.5Å; F175-L179 HydrophobicContact CE1-CG 3.6Å; F175-L179 HydrophobicContact CG-CG 4.44Å; F175-L179 PolarHBondContact O-N 3.09Å; F175-L183 HydrophobicContact CZ-CD1 4.22Å |
| 176 | I | 86 | Confident | 84.3 | Confident | 96 Ų | 96 | 87.2 Ų | 87.2 | 49% | 0.492 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -54.1 | -46.4 | 179.8 | -68.8 | 173.1 | 0 | 0 | 0 | 112.9 | V172 A173 I178 L179 W180 | V172-I176 WeakPolarHBondContact O-CG1 3.16Å; V172-I176 PolarHBondContact O-N 3.21Å; V172-I176 VanDerWaalsContact O-N 3.13Å; A173-I176 WeakPolarHBondContact O-CB 3.33Å; A173-I176 PolarHBondContact O-N 2.92Å; I176-I178 VanDerWaalsContact C-N 3.29Å; I176-I178 PolarHBondContact O-N 3.24Å; I176-L179 WeakPolarHBondContact O-CB 3.43Å; I176-L179 PolarHBondContact O-N 3.31Å; I176-W180 WeakPolarHBondContact O-CB 3.41Å; I176-W180 PolarHBondContact O-N 3.12Å |
| 177 | P | 85.1 | Confident | 83.8 | Confident | 68 Ų | 68 | 89.9 Ų | 89.9 | 44% | 0.442 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.3 | -40.2 | 178.5 | -23 | 34.5 | 0 | 0 | 0 | 111.9 | A174 W180 F181 | A174-P177 WeakPolarHBondContact O-CD 3.49Å; P177-W180 PolarHBondContact O-N 3.2Å; P177-F181 WeakPolarHBondContact O-CD2 3.36Å; P177-F181 PolarHBondContact O-N 3.42Å |
| 178 | I | 83.9 | Confident | 83.5 | Confident | 75 Ų | 75 | 87.6 Ų | 87.6 | 39% | 0.385 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.4 | -44.2 | 178.8 | -60.9 | 170.8 | 0 | 0 | 0 | 109.8 | F175 I176 W180 F182 L183 | F175-I178 HydrophobicContact CD2-CB 4.02Å; F175-I178 HydrophobicContact CD2-CD1 3.82Å; F175-I178 HydrophobicContact CD2-CG1 4.47Å; F175-I178 HydrophobicContact CD2-CG2 4.26Å; F175-I178 HydrophobicContact CE2-CB 3.95Å; F175-I178 HydrophobicContact CE2-CD1 3.99Å; F175-I178 HydrophobicContact CE2-CG2 3.66Å; F175-I178 HydrophobicContact CZ-CB 4.45Å; F175-I178 HydrophobicContact CZ-CG2 3.96Å; F175-I178 PolarHBondContact O-N 3.01Å; F175-I178 VanDerWaalsContact O-N 3.1Å; I176-I178 VanDerWaalsContact C-N 3.29Å; I176-I178 PolarHBondContact O-N 3.24Å; I178-W180 VanDerWaalsContact C-N 3.35Å; I178-W180 PolarHBondContact O-N 2.95Å; I178-F182 HydrophobicContact CG2-CD2 4.15Å; I178-F182 WeakPolarHBondContact O-CB 3.45Å; I178-F182 PolarHBondContact O-N 3.41Å; I178-L183 HydrophobicContact CG2-CD1 3.83Å |
| 179 | L | 82.4 | Confident | 83.4 | Confident | 61 Ų | 61 | 89 Ų | 89 | 32% | 0.319 | 46% | 0.461 | S | S | . | . | I | π-helix | trans | -56 | -49.5 | 173 | -74.3 | 171.7 | 0 | 0 | 0 | 111.3 | F175 I176 L183 M184 | F175-L179 HydrophobicContact CD1-CD1 3.77Å; F175-L179 HydrophobicContact CD1-CD2 3.86Å; F175-L179 HydrophobicContact CD1-CG 3.45Å; F175-L179 VanDerWaalsContact CD1-CG 3.45Å; F175-L179 HydrophobicContact CE1-CD1 4.31Å; F175-L179 HydrophobicContact CE1-CD2 3.5Å; F175-L179 HydrophobicContact CE1-CG 3.6Å; F175-L179 HydrophobicContact CG-CG 4.44Å; F175-L179 PolarHBondContact O-N 3.09Å; I176-L179 WeakPolarHBondContact O-CB 3.43Å; I176-L179 PolarHBondContact O-N 3.31Å; L179-L183 HydrophobicContact CD2-CB 4.08Å; L179-L183 HydrophobicContact CD2-CD1 4.38Å; L179-L183 HydrophobicContact CD2-CD2 4.32Å; L179-L183 CarbonylContact O-C 3.55Å; L179-L183 PolarHBondContact O-N 2.88Å; L179-L183 VanDerWaalsContact O-N 3.1Å; L179-M184 WeakPolarHBondContact O-CB 3.19Å; L179-M184 WeakPolarHBondContact O-CG 3.35Å; L179-M184 PolarHBondContact O-N 3.17Å |
| 180 | W | 82 | Confident | 83.1 | Confident | 69 Ų | 69 | 88.6 Ų | 88.6 | 26% | 0.261 | 45% | 0.453 | S | S | . | . | I | π-helix | trans | -64 | -43.5 | -175.6 | -174.9 | -94 | 0 | 0 | 0 | 113.5 | I176 P177 I178 M184 R189 V192 M193 | I176-W180 WeakPolarHBondContact O-CB 3.41Å; I176-W180 PolarHBondContact O-N 3.12Å; P177-W180 PolarHBondContact O-N 3.2Å; I178-W180 VanDerWaalsContact C-N 3.35Å; I178-W180 PolarHBondContact O-N 2.95Å; W180-M184 HydrophobicContact CD2-SD 4.45Å; W180-M184 HydrophobicContact CE3-CE 4.05Å; W180-M184 HydrophobicContact CE3-SD 3.59Å; W180-M184 VanDerWaalsContact CE3-SD 3.59Å; W180-M184 HydrophobicContact CZ3-CE 4.03Å; W180-M184 HydrophobicContact CZ3-SD 4.19Å; W180-R189 HydrophobicContact CD2-CG 4.38Å; W180-R189 HydrophobicContact CE3-CG 4.29Å; W180-R189 HydrophobicContact CH2-CB 4.04Å; W180-R189 HydrophobicContact CH2-CG 4.16Å; W180-R189 HydrophobicContact CZ2-CB 4.28Å; W180-R189 HydrophobicContact CZ2-CG 4.24Å; W180-R189 HydrophobicContact CZ3-CB 4.41Å; W180-R189 HydrophobicContact CZ3-CG 4.18Å; W180-V192 HydrophobicContact CH2-CB 3.96Å; W180-V192 HydrophobicContact CH2-CG1 3.99Å; W180-V192 HydrophobicContact CZ3-CB 3.78Å; W180-V192 HydrophobicContact CZ3-CG1 3.82Å; W180-V192 HydrophobicContact CZ3-CG2 4.05Å; W180-M193 HydrophobicContact CH2-CG 4.43Å; W180-M193 HydrophobicContact CH2-SD 4.28Å; W180-M193 HydrophobicContact CZ2-SD 4.26Å |
| 181 | F | 83.9 | Confident | 82.8 | Confident | 145 Ų | 145 | 88.3 Ų | 88.3 | 64% | 0.636 | 44% | 0.441 | S | S | * | . | I | π-helix | trans | -87.1 | -30.9 | -174.3 | -71.4 | -67.5 | 0 | 0 | 0 | 114 | P177 | P177-F181 WeakPolarHBondContact O-CD2 3.36Å; P177-F181 PolarHBondContact O-N 3.42Å |
| 182 | F | 83.1 | Confident | 82.6 | Confident | 170 Ų | 170 | 85 Ų | 85 | 75% | 0.746 | 43% | 0.426 | S | S | * | . | I | π-helix | trans | -117.9 | -28.1 | -169.6 | -58.6 | -82.2 | 0 | 0 | 0 | 114.8 | I178 | I178-F182 HydrophobicContact CG2-CD2 4.15Å; I178-F182 WeakPolarHBondContact O-CB 3.45Å; I178-F182 PolarHBondContact O-N 3.41Å |
| 183 | L | 77.7 | Confident | 82.4 | Confident | 94 Ų | 94 | 84.8 Ų | 84.8 | 49% | 0.492 | 42% | 0.42 | S | S | . | . | I | π-helix | trans | -113.4 | -27.2 | -173.2 | -67.7 | 95.9 | 0 | 0 | 0 | 114.6 | F175 I178 L179 H185 | F175-L183 HydrophobicContact CZ-CD1 4.22Å; I178-L183 HydrophobicContact CG2-CD1 3.83Å; L179-L183 HydrophobicContact CD2-CB 4.08Å; L179-L183 HydrophobicContact CD2-CD1 4.38Å; L179-L183 HydrophobicContact CD2-CD2 4.32Å; L179-L183 CarbonylContact O-C 3.55Å; L179-L183 PolarHBondContact O-N 2.88Å; L179-L183 VanDerWaalsContact O-N 3.1Å; L183-H185 PolarHBondContact O-N 3.49Å |
| 184 | M | 78.1 | Confident | 82.1 | Confident | 44 Ų | 44 | 83 Ų | 83 | 22% | 0.217 | 40% | 0.403 | C | S | . | . | trans | -74.9 | 125.1 | -176.3 | -81 | -175.9 | 75.1 | 0 | 0 | 111.2 | L179 W180 Q188 R189 V192 | L179-M184 WeakPolarHBondContact O-CB 3.19Å; L179-M184 WeakPolarHBondContact O-CG 3.35Å; L179-M184 PolarHBondContact O-N 3.17Å; W180-M184 HydrophobicContact CD2-SD 4.45Å; W180-M184 HydrophobicContact CE3-CE 4.05Å; W180-M184 HydrophobicContact CE3-SD 3.59Å; W180-M184 VanDerWaalsContact CE3-SD 3.59Å; W180-M184 HydrophobicContact CZ3-CE 4.03Å; W180-M184 HydrophobicContact CZ3-SD 4.19Å; M184-Q188 HydrophobicContact CE-CB 3.57Å; M184-R189 HydrophobicContact CB-CG 3.88Å; M184-R189 HydrophobicContact CE-CG 4.18Å; M184-V192 HydrophobicContact CE-CG2 4.33Å | ||
| 185 | H | 77.5 | Confident | 81.9 | Confident | 119 Ų | 119 | 81.6 Ų | 81.6 | 55% | 0.551 | 39% | 0.385 | S | S | * | . | trans | -66.7 | 155.6 | 171.9 | -66.4 | -69.3 | 0 | 0 | 0 | 111.5 | L183 Y187 Q188 R189 | L183-H185 PolarHBondContact O-N 3.49Å; H185-Y187 VanDerWaalsContact C-N 3.28Å; H185-Y187 HydrophobicContact CB-CD1 3.49Å; H185-Y187 VanDerWaalsContact CB-CD1 3.49Å; H185-Y187 HydrophobicContact CB-CE1 3.38Å; H185-Y187 AromaticContact CD2-CE1 3.9Å; H185-Y187 AromaticContact CG-CE1 3.84Å; H185-Y187 PolarHBondContact O-N 2.92Å; H185-Q188 HydrophobicContact CB-CG 4.38Å; H185-Q188 WeakPolarHBondContact O-CB 3.34Å; H185-Q188 PolarHBondContact O-N 3.25Å; H185-R189 PolarHBondContact O-N 2.57Å; H185-R189 VanDerWaalsContact O-N 3.14Å | ||
| 186 | D | 79.5 | Confident | 81.8 | Confident | 114 Ų | 114 | 83.5 Ų | 83.5 | 61% | 0.61 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -53.4 | -43.7 | -179.2 | -62.4 | -36.1 | 0 | 0 | 0 | 112.8 | Q188 R189 Q190 | D186-Q188 VanDerWaalsContact C-N 3.27Å; D186-Q188 PolarHBondContact O-N 3.49Å; D186-R189 PolarHBondContact O-N 3.41Å; D186-R189 IonicContact OD1-CZ 2.74Å; D186-R189 IonicContact OD1-NE 2.62Å; D186-R189 IonicContact OD1-NH2 3.51Å; D186-R189 PolarHBondContact OD1-NH2 3.04Å; D186-Q190 WeakPolarHBondContact O-CB 3.27Å; D186-Q190 PolarHBondContact O-N 2.86Å |
| 187 | Y | 76.1 | Confident | 81.9 | Confident | 88 Ų | 88 | 82.8 Ų | 82.8 | 35% | 0.345 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.1 | -31.3 | 178.9 | 79.8 | -93.4 | 0 | 0 | 0 | 113.1 | H185 R191 | H185-Y187 VanDerWaalsContact C-N 3.28Å; H185-Y187 HydrophobicContact CB-CD1 3.49Å; H185-Y187 VanDerWaalsContact CB-CD1 3.49Å; H185-Y187 HydrophobicContact CB-CE1 3.38Å; H185-Y187 AromaticContact CD2-CE1 3.9Å; H185-Y187 AromaticContact CG-CE1 3.84Å; H185-Y187 PolarHBondContact O-N 2.92Å; Y187-R191 WeakPolarHBondContact O-CG 3.28Å; Y187-R191 PolarHBondContact O-N 3.13Å |
| 188 | Q | 80.9 | Confident | 81.7 | Confident | 34 Ų | 34 | 80.4 Ų | 80.4 | 16% | 0.159 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -74.6 | -41.4 | 178.1 | -61.1 | 177.6 | -34.9 | 0 | 0 | 110.3 | M184 H185 D186 Q190 R191 V192 | M184-Q188 HydrophobicContact CE-CB 3.57Å; H185-Q188 HydrophobicContact CB-CG 4.38Å; H185-Q188 WeakPolarHBondContact O-CB 3.34Å; H185-Q188 PolarHBondContact O-N 3.25Å; D186-Q188 VanDerWaalsContact C-N 3.27Å; D186-Q188 PolarHBondContact O-N 3.49Å; Q188-Q190 VanDerWaalsContact C-N 3.34Å; Q188-R191 PolarHBondContact O-N 2.7Å; Q188-V192 PolarHBondContact O-N 2.81Å |
| 189 | R | 81.8 | Confident | 81.7 | Confident | 78 Ų | 78 | 84.3 Ų | 84.3 | 29% | 0.294 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 173.9 | -66.2 | -171.6 | -77.8 | 179.7 | -3.8 | 110.7 | W180 M184 H185 D186 R191 V192 M193 | W180-R189 HydrophobicContact CD2-CG 4.38Å; W180-R189 HydrophobicContact CE3-CG 4.29Å; W180-R189 HydrophobicContact CH2-CB 4.04Å; W180-R189 HydrophobicContact CH2-CG 4.16Å; W180-R189 HydrophobicContact CZ2-CB 4.28Å; W180-R189 HydrophobicContact CZ2-CG 4.24Å; W180-R189 HydrophobicContact CZ3-CB 4.41Å; W180-R189 HydrophobicContact CZ3-CG 4.18Å; M184-R189 HydrophobicContact CB-CG 3.88Å; M184-R189 HydrophobicContact CE-CG 4.18Å; H185-R189 PolarHBondContact O-N 2.57Å; H185-R189 VanDerWaalsContact O-N 3.14Å; D186-R189 PolarHBondContact O-N 3.41Å; D186-R189 IonicContact OD1-CZ 2.74Å; D186-R189 IonicContact OD1-NE 2.62Å; D186-R189 IonicContact OD1-NH2 3.51Å; D186-R189 PolarHBondContact OD1-NH2 3.04Å; R189-R191 VanDerWaalsContact C-N 3.31Å; R189-R191 PolarHBondContact O-N 2.71Å; R189-V192 PolarHBondContact O-N 3.24Å; R189-V192 VanDerWaalsContact O-N 3.08Å; R189-M193 WeakPolarHBondContact O-CG 3.29Å; R189-M193 PolarHBondContact O-N 2.95Å |
| 190 | Q | 81.1 | Confident | 81.8 | Confident | 86 Ų | 86 | 84.8 Ų | 84.8 | 40% | 0.402 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -56.9 | -43.1 | 176.6 | -167.8 | 177.1 | 16 | 0 | 0 | 111.6 | D186 Q188 V192 M193 M194 A205 | D186-Q190 WeakPolarHBondContact O-CB 3.27Å; D186-Q190 PolarHBondContact O-N 2.86Å; Q188-Q190 VanDerWaalsContact C-N 3.34Å; Q190-V192 VanDerWaalsContact C-N 3.3Å; Q190-V192 PolarHBondContact O-N 3.17Å; Q190-M193 PolarHBondContact O-N 2.97Å; Q190-M194 HydrophobicContact CG-CG 4.26Å; Q190-M194 WeakPolarHBondContact O-CB 3.35Å; Q190-M194 VanDerWaalsContact O-CG 3.25Å; Q190-M194 WeakPolarHBondContact O-CG 3.32Å; Q190-M194 PolarHBondContact O-N 2.89Å; Q190-A205 HydrophobicContact CG-CB 4.14Å |
| 191 | R | 82.4 | Confident | 81.9 | Confident | 93 Ų | 93 | 83.9 Ų | 83.9 | 35% | 0.351 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61 | -35.2 | 176.4 | -74.7 | 174 | 175.6 | -158.8 | 2.5 | 113.8 | Y187 Q188 R189 L195 V312 | Y187-R191 WeakPolarHBondContact O-CG 3.28Å; Y187-R191 PolarHBondContact O-N 3.13Å; Q188-R191 PolarHBondContact O-N 2.7Å; R189-R191 VanDerWaalsContact C-N 3.31Å; R189-R191 PolarHBondContact O-N 2.71Å; R191-L195 PolarHBondContact O-N 3.49Å; R191-V312 VanDerWaalsContact CD-O 3.24Å; R191-V312 WeakPolarHBondContact CD-O 3.32Å; R191-V312 PolarHBondContact NE-O 3.12Å; R191-V312 PolarHBondContact NH1-O 3.41Å |
| 192 | V | 84.4 | Confident | 81.8 | Confident | 47 Ų | 47 | 80.1 Ų | 80.1 | 29% | 0.285 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -74.5 | -41.5 | 175.5 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | W180 M184 Q188 R189 Q190 L195 L196 | W180-V192 HydrophobicContact CH2-CB 3.96Å; W180-V192 HydrophobicContact CH2-CG1 3.99Å; W180-V192 HydrophobicContact CZ3-CB 3.78Å; W180-V192 HydrophobicContact CZ3-CG1 3.82Å; W180-V192 HydrophobicContact CZ3-CG2 4.05Å; M184-V192 HydrophobicContact CE-CG2 4.33Å; Q188-V192 PolarHBondContact O-N 2.81Å; R189-V192 PolarHBondContact O-N 3.24Å; R189-V192 VanDerWaalsContact O-N 3.08Å; Q190-V192 VanDerWaalsContact C-N 3.3Å; Q190-V192 PolarHBondContact O-N 3.17Å; V192-L195 WeakPolarHBondContact O-CB 3.45Å; V192-L195 PolarHBondContact O-N 3.32Å; V192-L196 PolarHBondContact O-N 3.19Å |
| 193 | M | 82 | Confident | 81.7 | Confident | 90 Ų | 90 | 79.5 Ų | 79.5 | 44% | 0.443 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 176.8 | -66 | -56.6 | -65.2 | 0 | 0 | 112.1 | W180 R189 Q190 L195 L196 D197 | W180-M193 HydrophobicContact CH2-CG 4.43Å; W180-M193 HydrophobicContact CH2-SD 4.28Å; W180-M193 HydrophobicContact CZ2-SD 4.26Å; R189-M193 WeakPolarHBondContact O-CG 3.29Å; R189-M193 PolarHBondContact O-N 2.95Å; Q190-M193 PolarHBondContact O-N 2.97Å; M193-L195 PolarHBondContact O-N 3.34Å; M193-L196 PolarHBondContact O-N 3.27Å; M193-L196 VanDerWaalsContact O-N 3.07Å; M193-D197 PolarHBondContact O-N 2.87Å |
| 194 | M | 81.3 | Confident | 81.8 | Confident | 13 Ų | 13 | 76.6 Ų | 76.6 | 6% | 0.064 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -66.8 | -21 | 176.1 | -66.8 | -53.1 | 93.4 | 0 | 0 | 113.3 | Q190 P198 S200 D201 A205 I209 | Q190-M194 HydrophobicContact CG-CG 4.26Å; Q190-M194 WeakPolarHBondContact O-CB 3.35Å; Q190-M194 VanDerWaalsContact O-CG 3.25Å; Q190-M194 WeakPolarHBondContact O-CG 3.32Å; Q190-M194 PolarHBondContact O-N 2.89Å; M194-P198 VanDerWaalsContact O-CA 3.3Å; M194-P198 WeakPolarHBondContact O-CA 3.49Å; M194-P198 VanDerWaalsContact O-CB 3.25Å; M194-P198 WeakPolarHBondContact O-CB 3.28Å; M194-P198 WeakPolarHBondContact O-CD 3.23Å; M194-S200 WeakPolarHBondContact CE-OG 3.33Å; M194-D201 HydrophobicContact SD-CB 4.02Å; M194-A205 HydrophobicContact CG-CB 3.65Å; M194-A205 HydrophobicContact SD-CB 3.91Å; M194-I209 HydrophobicContact CB-CD1 4.37Å |
| 195 | L | 84.2 | Confident | 81.6 | Confident | 39 Ų | 39 | 76.4 Ų | 76.4 | 20% | 0.204 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -71 | -42 | 170.5 | 175.9 | 66.5 | 0 | 0 | 0 | 110.9 | R191 V192 M193 G308 P311 | R191-L195 PolarHBondContact O-N 3.49Å; V192-L195 WeakPolarHBondContact O-CB 3.45Å; V192-L195 PolarHBondContact O-N 3.32Å; M193-L195 PolarHBondContact O-N 3.34Å; L195-G308 WeakPolarHBondContact CD1-O 3.19Å; L195-P311 HydrophobicContact CD2-CB 4.47Å |
| 196 | L | 85.5 | Confident | 81.7 | Confident | 131 Ų | 131 | 70.7 Ų | 70.7 | 69% | 0.686 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -75.8 | -43.7 | -177.6 | -63.4 | 175 | 0 | 0 | 0 | 111.8 | V192 M193 | V192-L196 PolarHBondContact O-N 3.19Å; M193-L196 PolarHBondContact O-N 3.27Å; M193-L196 VanDerWaalsContact O-N 3.07Å |
| 197 | D | 86.5 | Confident | 82 | Confident | 80 Ų | 80 | 68 Ų | 68 | 43% | 0.428 | 35% | 0.353 | S | S | . | . | trans | -139.7 | 82.3 | 179.3 | -174.8 | 2.9 | 0 | 0 | 0 | 110.5 | M193 E199 S200 | M193-D197 PolarHBondContact O-N 2.87Å; D197-E199 PolarHBondContact O-N 2.84Å; D197-E199 PolarHBondContact OD1-N 2.88Å; D197-E199 VanDerWaalsContact OD1-N 3.12Å; D197-S200 PolarHBondContact O-N 2.96Å; D197-S200 PolarHBondContact O-OG 3.48Å; D197-S200 PolarHBondContact OD1-N 3.41Å; D197-S200 VanDerWaalsContact OD1-N 3.17Å | ||
