| 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 | 58.5 | Low | 59 | Low | 61 Ų | 61 | 70.2 Ų | 70.2 | 30% | 0.3 | 40% | 0.404 | S | S | . | . | 0 | -58.5 | 0 | -97 | -41.6 | -58 | 0 | 0 | 113.9 | L3 Y4 F5 F151 | M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 2.99Å; M1-Y4 HydrophobicContact CE-CD1 3.51Å; M1-Y4 HydrophobicContact CE-CE1 4.2Å; M1-Y4 HydrophobicContact CE-CG 4.49Å; M1-Y4 WeakPolarHBondContact O-CA 3.35Å; M1-Y4 WeakPolarHBondContact O-CB 3.45Å; M1-Y4 PolarHBondContact O-N 3.32Å; M1-Y4 HydrophobicContact SD-CD1 3.58Å; M1-Y4 VanDerWaalsContact SD-CD1 3.58Å; M1-Y4 HydrophobicContact SD-CE1 4.33Å; M1-Y4 HydrophobicContact SD-CG 4.25Å; M1-F5 HydrophobicContact CE-CD1 4.01Å; M1-F5 HydrophobicContact CE-CD2 3.08Å; M1-F5 HydrophobicContact CE-CE1 3.84Å; M1-F5 HydrophobicContact CE-CE2 2.89Å; M1-F5 HydrophobicContact CE-CG 3.66Å; M1-F5 HydrophobicContact CE-CZ 3.31Å; M1-F5 PolarHBondContact O-N 2.94Å; M1-F151 HydrophobicContact CB-CD2 4.31Å; M1-F151 HydrophobicContact CB-CE2 4.04Å; M1-F151 HydrophobicContact CB-CZ 4.16Å; M1-F151 HydrophobicContact CG-CB 4.37Å; M1-F151 HydrophobicContact CG-CD1 4.21Å; M1-F151 HydrophobicContact CG-CD2 3.42Å; M1-F151 VanDerWaalsContact CG-CD2 3.42Å; M1-F151 HydrophobicContact CG-CE1 4.39Å; M1-F151 HydrophobicContact CG-CE2 3.64Å; M1-F151 HydrophobicContact CG-CG 3.73Å; M1-F151 HydrophobicContact CG-CZ 4.13Å | |||
| 2 | A | 46.6 | Very low | 59.2 | Low | 79 Ų | 79 | 65.1 Ų | 65.1 | 65% | 0.653 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -54.3 | -44.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y4 F5 S6 | A2-Y4 VanDerWaalsContact C-N 3.33Å; A2-Y4 PolarHBondContact O-N 3.2Å; A2-F5 PolarHBondContact O-N 3.21Å; A2-S6 VanDerWaalsContact O-CB 3.3Å; A2-S6 WeakPolarHBondContact O-CB 3.37Å; A2-S6 PolarHBondContact O-N 3.14Å; A2-S6 PolarHBondContact O-OG 3.11Å |
| 3 | L | 54.3 | Low | 59.3 | Low | 138 Ų | 138 | 62.8 Ų | 62.8 | 72% | 0.723 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -59.4 | -36.1 | 170.2 | -91.2 | 141 | 0 | 0 | 0 | 113.9 | M1 L7 | M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 2.99Å; L3-L7 VanDerWaalsContact O-CB 3.29Å; L3-L7 WeakPolarHBondContact O-CB 3.47Å; L3-L7 WeakPolarHBondContact O-CD1 3.36Å; L3-L7 WeakPolarHBondContact O-CG 3.37Å; L3-L7 PolarHBondContact O-N 2.97Å |
| 4 | Y | 59.5 | Low | 59.8 | Low | 36 Ų | 36 | 63.3 Ų | 63.3 | 14% | 0.141 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -72.5 | -47.2 | 178.4 | 163.2 | -104.5 | 0 | 0 | 0 | 111.9 | M1 A2 S6 L7 I8 V147 I244 | M1-Y4 HydrophobicContact CE-CD1 3.51Å; M1-Y4 HydrophobicContact CE-CE1 4.2Å; M1-Y4 HydrophobicContact CE-CG 4.49Å; M1-Y4 WeakPolarHBondContact O-CA 3.35Å; M1-Y4 WeakPolarHBondContact O-CB 3.45Å; M1-Y4 PolarHBondContact O-N 3.32Å; M1-Y4 HydrophobicContact SD-CD1 3.58Å; M1-Y4 VanDerWaalsContact SD-CD1 3.58Å; M1-Y4 HydrophobicContact SD-CE1 4.33Å; M1-Y4 HydrophobicContact SD-CG 4.25Å; A2-Y4 VanDerWaalsContact C-N 3.33Å; A2-Y4 PolarHBondContact O-N 3.2Å; Y4-S6 PolarHBondContact O-N 3.17Å; Y4-L7 PolarHBondContact O-N 3.5Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; Y4-I8 HydrophobicContact CD2-CD1 4.22Å; Y4-I8 HydrophobicContact CD2-CG1 4.05Å; Y4-I8 HydrophobicContact CE1-CD1 3.77Å; Y4-I8 HydrophobicContact CE1-CG1 4.42Å; Y4-I8 HydrophobicContact CE2-CD1 3.26Å; Y4-I8 HydrophobicContact CE2-CG1 3.5Å; Y4-I8 PolarHBondContact O-N 3.24Å; Y4-I8 WeakPolarHBondContact OH-CD1 3.34Å; Y4-V147 HydrophobicContact CE1-CG1 4.34Å; Y4-I244 HydrophobicContact CD1-CD1 3.77Å; Y4-I244 HydrophobicContact CD2-CD1 3.2Å; Y4-I244 HydrophobicContact CE1-CD1 3.49Å; Y4-I244 VanDerWaalsContact CE1-CD1 3.49Å; Y4-I244 HydrophobicContact CE2-CD1 2.9Å; Y4-I244 HydrophobicContact CE2-CG1 4.32Å; Y4-I244 HydrophobicContact CG-CD1 3.59Å; Y4-I244 WeakPolarHBondContact OH-CD1 3.29Å |
| 5 | F | 61.5 | Low | 59.7 | Low | 21 Ų | 21 | 62.2 Ų | 62.2 | 9% | 0.092 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -60.8 | -37.6 | 173.6 | -78.9 | -45.6 | 0 | 0 | 0 | 111.1 | M1 A2 L9 V144 L175 T178 L182 | M1-F5 HydrophobicContact CE-CD1 4.01Å; M1-F5 HydrophobicContact CE-CD2 3.08Å; M1-F5 HydrophobicContact CE-CE1 3.84Å; M1-F5 HydrophobicContact CE-CE2 2.89Å; M1-F5 HydrophobicContact CE-CG 3.66Å; M1-F5 HydrophobicContact CE-CZ 3.31Å; M1-F5 PolarHBondContact O-N 2.94Å; A2-F5 PolarHBondContact O-N 3.21Å; F5-L9 WeakPolarHBondContact O-CB 3.25Å; F5-L9 PolarHBondContact O-N 3.13Å; F5-V144 HydrophobicContact CE1-CG1 3.44Å; F5-V144 VanDerWaalsContact CE1-CG1 3.44Å; F5-V144 HydrophobicContact CZ-CG1 3.7Å; F5-L175 HydrophobicContact CD2-CD2 4.47Å; F5-L175 HydrophobicContact CE2-CD2 3.51Å; F5-L175 HydrophobicContact CZ-CD2 4.24Å; F5-T178 HydrophobicContact CB-CG2 4.12Å; F5-T178 HydrophobicContact CD1-CG2 3.75Å; F5-T178 HydrophobicContact CD2-CG2 4.02Å; F5-T178 HydrophobicContact CE1-CG2 4.12Å; F5-T178 HydrophobicContact CE2-CG2 4.33Å; F5-T178 HydrophobicContact CG-CG2 3.72Å; F5-T178 HydrophobicContact CZ-CG2 4.4Å; F5-L182 HydrophobicContact CD1-CD1 3.58Å; F5-L182 HydrophobicContact CE1-CD1 3.87Å |
| 6 | S | 58.6 | Low | 59.7 | Low | 69 Ų | 69 | 63.4 Ų | 63.4 | 48% | 0.483 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 173.6 | -55.1 | 0 | 0 | 0 | 0 | 111.7 | A2 Y4 L9 H10 | A2-S6 VanDerWaalsContact O-CB 3.3Å; A2-S6 WeakPolarHBondContact O-CB 3.37Å; A2-S6 PolarHBondContact O-N 3.14Å; A2-S6 PolarHBondContact O-OG 3.11Å; Y4-S6 PolarHBondContact O-N 3.17Å; S6-L9 PolarHBondContact O-N 3.43Å; S6-H10 WeakPolarHBondContact O-CB 3.44Å; S6-H10 PolarHBondContact O-N 3.37Å |
| 7 | L | 63.2 | Low | 59.8 | Low | 119 Ų | 119 | 68.2 Ų | 68.2 | 62% | 0.623 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -67.4 | -39.2 | 177.2 | -77.8 | 164.1 | 0 | 0 | 0 | 112.8 | L3 Y4 G11 | L3-L7 VanDerWaalsContact O-CB 3.29Å; L3-L7 WeakPolarHBondContact O-CB 3.47Å; L3-L7 WeakPolarHBondContact O-CD1 3.36Å; L3-L7 WeakPolarHBondContact O-CG 3.37Å; L3-L7 PolarHBondContact O-N 2.97Å; Y4-L7 PolarHBondContact O-N 3.5Å; Y4-L7 VanDerWaalsContact O-N 3.12Å; L7-G11 PolarHBondContact O-N 3Å |
| 8 | I | 59.9 | Low | 59.8 | Low | 18 Ų | 18 | 71.7 Ų | 71.7 | 9% | 0.092 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -64.9 | -48.2 | 171.9 | -75.4 | -162 | 0 | 0 | 0 | 109.9 | Y4 H10 G11 M12 L182 S240 | Y4-I8 HydrophobicContact CD2-CD1 4.22Å; Y4-I8 HydrophobicContact CD2-CG1 4.05Å; Y4-I8 HydrophobicContact CE1-CD1 3.77Å; Y4-I8 HydrophobicContact CE1-CG1 4.42Å; Y4-I8 HydrophobicContact CE2-CD1 3.26Å; Y4-I8 HydrophobicContact CE2-CG1 3.5Å; Y4-I8 PolarHBondContact O-N 3.24Å; Y4-I8 WeakPolarHBondContact OH-CD1 3.34Å; I8-H10 VanDerWaalsContact C-N 3.29Å; I8-H10 PolarHBondContact O-N 3.29Å; I8-G11 PolarHBondContact O-N 3.02Å; I8-M12 HydrophobicContact CG2-CG 4.14Å; I8-M12 HydrophobicContact CG2-SD 3.51Å; I8-M12 VanDerWaalsContact CG2-SD 3.51Å; I8-M12 WeakPolarHBondContact O-CB 3.16Å; I8-M12 WeakPolarHBondContact O-CG 3.15Å; I8-M12 PolarHBondContact O-N 3.17Å; I8-L182 HydrophobicContact CG2-CD1 4.16Å; I8-L182 HydrophobicContact CG2-CD2 3.65Å; I8-S240 WeakPolarHBondContact CD1-OG 3.29Å |
| 9 | L | 60.5 | Low | 59.7 | Low | 75 Ų | 75 | 68.3 Ų | 68.3 | 39% | 0.393 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60.2 | -43.5 | -179.2 | -163.6 | 78.1 | 0 | 0 | 0 | 110.7 | F5 S6 S13 L182 L185 | F5-L9 WeakPolarHBondContact O-CB 3.25Å; F5-L9 PolarHBondContact O-N 3.13Å; S6-L9 PolarHBondContact O-N 3.43Å; L9-S13 WeakPolarHBondContact O-CB 3.48Å; L9-S13 PolarHBondContact O-N 2.78Å; L9-S13 PolarHBondContact O-OG 3.28Å; L9-S13 VanDerWaalsContact O-OG 3.12Å; L9-L182 HydrophobicContact CB-CD2 4.46Å; L9-L182 HydrophobicContact CD1-CD2 3.68Å; L9-L185 HydrophobicContact CD1-CD1 3.28Å; L9-L185 HydrophobicContact CG-CD1 4.38Å |