| 198 | P | 81.2 | Confident | 82.3 | Confident | 18 Ų | 18 | 67.1 Ų | 67.1 | 12% | 0.117 | 35% | 0.352 | C | S | . | . | G | 310 helix | trans | -67.8 | -20.8 | 175 | 25.2 | -31.1 | 0 | 0 | 0 | 112.7 | M194 S200 I210 | M194-P198 VanDerWaalsContact O-CA 3.3Å; M194-P198 WeakPolarHBondContact O-CA 3.49Å; M194-P198 VanDerWaalsContact O-CB 3.25Å; M194-P198 WeakPolarHBondContact O-CB 3.28Å; M194-P198 WeakPolarHBondContact O-CD 3.23Å; P198-S200 VanDerWaalsContact C-N 3.28Å; P198-S200 PolarHBondContact O-N 3.48Å; P198-I210 HydrophobicContact CB-CD1 4.39Å; P198-I210 HydrophobicContact CB-CG1 4.08Å |
| 199 | E | 84.6 | Confident | 82.4 | Confident | 157 Ų | 157 | 65.8 Ų | 65.8 | 73% | 0.734 | 35% | 0.346 | S | S | * | . | G | 310 helix | trans | -79.4 | -12.4 | -177.3 | -62.9 | -168.6 | 175.8 | 0 | 0 | 112.8 | D197 D201 P202 | D197-E199 PolarHBondContact O-N 2.84Å; D197-E199 PolarHBondContact OD1-N 2.88Å; D197-E199 VanDerWaalsContact OD1-N 3.12Å; E199-D201 PolarHBondContact O-N 3.34Å; E199-P202 WeakPolarHBondContact O-CD 3.36Å |
| 200 | S | 83.7 | Confident | 82.7 | Confident | 71 Ų | 71 | 63.9 Ų | 63.9 | 50% | 0.497 | 34% | 0.341 | S | S | . | . | G | 310 helix | trans | -63 | -26.2 | 172.6 | 62.7 | 0 | 0 | 0 | 0 | 114 | M194 D197 P198 | M194-S200 WeakPolarHBondContact CE-OG 3.33Å; D197-S200 PolarHBondContact O-N 2.96Å; D197-S200 PolarHBondContact O-OG 3.48Å; D197-S200 PolarHBondContact OD1-N 3.41Å; D197-S200 VanDerWaalsContact OD1-N 3.17Å; P198-S200 VanDerWaalsContact C-N 3.28Å; P198-S200 PolarHBondContact O-N 3.48Å |
| 201 | D | 83.6 | Confident | 83.1 | Confident | 51 Ų | 51 | 61.1 Ų | 61.1 | 27% | 0.273 | 33% | 0.328 | S | S | . | . | S | Bend | trans | -143.5 | 74.5 | 174.8 | -178.2 | 18.4 | 0 | 0 | 0 | 111 | M194 E199 L203 G204 A205 G206 | M194-D201 HydrophobicContact SD-CB 4.02Å; E199-D201 PolarHBondContact O-N 3.34Å; D201-L203 VanDerWaalsContact C-N 3.29Å; D201-L203 PolarHBondContact O-N 3.25Å; D201-G204 PolarHBondContact O-N 2.98Å; D201-G204 WeakPolarHBondContact OD1-CA 3.32Å; D201-G204 PolarHBondContact OD1-N 3.29Å; D201-G204 WeakPolarHBondContact OD2-CA 3.37Å; D201-A205 PolarHBondContact OD2-N 2.9Å; D201-G206 VanDerWaalsContact O-CA 3.29Å; D201-G206 WeakPolarHBondContact O-CA 3.42Å; D201-G206 PolarHBondContact O-N 3.01Å |
| 202 | P | 82 | Confident | 83.4 | Confident | 65 Ų | 65 | 56.7 Ų | 56.7 | 42% | 0.422 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -18.4 | -170.3 | 30.5 | -32.5 | 0 | 0 | 0 | 112.9 | E199 Y207 I210 | E199-P202 WeakPolarHBondContact O-CD 3.36Å; P202-Y207 WeakPolarHBondContact O-CA 3.43Å; P202-Y207 VanDerWaalsContact O-CB 3.3Å; P202-Y207 WeakPolarHBondContact O-CB 3.25Å; P202-Y207 WeakPolarHBondContact O-CD2 3.46Å; P202-I210 HydrophobicContact CB-CD1 3.84Å |
| 203 | L | 81 | Confident | 83.7 | Confident | 157 Ų | 157 | 58.4 Ų | 58.4 | 82% | 0.822 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98 | -16.8 | 178.5 | -63 | 178.1 | 0 | 0 | 0 | 112.9 | D201 | D201-L203 VanDerWaalsContact C-N 3.29Å; D201-L203 PolarHBondContact O-N 3.25Å |
| 204 | G | 81.1 | Confident | 84.1 | Confident | 33 Ų | 33 | 57.9 Ų | 57.9 | 34% | 0.34 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.3 | -113.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D201 G206 Y207 | D201-G204 PolarHBondContact O-N 2.98Å; D201-G204 WeakPolarHBondContact OD1-CA 3.32Å; D201-G204 PolarHBondContact OD1-N 3.29Å; D201-G204 WeakPolarHBondContact OD2-CA 3.37Å; G204-G206 VanDerWaalsContact C-N 3.31Å; G204-G206 PolarHBondContact O-N 3.29Å; G204-Y207 VanDerWaalsContact O-CB 3.31Å; G204-Y207 WeakPolarHBondContact O-CB 3.45Å; G204-Y207 PolarHBondContact O-N 3.42Å |
| 205 | A | 73.1 | Confident | 84.5 | Confident | 40 Ų | 40 | 57.3 Ų | 57.3 | 33% | 0.331 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -27.4 | -169 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q190 M194 D201 | Q190-A205 HydrophobicContact CG-CB 4.14Å; M194-A205 HydrophobicContact CG-CB 3.65Å; M194-A205 HydrophobicContact SD-CB 3.91Å; D201-A205 PolarHBondContact OD2-N 2.9Å |
| 206 | G | 80.7 | Confident | 84.9 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 31% | 0.312 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | -22.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D201 G204 H208 I209 I210 | D201-G206 VanDerWaalsContact O-CA 3.29Å; D201-G206 WeakPolarHBondContact O-CA 3.42Å; D201-G206 PolarHBondContact O-N 3.01Å; G204-G206 VanDerWaalsContact C-N 3.31Å; G204-G206 PolarHBondContact O-N 3.29Å; G206-H208 VanDerWaalsContact C-N 3.32Å; G206-H208 PolarHBondContact O-N 3.32Å; G206-I209 PolarHBondContact O-N 3.21Å; G206-I209 VanDerWaalsContact O-N 3.12Å; G206-I210 WeakPolarHBondContact O-CG1 3.18Å; G206-I210 PolarHBondContact O-N 3.39Å |
| 207 | Y | 84.7 | Confident | 85.3 | Confident | 57 Ų | 57 | 54.1 Ų | 54.1 | 22% | 0.224 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -51.9 | -47.5 | -172.8 | -178.8 | -100.3 | 0 | 0 | 0 | 112.8 | P202 G204 I209 I210 Q211 F236 P238 | P202-Y207 WeakPolarHBondContact O-CA 3.43Å; P202-Y207 VanDerWaalsContact O-CB 3.3Å; P202-Y207 WeakPolarHBondContact O-CB 3.25Å; P202-Y207 WeakPolarHBondContact O-CD2 3.46Å; G204-Y207 VanDerWaalsContact O-CB 3.31Å; G204-Y207 WeakPolarHBondContact O-CB 3.45Å; G204-Y207 PolarHBondContact O-N 3.42Å; Y207-I209 PolarHBondContact O-N 2.85Å; Y207-I210 PolarHBondContact O-N 3.38Å; Y207-Q211 HydrophobicContact CD1-CG 4.24Å; Y207-Q211 HydrophobicContact CD2-CG 4.23Å; Y207-Q211 HydrophobicContact CE1-CG 3.85Å; Y207-Q211 HydrophobicContact CE2-CG 3.83Å; Y207-Q211 HydrophobicContact CG-CG 4.42Å; Y207-Q211 WeakPolarHBondContact O-CG 3.46Å; Y207-Q211 PolarHBondContact O-N 2.99Å; Y207-F236 WeakPolarHBondContact CE1-O 3.49Å; Y207-F236 WeakPolarHBondContact OH-CD1 3.24Å; Y207-F236 PolarHBondContact OH-O 3.39Å; Y207-P238 HydrophobicContact CE1-CG 4.46Å |
| 208 | H | 82.2 | Confident | 85.6 | Confident | 70 Ų | 70 | 52.4 Ų | 52.4 | 32% | 0.324 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | -175.8 | -66.1 | -153.3 | 0 | 0 | 0 | 111.7 | G206 S212 P238 F244 | G206-H208 VanDerWaalsContact C-N 3.32Å; G206-H208 PolarHBondContact O-N 3.32Å; H208-S212 WeakPolarHBondContact O-CB 3.3Å; H208-S212 PolarHBondContact O-N 2.78Å; H208-P238 VanDerWaalsContact CE1-CB 3.47Å; H208-P238 WeakPolarHBondContact CE1-CB 3.4Å; H208-P238 WeakPolarHBondContact NE2-CG 3.38Å; H208-F244 HydrophobicContact CB-CE1 4.48Å; H208-F244 HydrophobicContact CB-CE2 4.26Å; H208-F244 HydrophobicContact CB-CZ 3.89Å |
| 209 | I | 84.5 | Confident | 86.1 | Confident | 6 Ų | 6 | 51.8 Ų | 51.8 | 3% | 0.031 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -70.5 | -41.6 | -179.6 | -61 | 174.2 | 0 | 0 | 0 | 109.7 | M194 G206 Y207 S212 K213 V312 | M194-I209 HydrophobicContact CB-CD1 4.37Å; G206-I209 PolarHBondContact O-N 3.21Å; G206-I209 VanDerWaalsContact O-N 3.12Å; Y207-I209 PolarHBondContact O-N 2.85Å; I209-S212 PolarHBondContact O-N 3.29Å; I209-K213 HydrophobicContact CG2-CD 4.25Å; I209-K213 WeakPolarHBondContact O-CB 3.42Å; I209-K213 WeakPolarHBondContact O-CG 3.49Å; I209-K213 PolarHBondContact O-N 3.25Å; I209-V312 HydrophobicContact CD1-CG2 3.74Å; I209-V312 HydrophobicContact CG1-CG2 3.66Å |
| 210 | I | 87.2 | Confident | 86.5 | Confident | 37 Ų | 37 | 46.4 Ų | 46.4 | 19% | 0.19 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.2 | -51.2 | 177.7 | -67.8 | 167.5 | 0 | 0 | 0 | 110.2 | P198 P202 G206 Y207 S212 K213 I214 | P198-I210 HydrophobicContact CB-CD1 4.39Å; P198-I210 HydrophobicContact CB-CG1 4.08Å; P202-I210 HydrophobicContact CB-CD1 3.84Å; G206-I210 WeakPolarHBondContact O-CG1 3.18Å; G206-I210 PolarHBondContact O-N 3.39Å; Y207-I210 PolarHBondContact O-N 3.38Å; I210-S212 VanDerWaalsContact C-N 3.32Å; I210-S212 PolarHBondContact O-N 2.92Å; I210-K213 PolarHBondContact O-N 3.38Å; I210-I214 HydrophobicContact CG2-CD1 3.76Å; I210-I214 VanDerWaalsContact O-CG1 3.32Å; I210-I214 WeakPolarHBondContact O-CG1 2.85Å; I210-I214 PolarHBondContact O-N 2.89Å |
| 211 | Q | 89 | Confident | 87 | Confident | 28 Ų | 28 | 48.9 Ų | 48.9 | 13% | 0.131 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.7 | -38.2 | 179.3 | -68.3 | -56.5 | -23.4 | 0 | 0 | 112.4 | Y207 I214 A215 L237 | Y207-Q211 HydrophobicContact CD1-CG 4.24Å; Y207-Q211 HydrophobicContact CD2-CG 4.23Å; Y207-Q211 HydrophobicContact CE1-CG 3.85Å; Y207-Q211 HydrophobicContact CE2-CG 3.83Å; Y207-Q211 HydrophobicContact CG-CG 4.42Å; Y207-Q211 WeakPolarHBondContact O-CG 3.46Å; Y207-Q211 PolarHBondContact O-N 2.99Å; Q211-I214 PolarHBondContact O-N 3.15Å; Q211-A215 WeakPolarHBondContact O-CB 2.95Å; Q211-A215 PolarHBondContact O-N 3.1Å; Q211-L237 HydrophobicContact CB-CG 4.26Å |
| 212 | S | 88.9 | Confident | 87.4 | Confident | 0 Ų | 0 | 57.2 Ų | 57.2 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.6 | -46.5 | 173.7 | -176.3 | 0 | 0 | 0 | 0 | 112.7 | H208 I209 I210 I214 A215 I216 V306 | H208-S212 WeakPolarHBondContact O-CB 3.3Å; H208-S212 PolarHBondContact O-N 2.78Å; I209-S212 PolarHBondContact O-N 3.29Å; I210-S212 VanDerWaalsContact C-N 3.32Å; I210-S212 PolarHBondContact O-N 2.92Å; S212-I214 PolarHBondContact O-N 3.2Å; S212-A215 PolarHBondContact O-N 2.87Å; S212-I216 VanDerWaalsContact O-CG1 3.31Å; S212-I216 WeakPolarHBondContact O-CG1 3.31Å; S212-I216 PolarHBondContact O-N 3.47Å; S212-V306 WeakPolarHBondContact CB-O 3.47Å; S212-V306 WeakPolarHBondContact OG-CG1 3.4Å; S212-V306 PolarHBondContact OG-O 2.95Å |
| 213 | K | 90.4 | Very high | 87.9 | Confident | 84 Ų | 84 | 55.1 Ų | 55.1 | 37% | 0.365 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.5 | -42.6 | 176.4 | -75.3 | 179.3 | 179.5 | -179.5 | 0 | 111.7 | I209 I210 G217 S307 | I209-K213 HydrophobicContact CG2-CD 4.25Å; I209-K213 WeakPolarHBondContact O-CB 3.42Å; I209-K213 WeakPolarHBondContact O-CG 3.49Å; I209-K213 PolarHBondContact O-N 3.25Å; I210-K213 PolarHBondContact O-N 3.38Å; K213-G217 PolarHBondContact O-N 3.21Å; K213-S307 VanDerWaalsContact CE-O 3.31Å; K213-S307 WeakPolarHBondContact CE-O 3.23Å |
| 214 | I | 90.8 | Very high | 88.4 | Confident | 79 Ų | 79 | 51 Ų | 51 | 41% | 0.405 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 176.3 | -67.8 | 167.6 | 0 | 0 | 0 | 110.4 | I210 Q211 S212 G217 S218 Q231 | I210-I214 HydrophobicContact CG2-CD1 3.76Å; I210-I214 VanDerWaalsContact O-CG1 3.32Å; I210-I214 WeakPolarHBondContact O-CG1 2.85Å; I210-I214 PolarHBondContact O-N 2.89Å; Q211-I214 PolarHBondContact O-N 3.15Å; S212-I214 PolarHBondContact O-N 3.2Å; I214-G217 PolarHBondContact O-N 2.89Å; I214-S218 WeakPolarHBondContact O-CB 3.35Å; I214-S218 PolarHBondContact O-N 2.93Å; I214-S218 PolarHBondContact O-OG 3.34Å; I214-Q231 HydrophobicContact CG2-CG 4.39Å |
| 215 | A | 90.5 | Very high | 88.8 | Confident | 0 Ų | 0 | 50.7 Ų | 50.7 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -60.7 | -50.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q211 S212 G217 S218 G219 Q231 L237 A247 E251 | Q211-A215 WeakPolarHBondContact O-CB 2.95Å; Q211-A215 PolarHBondContact O-N 3.1Å; S212-A215 PolarHBondContact O-N 2.87Å; A215-G217 VanDerWaalsContact C-N 3.35Å; A215-G217 PolarHBondContact O-N 3.42Å; A215-S218 PolarHBondContact O-N 3.28Å; A215-S218 PolarHBondContact O-OG 2.85Å; A215-G219 PolarHBondContact O-N 2.93Å; A215-Q231 HydrophobicContact CB-CB 3.99Å; A215-Q231 HydrophobicContact CB-CG 4.19Å; A215-L237 HydrophobicContact CB-CD1 3.62Å; A215-A247 HydrophobicContact CB-CB 4.27Å; A215-E251 HydrophobicContact CB-CB 4.23Å |
| 216 | I | 92.2 | Very high | 89.5 | Confident | 44 Ų | 44 | 54.1 Ų | 54.1 | 23% | 0.226 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -56.5 | -48.9 | 175.5 | -67.8 | 165.7 | 0 | 0 | 0 | 110.8 | S212 S218 G219 F246 A247 A250 V306 | S212-I216 VanDerWaalsContact O-CG1 3.31Å; S212-I216 WeakPolarHBondContact O-CG1 3.31Å; S212-I216 PolarHBondContact O-N 3.47Å; I216-S218 VanDerWaalsContact C-N 3.32Å; I216-S218 PolarHBondContact O-N 2.93Å; I216-G219 PolarHBondContact O-N 3.33Å; I216-F246 HydrophobicContact CD1-CD1 4.25Å; I216-F246 HydrophobicContact CD1-CE1 4.26Å; I216-A247 HydrophobicContact CG1-CB 4.11Å; I216-A250 HydrophobicContact CB-CB 4.12Å; I216-A250 HydrophobicContact CG1-CB 3.75Å; I216-A250 HydrophobicContact CG2-CB 4.17Å; I216-V306 HydrophobicContact CD1-CG1 4.02Å |
| 217 | G | 92.5 | Very high | 89.7 | Confident | 59 Ų | 59 | 56.2 Ų | 56.2 | 61% | 0.608 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -63.6 | -37.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | K213 I214 A215 G219 G220 | K213-G217 PolarHBondContact O-N 3.21Å; I214-G217 PolarHBondContact O-N 2.89Å; A215-G217 VanDerWaalsContact C-N 3.35Å; A215-G217 PolarHBondContact O-N 3.42Å; G217-G219 VanDerWaalsContact C-N 3.29Å; G217-G219 PolarHBondContact O-N 3.41Å; G217-G220 PolarHBondContact O-N 3.5Å |
| 218 | S | 92.8 | Very high | 89.7 | Confident | 44 Ų | 44 | 59.5 Ų | 59.5 | 31% | 0.308 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -73.7 | -16.7 | -177 | 75.6 | 0 | 0 | 0 | 0 | 114.5 | I214 A215 I216 G220 K224 | I214-S218 WeakPolarHBondContact O-CB 3.35Å; I214-S218 PolarHBondContact O-N 2.93Å; I214-S218 PolarHBondContact O-OG 3.34Å; A215-S218 PolarHBondContact O-N 3.28Å; A215-S218 PolarHBondContact O-OG 2.85Å; I216-S218 VanDerWaalsContact C-N 3.32Å; I216-S218 PolarHBondContact O-N 2.93Å; S218-G220 VanDerWaalsContact C-N 3.32Å; S218-K224 WeakPolarHBondContact O-CE 3.2Å; S218-K224 VanDerWaalsContact OG-CE 3.23Å; S218-K224 WeakPolarHBondContact OG-CE 3.43Å; S218-K224 PolarHBondContact OG-NZ 2.88Å |
| 219 | G | 91.8 | Very high | 89.4 | Confident | 5 Ų | 5 | 56.3 Ų | 56.3 | 5% | 0.052 | 30% | 0.302 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -25.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | A215 I216 G217 G223 A250 E251 | A215-G219 PolarHBondContact O-N 2.93Å; I216-G219 PolarHBondContact O-N 3.33Å; G217-G219 VanDerWaalsContact C-N 3.29Å; G217-G219 PolarHBondContact O-N 3.41Å; G219-G223 CarbonylContact O-C 3.59Å; G219-G223 WeakPolarHBondContact O-CA 3.24Å; G219-G223 PolarHBondContact O-N 3.45Å; G219-A250 WeakPolarHBondContact CA-O 3.36Å; G219-E251 WeakPolarHBondContact CA-O 3.33Å |
| 220 | G | 93.8 | Very high | 89.1 | Confident | 45 Ų | 45 | 59 Ų | 59 | 46% | 0.464 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 53.3 | -146.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | G217 S218 G254 L255 | G217-G220 PolarHBondContact O-N 3.5Å; S218-G220 VanDerWaalsContact C-N 3.32Å; G220-G254 WeakPolarHBondContact O-CA 3.48Å; G220-L255 PolarHBondContact O-N 3.26Å |
| 221 | L | 94.3 | Very high | 88.3 | Confident | 123 Ų | 123 | 58.8 Ų | 58.8 | 64% | 0.644 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | -40.6 | -177.3 | -68.3 | 176.7 | 0 | 0 | 0 | 113.8 | L255 V256 | L221-L255 HydrophobicContact CD2-CB 4.16Å; L221-L255 HydrophobicContact CD2-CD2 3.58Å; L221-L255 PolarHBondContact O-N 3.4Å; L221-V256 WeakPolarHBondContact O-CG2 3.4Å; L221-V256 PolarHBondContact O-N 3.49Å |
| 222 | R | 92.7 | Very high | 87 | Confident | 225 Ų | 225 | 57.4 Ų | 57.4 | 85% | 0.849 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.1 | -8.4 | -171 | -72.1 | -174.4 | 172.4 | 160 | -1.5 | 114.6 | L253 | R222-L253 CarbonylContact C-O 3.47Š|
| 223 | G | 92.5 | Very high | 85.5 | Confident | 21 Ų | 21 | 60 Ų | 60 | 22% | 0.216 | 32% | 0.323 | C | S | . | . | trans | 81.2 | 169.9 | -171.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | G219 G225 E251 E252 G254 | G219-G223 CarbonylContact O-C 3.59Å; G219-G223 WeakPolarHBondContact O-CA 3.24Å; G219-G223 PolarHBondContact O-N 3.45Å; G223-G225 VanDerWaalsContact C-N 3.25Å; G223-E251 WeakPolarHBondContact CA-O 3.45Å; G223-E252 WeakPolarHBondContact CA-O 3.34Å; G223-G254 VanDerWaalsContact CA-N 3.26Å; G223-G254 VanDerWaalsContact N-CA 3.33Å | ||
| 224 | K | 90.9 | Very high | 83.9 | Confident | 70 Ų | 70 | 61.4 Ų | 61.4 | 30% | 0.304 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -77.8 | -12.3 | 171.1 | -65.6 | -178.2 | -177 | 164.2 | 0 | 113.1 | S218 H228 T230 E251 E252 | S218-K224 WeakPolarHBondContact O-CE 3.2Å; S218-K224 VanDerWaalsContact OG-CE 3.23Å; S218-K224 WeakPolarHBondContact OG-CE 3.43Å; S218-K224 PolarHBondContact OG-NZ 2.88Å; K224-H228 WeakPolarHBondContact CB-O 3.41Å; K224-T230 HydrophobicContact CD-CG2 4.27Å; K224-T230 PolarHBondContact NZ-OG1 3.42Å; K224-E251 HydrophobicContact CD-CG 3.94Å; K224-E251 PolarHBondContact N-O 3.04Å; K224-E251 IonicContact NZ-OE1 3.84Å; K224-E251 PolarHBondContact NZ-OE1 3.12Å; K224-E252 PolarHBondContact N-O 3.25Å |
| 225 | G | 89.7 | Confident | 82.6 | Confident | 27 Ų | 27 | 64.4 Ų | 64.4 | 28% | 0.278 | 35% | 0.345 | S | S | . | . | trans | 106.7 | 147 | -172.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | G223 L227 H228 E252 | G223-G225 VanDerWaalsContact C-N 3.25Å; G225-L227 PolarHBondContact O-N 2.92Å; G225-H228 WeakPolarHBondContact O-CB 3.42Å; G225-H228 PolarHBondContact O-N 3.36Å; G225-E252 CarbonylContact C-O 3.31Å; G225-E252 WeakPolarHBondContact CA-O 3.27Å; G225-E252 PolarHBondContact N-O 3.44Å | ||
| 226 | W | 87.5 | Confident | 81.2 | Confident | 112 Ų | 112 | 68.4 Ų | 68.4 | 42% | 0.424 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.7 | 134.3 | 175.9 | -171.4 | 52.3 | 0 | 0 | 0 | 110 | L14 W17 H228 | L14-W226 HydrophobicContact CD2-CZ2 4.36Å; L14-W226 PolarHBondContact O-NE1 2.79Å; W17-W226 HydrophobicContact CB-CZ2 4.37Å; W17-W226 AromaticContact CD1-CH2 3.72Å; W17-W226 AromaticContact CD1-CZ2 3.39Å; W17-W226 HydrophobicContact CG-CZ2 4.21Å; W226-H228 PolarHBondContact O-N 3.44Å; W226-H228 PolarHBondContact O-ND1 2.88Å |
| 227 | L | 85.9 | Confident | 79.8 | Confident | 44 Ų | 44 | 66.5 Ų | 66.5 | 23% | 0.23 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 67 | 5.7 | -173.4 | -58.3 | 158.9 | 0 | 0 | 0 | 116.2 | S18 Q22 G225 | S18-L227 WeakPolarHBondContact OG-CA 3.1Å; S18-L227 PolarHBondContact OG-N 2.87Å; S18-L227 VanDerWaalsContact OG-N 3.16Å; Q22-L227 HydrophobicContact CG-CD2 3.67Å; G225-L227 PolarHBondContact O-N 2.92Å |
| 228 | H | 83.5 | Confident | 78.3 | Confident | 127 Ų | 127 | 65.6 Ų | 65.6 | 59% | 0.588 | 34% | 0.337 | S | S | * | . | trans | -112.9 | 19.9 | -178.7 | -62.5 | 80 | 0 | 0 | 0 | 112.8 | K224 G225 W226 T230 | K224-H228 WeakPolarHBondContact CB-O 3.41Å; G225-H228 WeakPolarHBondContact O-CB 3.42Å; G225-H228 PolarHBondContact O-N 3.36Å; W226-H228 PolarHBondContact O-N 3.44Å; W226-H228 PolarHBondContact O-ND1 2.88Å; H228-T230 PolarHBondContact O-N 3.28Å | ||
| 229 | G | 76.8 | Confident | 77.1 | Confident | 2 Ų | 2 | 67.1 Ų | 67.1 | 2% | 0.021 | 34% | 0.339 | C | S | . | . | trans | -69.7 | 122.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | S232 Q233 | G229-S232 WeakPolarHBondContact CA-OG 3.41Å; G229-S232 PolarHBondContact O-OG 3.18Å; G229-Q233 WeakPolarHBondContact O-CB 3.5Å; G229-Q233 WeakPolarHBondContact O-CG 3.35Å; G229-Q233 PolarHBondContact O-N 3.01Å | ||
| 230 | T | 76.9 | Confident | 76 | Confident | 62 Ų | 62 | 67.9 Ų | 67.9 | 38% | 0.38 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -78.7 | -40 | -177.1 | 58.5 | 0 | 0 | 0 | 0 | 111 | K224 H228 L234 E251 | K224-T230 HydrophobicContact CD-CG2 4.27Å; K224-T230 PolarHBondContact NZ-OG1 3.42Å; H228-T230 PolarHBondContact O-N 3.28Å; T230-L234 WeakPolarHBondContact O-CB 3.35Å; T230-L234 WeakPolarHBondContact O-CD1 3.23Å; T230-L234 WeakPolarHBondContact O-CG 3.45Å; T230-L234 PolarHBondContact O-N 2.92Å; T230-E251 PolarHBondContact N-OE1 2.96Å; T230-E251 PolarHBondContact OG1-OE1 2.77Å; T230-E251 VanDerWaalsContact OG1-OE1 3.05Å |
| 231 | Q | 71.5 | Confident | 74.7 | Confident | 33 Ų | 33 | 67.3 Ų | 67.3 | 15% | 0.154 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -79.5 | -37.5 | 178.9 | -56.1 | -59.5 | -11 | 0 | 0 | 111.1 | I214 A215 F236 L237 E251 | I214-Q231 HydrophobicContact CG2-CG 4.39Å; A215-Q231 HydrophobicContact CB-CB 3.99Å; A215-Q231 HydrophobicContact CB-CG 4.19Å; Q231-F236 PolarHBondContact O-N 3.38Å; Q231-L237 HydrophobicContact CB-CD1 3.67Å; Q231-E251 PolarHBondContact N-OE1 2.83Å; Q231-E251 PolarHBondContact N-OE2 3.04Å |
| 232 | S | 61.8 | Low | 74.1 | Confident | 0 Ų | 0 | 62.6 Ų | 62.6 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.9 | -48.3 | 175.8 | 70.5 | 0 | 0 | 0 | 0 | 112.4 | G229 R240 E251 E252 | G229-S232 WeakPolarHBondContact CA-OG 3.41Å; G229-S232 PolarHBondContact O-OG 3.18Å; S232-R240 WeakPolarHBondContact O-CD 3.33Å; S232-R240 PolarHBondContact O-NH1 3.49Å; S232-E251 PolarHBondContact N-OE2 3.02Å; S232-E252 PolarHBondContact OG-OE1 3.48Å |
| 233 | Q | 57 | Low | 73.6 | Confident | 55 Ų | 55 | 53.3 Ų | 53.3 | 26% | 0.257 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -78.8 | -33.6 | -173 | -61.8 | -63.6 | -29.2 | 0 | 0 | 113.3 | S18 G229 E235 R240 | S18-Q233 PolarHBondContact O-NE2 3Å; S18-Q233 PolarHBondContact OG-NE2 3.14Å; G229-Q233 WeakPolarHBondContact O-CB 3.5Å; G229-Q233 WeakPolarHBondContact O-CG 3.35Å; G229-Q233 PolarHBondContact O-N 3.01Å; Q233-E235 PolarHBondContact O-N 3.22Å; Q233-R240 PolarHBondContact O-NH1 2.93Å |
| 234 | L | 56.3 | Low | 73.3 | Confident | 113 Ų | 113 | 52.6 Ų | 52.6 | 59% | 0.592 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | 15.4 | -179.7 | -59.9 | 174.3 | 0 | 0 | 0 | 113.8 | T230 F236 | T230-L234 WeakPolarHBondContact O-CB 3.35Å; T230-L234 WeakPolarHBondContact O-CD1 3.23Å; T230-L234 WeakPolarHBondContact O-CG 3.45Å; T230-L234 PolarHBondContact O-N 2.92Å; L234-F236 HydrophobicContact CB-CD2 3.55Å; L234-F236 HydrophobicContact CB-CE2 3.4Å; L234-F236 HydrophobicContact CB-CZ 4.28Å; L234-F236 HydrophobicContact CD1-CD2 4.4Å; L234-F236 HydrophobicContact CD1-CE2 3.71Å; L234-F236 HydrophobicContact CG-CE2 4.2Å; L234-F236 PolarHBondContact O-N 2.86Å; L234-F236 VanDerWaalsContact O-N 3.1Å |
| 235 | E | 64.7 | Low | 73.3 | Confident | 141 Ų | 141 | 49.2 Ų | 49.2 | 66% | 0.659 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 63 | 16 | 174.2 | -70.4 | -177.3 | 175.3 | 0 | 0 | 115.6 | Q233 L237 R240 | Q233-E235 PolarHBondContact O-N 3.22Å; E235-L237 PolarHBondContact O-N 2.8Å; E235-R240 VanDerWaalsContact CG-CZ 3.42Å; E235-R240 IonicContact OE1-CZ 3.74Å; E235-R240 IonicContact OE1-NH1 2.85Å; E235-R240 IonicContact OE1-NH2 3.73Å; E235-R240 PolarHBondContact OE1-NH2 3.43Å |
| 236 | F | 59.4 | Low | 73.5 | Confident | 84 Ų | 84 | 48.4 Ų | 48.4 | 37% | 0.368 | 23% | 0.234 | S | C | . | . | trans | -72.5 | -16.4 | 175.8 | -64.5 | -58.5 | 0 | 0 | 0 | 113.6 | Y207 Q231 L234 P238 | Y207-F236 WeakPolarHBondContact CE1-O 3.49Å; Y207-F236 WeakPolarHBondContact OH-CD1 3.24Å; Y207-F236 PolarHBondContact OH-O 3.39Å; Q231-F236 PolarHBondContact O-N 3.38Å; L234-F236 HydrophobicContact CB-CD2 3.55Å; L234-F236 HydrophobicContact CB-CE2 3.4Å; L234-F236 HydrophobicContact CB-CZ 4.28Å; L234-F236 HydrophobicContact CD1-CD2 4.4Å; L234-F236 HydrophobicContact CD1-CE2 3.71Å; L234-F236 HydrophobicContact CG-CE2 4.2Å; L234-F236 PolarHBondContact O-N 2.86Å; L234-F236 VanDerWaalsContact O-N 3.1Å; F236-P238 VanDerWaalsContact O-CD 3.3Å; F236-P238 WeakPolarHBondContact O-CD 3.26Å | ||
| 237 | L | 64.7 | Low | 73.7 | Confident | 4 Ų | 4 | 43 Ų | 43 | 2% | 0.021 | 21% | 0.214 | C | C | . | . | S | Bend | trans | -101.4 | 104.4 | 172.7 | -95.4 | 133.5 | 0 | 0 | 0 | 110.9 | Q211 A215 Q231 E235 R240 F244 A247 | Q211-L237 HydrophobicContact CB-CG 4.26Å; A215-L237 HydrophobicContact CB-CD1 3.62Å; Q231-L237 HydrophobicContact CB-CD1 3.67Å; E235-L237 PolarHBondContact O-N 2.8Å; L237-R240 HydrophobicContact CB-CB 4.09Å; L237-R240 WeakPolarHBondContact O-CB 3.16Å; L237-F244 HydrophobicContact CD2-CB 3.72Å; L237-F244 HydrophobicContact CD2-CD1 4Å; L237-F244 HydrophobicContact CD2-CG 4.04Å; L237-A247 HydrophobicContact CD2-CB 4.09Å |
| 238 | P | 59.1 | Low | 74 | Confident | 41 Ų | 41 | 41 Ų | 41 | 27% | 0.266 | 20% | 0.203 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | 147.4 | 169.6 | -22.7 | 37.4 | 0 | 0 | 0 | 110 | Y207 H208 F236 R240 | Y207-P238 HydrophobicContact CE1-CG 4.46Å; H208-P238 VanDerWaalsContact CE1-CB 3.47Å; H208-P238 WeakPolarHBondContact CE1-CB 3.4Å; H208-P238 WeakPolarHBondContact NE2-CG 3.38Å; F236-P238 VanDerWaalsContact O-CD 3.3Å; F236-P238 WeakPolarHBondContact O-CD 3.26Å; P238-R240 PolarHBondContact O-N 3.28Å; P238-R240 VanDerWaalsContact O-N 3.14Å |
| 239 | E | 69.5 | Low | 74.4 | Confident | 75 Ų | 75 | 35 Ų | 35 | 35% | 0.35 | 18% | 0.175 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 57.5 | 28.9 | 177.4 | -62.3 | -58.8 | 147 | 0 | 0 | 113.7 | K78 H241 T242 D243 F244 | K78-E239 IonicContact NZ-OE1 2.54Å; K78-E239 PolarHBondContact NZ-OE1 3.38Å; E239-H241 PolarHBondContact O-N 3.02Å; E239-T242 VanDerWaalsContact CB-OG1 3.25Å; E239-T242 WeakPolarHBondContact CB-OG1 3.41Å; E239-T242 CarbonylContact O-C 3.49Å; E239-T242 PolarHBondContact O-N 3.28Å; E239-T242 PolarHBondContact O-OG1 2.83Å; E239-T242 VanDerWaalsContact O-OG1 3.05Å; E239-T242 PolarHBondContact OE2-OG1 2.58Å; E239-D243 PolarHBondContact O-N 3.34Å; E239-F244 HydrophobicContact CB-CD2 4.31Å; E239-F244 PolarHBondContact O-N 3.42Å |
| 240 | R | 67.5 | Low | 75.3 | Confident | 21 Ų | 21 | 34.9 Ų | 34.9 | 8% | 0.079 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -26.4 | 179 | 58.5 | -179.3 | -176.3 | -167.4 | -5.2 | 114.7 | A19 S232 Q233 E235 L237 P238 I245 V248 | A19-R240 PolarHBondContact O-NE 3.49Å; S232-R240 WeakPolarHBondContact O-CD 3.33Å; S232-R240 PolarHBondContact O-NH1 3.49Å; Q233-R240 PolarHBondContact O-NH1 2.93Å; E235-R240 VanDerWaalsContact CG-CZ 3.42Å; E235-R240 IonicContact OE1-CZ 3.74Å; E235-R240 IonicContact OE1-NH1 2.85Å; E235-R240 IonicContact OE1-NH2 3.73Å; E235-R240 PolarHBondContact OE1-NH2 3.43Å; L237-R240 HydrophobicContact CB-CB 4.09Å; L237-R240 WeakPolarHBondContact O-CB 3.16Å; P238-R240 PolarHBondContact O-N 3.28Å; P238-R240 VanDerWaalsContact O-N 3.14Å; R240-I245 WeakPolarHBondContact O-CA 3.31Å; R240-I245 WeakPolarHBondContact O-CB 3.38Å; R240-I245 PolarHBondContact O-N 2.98Å; R240-V248 HydrophobicContact CB-CG2 3.85Å |
| 241 | H | 67 | Low | 76.1 | Confident | 33 Ų | 33 | 32 Ų | 32 | 15% | 0.153 | 16% | 0.157 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88.9 | -13.5 | 177.3 | -34.4 | -74.4 | 0 | 0 | 0 | 112.9 | A19 S20 M26 E239 Y322 | A19-H241 PolarHBondContact O-CE1 3.4Å; A19-H241 PolarHBondContact O-ND1 3.19Å; S20-H241 WeakPolarHBondContact CA-CE1 3.45Å; S20-H241 VanDerWaalsContact CA-ND1 3.33Å; S20-H241 WeakPolarHBondContact CA-ND1 3.31Å; S20-H241 PolarHBondContact N-CE1 3.31Å; S20-H241 PolarHBondContact N-ND1 2.81Å; M26-H241 HydrophobicContact SD-CB 3.97Å; E239-H241 PolarHBondContact O-N 3.02Å; H241-Y322 VanDerWaalsContact O-CB 3.31Å; H241-Y322 WeakPolarHBondContact O-CB 3.47Å; H241-Y322 PolarHBondContact O-N 3.12Å |
| 242 | T | 81.2 | Confident | 77.2 | Confident | 25 Ų | 25 | 30.5 Ų | 30.5 | 15% | 0.153 | 15% | 0.15 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -113.6 | -100.9 | -174.9 | 50 | 0 | 0 | 0 | 0 | 108.6 | E239 F244 S321 Y322 | E239-T242 VanDerWaalsContact CB-OG1 3.25Å; E239-T242 WeakPolarHBondContact CB-OG1 3.41Å; E239-T242 CarbonylContact O-C 3.49Å; E239-T242 PolarHBondContact O-N 3.28Å; E239-T242 PolarHBondContact O-OG1 2.83Å; E239-T242 VanDerWaalsContact O-OG1 3.05Å; E239-T242 PolarHBondContact OE2-OG1 2.58Å; T242-F244 PolarHBondContact O-N 3.43Å; T242-S321 VanDerWaalsContact O-CB 3.24Å; T242-S321 WeakPolarHBondContact O-CB 3.47Å; T242-S321 PolarHBondContact O-OG 3.23Å; T242-Y322 HydrophobicContact CG2-CD1 4.49Å |
| 243 | D | 81.5 | Confident | 78.8 | Confident | 30 Ų | 30 | 32.8 Ų | 32.8 | 16% | 0.16 | 16% | 0.162 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71 | -33.3 | -167.4 | -62 | -22.2 | 0 | 0 | 0 | 112.9 | E239 N302 V306 G314 | E239-D243 PolarHBondContact O-N 3.34Å; D243-N302 PolarHBondContact O-ND2 2.72Å; D243-V306 WeakPolarHBondContact O-CG2 3.28Å; D243-G314 WeakPolarHBondContact OD2-CA 3.44Å |
| 244 | F | 87.2 | Confident | 80.6 | Confident | 5 Ų | 5 | 30.2 Ų | 30.2 | 2% | 0.022 | 15% | 0.15 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -100.1 | 14.3 | -174 | -71.6 | -88.6 | 0 | 0 | 0 | 114.2 | H208 L237 E239 T242 F246 A247 V248 V306 V312 | H208-F244 HydrophobicContact CB-CE1 4.48Å; H208-F244 HydrophobicContact CB-CE2 4.26Å; H208-F244 HydrophobicContact CB-CZ 3.89Å; L237-F244 HydrophobicContact CD2-CB 3.72Å; L237-F244 HydrophobicContact CD2-CD1 4Å; L237-F244 HydrophobicContact CD2-CG 4.04Å; E239-F244 HydrophobicContact CB-CD2 4.31Å; E239-F244 PolarHBondContact O-N 3.42Å; T242-F244 PolarHBondContact O-N 3.43Å; F244-F246 PolarHBondContact O-N 2.96Å; F244-F246 VanDerWaalsContact O-N 3.12Å; F244-A247 WeakPolarHBondContact O-CB 3.45Å; F244-A247 PolarHBondContact O-N 2.91Å; F244-V248 PolarHBondContact O-N 2.94Å; F244-V306 HydrophobicContact CD1-CB 4.48Å; F244-V306 HydrophobicContact CD1-CG1 4.04Å; F244-V306 HydrophobicContact CD1-CG2 4.13Å; F244-V312 HydrophobicContact CE2-CG1 4.38Å; F244-V312 HydrophobicContact CZ-CG1 4.13Å; F244-V312 HydrophobicContact CZ-CG2 4.23Å |
| 245 | I | 90.7 | Very high | 82.5 | Confident | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.9 | -27.2 | -179.9 | -162.9 | 161.5 | 0 | 0 | 0 | 113.4 | V15 I16 R240 A247 V248 L249 L317 V320 S321 | V15-I245 HydrophobicContact CG1-CD1 3.97Å; V15-I245 HydrophobicContact CG1-CG1 3.69Å; I16-I245 HydrophobicContact CD1-CD1 3.28Å; I16-I245 HydrophobicContact CG1-CD1 3.83Å; R240-I245 WeakPolarHBondContact O-CA 3.31Å; R240-I245 WeakPolarHBondContact O-CB 3.38Å; R240-I245 PolarHBondContact O-N 2.98Å; I245-A247 VanDerWaalsContact C-N 3.28Å; I245-A247 PolarHBondContact O-N 3.08Å; I245-V248 WeakPolarHBondContact O-CB 3.48Å; I245-V248 PolarHBondContact O-N 3.21Å; I245-L249 PolarHBondContact O-N 3.26Å; I245-L317 HydrophobicContact CG2-CB 3.96Å; I245-L317 HydrophobicContact CG2-CD2 4.06Å; I245-V320 HydrophobicContact CD1-CG1 4.04Å; I245-V320 HydrophobicContact CG1-CG1 4.29Å; I245-V320 HydrophobicContact CG2-CG1 3.97Å; I245-S321 WeakPolarHBondContact CG2-OG 3.18Å |
| 246 | F | 92.9 | Very high | 84 | Confident | 9 Ų | 9 | 25.8 Ų | 25.8 | 4% | 0.039 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -62.6 | -35.9 | 174.4 | -179.1 | -95.3 | 0 | 0 | 0 | 112 | I216 F244 L249 A250 I258 L261 I303 V306 L317 | I216-F246 HydrophobicContact CD1-CD1 4.25Å; I216-F246 HydrophobicContact CD1-CE1 4.26Å; F244-F246 PolarHBondContact O-N 2.96Å; F244-F246 VanDerWaalsContact O-N 3.12Å; F246-L249 PolarHBondContact O-N 2.87Å; F246-A250 WeakPolarHBondContact O-CB 3.42Å; F246-A250 PolarHBondContact O-N 3.43Å; F246-I258 HydrophobicContact CE1-CD1 4.49Å; F246-I258 HydrophobicContact CE2-CG1 4.23Å; F246-I258 HydrophobicContact CE2-CG2 3.89Å; F246-I258 HydrophobicContact CZ-CD1 4.02Å; F246-I258 HydrophobicContact CZ-CG1 4.07Å; F246-I258 HydrophobicContact CZ-CG2 3.75Å; F246-L261 HydrophobicContact CD2-CD2 4.11Å; F246-L261 HydrophobicContact CE2-CD2 4.32Å; F246-I303 HydrophobicContact CD1-CG2 4.49Å; F246-I303 HydrophobicContact CD2-CD1 4.15Å; F246-I303 HydrophobicContact CD2-CG1 3.79Å; F246-I303 HydrophobicContact CE1-CG2 3.95Å; F246-I303 HydrophobicContact CE2-CD1 3.78Å; F246-I303 HydrophobicContact CE2-CG1 3.8Å; F246-I303 HydrophobicContact CE2-CG2 4.26Å; F246-I303 HydrophobicContact CG-CG1 4.2Å; F246-I303 HydrophobicContact CZ-CD1 4.34Å; F246-I303 HydrophobicContact CZ-CG1 4.22Å; F246-I303 HydrophobicContact CZ-CG2 3.82Å; F246-V306 HydrophobicContact CB-CB 4.4Å; F246-V306 HydrophobicContact CB-CG1 4.09Å; F246-V306 HydrophobicContact CB-CG2 4.43Å; F246-V306 HydrophobicContact CD1-CB 4.29Å; F246-V306 HydrophobicContact CD1-CG1 3.97Å; F246-L317 HydrophobicContact CB-CD2 4.23Å; F246-L317 HydrophobicContact CD2-CD2 4.42Å |