| 10 | H | 66.1 | Low | 59.7 | Low | 116 Ų | 116 | 66.8 Ų | 66.8 | 54% | 0.537 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -69.2 | -46.3 | 178.5 | -150.5 | 81.5 | 0 | 0 | 0 | 111.5 | S6 I8 M12 S13 D14 | S6-H10 WeakPolarHBondContact O-CB 3.44Å; S6-H10 PolarHBondContact O-N 3.37Å; I8-H10 VanDerWaalsContact C-N 3.29Å; I8-H10 PolarHBondContact O-N 3.29Å; H10-M12 VanDerWaalsContact C-N 3.33Å; H10-M12 PolarHBondContact O-N 3.13Å; H10-S13 VanDerWaalsContact CA-OG 3.27Å; H10-S13 WeakPolarHBondContact CA-OG 3.44Å; H10-S13 CarbonylContact O-C 3.5Å; H10-S13 PolarHBondContact O-N 3.3Å; H10-S13 PolarHBondContact O-OG 3.02Å; H10-D14 IonicContact CD2-OD1 2.64Å; H10-D14 IonicContact CD2-OD2 2.68Å; H10-D14 PolarHBondContact CD2-OD2 3.21Å; H10-D14 IonicContact NE2-OD2 3.76Å; H10-D14 WeakPolarHBondContact O-CB 3.19Å; H10-D14 PolarHBondContact O-N 3.27Å |
| 11 | G | 60.2 | Low | 59.7 | Low | 40 Ų | 40 | 66.1 Ų | 66.1 | 41% | 0.412 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -63.2 | -38.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L7 I8 L15 | L7-G11 PolarHBondContact O-N 3Å; I8-G11 PolarHBondContact O-N 3.02Å; G11-L15 WeakPolarHBondContact O-CB 3.48Å; G11-L15 PolarHBondContact O-N 3.35Å |
| 12 | M | 62.1 | Low | 59.6 | Low | 9 Ų | 9 | 70.1 Ų | 70.1 | 4% | 0.044 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -70.1 | -37.1 | 173.6 | -73.7 | -179.7 | 73.1 | 0 | 0 | 111.9 | I8 H10 F16 L182 L185 H186 L189 | I8-M12 HydrophobicContact CG2-CG 4.14Å; I8-M12 HydrophobicContact CG2-SD 3.51Å; I8-M12 VanDerWaalsContact CG2-SD 3.51Å; I8-M12 WeakPolarHBondContact O-CB 3.16Å; I8-M12 WeakPolarHBondContact O-CG 3.15Å; I8-M12 PolarHBondContact O-N 3.17Å; H10-M12 VanDerWaalsContact C-N 3.33Å; H10-M12 PolarHBondContact O-N 3.13Å; M12-F16 WeakPolarHBondContact O-CB 3.38Å; M12-F16 PolarHBondContact O-N 2.9Å; M12-L182 HydrophobicContact SD-CD2 4.02Å; M12-L185 HydrophobicContact CE-CB 3.99Å; M12-H186 VanDerWaalsContact CE-CA 3.41Å; M12-H186 HydrophobicContact CE-CB 3.7Å; M12-H186 VanDerWaalsContact CE-N 3.33Å; M12-L189 HydrophobicContact CB-CD1 4.08Å; M12-L189 HydrophobicContact CE-CD1 3.57Å; M12-L189 HydrophobicContact CG-CD1 4.39Å |
| 13 | S | 60.6 | Low | 60.1 | Low | 36 Ų | 36 | 66.9 Ų | 66.9 | 25% | 0.252 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -70.3 | -39.5 | 174.5 | 62.1 | 0 | 0 | 0 | 0 | 112.2 | L9 H10 F16 F17 | L9-S13 WeakPolarHBondContact O-CB 3.48Å; L9-S13 PolarHBondContact O-N 2.78Å; L9-S13 PolarHBondContact O-OG 3.28Å; L9-S13 VanDerWaalsContact O-OG 3.12Å; H10-S13 VanDerWaalsContact CA-OG 3.27Å; H10-S13 WeakPolarHBondContact CA-OG 3.44Å; H10-S13 CarbonylContact O-C 3.5Å; H10-S13 PolarHBondContact O-N 3.3Å; H10-S13 PolarHBondContact O-OG 3.02Å; S13-F16 WeakPolarHBondContact O-CA 3.38Å; S13-F16 WeakPolarHBondContact O-CB 3.35Å; S13-F16 PolarHBondContact O-N 3.02Å; S13-F16 VanDerWaalsContact O-N 3.15Å; S13-F17 WeakPolarHBondContact O-CD2 3.38Å; S13-F17 PolarHBondContact O-N 3.39Å |
| 14 | D | 65.1 | Low | 60.4 | Low | 69 Ų | 69 | 68.7 Ų | 68.7 | 37% | 0.369 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -65.9 | -44.5 | 176.7 | -67.2 | -20.1 | 0 | 0 | 0 | 109.9 | H10 F16 F17 L18 | H10-D14 IonicContact CD2-OD1 2.64Å; H10-D14 IonicContact CD2-OD2 2.68Å; H10-D14 PolarHBondContact CD2-OD2 3.21Å; H10-D14 IonicContact NE2-OD2 3.76Å; H10-D14 WeakPolarHBondContact O-CB 3.19Å; H10-D14 PolarHBondContact O-N 3.27Å; D14-F16 VanDerWaalsContact C-N 3.26Å; D14-F16 PolarHBondContact O-N 2.97Å; D14-F17 PolarHBondContact O-N 3.48Å; D14-L18 WeakPolarHBondContact O-CB 3.43Å; D14-L18 WeakPolarHBondContact O-CD1 3.27Å; D14-L18 PolarHBondContact O-N 3.09Å |
| 15 | L | 59 | Low | 60.1 | Low | 47 Ų | 47 | 69.9 Ų | 69.9 | 25% | 0.246 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60.1 | -37.2 | 171.9 | -169.6 | 69.1 | 0 | 0 | 0 | 111.4 | G11 S19 N233 I236 | G11-L15 WeakPolarHBondContact O-CB 3.48Å; G11-L15 PolarHBondContact O-N 3.35Å; L15-S19 WeakPolarHBondContact O-CB 3.29Å; L15-S19 PolarHBondContact O-N 3.11Å; L15-S19 PolarHBondContact O-OG 3.19Å; L15-N233 HydrophobicContact CD2-CB 4.3Å; L15-I236 HydrophobicContact CD2-CD1 4.37Å |
| 16 | F | 60.4 | Low | 59.9 | Low | 81 Ų | 81 | 70.7 Ų | 70.7 | 36% | 0.355 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.2 | -51.8 | 172.6 | -173.1 | -126.4 | 0 | 0 | 0 | 111.7 | M12 S13 D14 S19 T20 L189 | M12-F16 WeakPolarHBondContact O-CB 3.38Å; M12-F16 PolarHBondContact O-N 2.9Å; S13-F16 WeakPolarHBondContact O-CA 3.38Å; S13-F16 WeakPolarHBondContact O-CB 3.35Å; S13-F16 PolarHBondContact O-N 3.02Å; S13-F16 VanDerWaalsContact O-N 3.15Å; D14-F16 VanDerWaalsContact C-N 3.26Å; D14-F16 PolarHBondContact O-N 2.97Å; F16-S19 PolarHBondContact O-N 3.17Å; F16-S19 PolarHBondContact O-OG 2.79Å; F16-S19 VanDerWaalsContact O-OG 3.1Å; F16-T20 HydrophobicContact CD1-CG2 4.46Å; F16-T20 HydrophobicContact CD2-CG2 3.58Å; F16-T20 HydrophobicContact CE1-CG2 4.27Å; F16-T20 HydrophobicContact CE2-CG2 3.43Å; F16-T20 VanDerWaalsContact CE2-CG2 3.43Å; F16-T20 HydrophobicContact CG-CG2 4.18Å; F16-T20 HydrophobicContact CZ-CG2 3.8Å; F16-T20 VanDerWaalsContact O-CB 3.28Å; F16-T20 WeakPolarHBondContact O-CB 3.44Å; F16-T20 VanDerWaalsContact O-CG2 3.25Å; F16-T20 WeakPolarHBondContact O-CG2 3.39Å; F16-T20 PolarHBondContact O-N 3.37Å; F16-T20 PolarHBondContact O-OG1 3.41Å; F16-L189 VanDerWaalsContact CA-CD2 3.43Å; F16-L189 HydrophobicContact CB-CD2 3.19Å; F16-L189 HydrophobicContact CD2-CD2 3.17Å; F16-L189 HydrophobicContact CD2-CG 4.33Å; F16-L189 HydrophobicContact CE2-CD2 4.23Å; F16-L189 HydrophobicContact CG-CD2 3.51Å |
| 17 | F | 60.7 | Low | 59.7 | Low | 145 Ų | 145 | 69 Ų | 69 | 64% | 0.636 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -67.1 | -39.5 | -176.6 | -76.8 | -67.9 | 0 | 0 | 0 | 111.9 | S13 D14 T20 G21 | S13-F17 WeakPolarHBondContact O-CD2 3.38Å; S13-F17 PolarHBondContact O-N 3.39Å; D14-F17 PolarHBondContact O-N 3.48Å; F17-T20 WeakPolarHBondContact CA-OG1 3.36Å; F17-T20 PolarHBondContact O-OG1 2.86Å; F17-G21 PolarHBondContact O-N 3.38Å |
| 18 | L | 60.1 | Low | 59.3 | Low | 131 Ų | 131 | 69 Ų | 69 | 69% | 0.686 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -65.1 | -45.5 | 174.1 | -89.9 | 140.2 | 0 | 0 | 0 | 112.3 | D14 Y22 | D14-L18 WeakPolarHBondContact O-CB 3.43Å; D14-L18 WeakPolarHBondContact O-CD1 3.27Å; D14-L18 PolarHBondContact O-N 3.09Å; L18-Y22 WeakPolarHBondContact O-CB 3.3Å; L18-Y22 PolarHBondContact O-N 2.89Å |
| 19 | S | 57.3 | Low | 58.9 | Low | 7 Ų | 7 | 75.1 Ų | 75.1 | 5% | 0.049 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -71.7 | -40.6 | -179.7 | 59 | 0 | 0 | 0 | 0 | 112.6 | L15 F16 Y22 L23 | L15-S19 WeakPolarHBondContact O-CB 3.29Å; L15-S19 PolarHBondContact O-N 3.11Å; L15-S19 PolarHBondContact O-OG 3.19Å; F16-S19 PolarHBondContact O-N 3.17Å; F16-S19 PolarHBondContact O-OG 2.79Å; F16-S19 VanDerWaalsContact O-OG 3.1Å; S19-Y22 PolarHBondContact O-N 3.34Å; S19-L23 VanDerWaalsContact O-CB 3.27Å; S19-L23 WeakPolarHBondContact O-CB 3.26Å; S19-L23 WeakPolarHBondContact O-CD1 3.33Å; S19-L23 PolarHBondContact O-N 3.06Å |