| 247 | A | 92.6 | Very high | 85.7 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -68.3 | -38.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | A215 I216 L237 F244 I245 A250 E251 V306 | A215-A247 HydrophobicContact CB-CB 4.27Å; I216-A247 HydrophobicContact CG1-CB 4.11Å; L237-A247 HydrophobicContact CD2-CB 4.09Å; F244-A247 WeakPolarHBondContact O-CB 3.45Å; F244-A247 PolarHBondContact O-N 2.91Å; I245-A247 VanDerWaalsContact C-N 3.28Å; I245-A247 PolarHBondContact O-N 3.08Å; A247-A250 PolarHBondContact O-N 3.36Å; A247-E251 WeakPolarHBondContact O-CB 3.47Å; A247-E251 PolarHBondContact O-N 3.49Å; A247-V306 HydrophobicContact CB-CG1 3.71Å |
| 248 | V | 91.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -61.5 | -48 | 173.9 | -179.4 | 0 | 0 | 0 | 0 | 110.6 | A19 R240 F244 I245 A250 E251 E252 | A19-V248 HydrophobicContact CB-CG1 4.02Å; A19-V248 HydrophobicContact CB-CG2 4.43Å; R240-V248 HydrophobicContact CB-CG2 3.85Å; F244-V248 PolarHBondContact O-N 2.94Å; I245-V248 WeakPolarHBondContact O-CB 3.48Å; I245-V248 PolarHBondContact O-N 3.21Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 2.91Å; V248-E251 PolarHBondContact O-N 2.94Å; V248-E252 HydrophobicContact CG1-CG 4.37Å; V248-E252 WeakPolarHBondContact CG1-OE1 3.47Å; V248-E252 WeakPolarHBondContact O-CB 3.37Å; V248-E252 WeakPolarHBondContact O-CG 3.32Å; V248-E252 PolarHBondContact O-N 3.48Å |
| 249 | L | 93.4 | Very high | 89 | Confident | 1 Ų | 1 | 25.5 Ų | 25.5 | 1% | 0.005 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -60.2 | -43.8 | 177.5 | -175.8 | 157.9 | 0 | 0 | 0 | 111.5 | Y11 V15 I245 F246 L253 I258 L261 | Y11-L249 HydrophobicContact CE1-CD1 3.67Å; V15-L249 HydrophobicContact CG1-CB 4.21Å; V15-L249 HydrophobicContact CG1-CD1 4.49Å; V15-L249 HydrophobicContact CG2-CD1 3.98Å; V15-L249 HydrophobicContact CG2-CG 4.39Å; I245-L249 PolarHBondContact O-N 3.26Å; F246-L249 PolarHBondContact O-N 2.87Å; L249-L253 HydrophobicContact CG-CD1 4.41Å; L249-L253 WeakPolarHBondContact O-CB 3.19Å; L249-L253 PolarHBondContact O-N 3.04Å; L249-I258 HydrophobicContact CD2-CB 4.39Å; L249-I258 HydrophobicContact CD2-CG1 3.7Å; L249-L261 HydrophobicContact CD1-CB 4.5Å; L249-L261 HydrophobicContact CD1-CD1 4.48Å; L249-L261 HydrophobicContact CD1-CD2 3.8Å; L249-L261 HydrophobicContact CD1-CG 4.48Å |
| 250 | A | 94.7 | Very high | 90.4 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.008 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.4 | -43.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | I216 G219 F246 A247 V248 G254 I258 | I216-A250 HydrophobicContact CB-CB 4.12Å; I216-A250 HydrophobicContact CG1-CB 3.75Å; I216-A250 HydrophobicContact CG2-CB 4.17Å; G219-A250 WeakPolarHBondContact CA-O 3.36Å; F246-A250 WeakPolarHBondContact O-CB 3.42Å; F246-A250 PolarHBondContact O-N 3.43Å; A247-A250 PolarHBondContact O-N 3.36Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 2.91Å; A250-G254 WeakPolarHBondContact O-CA 3.18Å; A250-G254 PolarHBondContact O-N 3.4Å; A250-I258 HydrophobicContact CB-CD1 3.54Å; A250-I258 HydrophobicContact CB-CG1 4.12Å |
| 251 | E | 94.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -65.6 | -44.8 | 179 | -176.3 | 173.6 | -156.8 | 0 | 0 | 112 | A215 G219 G223 K224 T230 Q231 S232 A247 V248 | A215-E251 HydrophobicContact CB-CB 4.23Å; G219-E251 WeakPolarHBondContact CA-O 3.33Å; G223-E251 WeakPolarHBondContact CA-O 3.45Å; K224-E251 HydrophobicContact CD-CG 3.94Å; K224-E251 PolarHBondContact N-O 3.04Å; K224-E251 IonicContact NZ-OE1 3.84Å; K224-E251 PolarHBondContact NZ-OE1 3.12Å; T230-E251 PolarHBondContact N-OE1 2.96Å; T230-E251 PolarHBondContact OG1-OE1 2.77Å; T230-E251 VanDerWaalsContact OG1-OE1 3.05Å; Q231-E251 PolarHBondContact N-OE1 2.83Å; Q231-E251 PolarHBondContact N-OE2 3.04Å; S232-E251 PolarHBondContact N-OE2 3.02Å; A247-E251 WeakPolarHBondContact O-CB 3.47Å; A247-E251 PolarHBondContact O-N 3.49Å; V248-E251 PolarHBondContact O-N 2.94Å |
| 252 | E | 94 | Very high | 93.2 | Very high | 3 Ų | 3 | 26.1 Ų | 26.1 | 1% | 0.014 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -83.9 | -38.5 | -171.7 | -68.2 | -178.3 | -177.5 | 0 | 0 | 113.7 | S18 G223 K224 G225 S232 V248 | S18-E252 WeakPolarHBondContact CB-OE2 3.42Å; S18-E252 PolarHBondContact OG-OE1 3.29Å; S18-E252 PolarHBondContact OG-OE2 3.11Å; G223-E252 WeakPolarHBondContact CA-O 3.34Å; K224-E252 PolarHBondContact N-O 3.25Å; G225-E252 CarbonylContact C-O 3.31Å; G225-E252 WeakPolarHBondContact CA-O 3.27Å; G225-E252 PolarHBondContact N-O 3.44Å; S232-E252 PolarHBondContact OG-OE1 3.48Å; V248-E252 HydrophobicContact CG1-CG 4.37Å; V248-E252 WeakPolarHBondContact CG1-OE1 3.47Å; V248-E252 WeakPolarHBondContact O-CB 3.37Å; V248-E252 WeakPolarHBondContact O-CG 3.32Å; V248-E252 PolarHBondContact O-N 3.48Å |
| 253 | L | 95.1 | Very high | 94 | Very high | 48 Ų | 48 | 27.2 Ų | 27.2 | 25% | 0.251 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -111.7 | -5.1 | -174.6 | -56.3 | 178.1 | 0 | 0 | 0 | 113.4 | Y11 R222 L249 G257 | Y11-L253 HydrophobicContact CE2-CD1 3.65Å; Y11-L253 WeakPolarHBondContact OH-CD1 3.47Å; R222-L253 CarbonylContact C-O 3.47Å; L249-L253 HydrophobicContact CG-CD1 4.41Å; L249-L253 WeakPolarHBondContact O-CB 3.19Å; L249-L253 PolarHBondContact O-N 3.04Å; L253-G257 PolarHBondContact O-N 3.41Å; L253-G257 VanDerWaalsContact O-N 3.13Å |
| 254 | G | 95.2 | Very high | 94.8 | Very high | 1 Ų | 1 | 27.1 Ų | 27.1 | 1% | 0.01 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | 64.4 | -163.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | G220 G223 A250 V256 G257 I258 | G220-G254 WeakPolarHBondContact O-CA 3.48Å; G223-G254 VanDerWaalsContact CA-N 3.26Å; G223-G254 VanDerWaalsContact N-CA 3.33Å; A250-G254 WeakPolarHBondContact O-CA 3.18Å; A250-G254 PolarHBondContact O-N 3.4Å; G254-V256 VanDerWaalsContact C-N 3.26Å; G254-V256 PolarHBondContact O-N 3.44Å; G254-G257 PolarHBondContact O-N 3.27Å; G254-I258 WeakPolarHBondContact O-CG1 3.32Å; G254-I258 PolarHBondContact O-N 2.82Å |
| 255 | L | 96.3 | Very high | 95.4 | Very high | 78 Ų | 78 | 27 Ų | 27 | 41% | 0.408 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -57 | -38.6 | 177.3 | -176 | 61.2 | 0 | 0 | 0 | 112.5 | G220 L221 G257 I258 L259 | G220-L255 PolarHBondContact O-N 3.26Å; L221-L255 HydrophobicContact CD2-CB 4.16Å; L221-L255 HydrophobicContact CD2-CD2 3.58Å; L221-L255 PolarHBondContact O-N 3.4Å; L255-G257 PolarHBondContact O-N 3.43Å; L255-I258 PolarHBondContact O-N 3.47Å; L255-L259 HydrophobicContact CD1-CD1 4.47Å; L255-L259 HydrophobicContact CD1-CG 4.23Å; L255-L259 HydrophobicContact CG-CD1 4.03Å; L255-L259 HydrophobicContact CG-CG 4.24Å; L255-L259 WeakPolarHBondContact O-CB 3.29Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.27Å; L255-L259 PolarHBondContact O-N 3.42Å |
| 256 | V | 96.2 | Very high | 95.7 | Very high | 83 Ų | 83 | 31.6 Ų | 31.6 | 50% | 0.503 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61.5 | -46.2 | 179.6 | 174.9 | 0 | 0 | 0 | 0 | 111.2 | L221 G254 I258 L259 I260 | L221-V256 WeakPolarHBondContact O-CG2 3.4Å; L221-V256 PolarHBondContact O-N 3.49Å; G254-V256 VanDerWaalsContact C-N 3.26Å; G254-V256 PolarHBondContact O-N 3.44Å; V256-I258 VanDerWaalsContact C-N 3.33Å; V256-I258 PolarHBondContact O-N 3.46Å; V256-L259 PolarHBondContact O-N 3.37Å; V256-I260 HydrophobicContact CG1-CD1 4.08Å; V256-I260 WeakPolarHBondContact O-CG1 3.46Å; V256-I260 PolarHBondContact O-N 2.9Å |
| 257 | G | 96 | Very high | 96 | Very high | 4 Ų | 4 | 35.5 Ų | 35.5 | 4% | 0.041 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -62.3 | -39 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y11 L253 G254 L255 I260 L261 | Y11-G257 WeakPolarHBondContact OH-CA 3.38Å; Y11-G257 PolarHBondContact OH-O 3.23Å; L253-G257 PolarHBondContact O-N 3.41Å; L253-G257 VanDerWaalsContact O-N 3.13Å; G254-G257 PolarHBondContact O-N 3.27Å; L255-G257 PolarHBondContact O-N 3.43Å; G257-I260 PolarHBondContact O-N 2.87Å; G257-L261 PolarHBondContact O-N 3.33Å; G257-L261 VanDerWaalsContact O-N 3.08Å |
| 258 | I | 96.5 | Very high | 96.2 | Very high | 20 Ų | 20 | 35.5 Ų | 35.5 | 10% | 0.103 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.1 | -45.2 | 174.9 | -64.5 | 170.1 | 0 | 0 | 0 | 110.8 | F246 L249 A250 G254 L255 V256 I260 L261 L262 | F246-I258 HydrophobicContact CE1-CD1 4.49Å; F246-I258 HydrophobicContact CE2-CG1 4.23Å; F246-I258 HydrophobicContact CE2-CG2 3.89Å; F246-I258 HydrophobicContact CZ-CD1 4.02Å; F246-I258 HydrophobicContact CZ-CG1 4.07Å; F246-I258 HydrophobicContact CZ-CG2 3.75Å; L249-I258 HydrophobicContact CD2-CB 4.39Å; L249-I258 HydrophobicContact CD2-CG1 3.7Å; A250-I258 HydrophobicContact CB-CD1 3.54Å; A250-I258 HydrophobicContact CB-CG1 4.12Å; G254-I258 WeakPolarHBondContact O-CG1 3.32Å; G254-I258 PolarHBondContact O-N 2.82Å; L255-I258 PolarHBondContact O-N 3.47Å; V256-I258 VanDerWaalsContact C-N 3.33Å; V256-I258 PolarHBondContact O-N 3.46Å; I258-I260 VanDerWaalsContact C-N 3.31Å; I258-I260 PolarHBondContact O-N 2.95Å; I258-L261 WeakPolarHBondContact O-CB 3.27Å; I258-L261 PolarHBondContact O-N 3.5Å; I258-L261 VanDerWaalsContact O-N 3.15Å; I258-L262 HydrophobicContact CG2-CD1 3.88Å; I258-L262 HydrophobicContact CG2-CG 4.18Å; I258-L262 WeakPolarHBondContact O-CG 3.22Å; I258-L262 PolarHBondContact O-N 3.43Å |
| 259 | L | 97 | Very high | 96.6 | Very high | 98 Ų | 98 | 36.5 Ų | 36.5 | 51% | 0.513 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.8 | -38.6 | 179.7 | -72.7 | 174.8 | 0 | 0 | 0 | 111.8 | L255 V256 L262 A263 | L255-L259 HydrophobicContact CD1-CD1 4.47Å; L255-L259 HydrophobicContact CD1-CG 4.23Å; L255-L259 HydrophobicContact CG-CD1 4.03Å; L255-L259 HydrophobicContact CG-CG 4.24Å; L255-L259 WeakPolarHBondContact O-CB 3.29Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.27Å; L255-L259 PolarHBondContact O-N 3.42Å; V256-L259 PolarHBondContact O-N 3.37Å; L259-L262 PolarHBondContact O-N 3.34Å; L259-A263 VanDerWaalsContact O-CB 3.23Å; L259-A263 WeakPolarHBondContact O-CB 3.43Å; L259-A263 PolarHBondContact O-N 2.65Å |
| 260 | I | 97.3 | Very high | 96.8 | Very high | 87 Ų | 87 | 42 Ų | 42 | 45% | 0.446 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.5 | -46.3 | 173.2 | -68.1 | 166 | 0 | 0 | 0 | 110.3 | V256 G257 I258 A263 L264 | V256-I260 HydrophobicContact CG1-CD1 4.08Å; V256-I260 WeakPolarHBondContact O-CG1 3.46Å; V256-I260 PolarHBondContact O-N 2.9Å; G257-I260 PolarHBondContact O-N 2.87Å; I258-I260 VanDerWaalsContact C-N 3.31Å; I258-I260 PolarHBondContact O-N 2.95Å; I260-A263 PolarHBondContact O-N 3.48Å; I260-L264 HydrophobicContact CG2-CD1 4.35Å; I260-L264 WeakPolarHBondContact O-CG 3.17Å; I260-L264 PolarHBondContact O-N 3.05Å |
| 261 | L | 97.3 | Very high | 96.9 | Very high | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.2 | -50.7 | 177.8 | -174 | 67.2 | 0 | 0 | 0 | 112 | L8 Y11 F246 L249 G257 I258 A263 L264 Y265 L317 V320 | L8-L261 HydrophobicContact CD2-CD1 4Å; Y11-L261 HydrophobicContact CD1-CD1 3.81Å; Y11-L261 HydrophobicContact CE1-CB 3.94Å; Y11-L261 HydrophobicContact CE1-CD1 3.79Å; Y11-L261 HydrophobicContact CE1-CG 4.4Å; F246-L261 HydrophobicContact CD2-CD2 4.11Å; F246-L261 HydrophobicContact CE2-CD2 4.32Å; L249-L261 HydrophobicContact CD1-CB 4.5Å; L249-L261 HydrophobicContact CD1-CD1 4.48Å; L249-L261 HydrophobicContact CD1-CD2 3.8Å; L249-L261 HydrophobicContact CD1-CG 4.48Å; G257-L261 PolarHBondContact O-N 3.33Å; G257-L261 VanDerWaalsContact O-N 3.08Å; I258-L261 WeakPolarHBondContact O-CB 3.27Å; I258-L261 PolarHBondContact O-N 3.5Å; I258-L261 VanDerWaalsContact O-N 3.15Å; L261-A263 VanDerWaalsContact C-N 3.32Å; L261-A263 PolarHBondContact O-N 3.01Å; L261-L264 PolarHBondContact O-N 3.04Å; L261-Y265 HydrophobicContact CD1-CD2 4.25Å; L261-Y265 HydrophobicContact CD1-CE2 3.71Å; L261-Y265 HydrophobicContact CD2-CE2 4.02Å; L261-Y265 HydrophobicContact CG-CD2 3.92Å; L261-Y265 HydrophobicContact CG-CE2 3.64Å; L261-Y265 WeakPolarHBondContact O-CD2 3.24Å; L261-Y265 PolarHBondContact O-N 3.04Å; L261-L317 HydrophobicContact CD2-CD2 4.06Å; L261-V320 HydrophobicContact CD1-CG2 3.85Å |
| 262 | L | 97.4 | Very high | 97.1 | Very high | 56 Ų | 56 | 46.1 Ų | 46.1 | 29% | 0.293 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62.3 | -41.5 | -179.8 | -71.4 | 179.3 | 0 | 0 | 0 | 111.1 | I258 L259 L264 Y265 I266 I303 | I258-L262 HydrophobicContact CG2-CD1 3.88Å; I258-L262 HydrophobicContact CG2-CG 4.18Å; I258-L262 WeakPolarHBondContact O-CG 3.22Å; I258-L262 PolarHBondContact O-N 3.43Å; L259-L262 PolarHBondContact O-N 3.34Å; L262-L264 VanDerWaalsContact C-N 3.34Å; L262-L264 PolarHBondContact O-N 3.37Å; L262-Y265 PolarHBondContact O-N 3.01Å; L262-I266 WeakPolarHBondContact O-CB 3.27Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 2.89Å; L262-I303 HydrophobicContact CD2-CD1 3.53Å |
| 263 | A | 98.2 | Very high | 97.3 | Very high | 47 Ų | 47 | 49.1 Ų | 49.1 | 39% | 0.388 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -59 | -44.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L259 I260 L261 I266 L267 | L259-A263 VanDerWaalsContact O-CB 3.23Å; L259-A263 WeakPolarHBondContact O-CB 3.43Å; L259-A263 PolarHBondContact O-N 2.65Å; I260-A263 PolarHBondContact O-N 3.48Å; L261-A263 VanDerWaalsContact C-N 3.32Å; L261-A263 PolarHBondContact O-N 3.01Å; A263-I266 PolarHBondContact O-N 3.07Å; A263-L267 WeakPolarHBondContact O-CB 3.01Å; A263-L267 WeakPolarHBondContact O-CG 3.44Å; A263-L267 PolarHBondContact O-N 3.19Å |
| 264 | L | 98.2 | Very high | 97.4 | Very high | 28 Ų | 28 | 51 Ų | 51 | 15% | 0.147 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 176.8 | -71.4 | 173.5 | 0 | 0 | 0 | 112.5 | I4 A7 L8 I260 L261 L262 L268 | I4-L264 HydrophobicContact CG2-CD2 4.31Å; I4-L264 WeakPolarHBondContact CG2-O 3.36Å; A7-L264 HydrophobicContact CB-CD1 4.49Å; A7-L264 HydrophobicContact CB-CD2 4.01Å; L8-L264 HydrophobicContact CD1-CB 4.25Å; L8-L264 HydrophobicContact CD2-CB 3.51Å; L8-L264 HydrophobicContact CD2-CD1 3.8Å; L8-L264 HydrophobicContact CD2-CG 4.3Å; L8-L264 HydrophobicContact CG-CB 3.75Å; L8-L264 HydrophobicContact CG-CD1 4.07Å; L8-L264 HydrophobicContact CG-CG 4.43Å; I260-L264 HydrophobicContact CG2-CD1 4.35Å; I260-L264 WeakPolarHBondContact O-CG 3.17Å; I260-L264 PolarHBondContact O-N 3.05Å; L261-L264 PolarHBondContact O-N 3.04Å; L262-L264 VanDerWaalsContact C-N 3.34Å; L262-L264 PolarHBondContact O-N 3.37Å; L264-L268 WeakPolarHBondContact O-CB 3.44Å; L264-L268 PolarHBondContact O-N 3.08Å |
| 265 | Y | 98.3 | Very high | 97.4 | Very high | 3 Ų | 3 | 51.2 Ų | 51.2 | 1% | 0.012 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -63.9 | -44.9 | 175 | -78.9 | -55.5 | 0 | 0 | 0 | 112.5 | L8 L261 L262 L267 L268 I269 V299 L317 P318 V320 | L8-Y265 HydrophobicContact CD1-CD1 4.32Å; L8-Y265 HydrophobicContact CD1-CE1 4.44Å; L8-Y265 HydrophobicContact CD2-CE1 4.46Å; L261-Y265 HydrophobicContact CD1-CD2 4.25Å; L261-Y265 HydrophobicContact CD1-CE2 3.71Å; L261-Y265 HydrophobicContact CD2-CE2 4.02Å; L261-Y265 HydrophobicContact CG-CD2 3.92Å; L261-Y265 HydrophobicContact CG-CE2 3.64Å; L261-Y265 WeakPolarHBondContact O-CD2 3.24Å; L261-Y265 PolarHBondContact O-N 3.04Å; L262-Y265 PolarHBondContact O-N 3.01Å; Y265-L267 PolarHBondContact O-N 3.42Å; Y265-L268 WeakPolarHBondContact O-CB 3.41Å; Y265-L268 PolarHBondContact O-N 3.37Å; Y265-I269 WeakPolarHBondContact O-CB 3.5Å; Y265-I269 WeakPolarHBondContact O-CD1 3.16Å; Y265-I269 VanDerWaalsContact O-CG1 3.29Å; Y265-I269 WeakPolarHBondContact O-CG1 3.43Å; Y265-I269 PolarHBondContact O-N 3.44Å; Y265-V299 HydrophobicContact CD1-CG2 3.65Å; Y265-V299 HydrophobicContact CD2-CG1 3.8Å; Y265-V299 HydrophobicContact CD2-CG2 4Å; Y265-V299 HydrophobicContact CE1-CG2 3.67Å; Y265-V299 HydrophobicContact CE2-CG1 4.1Å; Y265-V299 HydrophobicContact CE2-CG2 4Å; Y265-V299 HydrophobicContact CG-CG1 4.19Å; Y265-V299 HydrophobicContact CG-CG2 3.83Å; Y265-L317 HydrophobicContact CE2-CD1 4.24Å; Y265-L317 WeakPolarHBondContact OH-CG 3.25Å; Y265-P318 HydrophobicContact CE1-CB 4.38Å; Y265-P318 PolarHBondContact OH-O 3.34Å; Y265-V320 VanDerWaalsContact OH-CG2 3.25Å; Y265-V320 WeakPolarHBondContact OH-CG2 3.39Å |