| 20 | T | 59.7 | Low | 58.6 | Low | 38 Ų | 38 | 75.6 Ų | 75.6 | 23% | 0.233 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.8 | -38.3 | 178.7 | 50 | 0 | 0 | 0 | 0 | 113 | F16 F17 R24 F193 | F16-T20 HydrophobicContact CD1-CG2 4.46Å; F16-T20 HydrophobicContact CD2-CG2 3.58Å; F16-T20 HydrophobicContact CE1-CG2 4.27Å; F16-T20 HydrophobicContact CE2-CG2 3.43Å; F16-T20 VanDerWaalsContact CE2-CG2 3.43Å; F16-T20 HydrophobicContact CG-CG2 4.18Å; F16-T20 HydrophobicContact CZ-CG2 3.8Å; F16-T20 VanDerWaalsContact O-CB 3.28Å; F16-T20 WeakPolarHBondContact O-CB 3.44Å; F16-T20 VanDerWaalsContact O-CG2 3.25Å; F16-T20 WeakPolarHBondContact O-CG2 3.39Å; F16-T20 PolarHBondContact O-N 3.37Å; F16-T20 PolarHBondContact O-OG1 3.41Å; F17-T20 WeakPolarHBondContact CA-OG1 3.36Å; F17-T20 PolarHBondContact O-OG1 2.86Å; T20-R24 WeakPolarHBondContact O-CB 3.5Å; T20-R24 PolarHBondContact O-N 3.26Å; T20-F193 HydrophobicContact CG2-CE1 4.36Å; T20-F193 HydrophobicContact CG2-CE2 4.45Å; T20-F193 HydrophobicContact CG2-CZ 3.6Å |
| 21 | G | 60.1 | Low | 57.9 | Low | 53 Ų | 53 | 72.4 Ų | 72.4 | 55% | 0.546 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -67.5 | -44.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | F17 | F17-G21 PolarHBondContact O-N 3.38Å |
| 22 | Y | 55.8 | Low | 57.5 | Low | 145 Ų | 145 | 78.2 Ų | 78.2 | 57% | 0.569 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -80.8 | -49.3 | -174 | -166.3 | -98.9 | 0 | 0 | 0 | 112.9 | L18 S19 R24 A25 S26 L225 | L18-Y22 WeakPolarHBondContact O-CB 3.3Å; L18-Y22 PolarHBondContact O-N 2.89Å; S19-Y22 PolarHBondContact O-N 3.34Å; Y22-R24 PolarHBondContact O-N 3.44Å; Y22-A25 PolarHBondContact O-N 2.69Å; Y22-S26 PolarHBondContact O-N 2.65Å; Y22-S26 PolarHBondContact O-OG 2.99Å; Y22-L225 HydrophobicContact CD1-CD1 4.36Å; Y22-L225 HydrophobicContact CE1-CD1 3.72Å; Y22-L225 HydrophobicContact CE1-CD2 4.24Å |
| 23 | L | 57.3 | Low | 57.2 | Low | 11 Ų | 11 | 86.1 Ų | 86.1 | 6% | 0.058 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -70.6 | -32.7 | -178.1 | -86.5 | 80 | 0 | 0 | 0 | 112.8 | S19 A25 S26 C27 F193 V226 V229 | S19-L23 VanDerWaalsContact O-CB 3.27Å; S19-L23 WeakPolarHBondContact O-CB 3.26Å; S19-L23 WeakPolarHBondContact O-CD1 3.33Å; S19-L23 PolarHBondContact O-N 3.06Å; L23-A25 VanDerWaalsContact C-N 3.3Å; L23-A25 PolarHBondContact O-N 3.14Å; L23-S26 PolarHBondContact O-N 3.48Å; L23-C27 WeakPolarHBondContact O-CB 3.35Å; L23-C27 PolarHBondContact O-N 2.69Å; L23-F193 HydrophobicContact CB-CD1 3.83Å; L23-F193 HydrophobicContact CB-CE1 3.76Å; L23-F193 HydrophobicContact CD2-CB 4.16Å; L23-F193 HydrophobicContact CD2-CD1 3.9Å; L23-F193 HydrophobicContact CD2-CD2 4.4Å; L23-F193 HydrophobicContact CD2-CE1 4.39Å; L23-F193 HydrophobicContact CD2-CG 3.91Å; L23-V226 HydrophobicContact CD2-CG2 3.77Å; L23-V229 HydrophobicContact CD1-CG2 3.78Å; L23-V229 HydrophobicContact CD2-CG2 4.28Å |
| 24 | R | 59.9 | Low | 57 | Low | 177 Ų | 177 | 86.9 Ų | 86.9 | 67% | 0.668 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.4 | -37.8 | 177.9 | -168.4 | 177 | -167.5 | -178.5 | 4.3 | 111 | T20 Y22 M28 | T20-R24 WeakPolarHBondContact O-CB 3.5Å; T20-R24 PolarHBondContact O-N 3.26Å; Y22-R24 PolarHBondContact O-N 3.44Å; R24-M28 HydrophobicContact CG-CG 4.46Å; R24-M28 HydrophobicContact CG-SD 3.86Å; R24-M28 WeakPolarHBondContact O-CB 3.4Å; R24-M28 WeakPolarHBondContact O-CG 3.32Å; R24-M28 PolarHBondContact O-N 2.85Å; R24-M28 VanDerWaalsContact O-N 3.13Å |
| 25 | A | 55 | Low | 56.5 | Low | 61 Ų | 61 | 91.1 Ų | 91.1 | 50% | 0.504 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.8 | -46.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y22 L23 M29 | Y22-A25 PolarHBondContact O-N 2.69Å; L23-A25 VanDerWaalsContact C-N 3.3Å; L23-A25 PolarHBondContact O-N 3.14Å; A25-M29 WeakPolarHBondContact O-CB 3.5Å; A25-M29 PolarHBondContact O-N 3.29Å |
| 26 | S | 55.8 | Low | 56.3 | Low | 37 Ų | 37 | 97 Ų | 97 | 26% | 0.259 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -66.8 | -45.7 | 179.4 | -56.5 | 0 | 0 | 0 | 0 | 113 | Y22 L23 M29 E30 | Y22-S26 PolarHBondContact O-N 2.65Å; Y22-S26 PolarHBondContact O-OG 2.99Å; L23-S26 PolarHBondContact O-N 3.48Å; S26-M29 PolarHBondContact O-N 3.48Å; S26-E30 PolarHBondContact O-N 3.34Å |
| 27 | C | 55.3 | Low | 56.3 | Low | 34 Ų | 34 | 98 Ų | 98 | 23% | 0.23 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -70.2 | -36.3 | -177.4 | -166.7 | 0 | 0 | 0 | 0 | 112 | L23 S31 | L23-C27 WeakPolarHBondContact O-CB 3.35Å; L23-C27 PolarHBondContact O-N 2.69Å; C27-S31 WeakPolarHBondContact O-CB 3.29Å; C27-S31 PolarHBondContact O-N 3.41Å; C27-S31 PolarHBondContact O-OG 2.88Å |
| 28 | M | 54.9 | Low | 56.5 | Low | 120 Ų | 120 | 95.9 Ų | 95.9 | 59% | 0.591 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -66.3 | -36.8 | 173.8 | -74.4 | 180 | 66.7 | 0 | 0 | 112.2 | R24 S31 | R24-M28 HydrophobicContact CG-CG 4.46Å; R24-M28 HydrophobicContact CG-SD 3.86Å; R24-M28 WeakPolarHBondContact O-CB 3.4Å; R24-M28 WeakPolarHBondContact O-CG 3.32Å; R24-M28 PolarHBondContact O-N 2.85Å; R24-M28 VanDerWaalsContact O-N 3.13Å; M28-S31 WeakPolarHBondContact CA-OG 3.33Å; M28-S31 PolarHBondContact O-OG 3.44Å |
| 29 | M | 50.7 | Low | 57.1 | Low | 146 Ų | 146 | 98 Ų | 98 | 72% | 0.719 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -70.2 | -38.6 | -178 | -162.7 | 158.6 | 61 | 0 | 0 | 112.7 | A25 S26 | A25-M29 WeakPolarHBondContact O-CB 3.5Å; A25-M29 PolarHBondContact O-N 3.29Å; S26-M29 PolarHBondContact O-N 3.48Å |
| 30 | E | 54 | Low | 58.3 | Low | 85 Ų | 85 | 98.7 Ų | 98.7 | 40% | 0.397 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -80.9 | -31 | 175.4 | -85.3 | 175.2 | 151 | 0 | 0 | 113.7 | S26 M32 E33 V221 | S26-E30 PolarHBondContact O-N 3.34Å; E30-M32 PolarHBondContact O-N 2.94Å; E30-E33 PolarHBondContact O-N 3.4Å; E30-V221 HydrophobicContact CB-CG1 4.13Å |
| 31 | S | 52.7 | Low | 59.5 | Low | 49 Ų | 49 | 101 Ų | 101 | 34% | 0.343 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.9 | -23.9 | 178.5 | 69.5 | 0 | 0 | 0 | 0 | 113.7 | C27 M28 E33 | C27-S31 WeakPolarHBondContact O-CB 3.29Å; C27-S31 PolarHBondContact O-N 3.41Å; C27-S31 PolarHBondContact O-OG 2.88Å; M28-S31 WeakPolarHBondContact CA-OG 3.33Å; M28-S31 PolarHBondContact O-OG 3.44Å; S31-E33 VanDerWaalsContact C-N 3.33Å |
| 32 | M | 51.6 | Low | 60.8 | Low | 162 Ų | 162 | 102.9 Ų | 102.9 | 80% | 0.798 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | -14.9 | -177.5 | -151.7 | 168.3 | 72.3 | 0 | 0 | 112.9 | E30 | E30-M32 PolarHBondContact O-N 2.94Š|
| 33 | E | 54.5 | Low | 62.3 | Low | 174 Ų | 174 | 96 Ų | 96 | 81% | 0.813 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92 | -15 | 178.1 | -69 | -166.3 | 151.8 | 0 | 0 | 114.1 | E30 S31 | E30-E33 PolarHBondContact O-N 3.4Å; S31-E33 VanDerWaalsContact C-N 3.33Å |
| 34 | L | 56.5 | Low | 63.7 | Low | 53 Ų | 53 | 98.7 Ų | 98.7 | 28% | 0.277 | 52% | 0.517 | S | S | . | . | trans | -107.8 | 13.5 | -168.5 | -86.8 | 163.5 | 0 | 0 | 0 | 115.7 | N36 Q37 P198 V221 | L34-N36 PolarHBondContact O-N 3.12Å; L34-Q37 VanDerWaalsContact CD2-OE1 3.3Å; L34-P198 HydrophobicContact CD1-CG 4.28Å; L34-V221 HydrophobicContact CD1-CG1 3.58Å | ||
| 35 | L | 54.8 | Low | 64.9 | Low | 158 Ų | 158 | 90.5 Ų | 90.5 | 83% | 0.827 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.2 | 7 | -169.4 | -137.3 | 89.2 | 0 | 0 | 0 | 116.3 | ||
| 36 | N | 54.3 | Low | 66.1 | Low | 169 Ų | 169 | 91.7 Ų | 91.7 | 90% | 0.904 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -117.1 | 13.3 | -173.9 | -129.4 | 8.2 | 0 | 0 | 0 | 114.6 | L34 | L34-N36 PolarHBondContact O-N 3.12Š|