| 266 | I | 98.1 | Very high | 97.4 | Very high | 96 Ų | 96 | 47.7 Ų | 47.7 | 49% | 0.492 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -59.8 | -48.5 | 178 | -71.9 | 166.9 | 0 | 0 | 0 | 109.8 | L262 A263 L268 I269 M270 | L262-I266 WeakPolarHBondContact O-CB 3.27Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 2.89Å; A263-I266 PolarHBondContact O-N 3.07Å; I266-L268 VanDerWaalsContact C-N 3.29Å; I266-L268 PolarHBondContact O-N 2.75Å; I266-I269 PolarHBondContact O-N 3.36Å; I266-M270 HydrophobicContact CG2-CG 4.15Å; I266-M270 HydrophobicContact CG2-SD 3.62Å; I266-M270 VanDerWaalsContact O-CB 3.28Å; I266-M270 WeakPolarHBondContact O-CB 3.39Å; I266-M270 WeakPolarHBondContact O-CG 3.37Å; I266-M270 PolarHBondContact O-N 3.28Å |
| 267 | L | 98.3 | Very high | 97.3 | Very high | 92 Ų | 92 | 47.3 Ų | 47.3 | 48% | 0.482 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.4 | -39.1 | 177.2 | -71.2 | 172.9 | 0 | 0 | 0 | 112.1 | I4 A263 Y265 R271 | I4-L267 HydrophobicContact CD1-CB 4Å; I4-L267 HydrophobicContact CG2-CB 4.5Å; A263-L267 WeakPolarHBondContact O-CB 3.01Å; A263-L267 WeakPolarHBondContact O-CG 3.44Å; A263-L267 PolarHBondContact O-N 3.19Å; Y265-L267 PolarHBondContact O-N 3.42Å; L267-R271 VanDerWaalsContact O-CB 3.22Å; L267-R271 WeakPolarHBondContact O-CB 3.46Å; L267-R271 PolarHBondContact O-N 3.33Å |
| 268 | L | 98.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.2 | -50.7 | 177.2 | -177.7 | 59.4 | 0 | 0 | 0 | 111.6 | M1 I4 L5 L8 L264 Y265 I266 R271 G272 L295 F334 | M1-L268 HydrophobicContact CE-CD1 4.21Å; M1-L268 HydrophobicContact CG-CD1 3.83Å; I4-L268 HydrophobicContact CG2-CB 3.87Å; I4-L268 HydrophobicContact CG2-CD1 4.46Å; L5-L268 HydrophobicContact CD2-CD1 3.82Å; L5-L268 HydrophobicContact CD2-CD2 3.6Å; L5-L268 HydrophobicContact CD2-CG 4.39Å; L5-L268 HydrophobicContact CG-CD1 3.91Å; L8-L268 HydrophobicContact CD1-CD2 3.72Å; L264-L268 WeakPolarHBondContact O-CB 3.44Å; L264-L268 PolarHBondContact O-N 3.08Å; Y265-L268 WeakPolarHBondContact O-CB 3.41Å; Y265-L268 PolarHBondContact O-N 3.37Å; I266-L268 VanDerWaalsContact C-N 3.29Å; I266-L268 PolarHBondContact O-N 2.75Å; L268-R271 PolarHBondContact O-N 3.1Å; L268-G272 PolarHBondContact O-N 2.87Å; L268-L295 HydrophobicContact CD2-CD2 3.93Å; L268-L295 HydrophobicContact CG-CD2 4.21Å; L268-F334 HydrophobicContact CD1-CE1 4.31Å; L268-F334 HydrophobicContact CD2-CE1 3.94Å; L268-F334 HydrophobicContact CD2-CZ 3.72Å; L268-F334 HydrophobicContact CG-CE1 4.21Å; L268-F334 HydrophobicContact CG-CZ 4.48Å |
| 269 | I | 98.2 | Very high | 97.1 | Very high | 20 Ų | 20 | 52.8 Ų | 52.8 | 10% | 0.103 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.7 | -48.4 | 179.7 | -68.4 | 161.2 | 0 | 0 | 0 | 110.1 | Y265 I266 R271 G272 L273 L295 F296 | Y265-I269 WeakPolarHBondContact O-CB 3.5Å; Y265-I269 WeakPolarHBondContact O-CD1 3.16Å; Y265-I269 VanDerWaalsContact O-CG1 3.29Å; Y265-I269 WeakPolarHBondContact O-CG1 3.43Å; Y265-I269 PolarHBondContact O-N 3.44Å; I266-I269 PolarHBondContact O-N 3.36Å; I269-R271 VanDerWaalsContact C-N 3.32Å; I269-R271 PolarHBondContact O-N 2.97Å; I269-G272 PolarHBondContact O-N 3.12Å; I269-L273 HydrophobicContact CG2-CD1 3.86Å; I269-L273 HydrophobicContact CG2-CG 4.27Å; I269-L273 WeakPolarHBondContact O-CB 3.32Å; I269-L273 WeakPolarHBondContact O-CG 3.37Å; I269-L273 PolarHBondContact O-N 2.82Å; I269-L295 HydrophobicContact CG1-CD2 3.86Å; I269-L295 HydrophobicContact CG1-CG 4.22Å; I269-F296 HydrophobicContact CD1-CB 3.94Å; I269-F296 HydrophobicContact CD1-CD2 4.27Å |
| 270 | M | 98 | Very high | 96.6 | Very high | 118 Ų | 118 | 53.2 Ų | 53.2 | 58% | 0.581 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -57.7 | -44.5 | 176.6 | -74.3 | 179.1 | 72 | 0 | 0 | 111.6 | I266 G272 L273 W274 | I266-M270 HydrophobicContact CG2-CG 4.15Å; I266-M270 HydrophobicContact CG2-SD 3.62Å; I266-M270 VanDerWaalsContact O-CB 3.28Å; I266-M270 WeakPolarHBondContact O-CB 3.39Å; I266-M270 WeakPolarHBondContact O-CG 3.37Å; I266-M270 PolarHBondContact O-N 3.28Å; M270-G272 PolarHBondContact O-N 3Å; M270-L273 PolarHBondContact O-N 3.27Å; M270-W274 WeakPolarHBondContact O-CB 3.19Å; M270-W274 PolarHBondContact O-N 3.45Å |
| 271 | R | 97.7 | Very high | 96.2 | Very high | 87 Ų | 87 | 51.9 Ų | 51.9 | 33% | 0.328 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.3 | -41.1 | 178.3 | 179.6 | 58.3 | -177.6 | -171.7 | 0.6 | 111.8 | M1 I4 L267 L268 I269 W274 I275 | M1-R271 HydrophobicContact CB-CG 4Å; I4-R271 HydrophobicContact CD1-CB 4.47Å; L267-R271 VanDerWaalsContact O-CB 3.22Å; L267-R271 WeakPolarHBondContact O-CB 3.46Å; L267-R271 PolarHBondContact O-N 3.33Å; L268-R271 PolarHBondContact O-N 3.1Å; I269-R271 VanDerWaalsContact C-N 3.32Å; I269-R271 PolarHBondContact O-N 2.97Å; R271-W274 VanDerWaalsContact CZ-CZ3 3.41Å; R271-W274 PolarHBondContact O-N 2.84Å; R271-I275 WeakPolarHBondContact O-CG1 3.19Å; R271-I275 PolarHBondContact O-N 2.89Å |
| 272 | G | 97.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -68.6 | -41.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L268 I269 M270 W274 I275 A276 | L268-G272 PolarHBondContact O-N 2.87Å; I269-G272 PolarHBondContact O-N 3.12Å; M270-G272 PolarHBondContact O-N 3Å; G272-W274 VanDerWaalsContact C-N 3.29Å; G272-W274 PolarHBondContact O-N 3.36Å; G272-I275 WeakPolarHBondContact O-CB 3.41Å; G272-I275 PolarHBondContact O-N 3.42Å; G272-I275 VanDerWaalsContact O-N 3.1Å; G272-A276 PolarHBondContact O-N 3.45Å |
| 273 | L | 97.3 | Very high | 95.6 | Very high | 66 Ų | 66 | 52 Ų | 52 | 35% | 0.346 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -63.4 | -36.4 | 173.7 | -70.6 | 176.1 | 0 | 0 | 0 | 111.6 | I269 M270 I275 A276 A277 M292 | I269-L273 HydrophobicContact CG2-CD1 3.86Å; I269-L273 HydrophobicContact CG2-CG 4.27Å; I269-L273 WeakPolarHBondContact O-CB 3.32Å; I269-L273 WeakPolarHBondContact O-CG 3.37Å; I269-L273 PolarHBondContact O-N 2.82Å; M270-L273 PolarHBondContact O-N 3.27Å; L273-I275 VanDerWaalsContact C-N 3.35Å; L273-A276 WeakPolarHBondContact O-CB 3.2Å; L273-A276 PolarHBondContact O-N 3.26Å; L273-A277 WeakPolarHBondContact O-CB 3.37Å; L273-A277 PolarHBondContact O-N 3.36Å; L273-M292 HydrophobicContact CD2-CB 3.89Å; L273-M292 HydrophobicContact CG-CB 4.04Å |
| 274 | W | 97.5 | Very high | 95.3 | Very high | 88 Ų | 88 | 49.7 Ų | 49.7 | 33% | 0.333 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -64.7 | -37.4 | 172.3 | -178.7 | 94.9 | 0 | 0 | 0 | 112.6 | M270 R271 G272 R278 H341 | M270-W274 WeakPolarHBondContact O-CB 3.19Å; M270-W274 PolarHBondContact O-N 3.45Å; R271-W274 VanDerWaalsContact CZ-CZ3 3.41Å; R271-W274 PolarHBondContact O-N 2.84Å; G272-W274 VanDerWaalsContact C-N 3.29Å; G272-W274 PolarHBondContact O-N 3.36Å; W274-R278 VanDerWaalsContact CE2-NE 3.28Å; W274-R278 PolarHBondContact O-N 2.94Å; W274-R278 VanDerWaalsContact O-N 3.14Å; W274-H341 AromaticContact CZ3-CE1 3.58Å |
| 275 | I | 96.4 | Very high | 95.1 | Very high | 4 Ų | 4 | 54.4 Ų | 54.4 | 2% | 0.021 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.9 | -45.8 | 172.1 | -69.8 | 167.1 | 0 | 0 | 0 | 110 | M1 R271 G272 L273 R278 A279 V337 I340 H341 | M1-I275 HydrophobicContact SD-CD1 3.79Å; R271-I275 WeakPolarHBondContact O-CG1 3.19Å; R271-I275 PolarHBondContact O-N 2.89Å; G272-I275 WeakPolarHBondContact O-CB 3.41Å; G272-I275 PolarHBondContact O-N 3.42Å; G272-I275 VanDerWaalsContact O-N 3.1Å; L273-I275 VanDerWaalsContact C-N 3.35Å; I275-R278 CarbonylContact O-C 3.59Å; I275-R278 PolarHBondContact O-N 3.4Å; I275-A279 PolarHBondContact O-N 2.78Å; I275-V337 HydrophobicContact CB-CG1 4.34Å; I275-V337 HydrophobicContact CD1-CG1 4.05Å; I275-V337 HydrophobicContact CG2-CG1 4.07Å; I275-I340 HydrophobicContact CG2-CG2 4.47Å; I275-H341 HydrophobicContact CD1-CB 4.18Å; I275-H341 HydrophobicContact CG1-CB 4.14Å; I275-H341 HydrophobicContact CG2-CB 3.79Å |
| 276 | A | 95.7 | Very high | 94.9 | Very high | 5 Ų | 5 | 54.4 Ų | 54.4 | 4% | 0.041 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.2 | -47.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | G272 L273 R278 A279 R285 A288 | G272-A276 PolarHBondContact O-N 3.45Å; L273-A276 WeakPolarHBondContact O-CB 3.2Å; L273-A276 PolarHBondContact O-N 3.26Å; A276-R278 PolarHBondContact O-N 2.98Å; A276-A279 VanDerWaalsContact O-CB 3.26Å; A276-A279 WeakPolarHBondContact O-CB 3.45Å; A276-A279 PolarHBondContact O-N 3.29Å; A276-A279 VanDerWaalsContact O-N 3.08Å; A276-R285 WeakPolarHBondContact O-CG 3.29Å; A276-A288 HydrophobicContact CB-CB 3.73Å |
| 277 | A | 94.9 | Very high | 94.7 | Very high | 74 Ų | 74 | 49.9 Ų | 49.9 | 61% | 0.612 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -60.8 | -33 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L273 | L273-A277 WeakPolarHBondContact O-CB 3.37Å; L273-A277 PolarHBondContact O-N 3.36Å |
| 278 | R | 94.4 | Very high | 94.6 | Very high | 132 Ų | 132 | 45.5 Ų | 45.5 | 50% | 0.498 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -93.5 | 8.7 | 177.4 | -66.2 | -170.8 | 171.1 | -160 | 0.8 | 114.1 | W274 I275 A276 R344 | W274-R278 VanDerWaalsContact CE2-NE 3.28Å; W274-R278 PolarHBondContact O-N 2.94Å; W274-R278 VanDerWaalsContact O-N 3.14Å; I275-R278 CarbonylContact O-C 3.59Å; I275-R278 PolarHBondContact O-N 3.4Å; A276-R278 PolarHBondContact O-N 2.98Å; R278-R344 VanDerWaalsContact CB-NH2 3.25Å; R278-R344 PolarHBondContact O-NH2 3.35Å |
| 279 | A | 92.5 | Very high | 94.6 | Very high | 7 Ų | 7 | 45.6 Ų | 45.6 | 6% | 0.058 | 22% | 0.222 | C | C | . | . | trans | -71.3 | 136.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | I275 A276 R285 I340 | I275-A279 PolarHBondContact O-N 2.78Å; A276-A279 VanDerWaalsContact O-CB 3.26Å; A276-A279 WeakPolarHBondContact O-CB 3.45Å; A276-A279 PolarHBondContact O-N 3.29Å; A276-A279 VanDerWaalsContact O-N 3.08Å; A279-R285 HydrophobicContact CB-CB 4.09Å; A279-I340 HydrophobicContact CB-CG2 3.8Å | ||
| 280 | Q | 88.3 | Confident | 94.5 | Very high | 107 Ų | 107 | 44.7 Ų | 44.7 | 50% | 0.5 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -81.1 | -21.5 | -177.1 | -69.4 | 178 | -32.7 | 0 | 0 | 113.3 | ||
| 281 | T | 88.7 | Confident | 94.4 | Very high | 60 Ų | 60 | 39.8 Ų | 39.8 | 37% | 0.368 | 19% | 0.193 | S | C | . | . | S | Bend | trans | -110.8 | 147.1 | 179.9 | 61.6 | 0 | 0 | 0 | 0 | 110.4 | F283 G284 R285 | T281-F283 VanDerWaalsContact C-N 3.32Å; T281-F283 PolarHBondContact O-N 2.65Å; T281-G284 PolarHBondContact O-N 2.78Å; T281-G284 PolarHBondContact OG1-N 3.16Å; T281-G284 VanDerWaalsContact OG1-N 3.1Å; T281-R285 PolarHBondContact O-N 2.79Å |
| 282 | T | 89.1 | Confident | 94.4 | Very high | 55 Ų | 55 | 35.8 Ų | 35.8 | 34% | 0.337 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -58.2 | -47.3 | 174.5 | -54.4 | 0 | 0 | 0 | 0 | 110.3 | N110 G284 R285 V286 | N110-T282 WeakPolarHBondContact OD1-CB 3.47Å; T282-G284 PolarHBondContact O-N 3.22Å; T282-R285 WeakPolarHBondContact O-CB 3.06Å; T282-R285 PolarHBondContact O-N 3.48Å; T282-R285 VanDerWaalsContact O-N 3.13Å; T282-V286 HydrophobicContact CG2-CG1 4.31Å; T282-V286 WeakPolarHBondContact O-CG2 3.31Å; T282-V286 PolarHBondContact O-N 3.44Å |
| 283 | F | 91.7 | Very high | 94.3 | Very high | 2 Ų | 2 | 37.7 Ų | 37.7 | 1% | 0.009 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -47.9 | -53.3 | 171.7 | 176.9 | -97.5 | 0 | 0 | 0 | 113.1 | P49 E53 L103 A106 R107 N110 T281 R285 M287 | P49-F283 HydrophobicContact CB-CE1 4.41Å; E53-F283 HydrophobicContact CB-CD1 4.39Å; E53-F283 HydrophobicContact CB-CD2 4.24Å; E53-F283 HydrophobicContact CB-CE1 4.11Å; E53-F283 HydrophobicContact CB-CE2 3.95Å; E53-F283 HydrophobicContact CB-CG 4.44Å; E53-F283 HydrophobicContact CB-CZ 3.87Å; E53-F283 HydrophobicContact CG-CD2 4.09Å; E53-F283 HydrophobicContact CG-CE2 4.13Å; E53-F283 HydrophobicContact CG-CG 4.47Å; L103-F283 HydrophobicContact CD1-CE2 4.11Å; L103-F283 HydrophobicContact CD1-CZ 3.56Å; L103-F283 HydrophobicContact CG-CZ 4.4Å; A106-F283 HydrophobicContact CB-CD2 3.78Å; A106-F283 HydrophobicContact CB-CE2 3.85Å; R107-F283 HydrophobicContact CB-CE2 4.41Å; N110-F283 HydrophobicContact CB-CB 4.22Å; N110-F283 PolarHBondContact OD1-N 3.47Å; T281-F283 VanDerWaalsContact C-N 3.32Å; T281-F283 PolarHBondContact O-N 2.65Å; F283-R285 VanDerWaalsContact C-N 3.34Å; F283-R285 PolarHBondContact O-N 3.21Å; F283-M287 WeakPolarHBondContact O-CB 3.27Å; F283-M287 PolarHBondContact O-N 2.84Å |
| 284 | G | 92.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.6 | -37.8 | -179 | 0 | 0 | 0 | 0 | 0 | 112.7 | T281 T282 A288 | T281-G284 PolarHBondContact O-N 2.78Å; T281-G284 PolarHBondContact OG1-N 3.16Å; T281-G284 VanDerWaalsContact OG1-N 3.1Å; T282-G284 PolarHBondContact O-N 3.22Å; G284-A288 VanDerWaalsContact O-CB 3.24Å; G284-A288 WeakPolarHBondContact O-CB 3.24Å; G284-A288 PolarHBondContact O-N 3.31Å |
| 285 | R | 93.5 | Very high | 94.2 | Very high | 127 Ų | 127 | 31 Ų | 31 | 48% | 0.479 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -64.3 | -53 | 177.9 | -177.2 | -179.1 | -59.3 | 164.5 | 4.6 | 111.7 | A276 A279 T281 T282 F283 G289 | A276-R285 WeakPolarHBondContact O-CG 3.29Å; A279-R285 HydrophobicContact CB-CB 4.09Å; T281-R285 PolarHBondContact O-N 2.79Å; T282-R285 WeakPolarHBondContact O-CB 3.06Å; T282-R285 PolarHBondContact O-N 3.48Å; T282-R285 VanDerWaalsContact O-N 3.13Å; F283-R285 VanDerWaalsContact C-N 3.34Å; F283-R285 PolarHBondContact O-N 3.21Å; R285-G289 PolarHBondContact O-N 3.35Å |
| 286 | V | 93.7 | Very high | 94.2 | Very high | 3 Ų | 3 | 35.9 Ų | 35.9 | 2% | 0.018 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -70.8 | -35.5 | -176.9 | -57.8 | 0 | 0 | 0 | 0 | 111.6 | A106 V154 L157 T282 G290 | A106-V286 HydrophobicContact CB-CG2 3.8Å; V154-V286 HydrophobicContact CG1-CB 4.13Å; V154-V286 HydrophobicContact CG1-CG2 3.88Å; L157-V286 HydrophobicContact CB-CB 4.28Å; L157-V286 HydrophobicContact CB-CG1 4.07Å; T282-V286 HydrophobicContact CG2-CG1 4.31Å; T282-V286 WeakPolarHBondContact O-CG2 3.31Å; T282-V286 PolarHBondContact O-N 3.44Å; V286-G290 WeakPolarHBondContact O-CA 3.5Å; V286-G290 PolarHBondContact O-N 2.89Å |
| 287 | M | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -68.4 | -51 | 178.2 | -172 | 65.6 | -165.5 | 0 | 0 | 111.5 | I99 P102 L103 A106 F283 G289 G290 L291 I336 I340 | I99-M287 HydrophobicContact CG2-CE 4.42Å; P102-M287 HydrophobicContact CB-CE 4.34Å; P102-M287 HydrophobicContact CB-SD 4.23Å; P102-M287 HydrophobicContact CG-CE 4.22Å; L103-M287 HydrophobicContact CB-CE 4.13Å; L103-M287 HydrophobicContact CB-SD 4.3Å; L103-M287 HydrophobicContact CD1-CE 3.8Å; L103-M287 HydrophobicContact CD1-CG 4.22Å; L103-M287 HydrophobicContact CD1-SD 3.78Å; A106-M287 HydrophobicContact CB-CB 4.45Å; A106-M287 HydrophobicContact CB-SD 4.38Å; F283-M287 WeakPolarHBondContact O-CB 3.27Å; F283-M287 PolarHBondContact O-N 2.84Å; M287-G289 PolarHBondContact O-N 3.03Å; M287-G290 PolarHBondContact O-N 2.82Å; M287-L291 HydrophobicContact CE-CD1 3.72Å; M287-L291 HydrophobicContact CE-CD2 3.95Å; M287-L291 HydrophobicContact CE-CG 3.81Å; M287-L291 HydrophobicContact CG-CD1 4.41Å; M287-L291 WeakPolarHBondContact O-CB 3.45Å; M287-L291 WeakPolarHBondContact O-CG 3.3Å; M287-L291 PolarHBondContact O-N 3.35Å; M287-I336 HydrophobicContact CG-CG2 4.28Å; M287-I340 HydrophobicContact CB-CD1 4.37Å |
| 288 | A | 96.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -65.5 | -40.4 | 179 | 0 | 0 | 0 | 0 | 0 | 111.7 | A276 G284 M292 V337 I340 | A276-A288 HydrophobicContact CB-CB 3.73Å; G284-A288 VanDerWaalsContact O-CB 3.24Å; G284-A288 WeakPolarHBondContact O-CB 3.24Å; G284-A288 PolarHBondContact O-N 3.31Å; A288-M292 WeakPolarHBondContact O-CG 3.5Å; A288-M292 PolarHBondContact O-N 2.98Å; A288-V337 HydrophobicContact CB-CG1 4.26Å; A288-V337 HydrophobicContact CB-CG2 4.25Å; A288-I340 HydrophobicContact CB-CD1 3.98Å |