| 37 | Q | 60.6 | Low | 67 | Low | 103 Ų | 103 | 90 Ų | 90 | 48% | 0.481 | 47% | 0.472 | S | S | . | . | S | Bend | trans | -108.3 | 150.5 | 178.6 | -77.8 | 178.1 | -18.9 | 0 | 0 | 112.9 | L34 Q39 C200 | L34-Q37 VanDerWaalsContact CD2-OE1 3.3Å; Q37-Q39 PolarHBondContact O-N 3.21Å; Q37-C200 HydrophobicContact CB-CB 3.92Å; Q37-C200 HydrophobicContact CG-CB 4.42Å; Q37-C200 PolarHBondContact OE1-SG 3.34Å |
| 38 | S | 64.6 | Low | 67.8 | Low | 100 Ų | 100 | 90.6 Ų | 90.6 | 70% | 0.699 | 47% | 0.472 | S | S | * | . | P | Polyproline II helix | trans | -65 | 121 | 175.8 | 56.3 | 0 | 0 | 0 | 0 | 111 | ||
| 39 | Q | 74.3 | Confident | 68.7 | Low | 175 Ų | 175 | 86.7 Ų | 86.7 | 82% | 0.818 | 46% | 0.455 | S | S | * | . | P | Polyproline II helix | trans | -72.8 | 139.5 | 175.4 | -80.2 | -172.3 | -21.1 | 0 | 0 | 112.1 | Q37 S41 | Q37-Q39 PolarHBondContact O-N 3.21Å; Q39-S41 PolarHBondContact O-N 2.91Å |
| 40 | V | 81.3 | Confident | 69.9 | Low | 23 Ų | 23 | 85.7 Ų | 85.7 | 14% | 0.139 | 46% | 0.463 | C | S | . | . | P | Polyproline II helix | trans | -70.3 | 117.6 | 173.9 | 176 | 0 | 0 | 0 | 0 | 110.5 | E42 F43 F199 N203 | V40-E42 VanDerWaalsContact CG1-O 3.25Å; V40-E42 WeakPolarHBondContact CG1-O 3.43Å; V40-F43 HydrophobicContact CG1-CD1 4.34Å; V40-F43 HydrophobicContact CG1-CE1 4.09Å; V40-F43 HydrophobicContact CG1-CZ 4.25Å; V40-F199 HydrophobicContact CB-CB 3.91Å; V40-F199 HydrophobicContact CG2-CB 3.97Å; V40-F199 PolarHBondContact N-O 3.31Å; V40-N203 HydrophobicContact CG1-CB 3.67Å; V40-N203 HydrophobicContact CG2-CB 4.33Å |
| 41 | S | 84.8 | Confident | 71.2 | Confident | 87 Ų | 87 | 83.8 Ų | 83.8 | 61% | 0.608 | 46% | 0.459 | S | S | * | . | trans | -91.1 | -24 | 175.4 | 55 | 0 | 0 | 0 | 0 | 113.5 | Q39 F125 | Q39-S41 PolarHBondContact O-N 2.91Å; S41-F125 WeakPolarHBondContact O-CB 3.45Å; S41-F125 PolarHBondContact O-N 3.03Å | ||
| 42 | E | 89.1 | Confident | 72.6 | Confident | 92 Ų | 92 | 88.9 Ų | 88.9 | 43% | 0.43 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.8 | 144.7 | -171.2 | -60.3 | -177.9 | 167.3 | 0 | 0 | 111.4 | V40 I122 I123 N203 | V40-E42 VanDerWaalsContact CG1-O 3.25Å; V40-E42 WeakPolarHBondContact CG1-O 3.43Å; E42-I122 HydrophobicContact CB-CG2 3.84Å; E42-I122 HydrophobicContact CG-CG2 4.22Å; E42-I122 VanDerWaalsContact OE2-CG2 3.26Å; E42-I122 WeakPolarHBondContact OE2-CG2 3.33Å; E42-I123 CarbonylContact C-O 3.6Å; E42-I123 WeakPolarHBondContact CA-O 3.26Å; E42-N203 VanDerWaalsContact O-CB 3.28Å; E42-N203 WeakPolarHBondContact O-CB 3.09Å; E42-N203 PolarHBondContact O-ND2 3.32Å |
| 43 | F | 87.1 | Confident | 74.1 | Confident | 0 Ų | 0 | 87.6 Ų | 87.6 | 0% | 0 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 147.4 | 173.7 | -64.6 | -80.7 | 0 | 0 | 0 | 111.5 | V40 I122 I123 F125 C128 F129 F199 N203 V205 V215 L218 | V40-F43 HydrophobicContact CG1-CD1 4.34Å; V40-F43 HydrophobicContact CG1-CE1 4.09Å; V40-F43 HydrophobicContact CG1-CZ 4.25Å; F43-I122 WeakPolarHBondContact O-CA 3.37Å; F43-I123 HydrophobicContact CB-CG2 3.87Å; F43-I123 PolarHBondContact N-O 3.43Å; F43-I123 PolarHBondContact O-N 3.48Å; F43-F125 HydrophobicContact CE2-CB 4.41Å; F43-F125 AromaticContact CE2-CD2 3.64Å; F43-F125 HydrophobicContact CE2-CD2 3.64Å; F43-F125 HydrophobicContact CE2-CE2 4.34Å; F43-F125 HydrophobicContact CE2-CG 4.36Å; F43-F125 HydrophobicContact CZ-CD2 4.05Å; F43-F125 HydrophobicContact CZ-CE2 4.42Å; F43-C128 HydrophobicContact CD2-CB 3.85Å; F43-C128 HydrophobicContact CE2-CB 4.23Å; F43-F129 HydrophobicContact CE2-CE2 4.48Å; F43-F199 HydrophobicContact CE1-CD1 4.46Å; F43-F199 HydrophobicContact CZ-CD1 4.28Å; F43-F199 HydrophobicContact CZ-CE1 4.5Å; F43-F199 HydrophobicContact CZ-CG 4.47Å; F43-N203 CarbonylContact C-O 3.59Å; F43-N203 VanDerWaalsContact CA-O 3.25Å; F43-N203 WeakPolarHBondContact CA-O 3.16Å; F43-N203 HydrophobicContact CD1-CB 4.4Å; F43-V205 HydrophobicContact CB-CG2 4.15Å; F43-V205 HydrophobicContact CD1-CG2 3.93Å; F43-V205 HydrophobicContact CG-CG2 4.28Å; F43-V215 HydrophobicContact CE1-CG1 4.39Å; F43-V215 HydrophobicContact CZ-CG1 4.05Å; F43-L218 HydrophobicContact CD1-CD1 3.97Å; F43-L218 HydrophobicContact CE1-CD1 3.92Å |
| 44 | I | 85.9 | Confident | 75.4 | Confident | 67 Ų | 67 | 83.1 Ų | 83.1 | 34% | 0.344 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.8 | 120.1 | 176.3 | -56.3 | 172.9 | 0 | 0 | 0 | 108.3 | N203 V204 V205 | I44-N203 PolarHBondContact N-O 3.45Å; I44-V204 HydrophobicContact CB-CG2 4.38Å; I44-V204 CarbonylContact O-C 3.58Å; I44-V204 WeakPolarHBondContact O-CA 3.37Å; I44-V205 PolarHBondContact O-N 3.47Å |
| 45 | L | 85 | Confident | 76.7 | Confident | 5 Ų | 5 | 81.9 Ų | 81.9 | 3% | 0.026 | 45% | 0.447 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 120.6 | 178.7 | -61.5 | 171 | 0 | 0 | 0 | 109.9 | G47 K121 I123 V205 S207 | L45-G47 VanDerWaalsContact C-N 3.32Å; L45-G47 PolarHBondContact O-N 2.93Å; L45-K121 HydrophobicContact CB-CB 4.03Å; L45-K121 PolarHBondContact N-O 2.78Å; L45-K121 VanDerWaalsContact O-CB 3.31Å; L45-K121 WeakPolarHBondContact O-CB 3.5Å; L45-K121 WeakPolarHBondContact O-CD 3.33Å; L45-I123 HydrophobicContact CD1-CG2 4.14Å; L45-I123 HydrophobicContact CD2-CG2 4.39Å; L45-I123 HydrophobicContact CG-CG2 4.11Å; L45-V205 HydrophobicContact CD2-CB 4.05Å; L45-V205 HydrophobicContact CD2-CG1 4.26Å; L45-S207 WeakPolarHBondContact CB-O 3.49Å |
| 46 | L | 79.9 | Confident | 78.1 | Confident | 86 Ų | 86 | 80.9 Ų | 80.9 | 45% | 0.45 | 44% | 0.437 | S | S | . | . | trans | -70.7 | -29.5 | -173.8 | -143.4 | 142.9 | 0 | 0 | 0 | 112.5 | V204 V205 S207 | L46-V204 HydrophobicContact CD1-CG1 3.69Å; L46-V204 HydrophobicContact CG-CG1 4.49Å; L46-V205 PolarHBondContact N-O 2.91Å; L46-S207 PolarHBondContact N-O 3.13Å | ||
| 47 | G | 74.9 | Confident | 79.6 | Confident | 1 Ų | 1 | 78.5 Ų | 78.5 | 1% | 0.01 | 42% | 0.423 | C | S | . | . | trans | 81.3 | -169.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L45 S207 K300 | L45-G47 VanDerWaalsContact C-N 3.32Å; L45-G47 PolarHBondContact O-N 2.93Å; G47-S207 PolarHBondContact N-O 3.48Å; G47-K300 PolarHBondContact O-NZ 3.08Å | ||
| 48 | L | 71.8 | Confident | 80.7 | Confident | 47 Ų | 47 | 75 Ų | 75 | 25% | 0.246 | 41% | 0.408 | C | S | . | . | S | Bend | trans | -88 | -32.1 | -172.1 | -79.7 | 160.9 | 0 | 0 | 0 | 114.6 | L58 F62 I208 K300 V304 | L48-L58 HydrophobicContact CB-CD1 3.98Å; L48-L58 HydrophobicContact CD1-CD1 3.91Å; L48-F62 HydrophobicContact CD1-CE2 3.65Å; L48-F62 HydrophobicContact CD1-CZ 3.84Å; L48-I208 HydrophobicContact CB-CG2 4.36Å; L48-I208 HydrophobicContact CD1-CD1 4.09Å; L48-I208 HydrophobicContact CD1-CG2 3.97Å; L48-I208 HydrophobicContact CD2-CD1 4.47Å; L48-I208 HydrophobicContact CD2-CG2 4.48Å; L48-I208 HydrophobicContact CG-CD1 4.28Å; L48-I208 HydrophobicContact CG-CG2 3.57Å; L48-K300 HydrophobicContact CD2-CB 4.2Å; L48-V304 HydrophobicContact CD1-CG2 4.13Å; L48-V304 HydrophobicContact CD2-CG2 3.98Å |
| 49 | T | 74.3 | Confident | 81.7 | Confident | 38 Ų | 38 | 72.7 Ų | 72.7 | 23% | 0.233 | 39% | 0.385 | C | S | . | . | trans | -157.9 | 156.6 | -173.1 | -175.8 | 0 | 0 | 0 | 0 | 110.3 | S51 I54 E55 L58 | T49-S51 PolarHBondContact OG1-N 3.43Å; T49-I54 HydrophobicContact CG2-CB 3.81Å; T49-I54 HydrophobicContact CG2-CG2 3.75Å; T49-E55 HydrophobicContact CG2-CG 3.58Å; T49-L58 HydrophobicContact CG2-CD1 4.25Å | ||
| 50 | S | 75.3 | Confident | 82.3 | Confident | 125 Ų | 125 | 66.4 Ų | 66.4 | 87% | 0.874 | 36% | 0.363 | S | S | * | . | S | Bend | trans | -94.4 | -4.9 | 173.9 | -49.4 | 0 | 0 | 0 | 0 | 112.9 | ||
| 51 | S | 83 | Confident | 82.4 | Confident | 46 Ų | 46 | 69.5 Ų | 69.5 | 32% | 0.322 | 38% | 0.379 | S | S | . | . | trans | -88.2 | 118.3 | 179.4 | 175.4 | 0 | 0 | 0 | 0 | 111.4 | T49 D53 I54 E55 | T49-S51 PolarHBondContact OG1-N 3.43Å; S51-D53 VanDerWaalsContact C-N 3.29Å; S51-D53 PolarHBondContact O-N 3.41Å; S51-I54 PolarHBondContact O-N 2.89Å; S51-I54 VanDerWaalsContact O-N 3.15Å; S51-E55 PolarHBondContact O-N 2.94Å | ||
| 52 | Q | 81.4 | Confident | 82.4 | Confident | 155 Ų | 155 | 65.8 Ų | 65.8 | 72% | 0.724 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.9 | -35.7 | -177.9 | -170 | 174.8 | -10.9 | 0 | 0 | 112.9 | I54 E55 F56 | Q52-I54 VanDerWaalsContact C-N 3.34Å; Q52-I54 PolarHBondContact O-N 3.46Å; Q52-E55 PolarHBondContact O-N 3.49Å; Q52-F56 PolarHBondContact O-N 2.95Å |
| 53 | D | 82.6 | Confident | 82.3 | Confident | 135 Ų | 135 | 62.9 Ų | 62.9 | 72% | 0.722 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -66.3 | -38.4 | 177.8 | -62.8 | -35.4 | 0 | 0 | 0 | 111.6 | S51 F56 L57 | S51-D53 VanDerWaalsContact C-N 3.29Å; S51-D53 PolarHBondContact O-N 3.41Å; D53-F56 PolarHBondContact O-N 3.48Å; D53-L57 PolarHBondContact O-N 3.48Å; D53-L57 VanDerWaalsContact O-N 3.16Å |
| 54 | I | 82 | Confident | 82.2 | Confident | 80 Ų | 80 | 67.4 Ų | 67.4 | 41% | 0.41 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -72.2 | -38.6 | 177.5 | -56.9 | 179.3 | 0 | 0 | 0 | 110.3 | T49 S51 Q52 F56 L57 L58 | T49-I54 HydrophobicContact CG2-CB 3.81Å; T49-I54 HydrophobicContact CG2-CG2 3.75Å; S51-I54 PolarHBondContact O-N 2.89Å; S51-I54 VanDerWaalsContact O-N 3.15Å; Q52-I54 VanDerWaalsContact C-N 3.34Å; Q52-I54 PolarHBondContact O-N 3.46Å; I54-F56 VanDerWaalsContact C-N 3.31Å; I54-F56 PolarHBondContact O-N 3.49Å; I54-L57 PolarHBondContact O-N 2.89Å; I54-L58 HydrophobicContact CG2-CD1 4.03Å; I54-L58 HydrophobicContact CG2-CG 4.27Å; I54-L58 WeakPolarHBondContact O-CB 3.38Å; I54-L58 VanDerWaalsContact O-CG 3.27Å; I54-L58 WeakPolarHBondContact O-CG 3.35Å; I54-L58 PolarHBondContact O-N 3.31Å |
| 55 | E | 83.5 | Confident | 82.1 | Confident | 27 Ų | 27 | 65.9 Ų | 65.9 | 13% | 0.126 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -61.2 | -39.6 | 174.8 | -69.2 | -168.3 | 133 | 0 | 0 | 112.2 | T49 S51 Q52 L58 F59 K121 | T49-E55 HydrophobicContact CG2-CG 3.58Å; S51-E55 PolarHBondContact O-N 2.94Å; Q52-E55 PolarHBondContact O-N 3.49Å; E55-L58 PolarHBondContact O-N 3.3Å; E55-F59 WeakPolarHBondContact O-CB 3.37Å; E55-F59 PolarHBondContact O-N 3.36Å; E55-K121 WeakPolarHBondContact OE1-CE 3.47Å; E55-K121 IonicContact OE1-NZ 3.93Å; E55-K121 PolarHBondContact OE1-NZ 3.23Å |
| 56 | F | 84.8 | Confident | 82.2 | Confident | 138 Ų | 138 | 68.8 Ų | 68.8 | 61% | 0.605 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -65.4 | -41.6 | 175.8 | -171 | -97.1 | 0 | 0 | 0 | 112.3 | Q52 D53 I54 F59 A60 | Q52-F56 PolarHBondContact O-N 2.95Å; D53-F56 PolarHBondContact O-N 3.48Å; I54-F56 VanDerWaalsContact C-N 3.31Å; I54-F56 PolarHBondContact O-N 3.49Å; F56-F59 WeakPolarHBondContact O-CB 3.45Å; F56-F59 PolarHBondContact O-N 3.29Å; F56-A60 PolarHBondContact O-N 3.04Å |
| 57 | L | 85.4 | Confident | 82.5 | Confident | 118 Ų | 118 | 68.2 Ų | 68.2 | 62% | 0.618 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -62 | -45.3 | 174.1 | -179.3 | 65.2 | 0 | 0 | 0 | 111.7 | D53 I54 F59 A60 L61 | D53-L57 PolarHBondContact O-N 3.48Å; D53-L57 VanDerWaalsContact O-N 3.16Å; I54-L57 PolarHBondContact O-N 2.89Å; L57-F59 VanDerWaalsContact C-N 3.34Å; L57-A60 PolarHBondContact O-N 2.92Å; L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 PolarHBondContact O-N 3.01Å |
| 58 | L | 83.2 | Confident | 83.1 | Confident | 31 Ų | 31 | 71.8 Ų | 71.8 | 16% | 0.162 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -64.2 | -38.6 | 177.1 | -71.3 | 171.8 | 0 | 0 | 0 | 111.8 | L48 T49 I54 E55 L61 F62 L116 | L48-L58 HydrophobicContact CB-CD1 3.98Å; L48-L58 HydrophobicContact CD1-CD1 3.91Å; T49-L58 HydrophobicContact CG2-CD1 4.25Å; I54-L58 HydrophobicContact CG2-CD1 4.03Å; I54-L58 HydrophobicContact CG2-CG 4.27Å; I54-L58 WeakPolarHBondContact O-CB 3.38Å; I54-L58 VanDerWaalsContact O-CG 3.27Å; I54-L58 WeakPolarHBondContact O-CG 3.35Å; I54-L58 PolarHBondContact O-N 3.31Å; E55-L58 PolarHBondContact O-N 3.3Å; L58-L61 PolarHBondContact O-N 3.44Å; L58-F62 HydrophobicContact CB-CE2 4.38Å; L58-F62 HydrophobicContact CD2-CE1 4.39Å; L58-F62 HydrophobicContact CD2-CE2 4.45Å; L58-F62 HydrophobicContact CD2-CZ 4.02Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.41Å; L58-F62 VanDerWaalsContact O-CG 3.27Å; L58-F62 WeakPolarHBondContact O-CG 3.45Å; L58-F62 PolarHBondContact O-N 3.19Å; L58-L116 HydrophobicContact CB-CD1 3.95Å |
| 59 | F | 85.9 | Confident | 83.7 | Confident | 51 Ų | 51 | 69.7 Ų | 69.7 | 22% | 0.224 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -58.5 | -49.8 | 174.2 | 166.6 | -95.2 | 0 | 0 | 0 | 111 | E55 F56 L57 S63 I113 L116 L117 | E55-F59 WeakPolarHBondContact O-CB 3.37Å; E55-F59 PolarHBondContact O-N 3.36Å; F56-F59 WeakPolarHBondContact O-CB 3.45Å; F56-F59 PolarHBondContact O-N 3.29Å; L57-F59 VanDerWaalsContact C-N 3.34Å; F59-S63 VanDerWaalsContact O-CB 3.22Å; F59-S63 WeakPolarHBondContact O-CB 3.44Å; F59-S63 PolarHBondContact O-N 2.91Å; F59-S63 PolarHBondContact O-OG 2.91Å; F59-I113 HydrophobicContact CD2-CG2 3.42Å; F59-I113 VanDerWaalsContact CD2-CG2 3.42Å; F59-I113 HydrophobicContact CE2-CG2 3.38Å; F59-I113 HydrophobicContact CZ-CG2 4.49Å; F59-L116 HydrophobicContact CB-CB 4.29Å; F59-L116 HydrophobicContact CB-CD1 4.35Å; F59-L117 HydrophobicContact CB-CD2 4.21Å; F59-L117 HydrophobicContact CD1-CD2 4.16Å; F59-L117 HydrophobicContact CD2-CD1 3.77Å; F59-L117 HydrophobicContact CD2-CD2 3.82Å; F59-L117 HydrophobicContact CD2-CG 3.63Å; F59-L117 HydrophobicContact CE1-CD1 4.47Å; F59-L117 HydrophobicContact CE2-CD1 3.42Å; F59-L117 VanDerWaalsContact CE2-CD1 3.42Å; F59-L117 HydrophobicContact CE2-CD2 4.26Å; F59-L117 HydrophobicContact CE2-CG 3.86Å; F59-L117 HydrophobicContact CG-CD1 4.45Å; F59-L117 HydrophobicContact CG-CD2 3.78Å; F59-L117 HydrophobicContact CG-CG 4.14Å; F59-L117 HydrophobicContact CZ-CD1 3.82Å |
| 60 | A | 86.3 | Confident | 84.4 | Confident | 43 Ų | 43 | 69.2 Ų | 69.2 | 36% | 0.355 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.7 | -47.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.3 | F56 L57 S63 V64 | F56-A60 PolarHBondContact O-N 3.04Å; L57-A60 PolarHBondContact O-N 2.92Å; A60-S63 PolarHBondContact O-N 3.42Å; A60-V64 WeakPolarHBondContact O-CG2 3.41Å; A60-V64 PolarHBondContact O-N 3.15Å; A60-V64 VanDerWaalsContact O-N 3.07Å |
| 61 | L | 85.1 | Confident | 85 | Confident | 88 Ų | 88 | 68.3 Ų | 68.3 | 46% | 0.461 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.4 | -51.7 | 179.9 | 179.5 | 64.1 | 0 | 0 | 0 | 112.3 | L57 L58 S63 V64 I65 | L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 PolarHBondContact O-N 3.01Å; L58-L61 PolarHBondContact O-N 3.44Å; L61-S63 VanDerWaalsContact C-N 3.32Å; L61-S63 PolarHBondContact O-N 2.65Å; L61-V64 PolarHBondContact O-N 3.34Å; L61-I65 HydrophobicContact CD1-CD1 4.09Å; L61-I65 HydrophobicContact CG-CD1 3.98Å; L61-I65 WeakPolarHBondContact O-CG1 3.04Å; L61-I65 PolarHBondContact O-N 3.39Å |