| 289 | G | 96.7 | Very high | 94.1 | Very high | 3 Ų | 3 | 27.7 Ų | 27.7 | 3% | 0.031 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -62.4 | -47.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | R285 M287 L291 M292 L293 | R285-G289 PolarHBondContact O-N 3.35Å; M287-G289 PolarHBondContact O-N 3.03Å; G289-L291 PolarHBondContact O-N 3.12Å; G289-M292 PolarHBondContact O-N 3.48Å; G289-L293 WeakPolarHBondContact O-CG 3.44Å; G289-L293 PolarHBondContact O-N 3.03Å |
| 290 | G | 96.2 | Very high | 94.2 | Very high | 1 Ų | 1 | 32.9 Ų | 32.9 | 1% | 0.01 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -59.6 | -45.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | L157 V286 M287 M292 L293 I294 | L157-G290 VanDerWaalsContact CD1-N 3.31Å; V286-G290 WeakPolarHBondContact O-CA 3.5Å; V286-G290 PolarHBondContact O-N 2.89Å; M287-G290 PolarHBondContact O-N 2.82Å; G290-M292 VanDerWaalsContact C-N 3.32Å; G290-M292 PolarHBondContact O-N 3.02Å; G290-L293 PolarHBondContact O-N 3.19Å; G290-I294 WeakPolarHBondContact O-CG2 3.46Å; G290-I294 PolarHBondContact O-N 2.95Å |
| 291 | L | 96.6 | Very high | 94.4 | Very high | 14 Ų | 14 | 29.2 Ų | 29.2 | 7% | 0.073 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63 | -33.6 | 176.9 | -73.2 | 177.9 | 0 | 0 | 0 | 113.4 | M287 G289 I294 L295 I336 V337 | M287-L291 HydrophobicContact CE-CD1 3.72Å; M287-L291 HydrophobicContact CE-CD2 3.95Å; M287-L291 HydrophobicContact CE-CG 3.81Å; M287-L291 HydrophobicContact CG-CD1 4.41Å; M287-L291 WeakPolarHBondContact O-CB 3.45Å; M287-L291 WeakPolarHBondContact O-CG 3.3Å; M287-L291 PolarHBondContact O-N 3.35Å; G289-L291 PolarHBondContact O-N 3.12Å; L291-I294 WeakPolarHBondContact O-CG2 3.37Å; L291-L295 WeakPolarHBondContact O-CB 3.36Å; L291-L295 PolarHBondContact O-N 3.36Å; L291-L295 VanDerWaalsContact O-N 3.17Å; L291-I336 HydrophobicContact CD1-CG2 4.48Å; L291-V337 HydrophobicContact CB-CG2 4.17Å; L291-V337 HydrophobicContact CD1-CG2 3.77Å |
| 292 | M | 97.6 | Very high | 94.6 | Very high | 3 Ų | 3 | 26.3 Ų | 26.3 | 2% | 0.015 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -80.2 | -35.8 | 177.4 | -64.6 | -57.7 | 90.5 | 0 | 0 | 112.7 | L273 A288 G289 G290 L295 F296 F334 V337 | L273-M292 HydrophobicContact CD2-CB 3.89Å; L273-M292 HydrophobicContact CG-CB 4.04Å; A288-M292 WeakPolarHBondContact O-CG 3.5Å; A288-M292 PolarHBondContact O-N 2.98Å; G289-M292 PolarHBondContact O-N 3.48Å; G290-M292 VanDerWaalsContact C-N 3.32Å; G290-M292 PolarHBondContact O-N 3.02Å; M292-L295 HydrophobicContact CE-CD2 4.43Å; M292-L295 PolarHBondContact O-N 3.17Å; M292-L295 HydrophobicContact SD-CD2 4.4Å; M292-F296 PolarHBondContact O-N 3.44Å; M292-F334 HydrophobicContact CE-CD1 3.91Å; M292-F334 HydrophobicContact CE-CE1 3.66Å; M292-F334 HydrophobicContact SD-CE1 4.37Å; M292-V337 HydrophobicContact CE-CG2 4.01Å |
| 293 | L | 96.8 | Very high | 94.9 | Very high | 41 Ų | 41 | 25.2 Ų | 25.2 | 22% | 0.215 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -65.5 | -40.9 | 174 | -70.2 | 178.4 | 0 | 0 | 0 | 111.2 | F153 L157 G289 G290 F296 V297 | F153-L293 HydrophobicContact CB-CB 4.31Å; F153-L293 HydrophobicContact CB-CD1 4.14Å; F153-L293 HydrophobicContact CD1-CB 4.27Å; F153-L293 HydrophobicContact CD1-CD1 3.98Å; F153-L293 HydrophobicContact CD2-CB 3.59Å; F153-L293 HydrophobicContact CE2-CB 3.86Å; F153-L293 HydrophobicContact CG-CB 3.83Å; F153-L293 HydrophobicContact CG-CD1 4.03Å; F153-L293 HydrophobicContact CZ-CB 4.33Å; L157-L293 HydrophobicContact CD1-CD1 3.89Å; L157-L293 HydrophobicContact CD2-CD1 4.2Å; L157-L293 HydrophobicContact CG-CD1 4.11Å; G289-L293 WeakPolarHBondContact O-CG 3.44Å; G289-L293 PolarHBondContact O-N 3.03Å; G290-L293 PolarHBondContact O-N 3.19Å; L293-F296 WeakPolarHBondContact O-CB 3.36Å; L293-F296 PolarHBondContact O-N 3.15Å; L293-V297 PolarHBondContact O-N 3.36Å |
| 294 | I | 95.4 | Very high | 94.9 | Very high | 10 Ų | 10 | 25.4 Ų | 25.4 | 5% | 0.051 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -66.2 | -40 | 175 | -167.9 | 61.7 | 0 | 0 | 0 | 111.2 | L146 L149 F153 G290 L291 F296 V297 Y298 | L146-I294 HydrophobicContact CB-CD1 4.29Å; L146-I294 HydrophobicContact CD2-CD1 4.01Å; L146-I294 VanDerWaalsContact O-CD1 3.3Å; L146-I294 WeakPolarHBondContact O-CD1 3.31Å; L149-I294 HydrophobicContact CB-CD1 3.92Å; F153-I294 HydrophobicContact CD2-CB 4.4Å; G290-I294 WeakPolarHBondContact O-CG2 3.46Å; G290-I294 PolarHBondContact O-N 2.95Å; L291-I294 WeakPolarHBondContact O-CG2 3.37Å; I294-F296 VanDerWaalsContact C-N 3.3Å; I294-F296 PolarHBondContact O-N 2.93Å; I294-V297 HydrophobicContact CD1-CB 4.39Å; I294-V297 PolarHBondContact O-N 3.16Å; I294-V297 VanDerWaalsContact O-N 3.1Å; I294-Y298 HydrophobicContact CD1-CD2 4.14Å; I294-Y298 HydrophobicContact CD1-CE2 3.87Å; I294-Y298 HydrophobicContact CG1-CD2 3.88Å; I294-Y298 HydrophobicContact CG1-CE2 3.54Å; I294-Y298 WeakPolarHBondContact O-CD2 3.48Å; I294-Y298 PolarHBondContact O-N 3.08Å |
| 295 | L | 96.1 | Very high | 94.8 | Very high | 2 Ų | 2 | 25.5 Ų | 25.5 | 1% | 0.01 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -57 | -43.7 | 173.4 | 178 | 66.9 | 0 | 0 | 0 | 112.1 | L268 I269 L291 M292 V297 Y298 V299 P318 F334 | L268-L295 HydrophobicContact CD2-CD2 3.93Å; L268-L295 HydrophobicContact CG-CD2 4.21Å; I269-L295 HydrophobicContact CG1-CD2 3.86Å; I269-L295 HydrophobicContact CG1-CG 4.22Å; L291-L295 WeakPolarHBondContact O-CB 3.36Å; L291-L295 PolarHBondContact O-N 3.36Å; L291-L295 VanDerWaalsContact O-N 3.17Å; M292-L295 HydrophobicContact CE-CD2 4.43Å; M292-L295 PolarHBondContact O-N 3.17Å; M292-L295 HydrophobicContact SD-CD2 4.4Å; L295-V297 VanDerWaalsContact C-N 3.35Å; L295-V297 PolarHBondContact O-N 2.67Å; L295-Y298 PolarHBondContact O-N 3.05Å; L295-V299 WeakPolarHBondContact O-CG2 3.31Å; L295-V299 PolarHBondContact O-N 3.01Å; L295-V299 VanDerWaalsContact O-N 3.12Å; L295-P318 HydrophobicContact CD1-CB 3.68Å; L295-P318 HydrophobicContact CD1-CG 3.97Å; L295-F334 HydrophobicContact CD1-CZ 4.16Å; L295-F334 HydrophobicContact CD2-CE1 3.73Å; L295-F334 HydrophobicContact CD2-CZ 3.66Å |
| 296 | F | 96.6 | Very high | 94.6 | Very high | 108 Ų | 108 | 19.6 Ų | 19.6 | 47% | 0.474 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -57.4 | -47.8 | 174 | 170.9 | -97.8 | 0 | 0 | 0 | 111.5 | I269 M292 L293 I294 Y298 V299 F300 | I269-F296 HydrophobicContact CD1-CB 3.94Å; I269-F296 HydrophobicContact CD1-CD2 4.27Å; M292-F296 PolarHBondContact O-N 3.44Å; L293-F296 WeakPolarHBondContact O-CB 3.36Å; L293-F296 PolarHBondContact O-N 3.15Å; I294-F296 VanDerWaalsContact C-N 3.3Å; I294-F296 PolarHBondContact O-N 2.93Å; F296-Y298 VanDerWaalsContact C-N 3.32Å; F296-Y298 PolarHBondContact O-N 3.43Å; F296-V299 PolarHBondContact O-N 2.96Å; F296-F300 HydrophobicContact CZ-CD2 4.47Å; F296-F300 WeakPolarHBondContact O-CB 3.39Å; F296-F300 PolarHBondContact O-N 3.05Å |
| 297 | V | 94.9 | Very high | 94.4 | Very high | 20 Ų | 20 | 21 Ų | 21 | 12% | 0.121 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.3 | -40.7 | 177.4 | 171.4 | 0 | 0 | 0 | 0 | 111.6 | L146 L149 F153 L293 I294 L295 V299 F300 V301 | L146-V297 HydrophobicContact CD2-CG1 3.77Å; L149-V297 HydrophobicContact CD1-CG1 3.8Å; F153-V297 HydrophobicContact CE2-CB 4.48Å; F153-V297 HydrophobicContact CE2-CG2 3.55Å; F153-V297 HydrophobicContact CZ-CG2 3.57Å; L293-V297 PolarHBondContact O-N 3.36Å; I294-V297 HydrophobicContact CD1-CB 4.39Å; I294-V297 PolarHBondContact O-N 3.16Å; I294-V297 VanDerWaalsContact O-N 3.1Å; L295-V297 VanDerWaalsContact C-N 3.35Å; L295-V297 PolarHBondContact O-N 2.67Å; V297-V299 PolarHBondContact O-N 2.91Å; V297-F300 PolarHBondContact O-N 2.74Å; V297-V301 HydrophobicContact CG1-CG2 3.84Å; V297-V301 VanDerWaalsContact O-CB 3.25Å; V297-V301 WeakPolarHBondContact O-CB 3.16Å; V297-V301 WeakPolarHBondContact O-CG2 3.43Å; V297-V301 PolarHBondContact O-N 3.41Å |
| 298 | Y | 92.5 | Very high | 94 | Very high | 8 Ų | 8 | 21.5 Ų | 21.5 | 3% | 0.031 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -60.3 | -48.3 | 177.4 | -87.1 | -122.4 | 0 | 0 | 0 | 111.9 | K98 L146 I294 L295 F296 V301 N302 V315 P318 | K98-Y298 WeakPolarHBondContact CD-OH 3.37Å; K98-Y298 WeakPolarHBondContact CE-OH 3.12Å; K98-Y298 PolarHBondContact NZ-OH 3.29Å; L146-Y298 HydrophobicContact CB-CE2 3.6Å; L146-Y298 WeakPolarHBondContact CB-OH 3.15Å; L146-Y298 HydrophobicContact CD1-CD1 4.14Å; L146-Y298 HydrophobicContact CD1-CD2 3.91Å; L146-Y298 HydrophobicContact CD1-CE1 3.66Å; L146-Y298 HydrophobicContact CD1-CE2 3.42Å; L146-Y298 VanDerWaalsContact CD1-CE2 3.42Å; L146-Y298 HydrophobicContact CD1-CG 4.25Å; L146-Y298 VanDerWaalsContact CD1-OH 3.31Å; L146-Y298 WeakPolarHBondContact CD1-OH 3.26Å; L146-Y298 HydrophobicContact CD2-CD2 3.62Å; L146-Y298 HydrophobicContact CD2-CE2 3.53Å; L146-Y298 HydrophobicContact CD2-CG 4.46Å; L146-Y298 HydrophobicContact CG-CD2 4.19Å; L146-Y298 HydrophobicContact CG-CE2 3.65Å; I294-Y298 HydrophobicContact CD1-CD2 4.14Å; I294-Y298 HydrophobicContact CD1-CE2 3.87Å; I294-Y298 HydrophobicContact CG1-CD2 3.88Å; I294-Y298 HydrophobicContact CG1-CE2 3.54Å; I294-Y298 WeakPolarHBondContact O-CD2 3.48Å; I294-Y298 PolarHBondContact O-N 3.08Å; L295-Y298 PolarHBondContact O-N 3.05Å; F296-Y298 VanDerWaalsContact C-N 3.32Å; F296-Y298 PolarHBondContact O-N 3.43Å; Y298-V301 PolarHBondContact O-N 3.41Å; Y298-N302 WeakPolarHBondContact O-CB 3.4Å; Y298-N302 PolarHBondContact O-N 3.21Å; Y298-V315 HydrophobicContact CD1-CG1 4.02Å; Y298-V315 HydrophobicContact CE1-CG1 4.25Å; Y298-P318 HydrophobicContact CD1-CG 3.8Å; Y298-P318 HydrophobicContact CG-CG 3.93Å |
| 299 | V | 95.4 | Very high | 93.7 | Very high | 11 Ų | 11 | 27.2 Ų | 27.2 | 7% | 0.067 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.2 | -46.1 | -179.7 | 175.6 | 0 | 0 | 0 | 0 | 109.8 | Y265 L295 F296 V297 I303 P318 | Y265-V299 HydrophobicContact CD1-CG2 3.65Å; Y265-V299 HydrophobicContact CD2-CG1 3.8Å; Y265-V299 HydrophobicContact CD2-CG2 4Å; Y265-V299 HydrophobicContact CE1-CG2 3.67Å; Y265-V299 HydrophobicContact CE2-CG1 4.1Å; Y265-V299 HydrophobicContact CE2-CG2 4Å; Y265-V299 HydrophobicContact CG-CG1 4.19Å; Y265-V299 HydrophobicContact CG-CG2 3.83Å; L295-V299 WeakPolarHBondContact O-CG2 3.31Å; L295-V299 PolarHBondContact O-N 3.01Å; L295-V299 VanDerWaalsContact O-N 3.12Å; F296-V299 PolarHBondContact O-N 2.96Å; V297-V299 PolarHBondContact O-N 2.91Å; V299-I303 HydrophobicContact CG1-CD1 3.69Å; V299-I303 HydrophobicContact CG1-CG1 4.43Å; V299-I303 WeakPolarHBondContact O-CB 3.31Å; V299-I303 VanDerWaalsContact O-CG1 3.27Å; V299-I303 WeakPolarHBondContact O-CG1 3.42Å; V299-I303 PolarHBondContact O-N 2.85Å; V299-P318 HydrophobicContact CG2-CG 4.1Å |
| 300 | F | 95.1 | Very high | 93.3 | Very high | 116 Ų | 116 | 29.2 Ų | 29.2 | 51% | 0.509 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -62.2 | -46.5 | 178.7 | -177.2 | -95.3 | 0 | 0 | 0 | 112.3 | F296 V297 G304 L310 | F296-F300 HydrophobicContact CZ-CD2 4.47Å; F296-F300 WeakPolarHBondContact O-CB 3.39Å; F296-F300 PolarHBondContact O-N 3.05Å; V297-F300 PolarHBondContact O-N 2.74Å; F300-G304 PolarHBondContact O-N 3.14Å; F300-L310 HydrophobicContact CD1-CD1 4.13Å; F300-L310 HydrophobicContact CE1-CD1 3.93Å |
| 301 | V | 92.8 | Very high | 92.7 | Very high | 29 Ų | 29 | 31 Ų | 31 | 18% | 0.176 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -65.7 | -47.7 | 179.5 | 171.8 | 0 | 0 | 0 | 0 | 110.4 | V297 Y298 G304 M305 L310 V313 | V297-V301 HydrophobicContact CG1-CG2 3.84Å; V297-V301 VanDerWaalsContact O-CB 3.25Å; V297-V301 WeakPolarHBondContact O-CB 3.16Å; V297-V301 WeakPolarHBondContact O-CG2 3.43Å; V297-V301 PolarHBondContact O-N 3.41Å; Y298-V301 PolarHBondContact O-N 3.41Å; V301-G304 PolarHBondContact O-N 3.24Å; V301-M305 HydrophobicContact CG1-CE 4.04Å; V301-M305 HydrophobicContact CG1-CG 4.24Å; V301-M305 HydrophobicContact CG1-SD 4.08Å; V301-M305 WeakPolarHBondContact O-CB 3.47Å; V301-M305 WeakPolarHBondContact O-CG 3.49Å; V301-M305 PolarHBondContact O-N 3.41Å; V301-L310 HydrophobicContact CB-CD1 4.49Å; V301-L310 HydrophobicContact CG2-CD1 4.32Å; V301-V313 HydrophobicContact CG1-CG2 4.07Å |
| 302 | N | 92.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 31.6 Ų | 31.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60 | -51.9 | 178.1 | -179.2 | -87.8 | 0 | 0 | 0 | 112 | D243 Y298 G304 M305 V306 V315 L317 | D243-N302 PolarHBondContact O-ND2 2.72Å; Y298-N302 WeakPolarHBondContact O-CB 3.4Å; Y298-N302 PolarHBondContact O-N 3.21Å; N302-G304 VanDerWaalsContact C-N 3.32Å; N302-G304 PolarHBondContact O-N 2.85Å; N302-M305 HydrophobicContact CB-CE 4.29Å; N302-M305 PolarHBondContact O-N 2.98Å; N302-V306 VanDerWaalsContact O-CG2 3.26Å; N302-V306 WeakPolarHBondContact O-CG2 3.36Å; N302-V306 PolarHBondContact O-N 3.23Å; N302-V315 PolarHBondContact ND2-O 2.94Å; N302-L317 HydrophobicContact CB-CB 4.39Å; N302-L317 HydrophobicContact CB-CD1 3.94Å; N302-L317 PolarHBondContact ND2-N 2.81Å; N302-L317 WeakPolarHBondContact OD1-CB 3.25Å; N302-L317 WeakPolarHBondContact OD1-CD1 3.47Å |
| 303 | I | 93.6 | Very high | 90.8 | Very high | 31 Ų | 31 | 32.7 Ų | 32.7 | 16% | 0.159 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.7 | -43.9 | 179.9 | -65.4 | 177.7 | 0 | 0 | 0 | 110.6 | F246 L262 V299 M305 V306 S307 L317 | F246-I303 HydrophobicContact CD1-CG2 4.49Å; F246-I303 HydrophobicContact CD2-CD1 4.15Å; F246-I303 HydrophobicContact CD2-CG1 3.79Å; F246-I303 HydrophobicContact CE1-CG2 3.95Å; F246-I303 HydrophobicContact CE2-CD1 3.78Å; F246-I303 HydrophobicContact CE2-CG1 3.8Å; F246-I303 HydrophobicContact CE2-CG2 4.26Å; F246-I303 HydrophobicContact CG-CG1 4.2Å; F246-I303 HydrophobicContact CZ-CD1 4.34Å; F246-I303 HydrophobicContact CZ-CG1 4.22Å; F246-I303 HydrophobicContact CZ-CG2 3.82Å; L262-I303 HydrophobicContact CD2-CD1 3.53Å; V299-I303 HydrophobicContact CG1-CD1 3.69Å; V299-I303 HydrophobicContact CG1-CG1 4.43Å; V299-I303 WeakPolarHBondContact O-CB 3.31Å; V299-I303 VanDerWaalsContact O-CG1 3.27Å; V299-I303 WeakPolarHBondContact O-CG1 3.42Å; V299-I303 PolarHBondContact O-N 2.85Å; I303-M305 VanDerWaalsContact C-N 3.34Å; I303-M305 PolarHBondContact O-N 2.86Å; I303-V306 PolarHBondContact O-N 3.36Å; I303-S307 WeakPolarHBondContact O-CB 3.25Å; I303-S307 PolarHBondContact O-N 2.74Å; I303-S307 PolarHBondContact O-OG 2.87Å; I303-L317 HydrophobicContact CG1-CD1 4.32Å |
| 304 | G | 92.5 | Very high | 89.9 | Confident | 6 Ų | 6 | 32 Ų | 32 | 6% | 0.062 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -62.5 | -37.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | F300 V301 N302 S307 G308 I309 L310 | F300-G304 PolarHBondContact O-N 3.14Å; V301-G304 PolarHBondContact O-N 3.24Å; N302-G304 VanDerWaalsContact C-N 3.32Å; N302-G304 PolarHBondContact O-N 2.85Å; G304-S307 PolarHBondContact O-OG 2.9Å; G304-G308 PolarHBondContact O-N 3.4Å; G304-I309 WeakPolarHBondContact O-CA 3.32Å; G304-I309 PolarHBondContact O-N 2.99Å; G304-L310 PolarHBondContact O-N 3.31Å |
| 305 | M | 90 | Very high | 89.3 | Confident | 3 Ų | 3 | 31.6 Ų | 31.6 | 2% | 0.015 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -65.6 | -49.5 | 174.3 | -73.6 | -175.1 | -56.7 | 0 | 0 | 111.7 | V301 N302 I303 S307 G308 L310 P311 V312 V313 V315 | V301-M305 HydrophobicContact CG1-CE 4.04Å; V301-M305 HydrophobicContact CG1-CG 4.24Å; V301-M305 HydrophobicContact CG1-SD 4.08Å; V301-M305 WeakPolarHBondContact O-CB 3.47Å; V301-M305 WeakPolarHBondContact O-CG 3.49Å; V301-M305 PolarHBondContact O-N 3.41Å; N302-M305 HydrophobicContact CB-CE 4.29Å; N302-M305 PolarHBondContact O-N 2.98Å; I303-M305 VanDerWaalsContact C-N 3.34Å; I303-M305 PolarHBondContact O-N 2.86Å; M305-S307 VanDerWaalsContact C-N 3.31Å; M305-S307 PolarHBondContact O-N 2.92Å; M305-G308 PolarHBondContact O-N 3.37Å; M305-L310 WeakPolarHBondContact CA-O 3.22Å; M305-L310 HydrophobicContact CG-CB 4.25Å; M305-P311 VanDerWaalsContact CG-O 3.27Å; M305-P311 WeakPolarHBondContact CG-O 3.5Å; M305-V312 HydrophobicContact CB-CG2 4.5Å; M305-V313 HydrophobicContact CE-CG2 4.3Å; M305-V313 HydrophobicContact SD-CB 4.14Å; M305-V313 HydrophobicContact SD-CG2 3.3Å; M305-V313 WeakPolarHBondContact SD-CG2 3.37Å; M305-V313 PolarHBondContact SD-N 3.2Å; M305-V315 HydrophobicContact CE-CB 3.77Å; M305-V315 WeakPolarHBondContact CE-O 3.44Å |