| 62 | F | 83.4 | Confident | 85.1 | Confident | 9 Ų | 9 | 67 Ų | 67 | 4% | 0.039 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -68.4 | -32 | -178.6 | -66.3 | -16.1 | 0 | 0 | 0 | 112.4 | L48 L58 I65 Y66 M112 I113 L116 V304 I308 | L48-F62 HydrophobicContact CD1-CE2 3.65Å; L48-F62 HydrophobicContact CD1-CZ 3.84Å; L58-F62 HydrophobicContact CB-CE2 4.38Å; L58-F62 HydrophobicContact CD2-CE1 4.39Å; L58-F62 HydrophobicContact CD2-CE2 4.45Å; L58-F62 HydrophobicContact CD2-CZ 4.02Å; L58-F62 VanDerWaalsContact O-CB 3.31Å; L58-F62 WeakPolarHBondContact O-CB 3.41Å; L58-F62 VanDerWaalsContact O-CG 3.27Å; L58-F62 WeakPolarHBondContact O-CG 3.45Å; L58-F62 PolarHBondContact O-N 3.19Å; F62-I65 HydrophobicContact CD1-CD1 4.34Å; F62-I65 PolarHBondContact O-N 3.46Å; F62-Y66 VanDerWaalsContact O-CB 3.28Å; F62-Y66 WeakPolarHBondContact O-CB 3.31Å; F62-Y66 PolarHBondContact O-N 3.37Å; F62-M112 HydrophobicContact CD2-CE 3.79Å; F62-M112 HydrophobicContact CE2-CE 4.21Å; F62-M112 HydrophobicContact CG-CE 4.28Å; F62-I113 HydrophobicContact CB-CD1 4.22Å; F62-I113 HydrophobicContact CB-CG1 3.82Å; F62-L116 HydrophobicContact CD2-CD1 3.67Å; F62-L116 HydrophobicContact CE2-CD1 4.12Å; F62-V304 HydrophobicContact CE1-CG1 4.41Å; F62-V304 HydrophobicContact CZ-CG1 4.34Å; F62-V304 HydrophobicContact CZ-CG2 4.17Å; F62-I308 HydrophobicContact CD1-CD1 3.43Å; F62-I308 VanDerWaalsContact CD1-CD1 3.43Å; F62-I308 HydrophobicContact CD1-CG2 4.37Å; F62-I308 HydrophobicContact CD2-CD1 3.89Å; F62-I308 HydrophobicContact CE1-CD1 3.32Å; F62-I308 HydrophobicContact CE2-CD1 3.79Å; F62-I308 HydrophobicContact CG-CD1 3.73Å; F62-I308 HydrophobicContact CZ-CD1 3.51Å |
| 63 | S | 86.6 | Confident | 85.5 | Confident | 31 Ų | 31 | 59.6 Ų | 59.6 | 22% | 0.217 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 172.8 | -62.4 | 0 | 0 | 0 | 0 | 111.8 | F59 A60 L61 Y66 V67 I113 | F59-S63 VanDerWaalsContact O-CB 3.22Å; F59-S63 WeakPolarHBondContact O-CB 3.44Å; F59-S63 PolarHBondContact O-N 2.91Å; F59-S63 PolarHBondContact O-OG 2.91Å; A60-S63 PolarHBondContact O-N 3.42Å; L61-S63 VanDerWaalsContact C-N 3.32Å; L61-S63 PolarHBondContact O-N 2.65Å; S63-Y66 PolarHBondContact O-N 3.28Å; S63-V67 WeakPolarHBondContact O-CG2 3.38Å; S63-V67 PolarHBondContact O-N 2.85Å; S63-V67 VanDerWaalsContact O-N 3.08Å; S63-I113 WeakPolarHBondContact OG-CG2 3.35Å |
| 64 | V | 86.5 | Confident | 85.9 | Confident | 94 Ų | 94 | 56.8 Ų | 56.8 | 57% | 0.57 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -61.8 | -47.6 | 175.3 | 171.7 | 0 | 0 | 0 | 0 | 110.5 | A60 L61 Y66 V67 V68 | A60-V64 WeakPolarHBondContact O-CG2 3.41Å; A60-V64 PolarHBondContact O-N 3.15Å; A60-V64 VanDerWaalsContact O-N 3.07Å; L61-V64 PolarHBondContact O-N 3.34Å; V64-Y66 VanDerWaalsContact C-N 3.34Å; V64-Y66 PolarHBondContact O-N 2.89Å; V64-V67 PolarHBondContact O-N 3.27Å; V64-V68 HydrophobicContact CG1-CG2 4.38Å; V64-V68 WeakPolarHBondContact O-CG2 3.37Å; V64-V68 PolarHBondContact O-N 3.21Å |
| 65 | I | 82.9 | Confident | 86.2 | Confident | 36 Ų | 36 | 56.8 Ų | 56.8 | 19% | 0.185 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 178.8 | -67.1 | 166.6 | 0 | 0 | 0 | 111 | L61 F62 V67 V68 T69 I308 I312 | L61-I65 HydrophobicContact CD1-CD1 4.09Å; L61-I65 HydrophobicContact CG-CD1 3.98Å; L61-I65 WeakPolarHBondContact O-CG1 3.04Å; L61-I65 PolarHBondContact O-N 3.39Å; F62-I65 HydrophobicContact CD1-CD1 4.34Å; F62-I65 PolarHBondContact O-N 3.46Å; I65-V67 PolarHBondContact O-N 3.43Å; I65-V68 PolarHBondContact O-N 2.75Å; I65-T69 WeakPolarHBondContact O-CB 3.47Å; I65-T69 PolarHBondContact O-N 2.96Å; I65-T69 PolarHBondContact O-OG1 3.24Å; I65-I308 HydrophobicContact CB-CG2 4.13Å; I65-I308 HydrophobicContact CD1-CG2 3.76Å; I65-I308 HydrophobicContact CG2-CG2 3.43Å; I65-I308 VanDerWaalsContact CG2-CG2 3.43Å; I65-I312 HydrophobicContact CG2-CD1 3.91Å |
| 66 | Y | 86.4 | Confident | 86.4 | Confident | 65 Ų | 65 | 55.5 Ų | 55.5 | 26% | 0.255 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -55.6 | -51.3 | 177.1 | 170.2 | -108.2 | 0 | 0 | 0 | 112 | F62 S63 V64 V68 T69 V70 A105 T109 P110 I113 | F62-Y66 VanDerWaalsContact O-CB 3.28Å; F62-Y66 WeakPolarHBondContact O-CB 3.31Å; F62-Y66 PolarHBondContact O-N 3.37Å; S63-Y66 PolarHBondContact O-N 3.28Å; V64-Y66 VanDerWaalsContact C-N 3.34Å; V64-Y66 PolarHBondContact O-N 2.89Å; Y66-V68 PolarHBondContact O-N 2.77Å; Y66-T69 PolarHBondContact O-N 3.43Å; Y66-V70 HydrophobicContact CD2-CG2 4Å; Y66-V70 HydrophobicContact CE1-CG2 4.5Å; Y66-V70 HydrophobicContact CE2-CG2 3.51Å; Y66-V70 WeakPolarHBondContact O-CG2 3.37Å; Y66-V70 PolarHBondContact O-N 3.38Å; Y66-A105 HydrophobicContact CD2-CB 4.49Å; Y66-T109 HydrophobicContact CD2-CG2 4.15Å; Y66-T109 HydrophobicContact CG-CG2 4.44Å; Y66-P110 HydrophobicContact CD2-CG 4.46Å; Y66-P110 HydrophobicContact CE2-CG 3.84Å; Y66-I113 HydrophobicContact CG-CD1 4.33Å |
| 67 | V | 88 | Confident | 86.6 | Confident | 75 Ų | 75 | 50 Ų | 50 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61 | -45.4 | 179.5 | 172.2 | 0 | 0 | 0 | 0 | 111 | S63 V64 I65 T69 V70 L71 | S63-V67 WeakPolarHBondContact O-CG2 3.38Å; S63-V67 PolarHBondContact O-N 2.85Å; S63-V67 VanDerWaalsContact O-N 3.08Å; V64-V67 PolarHBondContact O-N 3.27Å; I65-V67 PolarHBondContact O-N 3.43Å; V67-T69 PolarHBondContact O-N 3.09Å; V67-V70 PolarHBondContact O-N 3.46Å; V67-L71 HydrophobicContact CG1-CD1 3.64Å; V67-L71 HydrophobicContact CG1-CG 4.24Å; V67-L71 VanDerWaalsContact O-CB 3.31Å; V67-L71 WeakPolarHBondContact O-CB 3.42Å; V67-L71 VanDerWaalsContact O-CG 3.26Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.1Å |
| 68 | V | 85.8 | Confident | 86.7 | Confident | 75 Ų | 75 | 47 Ų | 47 | 46% | 0.455 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 178.2 | 171.2 | 0 | 0 | 0 | 0 | 111.3 | V64 I65 Y66 G72 I312 | V64-V68 HydrophobicContact CG1-CG2 4.38Å; V64-V68 WeakPolarHBondContact O-CG2 3.37Å; V64-V68 PolarHBondContact O-N 3.21Å; I65-V68 PolarHBondContact O-N 2.75Å; Y66-V68 PolarHBondContact O-N 2.77Å; V68-G72 WeakPolarHBondContact O-CA 3.37Å; V68-G72 PolarHBondContact O-N 3.4Å; V68-I312 HydrophobicContact CB-CD1 4.29Å; V68-I312 HydrophobicContact CG1-CD1 3.81Å; V68-I312 HydrophobicContact CG1-CG1 4.39Å |
| 69 | T | 84.9 | Confident | 86.7 | Confident | 3 Ų | 3 | 45.5 Ų | 45.5 | 2% | 0.018 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.5 | -48 | 179.3 | -66.5 | 0 | 0 | 0 | 0 | 111.7 | I65 Y66 V67 N73 A105 P311 | I65-T69 WeakPolarHBondContact O-CB 3.47Å; I65-T69 PolarHBondContact O-N 2.96Å; I65-T69 PolarHBondContact O-OG1 3.24Å; Y66-T69 PolarHBondContact O-N 3.43Å; V67-T69 PolarHBondContact O-N 3.09Å; T69-N73 WeakPolarHBondContact O-CB 3.46Å; T69-N73 PolarHBondContact O-N 3.18Å; T69-N73 PolarHBondContact O-ND2 3.42Å; T69-A105 HydrophobicContact CG2-CB 3.81Å; T69-P311 HydrophobicContact CG2-CB 3.71Å |
| 70 | V | 88.6 | Confident | 86.7 | Confident | 28 Ų | 28 | 43.7 Ų | 43.7 | 17% | 0.17 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -65.1 | -49.3 | 180 | 172 | 0 | 0 | 0 | 0 | 110.7 | Y66 V67 G72 N73 L74 M102 | Y66-V70 HydrophobicContact CD2-CG2 4Å; Y66-V70 HydrophobicContact CE1-CG2 4.5Å; Y66-V70 HydrophobicContact CE2-CG2 3.51Å; Y66-V70 WeakPolarHBondContact O-CG2 3.37Å; Y66-V70 PolarHBondContact O-N 3.38Å; V67-V70 PolarHBondContact O-N 3.46Å; V70-G72 PolarHBondContact O-N 2.88Å; V70-N73 PolarHBondContact O-N 3.45Å; V70-L74 VanDerWaalsContact O-CB 3.22Å; V70-L74 WeakPolarHBondContact O-CB 3.4Å; V70-L74 PolarHBondContact O-N 3.2Å; V70-M102 HydrophobicContact CG1-CG 4.24Å; V70-M102 HydrophobicContact CG1-SD 4.37Å |
| 71 | L | 88.2 | Confident | 86.6 | Confident | 106 Ų | 106 | 49.1 Ų | 49.1 | 56% | 0.555 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -65.4 | -40.2 | 180 | -68.4 | 178.9 | 0 | 0 | 0 | 112.1 | V67 L74 L75 | V67-L71 HydrophobicContact CG1-CD1 3.64Å; V67-L71 HydrophobicContact CG1-CG 4.24Å; V67-L71 VanDerWaalsContact O-CB 3.31Å; V67-L71 WeakPolarHBondContact O-CB 3.42Å; V67-L71 VanDerWaalsContact O-CG 3.26Å; V67-L71 WeakPolarHBondContact O-CG 3.43Å; V67-L71 PolarHBondContact O-N 3.1Å; L71-L74 PolarHBondContact O-N 3.34Å; L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.33Å; L71-L75 PolarHBondContact O-N 3.32Å |
| 72 | G | 86.4 | Confident | 86.4 | Confident | 18 Ų | 18 | 52.2 Ų | 52.2 | 19% | 0.186 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -62.6 | -47.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V68 V70 L75 I76 | V68-G72 WeakPolarHBondContact O-CA 3.37Å; V68-G72 PolarHBondContact O-N 3.4Å; V70-G72 PolarHBondContact O-N 2.88Å; G72-L75 PolarHBondContact O-N 3.3Å; G72-I76 WeakPolarHBondContact O-CG1 3.27Å; G72-I76 PolarHBondContact O-N 2.89Å; G72-I76 VanDerWaalsContact O-N 3.17Å |
| 73 | N | 89.2 | Confident | 86.2 | Confident | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -69.1 | -39.6 | 177.5 | -79.5 | -58.3 | 0 | 0 | 0 | 112.5 | T69 V70 L75 I76 I77 S98 M102 P311 P315 | T69-N73 WeakPolarHBondContact O-CB 3.46Å; T69-N73 PolarHBondContact O-N 3.18Å; T69-N73 PolarHBondContact O-ND2 3.42Å; V70-N73 PolarHBondContact O-N 3.45Å; N73-L75 VanDerWaalsContact C-N 3.31Å; N73-L75 PolarHBondContact O-N 3.36Å; N73-I76 WeakPolarHBondContact O-CB 3.26Å; N73-I76 PolarHBondContact O-N 2.92Å; N73-I77 VanDerWaalsContact O-CG1 3.31Å; N73-I77 WeakPolarHBondContact O-CG1 3.42Å; N73-I77 PolarHBondContact O-N 3.37Å; N73-S98 WeakPolarHBondContact CB-O 3.44Å; N73-S98 VanDerWaalsContact OD1-CA 3.32Å; N73-S98 WeakPolarHBondContact OD1-CA 3.46Å; N73-S98 VanDerWaalsContact OD1-CB 3.27Å; N73-S98 WeakPolarHBondContact OD1-CB 3.24Å; N73-S98 PolarHBondContact OD1-OG 3.12Å; N73-M102 HydrophobicContact CB-CB 4.03Å; N73-P311 PolarHBondContact ND2-O 2.62Å; N73-P315 WeakPolarHBondContact ND2-CG 3.28Å |
| 74 | L | 90.3 | Very high | 85.5 | Confident | 77 Ų | 77 | 55.7 Ų | 55.7 | 40% | 0.403 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -59.1 | -43.6 | 173.2 | 180 | 62.2 | 0 | 0 | 0 | 111.6 | V70 L71 I76 I77 V78 M102 | V70-L74 VanDerWaalsContact O-CB 3.22Å; V70-L74 WeakPolarHBondContact O-CB 3.4Å; V70-L74 PolarHBondContact O-N 3.2Å; L71-L74 PolarHBondContact O-N 3.34Å; L74-I76 VanDerWaalsContact C-N 3.3Å; L74-I76 PolarHBondContact O-N 2.71Å; L74-I77 PolarHBondContact O-N 2.87Å; L74-V78 HydrophobicContact CD1-CG2 4.18Å; L74-V78 HydrophobicContact CG-CG2 4.42Å; L74-V78 WeakPolarHBondContact O-CG2 3.43Å; L74-V78 PolarHBondContact O-N 3.37Å; L74-M102 HydrophobicContact CB-SD 4.21Å |
| 75 | L | 88.1 | Confident | 84.8 | Confident | 79 Ų | 79 | 57.6 Ų | 57.6 | 41% | 0.414 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.8 | -40 | 177.6 | -177.4 | 65.5 | 0 | 0 | 0 | 111.6 | L71 G72 N73 T79 M329 | L71-L75 VanDerWaalsContact O-CB 3.31Å; L71-L75 WeakPolarHBondContact O-CB 3.33Å; L71-L75 PolarHBondContact O-N 3.32Å; G72-L75 PolarHBondContact O-N 3.3Å; N73-L75 VanDerWaalsContact C-N 3.31Å; N73-L75 PolarHBondContact O-N 3.36Å; L75-T79 VanDerWaalsContact O-CB 3.26Å; L75-T79 WeakPolarHBondContact O-CB 3.37Å; L75-T79 PolarHBondContact O-N 3.37Å; L75-T79 PolarHBondContact O-OG1 3.31Å; L75-M329 HydrophobicContact CD2-CE 3.9Å; L75-M329 HydrophobicContact CD2-CG 4.39Å; L75-M329 HydrophobicContact CD2-SD 3.69Å; L75-M329 HydrophobicContact CG-CE 3.79Å; L75-M329 HydrophobicContact CG-CG 4.42Å; L75-M329 HydrophobicContact CG-SD 4.1Å |
| 76 | I | 87.5 | Confident | 84.3 | Confident | 1 Ų | 1 | 56 Ų | 56 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.9 | -51.1 | 175.9 | -66.9 | 163.8 | 0 | 0 | 0 | 110.3 | G72 N73 L74 V78 T79 V80 L94 S98 P315 T319 M329 | G72-I76 WeakPolarHBondContact O-CG1 3.27Å; G72-I76 PolarHBondContact O-N 2.89Å; G72-I76 VanDerWaalsContact O-N 3.17Å; N73-I76 WeakPolarHBondContact O-CB 3.26Å; N73-I76 PolarHBondContact O-N 2.92Å; L74-I76 VanDerWaalsContact C-N 3.3Å; L74-I76 PolarHBondContact O-N 2.71Å; I76-V78 PolarHBondContact O-N 3.49Å; I76-T79 PolarHBondContact O-N 2.97Å; I76-T79 VanDerWaalsContact O-N 3.15Å; I76-V80 HydrophobicContact CG2-CG2 4.28Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 3.47Å; I76-L94 HydrophobicContact CG2-CD2 4.05Å; I76-L94 HydrophobicContact CG2-CG 3.91Å; I76-S98 WeakPolarHBondContact CD1-OG 3.19Å; I76-S98 WeakPolarHBondContact CG2-OG 3.12Å; I76-P315 HydrophobicContact CD1-CB 4.09Å; I76-P315 HydrophobicContact CD1-CG 4.25Å; I76-T319 HydrophobicContact CD1-CG2 3.68Å; I76-T319 HydrophobicContact CG1-CG2 3.54Å; I76-M329 HydrophobicContact CG1-CE 3.98Å |
| 77 | I | 89.6 | Confident | 83.5 | Confident | 23 Ų | 23 | 58.5 Ų | 58.5 | 12% | 0.118 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -52.8 | -55.5 | 178.1 | -68.1 | 166.6 | 0 | 0 | 0 | 109.9 | N73 L74 T79 V80 F81 F99 M102 | N73-I77 VanDerWaalsContact O-CG1 3.31Å; N73-I77 WeakPolarHBondContact O-CG1 3.42Å; N73-I77 PolarHBondContact O-N 3.37Å; L74-I77 PolarHBondContact O-N 2.87Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 3.48Å; I77-V80 PolarHBondContact O-N 2.91Å; I77-F81 HydrophobicContact CG2-CD2 3.71Å; I77-F81 HydrophobicContact CG2-CE2 3.77Å; I77-F81 WeakPolarHBondContact O-CD2 3.14Å; I77-F81 PolarHBondContact O-N 2.93Å; I77-F99 HydrophobicContact CD1-CB 4.11Å; I77-M102 HydrophobicContact CD1-CE 4Å; I77-M102 HydrophobicContact CD1-SD 4.42Å |
| 78 | V | 87 | Confident | 83.3 | Confident | 54 Ų | 54 | 57.3 Ų | 57.3 | 33% | 0.327 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -59 | -43.1 | -180 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | L74 I76 F81 K82 L332 | L74-V78 HydrophobicContact CD1-CG2 4.18Å; L74-V78 HydrophobicContact CG-CG2 4.42Å; L74-V78 WeakPolarHBondContact O-CG2 3.43Å; L74-V78 PolarHBondContact O-N 3.37Å; I76-V78 PolarHBondContact O-N 3.49Å; V78-F81 PolarHBondContact O-N 2.9Å; V78-K82 HydrophobicContact CG1-CG 4.02Å; V78-K82 VanDerWaalsContact O-CB 3.25Å; V78-K82 WeakPolarHBondContact O-CB 3.36Å; V78-K82 VanDerWaalsContact O-CG 3.29Å; V78-K82 WeakPolarHBondContact O-CG 3.22Å; V78-K82 PolarHBondContact O-N 2.82Å; V78-L332 HydrophobicContact CG1-CD2 3.91Å |
| 79 | T | 84.7 | Confident | 83.3 | Confident | 0 Ų | 0 | 54.6 Ų | 54.6 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.4 | -42.2 | -178.5 | -56.1 | 0 | 0 | 0 | 0 | 111.7 | L75 I76 I77 T83 L86 M325 M329 | L75-T79 VanDerWaalsContact O-CB 3.26Å; L75-T79 WeakPolarHBondContact O-CB 3.37Å; L75-T79 PolarHBondContact O-N 3.37Å; L75-T79 PolarHBondContact O-OG1 3.31Å; I76-T79 PolarHBondContact O-N 2.97Å; I76-T79 VanDerWaalsContact O-N 3.15Å; I77-T79 VanDerWaalsContact C-N 3.31Å; I77-T79 PolarHBondContact O-N 3.48Å; T79-T83 WeakPolarHBondContact O-CB 3.31Å; T79-T83 PolarHBondContact O-N 3.02Å; T79-T83 VanDerWaalsContact O-N 3.11Å; T79-T83 PolarHBondContact O-OG1 3.3Å; T79-L86 HydrophobicContact CG2-CD1 3.75Å; T79-M325 HydrophobicContact CG2-CE 3.43Å; T79-M325 VanDerWaalsContact CG2-CE 3.43Å; T79-M329 HydrophobicContact CG2-CG 3.97Å |
| 80 | V | 85.4 | Confident | 83.3 | Confident | 12 Ų | 12 | 54.7 Ų | 54.7 | 7% | 0.073 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.6 | -46.3 | 176.6 | 170.6 | 0 | 0 | 0 | 0 | 110.6 | I76 I77 Y91 | I76-V80 HydrophobicContact CG2-CG2 4.28Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 3.47Å; I77-V80 PolarHBondContact O-N 2.91Å; V80-Y91 WeakPolarHBondContact CG1-O 3.29Å |