| 306 | V | 89.2 | Confident | 89 | Confident | 2 Ų | 2 | 32.8 Ų | 32.8 | 1% | 0.012 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.4 | -33.5 | -175 | -179.9 | 0 | 0 | 0 | 0 | 110.8 | S212 I216 D243 F244 F246 A247 N302 I303 G308 | S212-V306 WeakPolarHBondContact CB-O 3.47Å; S212-V306 WeakPolarHBondContact OG-CG1 3.4Å; S212-V306 PolarHBondContact OG-O 2.95Å; I216-V306 HydrophobicContact CD1-CG1 4.02Å; D243-V306 WeakPolarHBondContact O-CG2 3.28Å; F244-V306 HydrophobicContact CD1-CB 4.48Å; F244-V306 HydrophobicContact CD1-CG1 4.04Å; F244-V306 HydrophobicContact CD1-CG2 4.13Å; F246-V306 HydrophobicContact CB-CB 4.4Å; F246-V306 HydrophobicContact CB-CG1 4.09Å; F246-V306 HydrophobicContact CB-CG2 4.43Å; F246-V306 HydrophobicContact CD1-CB 4.29Å; F246-V306 HydrophobicContact CD1-CG1 3.97Å; A247-V306 HydrophobicContact CB-CG1 3.71Å; N302-V306 VanDerWaalsContact O-CG2 3.26Å; N302-V306 WeakPolarHBondContact O-CG2 3.36Å; N302-V306 PolarHBondContact O-N 3.23Å; I303-V306 PolarHBondContact O-N 3.36Å; V306-G308 VanDerWaalsContact C-N 3.28Å; V306-G308 PolarHBondContact O-N 3.22Å |
| 307 | S | 90.2 | Very high | 88.8 | Confident | 33 Ų | 33 | 27.7 Ų | 27.7 | 23% | 0.231 | 16% | 0.16 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -5.7 | 172.4 | 69.9 | 0 | 0 | 0 | 0 | 114.1 | K213 I303 G304 M305 I309 | K213-S307 VanDerWaalsContact CE-O 3.31Å; K213-S307 WeakPolarHBondContact CE-O 3.23Å; I303-S307 WeakPolarHBondContact O-CB 3.25Å; I303-S307 PolarHBondContact O-N 2.74Å; I303-S307 PolarHBondContact O-OG 2.87Å; G304-S307 PolarHBondContact O-OG 2.9Å; M305-S307 VanDerWaalsContact C-N 3.31Å; M305-S307 PolarHBondContact O-N 2.92Å; S307-I309 VanDerWaalsContact OG-CD1 3.31Å; S307-I309 WeakPolarHBondContact OG-CD1 2.91Å; S307-I309 WeakPolarHBondContact OG-CG1 3.17Å |
| 308 | G | 87.4 | Confident | 88.8 | Confident | 10 Ų | 10 | 26.8 Ų | 26.8 | 10% | 0.103 | 16% | 0.155 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 66.3 | 36.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | L195 G304 M305 V306 | L195-G308 WeakPolarHBondContact CD1-O 3.19Å; G304-G308 PolarHBondContact O-N 3.4Å; M305-G308 PolarHBondContact O-N 3.37Å; V306-G308 VanDerWaalsContact C-N 3.28Å; V306-G308 PolarHBondContact O-N 3.22Å |
| 309 | I | 88.6 | Confident | 88.8 | Confident | 120 Ų | 120 | 26.6 Ų | 26.6 | 62% | 0.615 | 16% | 0.155 | S | C | * | . | S | Bend | trans | -94.8 | -27.1 | 168 | -61.3 | 170.4 | 0 | 0 | 0 | 110.4 | G304 S307 | G304-I309 WeakPolarHBondContact O-CA 3.32Å; G304-I309 PolarHBondContact O-N 2.99Å; S307-I309 VanDerWaalsContact OG-CD1 3.31Å; S307-I309 WeakPolarHBondContact OG-CD1 2.91Å; S307-I309 WeakPolarHBondContact OG-CG1 3.17Å |
| 310 | L | 88.5 | Confident | 88.8 | Confident | 46 Ų | 46 | 26.1 Ų | 26.1 | 24% | 0.241 | 15% | 0.151 | C | C | . | . | S | Bend | trans | -123.8 | 154 | 177.9 | -67.3 | 175.4 | 0 | 0 | 0 | 110.9 | F300 V301 G304 M305 | F300-L310 HydrophobicContact CD1-CD1 4.13Å; F300-L310 HydrophobicContact CE1-CD1 3.93Å; V301-L310 HydrophobicContact CB-CD1 4.49Å; V301-L310 HydrophobicContact CG2-CD1 4.32Å; G304-L310 PolarHBondContact O-N 3.31Å; M305-L310 WeakPolarHBondContact CA-O 3.22Å; M305-L310 HydrophobicContact CG-CB 4.25Å |
| 311 | P | 84.5 | Confident | 88.6 | Confident | 37 Ų | 37 | 20.8 Ų | 20.8 | 24% | 0.24 | 13% | 0.129 | C | C | . | . | trans | -70.5 | 140.7 | 179.2 | 30 | -33.3 | 0 | 0 | 0 | 110.5 | L195 M305 V313 | L195-P311 HydrophobicContact CD2-CB 4.47Å; M305-P311 VanDerWaalsContact CG-O 3.27Å; M305-P311 WeakPolarHBondContact CG-O 3.5Å; P311-V313 PolarHBondContact O-N 3.21Å | ||
| 312 | V | 79 | Confident | 88.3 | Confident | 28 Ų | 28 | 22.2 Ų | 22.2 | 17% | 0.17 | 13% | 0.131 | C | C | . | . | trans | -69.5 | 105.4 | -176.7 | -176.9 | 0 | 0 | 0 | 0 | 110.4 | R191 I209 F244 M305 | R191-V312 VanDerWaalsContact CD-O 3.24Å; R191-V312 WeakPolarHBondContact CD-O 3.32Å; R191-V312 PolarHBondContact NE-O 3.12Å; R191-V312 PolarHBondContact NH1-O 3.41Å; I209-V312 HydrophobicContact CD1-CG2 3.74Å; I209-V312 HydrophobicContact CG1-CG2 3.66Å; F244-V312 HydrophobicContact CE2-CG1 4.38Å; F244-V312 HydrophobicContact CZ-CG1 4.13Å; F244-V312 HydrophobicContact CZ-CG2 4.23Å; M305-V312 HydrophobicContact CB-CG2 4.5Å | ||
| 313 | V | 75.4 | Confident | 87.8 | Confident | 25 Ų | 25 | 23.1 Ų | 23.1 | 15% | 0.152 | 14% | 0.14 | C | C | . | . | trans | -97.7 | -8 | 176.9 | -67.4 | 0 | 0 | 0 | 0 | 114.5 | L141 V301 M305 P311 V315 | L141-V313 HydrophobicContact CD2-CG1 4.47Å; V301-V313 HydrophobicContact CG1-CG2 4.07Å; M305-V313 HydrophobicContact CE-CG2 4.3Å; M305-V313 HydrophobicContact SD-CB 4.14Å; M305-V313 HydrophobicContact SD-CG2 3.3Å; M305-V313 WeakPolarHBondContact SD-CG2 3.37Å; M305-V313 PolarHBondContact SD-N 3.2Å; P311-V313 PolarHBondContact O-N 3.21Å; V313-V315 HydrophobicContact CG2-CG2 3.71Å | ||
| 314 | G | 76.7 | Confident | 87.3 | Confident | 26 Ų | 26 | 22.2 Ų | 22.2 | 27% | 0.268 | 14% | 0.139 | S | C | . | . | trans | 78.5 | 49.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | D243 | D243-G314 WeakPolarHBondContact OD2-CA 3.44Š| ||
| 315 | V | 83.7 | Confident | 87.1 | Confident | 2 Ų | 2 | 22.3 Ų | 22.3 | 1% | 0.012 | 14% | 0.139 | C | C | . | . | trans | -109.1 | 122.6 | 179.7 | 174.4 | 0 | 0 | 0 | 0 | 108.3 | L146 Y298 N302 M305 V313 | L146-V315 HydrophobicContact CD1-CB 4.27Å; L146-V315 HydrophobicContact CD1-CG1 3.49Å; L146-V315 VanDerWaalsContact CD1-CG1 3.49Å; L146-V315 HydrophobicContact CD1-CG2 3.72Å; Y298-V315 HydrophobicContact CD1-CG1 4.02Å; Y298-V315 HydrophobicContact CE1-CG1 4.25Å; N302-V315 PolarHBondContact ND2-O 2.94Å; M305-V315 HydrophobicContact CE-CB 3.77Å; M305-V315 WeakPolarHBondContact CE-O 3.44Å; V313-V315 HydrophobicContact CG2-CG2 3.71Å | ||
| 316 | P | 89.7 | Confident | 87.1 | Confident | 27 Ų | 27 | 22.7 Ų | 22.7 | 18% | 0.175 | 14% | 0.142 | C | C | . | . | P | Polyproline II helix | trans | -70.9 | 151 | -179.7 | 28.1 | -34.5 | 0 | 0 | 0 | 111.7 | P318 | P316-P318 WeakPolarHBondContact O-CD 3.38Š|
| 317 | L | 92.9 | Very high | 87.3 | Confident | 1 Ų | 1 | 22.8 Ų | 22.8 | 1% | 0.005 | 14% | 0.143 | C | C | . | . | P | Polyproline II helix | trans | -69 | 119.7 | 173.8 | -170.6 | 62.2 | 0 | 0 | 0 | 109.9 | I245 F246 L261 Y265 N302 I303 L319 V320 S321 | I245-L317 HydrophobicContact CG2-CB 3.96Å; I245-L317 HydrophobicContact CG2-CD2 4.06Å; F246-L317 HydrophobicContact CB-CD2 4.23Å; F246-L317 HydrophobicContact CD2-CD2 4.42Å; L261-L317 HydrophobicContact CD2-CD2 4.06Å; Y265-L317 HydrophobicContact CE2-CD1 4.24Å; Y265-L317 WeakPolarHBondContact OH-CG 3.25Å; N302-L317 HydrophobicContact CB-CB 4.39Å; N302-L317 HydrophobicContact CB-CD1 3.94Å; N302-L317 PolarHBondContact ND2-N 2.81Å; N302-L317 WeakPolarHBondContact OD1-CB 3.25Å; N302-L317 WeakPolarHBondContact OD1-CD1 3.47Å; I303-L317 HydrophobicContact CG1-CD1 4.32Å; L317-L319 PolarHBondContact O-N 3.34Å; L317-V320 HydrophobicContact CB-CB 4.36Å; L317-V320 HydrophobicContact CD2-CB 3.85Å; L317-V320 HydrophobicContact CD2-CG1 4.03Å; L317-V320 HydrophobicContact CD2-CG2 4.2Å; L317-V320 HydrophobicContact CG-CB 4.08Å; L317-V320 HydrophobicContact CG-CG2 4.44Å; L317-V320 PolarHBondContact O-N 3.22Å; L317-S321 WeakPolarHBondContact CA-OG 3.35Å; L317-S321 VanDerWaalsContact CB-OG 3.3Å; L317-S321 WeakPolarHBondContact CB-OG 3.3Å; L317-S321 PolarHBondContact N-OG 3.43Å; L317-S321 WeakPolarHBondContact O-CB 3.08Å; L317-S321 PolarHBondContact O-N 3.2Å; L317-S321 PolarHBondContact O-OG 2.89Å |
| 318 | P | 93.5 | Very high | 87.4 | Confident | 2 Ų | 2 | 23.4 Ų | 23.4 | 1% | 0.013 | 14% | 0.143 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -51.9 | 129.8 | -173.1 | -31.2 | 36.7 | 0 | 0 | 0 | 113.9 | Y265 L295 Y298 V299 P316 V320 L330 | Y265-P318 HydrophobicContact CE1-CB 4.38Å; Y265-P318 PolarHBondContact OH-O 3.34Å; L295-P318 HydrophobicContact CD1-CB 3.68Å; L295-P318 HydrophobicContact CD1-CG 3.97Å; Y298-P318 HydrophobicContact CD1-CG 3.8Å; Y298-P318 HydrophobicContact CG-CG 3.93Å; V299-P318 HydrophobicContact CG2-CG 4.1Å; P316-P318 WeakPolarHBondContact O-CD 3.38Å; P318-V320 PolarHBondContact O-N 3.14Å; P318-L330 HydrophobicContact CB-CD1 3.73Å |
| 319 | L | 94 | Very high | 87.7 | Confident | 4 Ų | 4 | 23.6 Ų | 23.6 | 2% | 0.021 | 14% | 0.142 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 66.2 | -28 | -179.1 | -50.8 | 174.6 | 0 | 0 | 0 | 115.7 | L5 L8 L9 S12 K30 L317 L327 L330 M331 F334 | L5-L319 HydrophobicContact CD2-CD1 3.67Å; L8-L319 HydrophobicContact CB-CD1 4.5Å; L8-L319 HydrophobicContact CD1-CD1 4.34Å; L9-L319 HydrophobicContact CD2-CB 4.42Å; L9-L319 HydrophobicContact CD2-CD2 4.38Å; S12-L319 VanDerWaalsContact CB-O 3.29Å; S12-L319 WeakPolarHBondContact CB-O 3.43Å; S12-L319 PolarHBondContact OG-O 3.45Å; K30-L319 PolarHBondContact NZ-O 2.83Å; L317-L319 PolarHBondContact O-N 3.34Å; L319-L327 HydrophobicContact CD2-CG 4.37Å; L319-L330 HydrophobicContact CD2-CB 4.24Å; L319-M331 HydrophobicContact CD2-CG 4.18Å; L319-M331 HydrophobicContact CD2-SD 3.83Å; L319-F334 HydrophobicContact CD1-CE2 3.84Å; L319-F334 HydrophobicContact CD1-CZ 4.38Å; L319-F334 HydrophobicContact CD2-CE2 4.11Å; L319-F334 HydrophobicContact CG-CE2 4.27Å |
| 320 | V | 94.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82.7 | -56.9 | -175.4 | -179.4 | 0 | 0 | 0 | 0 | 111.1 | I16 K30 I245 L261 Y265 L317 P318 | I16-V320 WeakPolarHBondContact CG1-O 3.42Å; K30-V320 PolarHBondContact NZ-O 3.28Å; I245-V320 HydrophobicContact CD1-CG1 4.04Å; I245-V320 HydrophobicContact CG1-CG1 4.29Å; I245-V320 HydrophobicContact CG2-CG1 3.97Å; L261-V320 HydrophobicContact CD1-CG2 3.85Å; Y265-V320 VanDerWaalsContact OH-CG2 3.25Å; Y265-V320 WeakPolarHBondContact OH-CG2 3.39Å; L317-V320 HydrophobicContact CB-CB 4.36Å; L317-V320 HydrophobicContact CD2-CB 3.85Å; L317-V320 HydrophobicContact CD2-CG1 4.03Å; L317-V320 HydrophobicContact CD2-CG2 4.2Å; L317-V320 HydrophobicContact CG-CB 4.08Å; L317-V320 HydrophobicContact CG-CG2 4.44Å; L317-V320 PolarHBondContact O-N 3.22Å; P318-V320 PolarHBondContact O-N 3.14Å |
| 321 | S | 91.3 | Very high | 88.5 | Confident | 5 Ų | 5 | 17.2 Ų | 17.2 | 4% | 0.035 | 11% | 0.109 | C | C | . | . | S | Bend | trans | -58.8 | 157.6 | 178.5 | -63.3 | 0 | 0 | 0 | 0 | 113.2 | K30 T242 I245 L317 | K30-S321 PolarHBondContact NZ-O 2.97Å; T242-S321 VanDerWaalsContact O-CB 3.24Å; T242-S321 WeakPolarHBondContact O-CB 3.47Å; T242-S321 PolarHBondContact O-OG 3.23Å; I245-S321 WeakPolarHBondContact CG2-OG 3.18Å; L317-S321 WeakPolarHBondContact CA-OG 3.35Å; L317-S321 VanDerWaalsContact CB-OG 3.3Å; L317-S321 WeakPolarHBondContact CB-OG 3.3Å; L317-S321 PolarHBondContact N-OG 3.43Å; L317-S321 WeakPolarHBondContact O-CB 3.08Å; L317-S321 PolarHBondContact O-N 3.2Å; L317-S321 PolarHBondContact O-OG 2.89Å |
| 322 | Y | 85.8 | Confident | 89.1 | Confident | 59 Ų | 59 | 16 Ų | 16 | 23% | 0.231 | 10% | 0.102 | C | C | . | . | S | Bend | trans | -70.4 | 131.3 | 166.9 | -173.4 | -97.4 | 0 | 0 | 0 | 109.9 | M26 R29 Q33 H241 T242 | M26-Y322 HydrophobicContact CG-CD2 4.25Å; M26-Y322 HydrophobicContact CG-CE2 4.31Å; R29-Y322 HydrophobicContact CB-CE2 4.11Å; Q33-Y322 PolarHBondContact NE2-OH 3.38Å; H241-Y322 VanDerWaalsContact O-CB 3.31Å; H241-Y322 WeakPolarHBondContact O-CB 3.47Å; H241-Y322 PolarHBondContact O-N 3.12Å; T242-Y322 HydrophobicContact CG2-CD1 4.49Å |
| 323 | G | 83.9 | Confident | 89.9 | Confident | 18 Ų | 18 | 14.9 Ų | 14.9 | 19% | 0.186 | 10% | 0.097 | C | C | . | . | trans | 165.3 | 87.9 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | A326 L327 | G323-A326 PolarHBondContact O-N 3.17Å; G323-L327 WeakPolarHBondContact O-CB 3.49Å; G323-L327 PolarHBondContact O-N 3.45Å | ||
| 324 | G | 82.9 | Confident | 91 | Very high | 13 Ų | 13 | 13.9 Ų | 13.9 | 13% | 0.134 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -58.9 | -52.5 | -171.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A326 L327 I328 | G324-A326 PolarHBondContact O-N 2.72Å; G324-L327 PolarHBondContact O-N 3.49Å; G324-I328 WeakPolarHBondContact O-CB 3.38Å; G324-I328 WeakPolarHBondContact O-CD1 3.47Å; G324-I328 WeakPolarHBondContact O-CG1 3.31Å; G324-I328 PolarHBondContact O-N 3.42Å |
| 325 | S | 87.6 | Confident | 92 | Very high | 8 Ų | 8 | 12.7 Ų | 12.7 | 6% | 0.056 | 8% | 0.078 | C | C | . | . | H | α-helix | trans | -58.2 | -47.3 | 178.4 | -55.1 | 0 | 0 | 0 | 0 | 111.9 | Q92 I328 V329 | Q92-S325 PolarHBondContact N-OG 2.62Å; S325-I328 PolarHBondContact O-N 3.12Å; S325-V329 WeakPolarHBondContact O-CB 3.28Å; S325-V329 WeakPolarHBondContact O-CG2 3.33Å; S325-V329 PolarHBondContact O-N 3.04Å |
| 326 | A | 89.4 | Confident | 92.6 | Very high | 11 Ų | 11 | 12.6 Ų | 12.6 | 9% | 0.091 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -63.9 | -44.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | E95 G323 G324 L330 | E95-A326 HydrophobicContact CG-CB 4.47Å; E95-A326 WeakPolarHBondContact OE2-CA 3.37Å; G323-A326 PolarHBondContact O-N 3.17Å; G324-A326 PolarHBondContact O-N 2.72Å; A326-L330 WeakPolarHBondContact O-CB 3.09Å; A326-L330 VanDerWaalsContact O-CG 3.28Å; A326-L330 WeakPolarHBondContact O-CG 3.5Å; A326-L330 PolarHBondContact O-N 3.17Å |
| 327 | L | 93.4 | Very high | 93 | Very high | 4 Ų | 4 | 11.3 Ų | 11.3 | 2% | 0.021 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -62.3 | -48.9 | 176.9 | -174.8 | 154.2 | 0 | 0 | 0 | 110.8 | L9 Q33 I34 L319 G323 G324 V329 L330 M331 | L9-L327 HydrophobicContact CD2-CD1 4.39Å; Q33-L327 WeakPolarHBondContact O-CD2 3.49Å; I34-L327 HydrophobicContact CG1-CD1 4.07Å; L319-L327 HydrophobicContact CD2-CG 4.37Å; G323-L327 WeakPolarHBondContact O-CB 3.49Å; G323-L327 PolarHBondContact O-N 3.45Å; G324-L327 PolarHBondContact O-N 3.49Å; L327-V329 VanDerWaalsContact C-N 3.34Å; L327-V329 PolarHBondContact O-N 3.05Å; L327-L330 PolarHBondContact O-N 3.33Å; L327-M331 HydrophobicContact CD2-CG 3.82Å; L327-M331 HydrophobicContact CG-CG 4.41Å; L327-M331 WeakPolarHBondContact O-CB 3.06Å; L327-M331 WeakPolarHBondContact O-CG 3.12Å; L327-M331 PolarHBondContact O-N 3.08Å |
| 328 | I | 93.8 | Very high | 93.1 | Very high | 46 Ų | 46 | 12.6 Ų | 12.6 | 24% | 0.236 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.2 | -46.3 | -179.6 | -74.2 | 163.1 | 0 | 0 | 0 | 111 | M36 I40 G324 S325 M331 A332 | M36-I328 HydrophobicContact CG-CD1 4.12Å; M36-I328 HydrophobicContact CG-CG1 4.37Å; I40-I328 HydrophobicContact CD1-CG2 3.44Å; I40-I328 VanDerWaalsContact CD1-CG2 3.44Å; G324-I328 WeakPolarHBondContact O-CB 3.38Å; G324-I328 WeakPolarHBondContact O-CD1 3.47Å; G324-I328 WeakPolarHBondContact O-CG1 3.31Å; G324-I328 PolarHBondContact O-N 3.42Å; S325-I328 PolarHBondContact O-N 3.12Å; I328-M331 PolarHBondContact O-N 3.06Å; I328-A332 PolarHBondContact O-N 3.5Å |
| 329 | V | 94 | Very high | 93.3 | Very high | 13 Ų | 13 | 12.5 Ų | 12.5 | 8% | 0.079 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -65 | -46.7 | 178.9 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | E95 I96 I99 S325 L327 M331 A332 G333 | E95-V329 HydrophobicContact CB-CB 4.35Å; E95-V329 HydrophobicContact CB-CG2 3.83Å; E95-V329 WeakPolarHBondContact O-CG1 3.26Å; I96-V329 HydrophobicContact CG1-CG2 4.42Å; I99-V329 HydrophobicContact CD1-CG1 3.6Å; I99-V329 WeakPolarHBondContact CD1-O 3.48Å; I99-V329 HydrophobicContact CG1-CG1 3.8Å; S325-V329 WeakPolarHBondContact O-CB 3.28Å; S325-V329 WeakPolarHBondContact O-CG2 3.33Å; S325-V329 PolarHBondContact O-N 3.04Å; L327-V329 VanDerWaalsContact C-N 3.34Å; L327-V329 PolarHBondContact O-N 3.05Å; V329-M331 VanDerWaalsContact C-N 3.27Å; V329-M331 PolarHBondContact O-N 3.39Å; V329-A332 WeakPolarHBondContact O-CB 3.18Å; V329-A332 PolarHBondContact O-N 3.15Å; V329-A332 VanDerWaalsContact O-N 3.13Å; V329-G333 PolarHBondContact O-N 2.97Å |
| 330 | L | 95.3 | Very high | 93.2 | Very high | 32 Ų | 32 | 12.9 Ų | 12.9 | 17% | 0.168 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -57.5 | -42.6 | 176.2 | -77 | 168.1 | 0 | 0 | 0 | 111.7 | P318 L319 A326 L327 G333 F334 | P318-L330 HydrophobicContact CB-CD1 3.73Å; L319-L330 HydrophobicContact CD2-CB 4.24Å; A326-L330 WeakPolarHBondContact O-CB 3.09Å; A326-L330 VanDerWaalsContact O-CG 3.28Å; A326-L330 WeakPolarHBondContact O-CG 3.5Å; A326-L330 PolarHBondContact O-N 3.17Å; L327-L330 PolarHBondContact O-N 3.33Å; L330-G333 WeakPolarHBondContact O-CA 3.47Å; L330-G333 PolarHBondContact O-N 3.47Å; L330-G333 VanDerWaalsContact O-N 3.16Å; L330-F334 HydrophobicContact CB-CE2 4.28Å; L330-F334 WeakPolarHBondContact O-CD2 3.21Å; L330-F334 WeakPolarHBondContact O-CG 3.21Å; L330-F334 PolarHBondContact O-N 3.28Å |
| 331 | M | 97.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -64.4 | -39.9 | 176.2 | -69.4 | -60.8 | -73 | 0 | 0 | 112.4 | L9 G37 L38 M41 L319 L327 I328 V329 G333 F334 G335 | L9-M331 HydrophobicContact CD1-CE 3.92Å; L9-M331 HydrophobicContact CD1-SD 4.33Å; G37-M331 WeakPolarHBondContact O-CB 3.15Å; L38-M331 HydrophobicContact CD2-CE 3.63Å; L38-M331 HydrophobicContact CG-CE 4.06Å; M41-M331 HydrophobicContact CB-CB 4.21Å; M41-M331 HydrophobicContact CB-CE 3.97Å; M41-M331 VanDerWaalsContact CB-O 3.29Å; M41-M331 WeakPolarHBondContact CB-O 3.48Å; M41-M331 HydrophobicContact CE-CE 3.89Å; M41-M331 HydrophobicContact CG-CE 4.32Å; M41-M331 WeakPolarHBondContact CG-O 3.34Å; M41-M331 HydrophobicContact SD-CE 3.49Å; M41-M331 WeakPolarHBondContact SD-CE 3.49Å; M41-M331 HydrophobicContact SD-SD 4.38Å; L319-M331 HydrophobicContact CD2-CG 4.18Å; L319-M331 HydrophobicContact CD2-SD 3.83Å; L327-M331 HydrophobicContact CD2-CG 3.82Å; L327-M331 HydrophobicContact CG-CG 4.41Å; L327-M331 WeakPolarHBondContact O-CB 3.06Å; L327-M331 WeakPolarHBondContact O-CG 3.12Å; L327-M331 PolarHBondContact O-N 3.08Å; I328-M331 PolarHBondContact O-N 3.06Å; V329-M331 VanDerWaalsContact C-N 3.27Å; V329-M331 PolarHBondContact O-N 3.39Å; M331-G333 VanDerWaalsContact C-N 3.32Å; M331-G333 PolarHBondContact O-N 2.78Å; M331-F334 PolarHBondContact O-N 3.2Å; M331-F334 HydrophobicContact SD-CD2 4.12Å; M331-G335 PolarHBondContact O-N 2.81Å |
| 332 | A | 96.9 | Very high | 93.1 | Very high | 12 Ų | 12 | 19.3 Ų | 19.3 | 10% | 0.099 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -60.6 | -42 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | I40 M44 I99 I328 V329 G335 I336 | I40-A332 HydrophobicContact CG2-CB 3.76Å; M44-A332 HydrophobicContact CE-CB 4.47Å; M44-A332 HydrophobicContact CG-CB 4.38Å; I99-A332 HydrophobicContact CD1-CB 4.14Å; I328-A332 PolarHBondContact O-N 3.5Å; V329-A332 WeakPolarHBondContact O-CB 3.18Å; V329-A332 PolarHBondContact O-N 3.15Å; V329-A332 VanDerWaalsContact O-N 3.13Å; A332-G335 WeakPolarHBondContact O-CA 3.47Å; A332-G335 PolarHBondContact O-N 2.82Å; A332-G335 VanDerWaalsContact O-N 3.15Å; A332-I336 WeakPolarHBondContact O-CG1 3.3Å; A332-I336 PolarHBondContact O-N 2.85Å |
| 333 | G | 97.1 | Very high | 93 | Very high | 5 Ų | 5 | 20 Ų | 20 | 5% | 0.052 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -59.8 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V329 L330 M331 G335 I336 V337 | V329-G333 PolarHBondContact O-N 2.97Å; L330-G333 WeakPolarHBondContact O-CA 3.47Å; L330-G333 PolarHBondContact O-N 3.47Å; L330-G333 VanDerWaalsContact O-N 3.16Å; M331-G333 VanDerWaalsContact C-N 3.32Å; M331-G333 PolarHBondContact O-N 2.78Å; G333-G335 VanDerWaalsContact C-N 3.3Å; G333-G335 PolarHBondContact O-N 3.43Å; G333-I336 WeakPolarHBondContact O-CB 3.4Å; G333-I336 PolarHBondContact O-N 2.65Å; G333-V337 WeakPolarHBondContact O-CG2 3.38Å; G333-V337 PolarHBondContact O-N 3.4Å |
| 334 | F | 97.8 | Very high | 92.5 | Very high | 4 Ų | 4 | 23.1 Ų | 23.1 | 2% | 0.018 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.6 | -37.3 | 173.3 | -66.4 | -51.2 | 0 | 0 | 0 | 112.5 | M1 L5 M41 L268 M292 L295 L319 L330 M331 V337 M338 | M1-F334 HydrophobicContact CE-CB 3.97Å; M1-F334 HydrophobicContact CE-CD1 3.26Å; M1-F334 HydrophobicContact CE-CE1 4.08Å; M1-F334 HydrophobicContact CE-CG 3.98Å; L5-F334 HydrophobicContact CD1-CB 3.95Å; L5-F334 HydrophobicContact CD1-CD2 4.14Å; L5-F334 HydrophobicContact CD1-CG 3.98Å; L5-F334 HydrophobicContact CD2-CD1 4.45Å; L5-F334 HydrophobicContact CD2-CD2 3.65Å; L5-F334 HydrophobicContact CD2-CE1 4.38Å; L5-F334 HydrophobicContact CD2-CE2 3.64Å; L5-F334 HydrophobicContact CD2-CG 4.09Å; L5-F334 HydrophobicContact CD2-CZ 4Å; M41-F334 HydrophobicContact CG-CB 4.36Å; M41-F334 HydrophobicContact SD-CB 4.22Å; L268-F334 HydrophobicContact CD1-CE1 4.31Å; L268-F334 HydrophobicContact CD2-CE1 3.94Å; L268-F334 HydrophobicContact CD2-CZ 3.72Å; L268-F334 HydrophobicContact CG-CE1 4.21Å; L268-F334 HydrophobicContact CG-CZ 4.48Å; M292-F334 HydrophobicContact CE-CD1 3.91Å; M292-F334 HydrophobicContact CE-CE1 3.66Å; M292-F334 HydrophobicContact SD-CE1 4.37Å; L295-F334 HydrophobicContact CD1-CZ 4.16Å; L295-F334 HydrophobicContact CD2-CE1 3.73Å; L295-F334 HydrophobicContact CD2-CZ 3.66Å; L319-F334 HydrophobicContact CD1-CE2 3.84Å; L319-F334 HydrophobicContact CD1-CZ 4.38Å; L319-F334 HydrophobicContact CD2-CE2 4.11Å; L319-F334 HydrophobicContact CG-CE2 4.27Å; L330-F334 HydrophobicContact CB-CE2 4.28Å; L330-F334 WeakPolarHBondContact O-CD2 3.21Å; L330-F334 WeakPolarHBondContact O-CG 3.21Å; L330-F334 PolarHBondContact O-N 3.28Å; M331-F334 PolarHBondContact O-N 3.2Å; M331-F334 HydrophobicContact SD-CD2 4.12Å; F334-V337 PolarHBondContact O-N 2.97Å; F334-M338 WeakPolarHBondContact O-CG 3.38Å; F334-M338 PolarHBondContact O-N 3.06Å |
| 335 | G | 97.6 | Very high | 91.6 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -58.5 | -45.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | M41 A45 M331 A332 G333 V337 M338 S339 | M41-G335 WeakPolarHBondContact O-CA 3.32Å; A45-G335 VanDerWaalsContact CA-O 3.32Å; A45-G335 WeakPolarHBondContact CA-O 3.28Å; M331-G335 PolarHBondContact O-N 2.81Å; A332-G335 WeakPolarHBondContact O-CA 3.47Å; A332-G335 PolarHBondContact O-N 2.82Å; A332-G335 VanDerWaalsContact O-N 3.15Å; G333-G335 VanDerWaalsContact C-N 3.3Å; G333-G335 PolarHBondContact O-N 3.43Å; G335-V337 PolarHBondContact O-N 2.78Å; G335-M338 PolarHBondContact O-N 3.34Å; G335-S339 PolarHBondContact O-N 2.9Å |
| 336 | I | 96.7 | Very high | 89.7 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.005 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.2 | -44.9 | 174.8 | -64.8 | 165.5 | 0 | 0 | 0 | 111 | M44 Y52 I99 M287 L291 A332 G333 M338 S339 I340 | M44-I336 HydrophobicContact CE-CD1 3.87Å; M44-I336 HydrophobicContact CE-CG1 3.78Å; Y52-I336 HydrophobicContact CD2-CG1 4.33Å; Y52-I336 HydrophobicContact CD2-CG2 4.23Å; Y52-I336 HydrophobicContact CE1-CG1 4.16Å; Y52-I336 HydrophobicContact CE2-CB 4.42Å; Y52-I336 HydrophobicContact CE2-CG1 3.96Å; Y52-I336 HydrophobicContact CE2-CG2 4.38Å; I99-I336 HydrophobicContact CG2-CD1 3.77Å; M287-I336 HydrophobicContact CG-CG2 4.28Å; L291-I336 HydrophobicContact CD1-CG2 4.48Å; A332-I336 WeakPolarHBondContact O-CG1 3.3Å; A332-I336 PolarHBondContact O-N 2.85Å; G333-I336 WeakPolarHBondContact O-CB 3.4Å; G333-I336 PolarHBondContact O-N 2.65Å; I336-M338 VanDerWaalsContact C-N 3.34Å; I336-M338 PolarHBondContact O-N 3.39Å; I336-S339 WeakPolarHBondContact O-CB 3.34Å; I336-S339 PolarHBondContact O-N 3.33Å; I336-I340 HydrophobicContact CG2-CD1 4.21Å; I336-I340 WeakPolarHBondContact O-CG1 3.29Å; I336-I340 PolarHBondContact O-N 3.37Å; I336-I340 VanDerWaalsContact O-N 3.12Å |
| 337 | V | 97.2 | Very high | 87.5 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62 | -41.9 | 176.8 | 176.5 | 0 | 0 | 0 | 0 | 111.5 | M1 I275 A288 L291 M292 G333 F334 G335 I340 H341 | M1-V337 HydrophobicContact CE-CB 4.08Å; M1-V337 HydrophobicContact CE-CG1 3.9Å; M1-V337 HydrophobicContact SD-CG1 4.04Å; I275-V337 HydrophobicContact CB-CG1 4.34Å; I275-V337 HydrophobicContact CD1-CG1 4.05Å; I275-V337 HydrophobicContact CG2-CG1 4.07Å; A288-V337 HydrophobicContact CB-CG1 4.26Å; A288-V337 HydrophobicContact CB-CG2 4.25Å; L291-V337 HydrophobicContact CB-CG2 4.17Å; L291-V337 HydrophobicContact CD1-CG2 3.77Å; M292-V337 HydrophobicContact CE-CG2 4.01Å; G333-V337 WeakPolarHBondContact O-CG2 3.38Å; G333-V337 PolarHBondContact O-N 3.4Å; F334-V337 PolarHBondContact O-N 2.97Å; G335-V337 PolarHBondContact O-N 2.78Å; V337-I340 PolarHBondContact O-N 3.1Å; V337-H341 PolarHBondContact O-N 2.54Å |
| 338 | M | 96.4 | Very high | 85 | Confident | 28 Ų | 28 | 49.7 Ų | 49.7 | 14% | 0.138 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 175.8 | -70.6 | -172.9 | -164.9 | 0 | 0 | 111.7 | M1 L2 L5 M41 A45 F334 G335 I336 I340 H341 T342 | M1-M338 HydrophobicContact CB-CE 4.1Å; M1-M338 HydrophobicContact CG-CE 3.78Å; M1-M338 HydrophobicContact SD-CE 4.14Å; M1-M338 HydrophobicContact SD-CG 3.94Å; L2-M338 HydrophobicContact CB-CE 4.2Å; L5-M338 HydrophobicContact CD1-CE 3.52Å; M41-M338 HydrophobicContact CE-CE 4.32Å; M41-M338 HydrophobicContact SD-CE 3.67Å; M41-M338 HydrophobicContact SD-SD 4.34Å; A45-M338 HydrophobicContact CB-CB 3.86Å; F334-M338 WeakPolarHBondContact O-CG 3.38Å; F334-M338 PolarHBondContact O-N 3.06Å; G335-M338 PolarHBondContact O-N 3.34Å; I336-M338 VanDerWaalsContact C-N 3.34Å; I336-M338 PolarHBondContact O-N 3.39Å; M338-I340 VanDerWaalsContact C-N 3.29Å; M338-I340 PolarHBondContact O-N 2.9Å; M338-H341 WeakPolarHBondContact O-CA 3.45Å; M338-H341 WeakPolarHBondContact O-CB 3.18Å; M338-H341 PolarHBondContact O-N 3.38Å; M338-T342 PolarHBondContact O-N 3.02Å; M338-T342 PolarHBondContact O-OG1 3.24Å; M338-T342 VanDerWaalsContact O-OG1 3.08Å |
| 339 | S | 95.9 | Very high | 82.1 | Confident | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56.7 | -41.9 | 176.1 | 165.3 | 0 | 0 | 0 | 0 | 112.3 | A45 I47 P49 G335 I336 H341 T342 H343 | A45-S339 WeakPolarHBondContact O-CA 3.3Å; I47-S339 WeakPolarHBondContact O-CB 3.31Å; I47-S339 PolarHBondContact O-OG 3.37Å; P49-S339 WeakPolarHBondContact CD-OG 3.36Å; G335-S339 PolarHBondContact O-N 2.9Å; I336-S339 WeakPolarHBondContact O-CB 3.34Å; I336-S339 PolarHBondContact O-N 3.33Å; S339-H341 PolarHBondContact O-N 3.07Å; S339-T342 PolarHBondContact O-N 3.38Å; S339-H343 WeakPolarHBondContact O-CB 3.41Å; S339-H343 PolarHBondContact O-N 2.84Å; S339-H343 PolarHBondContact O-ND1 3.34Å; S339-H343 VanDerWaalsContact O-ND1 3.13Å; S339-H343 PolarHBondContact OG-ND1 3.48Å |
| 340 | I | 93.7 | Very high | 79.3 | Confident | 11 Ų | 11 | 61.5 Ų | 61.5 | 6% | 0.056 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.3 | -33.3 | 176.1 | -66.7 | 160.5 | 0 | 0 | 0 | 111.5 | P49 I275 A279 M287 A288 I336 V337 M338 | P49-I340 HydrophobicContact CB-CG1 4.28Å; P49-I340 HydrophobicContact CG-CB 4.44Å; P49-I340 HydrophobicContact CG-CG1 3.92Å; I275-I340 HydrophobicContact CG2-CG2 4.47Å; A279-I340 HydrophobicContact CB-CG2 3.8Å; M287-I340 HydrophobicContact CB-CD1 4.37Å; A288-I340 HydrophobicContact CB-CD1 3.98Å; I336-I340 HydrophobicContact CG2-CD1 4.21Å; I336-I340 WeakPolarHBondContact O-CG1 3.29Å; I336-I340 PolarHBondContact O-N 3.37Å; I336-I340 VanDerWaalsContact O-N 3.12Å; V337-I340 PolarHBondContact O-N 3.1Å; M338-I340 VanDerWaalsContact C-N 3.29Å; M338-I340 PolarHBondContact O-N 2.9Å |
| 341 | H | 92.6 | Very high | 76.4 | Confident | 53 Ų | 53 | 70.1 Ų | 70.1 | 25% | 0.245 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -76.3 | -42.2 | 176.2 | -171 | 66.2 | 0 | 0 | 0 | 113.1 | W274 I275 V337 M338 S339 R344 | W274-H341 AromaticContact CZ3-CE1 3.58Å; I275-H341 HydrophobicContact CD1-CB 4.18Å; I275-H341 HydrophobicContact CG1-CB 4.14Å; I275-H341 HydrophobicContact CG2-CB 3.79Å; V337-H341 PolarHBondContact O-N 2.54Å; M338-H341 WeakPolarHBondContact O-CA 3.45Å; M338-H341 WeakPolarHBondContact O-CB 3.18Å; M338-H341 PolarHBondContact O-N 3.38Å; S339-H341 PolarHBondContact O-N 3.07Å; H341-R344 PolarHBondContact CE1-NH2 2.85Å; H341-R344 PolarHBondContact ND1-NH2 3.18Å; H341-R344 WeakPolarHBondContact O-CD 3.32Å; H341-R344 WeakPolarHBondContact O-CG 3.38Å; H341-R344 PolarHBondContact O-NE 3.14Å |
| 342 | T | 89.6 | Confident | 75.4 | Confident | 88 Ų | 88 | 73.6 Ų | 73.6 | 54% | 0.54 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -71.2 | -43.7 | -175.4 | -55.3 | 0 | 0 | 0 | 0 | 111.8 | M338 S339 R344 | M338-T342 PolarHBondContact O-N 3.02Å; M338-T342 PolarHBondContact O-OG1 3.24Å; M338-T342 VanDerWaalsContact O-OG1 3.08Å; S339-T342 PolarHBondContact O-N 3.38Å; T342-R344 PolarHBondContact O-N 3.38Å |
| 343 | H | 84.9 | Confident | 74.3 | Confident | 73 Ų | 73 | 76.8 Ų | 76.8 | 34% | 0.338 | 41% | 0.408 | S | S | . | . | trans | -87.3 | 49.5 | -175.7 | -64.6 | 91.3 | 0 | 0 | 0 | 113 | Q46 P49 S339 | Q46-H343 PolarHBondContact O-CE1 2.93Å; Q46-H343 VanDerWaalsContact O-CE1 3.29Å; Q46-H343 PolarHBondContact O-NE2 3.46Å; P49-H343 HydrophobicContact CG-CB 4.37Å; S339-H343 WeakPolarHBondContact O-CB 3.41Å; S339-H343 PolarHBondContact O-N 2.84Å; S339-H343 PolarHBondContact O-ND1 3.34Å; S339-H343 VanDerWaalsContact O-ND1 3.13Å; S339-H343 PolarHBondContact OG-ND1 3.48Å | ||
| 344 | R | 72.1 | Confident | 73 | Confident | 83 Ų | 83 | 80.8 Ų | 80.8 | 31% | 0.313 | 43% | 0.428 | S | S | . | . | trans | -69.3 | 131.2 | 168.3 | -71.1 | 167.5 | -174 | -115 | -19.2 | 108.2 | R278 H341 T342 M346 | R278-R344 VanDerWaalsContact CB-NH2 3.25Å; R278-R344 PolarHBondContact O-NH2 3.35Å; H341-R344 PolarHBondContact CE1-NH2 2.85Å; H341-R344 PolarHBondContact ND1-NH2 3.18Å; H341-R344 WeakPolarHBondContact O-CD 3.32Å; H341-R344 WeakPolarHBondContact O-CG 3.38Å; H341-R344 PolarHBondContact O-NE 3.14Å; T342-R344 PolarHBondContact O-N 3.38Å; R344-M346 PolarHBondContact O-N 3.2Å | ||
| 345 | K | 64.4 | Low | 71.5 | Confident | 130 Ų | 130 | 85.4 Ų | 85.4 | 57% | 0.565 | 45% | 0.452 | S | S | * | . | trans | -54.4 | 109 | 170.1 | -68.9 | -175.9 | 179.7 | -179.1 | 0 | 107.8 | L347 | K345-L347 PolarHBondContact O-N 2.98Å; K345-L347 VanDerWaalsContact O-N 3.13Å | ||
| 346 | M | 48.5 | Very low | 69.9 | Low | 187 Ų | 187 | 90.7 Ų | 90.7 | 92% | 0.921 | 48% | 0.48 | S | S | * | . | S | Bend | trans | -75.2 | 18.7 | 174.1 | -87.9 | -141.2 | -75 | 0 | 0 | 113.2 | R344 | R344-M346 PolarHBondContact O-N 3.2Š|
| 347 | L | 42.7 | Very low | 68.1 | Low | 163 Ų | 163 | 96.7 Ų | 96.7 | 85% | 0.853 | 51% | 0.512 | S | S | * | . | trans | -132.1 | 71.7 | -176.1 | -68.7 | 171.8 | 0 | 0 | 0 | 111.7 | K345 | K345-L347 PolarHBondContact O-N 2.98Å; K345-L347 VanDerWaalsContact O-N 3.13Å | ||
| 348 | S | 41.4 | Very low | 66.1 | Low | 115 Ų | 115 | 103.6 Ų | 103.6 | 80% | 0.804 | 55% | 0.548 | S | S | * | . | trans | -125.9 | 36.9 | 158.4 | 179.4 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 349 | K | 31.8 | Very low | 63.7 | Low | 201 Ų | 201 | 109.4 Ų | 109.4 | 87% | 0.874 | 58% | 0.58 | S | S | * | * | trans | -121.1 | 85.9 | 168.8 | -87.9 | -169.7 | 173.7 | -174 | 0 | 109.6 | ||||
| 350 | S | 35.4 | Very low | 61 | Low | 105 Ų | 105 | 118.5 Ų | 118.5 | 73% | 0.734 | 63% | 0.628 | S | S | * | * | trans | 169.1 | 95.7 | 157.5 | 24.7 | 0 | 0 | 0 | 0 | 102.6 | ||||
| 351 | V | 35.4 | Very low | 58.1 | Low | 213 Ų | 213 | 128.3 Ų | 128.3 | 100% | 1.291 | 68% | 0.68 | S | S | * | * | 24.3 | 0 | 71.3 | -165.1 | 0 | 0 | 0 | 0 | 111.9 |
Retrieved 351 of 351 residues in 197.7 ms
(Link to these results)