| 81 | F | 83.3 | Confident | 83.2 | Confident | 157 Ų | 157 | 53.6 Ų | 53.6 | 69% | 0.689 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -70.7 | -35.4 | -178.9 | -81.5 | -68.6 | 0 | 0 | 0 | 113.9 | I77 V78 | I77-F81 HydrophobicContact CG2-CD2 3.71Å; I77-F81 HydrophobicContact CG2-CE2 3.77Å; I77-F81 WeakPolarHBondContact O-CD2 3.14Å; I77-F81 PolarHBondContact O-N 2.93Å; V78-F81 PolarHBondContact O-N 2.9Å |
| 82 | K | 80.6 | Confident | 83.3 | Confident | 153 Ų | 153 | 52.2 Ų | 52.2 | 67% | 0.665 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -91.3 | -9.7 | -174.2 | -65.3 | -67.5 | -174.4 | 178.4 | 0 | 114.1 | V78 P84 L332 | V78-K82 HydrophobicContact CG1-CG 4.02Å; V78-K82 VanDerWaalsContact O-CB 3.25Å; V78-K82 WeakPolarHBondContact O-CB 3.36Å; V78-K82 VanDerWaalsContact O-CG 3.29Å; V78-K82 WeakPolarHBondContact O-CG 3.22Å; V78-K82 PolarHBondContact O-N 2.82Å; K82-P84 WeakPolarHBondContact O-CD 3.38Å; K82-L332 HydrophobicContact CB-CD1 4.15Å |
| 83 | T | 79.8 | Confident | 83.4 | Confident | 20 Ų | 20 | 51.3 Ų | 51.3 | 12% | 0.123 | 27% | 0.266 | C | S | . | . | trans | -110.8 | 106 | -175.6 | -48.7 | 0 | 0 | 0 | 0 | 111.2 | T79 N85 L86 | T79-T83 WeakPolarHBondContact O-CB 3.31Å; T79-T83 PolarHBondContact O-N 3.02Å; T79-T83 VanDerWaalsContact O-N 3.11Å; T79-T83 PolarHBondContact O-OG1 3.3Å; T83-N85 HydrophobicContact CG2-CB 4.21Å; T83-N85 PolarHBondContact O-N 3.34Å; T83-L86 HydrophobicContact CG2-CB 4.5Å; T83-L86 HydrophobicContact CG2-CD1 4.1Å; T83-L86 HydrophobicContact CG2-CG 3.86Å; T83-L86 PolarHBondContact O-N 3.4Å | ||
| 84 | P | 72.7 | Confident | 83.4 | Confident | 94 Ų | 94 | 51.3 Ų | 51.3 | 61% | 0.61 | 27% | 0.266 | S | S | * | . | G | 310 helix | trans | -58.3 | -33.3 | -179.8 | -24.4 | 33.3 | 0 | 0 | 0 | 113.7 | K82 L86 N87 | K82-P84 WeakPolarHBondContact O-CD 3.38Å; P84-L86 PolarHBondContact O-N 3.39Å; P84-N87 VanDerWaalsContact O-CB 3.29Å; P84-N87 WeakPolarHBondContact O-CB 3.28Å; P84-N87 PolarHBondContact O-N 3.08Å; P84-N87 VanDerWaalsContact O-N 3.14Å; P84-N87 PolarHBondContact O-ND2 3.31Å |
| 85 | N | 70.8 | Confident | 83.4 | Confident | 134 Ų | 134 | 48 Ų | 48 | 72% | 0.717 | 25% | 0.25 | S | C | * | . | G | 310 helix | trans | -67 | -13.6 | 178.1 | -67.7 | 50.6 | 0 | 0 | 0 | 113.7 | T83 | T83-N85 HydrophobicContact CG2-CB 4.21Å; T83-N85 PolarHBondContact O-N 3.34Å |
| 86 | L | 73.6 | Confident | 83.6 | Confident | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.016 | 24% | 0.24 | C | C | . | . | G | 310 helix | trans | -99.8 | 13.3 | 176.3 | -60.6 | 178 | 0 | 0 | 0 | 112.3 | T79 T83 P84 T88 Y91 E324 M325 | T79-L86 HydrophobicContact CG2-CD1 3.75Å; T83-L86 HydrophobicContact CG2-CB 4.5Å; T83-L86 HydrophobicContact CG2-CD1 4.1Å; T83-L86 HydrophobicContact CG2-CG 3.86Å; T83-L86 PolarHBondContact O-N 3.4Å; P84-L86 PolarHBondContact O-N 3.39Å; L86-T88 PolarHBondContact O-N 2.95Å; L86-Y91 HydrophobicContact CB-CD2 3.86Å; L86-Y91 HydrophobicContact CB-CE2 4.48Å; L86-Y91 HydrophobicContact CB-CG 4.09Å; L86-Y91 HydrophobicContact CD2-CD1 4.39Å; L86-Y91 HydrophobicContact CD2-CD2 3.67Å; L86-Y91 HydrophobicContact CD2-CE1 4.17Å; L86-Y91 HydrophobicContact CD2-CE2 3.41Å; L86-Y91 VanDerWaalsContact CD2-CE2 3.41Å; L86-Y91 HydrophobicContact CD2-CG 4.2Å; L86-Y91 HydrophobicContact CG-CD2 4.34Å; L86-Y91 WeakPolarHBondContact O-CB 3.32Å; L86-Y91 WeakPolarHBondContact O-CD2 3.42Å; L86-E324 HydrophobicContact CD2-CB 4.38Å; L86-M325 HydrophobicContact CD1-CE 3.68Å; L86-M325 HydrophobicContact CD1-SD 3.45Å; L86-M325 WeakPolarHBondContact CD1-SD 3.36Å; L86-M325 HydrophobicContact CD2-SD 3.89Å; L86-M325 HydrophobicContact CG-SD 4.32Å |
| 87 | N | 69.8 | Low | 83.7 | Confident | 117 Ų | 117 | 46 Ų | 46 | 63% | 0.626 | 24% | 0.24 | S | C | * | . | trans | -73.7 | 50.6 | 175.3 | -75.7 | -32 | 0 | 0 | 0 | 112.8 | P84 | P84-N87 VanDerWaalsContact O-CB 3.29Å; P84-N87 WeakPolarHBondContact O-CB 3.28Å; P84-N87 PolarHBondContact O-N 3.08Å; P84-N87 VanDerWaalsContact O-N 3.14Å; P84-N87 PolarHBondContact O-ND2 3.31Å | ||
| 88 | T | 82.2 | Confident | 83.7 | Confident | 50 Ų | 50 | 44.9 Ų | 44.9 | 31% | 0.307 | 23% | 0.234 | S | C | . | . | S | Bend | trans | -105.2 | 154.2 | 173.6 | 74.1 | 0 | 0 | 0 | 0 | 110.7 | L86 M90 Y91 F92 | L86-T88 PolarHBondContact O-N 2.95Å; T88-M90 PolarHBondContact O-N 3.42Å; T88-Y91 HydrophobicContact CG2-CD2 4.31Å; T88-Y91 PolarHBondContact O-N 3.21Å; T88-Y91 WeakPolarHBondContact OG1-CD2 3.5Å; T88-F92 PolarHBondContact O-N 3.31Å; T88-F92 VanDerWaalsContact O-N 3.1Å |
| 89 | P | 86 | Confident | 84 | Confident | 18 Ų | 18 | 46.9 Ų | 46.9 | 12% | 0.117 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -46.3 | -42.9 | 174.2 | -35.6 | 40.3 | 0 | 0 | 0 | 114.8 | F92 L93 D152 Y163 M167 C172 | P89-F92 PolarHBondContact O-N 2.89Å; P89-L93 WeakPolarHBondContact O-CG 3.26Å; P89-L93 PolarHBondContact O-N 2.96Å; P89-D152 WeakPolarHBondContact CB-OD1 3.4Å; P89-Y163 WeakPolarHBondContact CG-OH 3.45Å; P89-M167 HydrophobicContact CB-CB 4.36Å; P89-M167 HydrophobicContact CB-CE 3.8Å; P89-M167 HydrophobicContact CG-CB 4.12Å; P89-M167 VanDerWaalsContact CG-O 3.27Å; P89-M167 WeakPolarHBondContact CG-O 3.27Å; P89-C172 WeakPolarHBondContact CB-SG 3.27Å |
| 90 | M | 86.6 | Confident | 84.3 | Confident | 5 Ų | 5 | 46.9 Ų | 46.9 | 3% | 0.025 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.3 | -47.5 | 180 | -172.2 | -161.5 | -175 | 0 | 0 | 113.2 | T88 F92 L93 L94 D152 R153 H274 Y318 | T88-M90 PolarHBondContact O-N 3.42Å; M90-F92 VanDerWaalsContact C-N 3.32Å; M90-L93 PolarHBondContact O-N 3.13Å; M90-L94 WeakPolarHBondContact O-CB 3.38Å; M90-L94 PolarHBondContact O-N 3.29Å; M90-D152 WeakPolarHBondContact CB-OD2 3.31Å; M90-R153 PolarHBondContact SD-NH1 2.96Å; M90-R153 VanDerWaalsContact SD-NH1 3.36Å; M90-R153 PolarHBondContact SD-NH2 3.48Å; M90-H274 WeakPolarHBondContact CE-NE2 2.93Å; M90-Y318 HydrophobicContact CE-CD1 4.28Å; M90-Y318 HydrophobicContact CE-CE1 3.93Å |
| 91 | Y | 85.9 | Confident | 84.4 | Confident | 4 Ų | 4 | 46.3 Ų | 46.3 | 2% | 0.016 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -71.8 | -31.3 | -177.7 | -69.7 | -55.8 | 0 | 0 | 0 | 111.4 | V80 L86 T88 L94 G95 N322 E324 M325 | V80-Y91 WeakPolarHBondContact CG1-O 3.29Å; L86-Y91 HydrophobicContact CB-CD2 3.86Å; L86-Y91 HydrophobicContact CB-CE2 4.48Å; L86-Y91 HydrophobicContact CB-CG 4.09Å; L86-Y91 HydrophobicContact CD2-CD1 4.39Å; L86-Y91 HydrophobicContact CD2-CD2 3.67Å; L86-Y91 HydrophobicContact CD2-CE1 4.17Å; L86-Y91 HydrophobicContact CD2-CE2 3.41Å; L86-Y91 VanDerWaalsContact CD2-CE2 3.41Å; L86-Y91 HydrophobicContact CD2-CG 4.2Å; L86-Y91 HydrophobicContact CG-CD2 4.34Å; L86-Y91 WeakPolarHBondContact O-CB 3.32Å; L86-Y91 WeakPolarHBondContact O-CD2 3.42Å; T88-Y91 HydrophobicContact CG2-CD2 4.31Å; T88-Y91 PolarHBondContact O-N 3.21Å; T88-Y91 WeakPolarHBondContact OG1-CD2 3.5Å; Y91-L94 HydrophobicContact CD1-CD2 4.18Å; Y91-L94 PolarHBondContact O-N 2.89Å; Y91-G95 PolarHBondContact O-N 3.12Å; Y91-N322 PolarHBondContact OH-ND2 3.42Å; Y91-N322 PolarHBondContact OH-OD1 3.46Å; Y91-E324 WeakPolarHBondContact CE2-OE2 3.48Å; Y91-E324 WeakPolarHBondContact OH-CB 3.36Å; Y91-E324 PolarHBondContact OH-OE2 2.81Å; Y91-M325 HydrophobicContact CD1-CG 4.48Å; Y91-M325 HydrophobicContact CD1-SD 3.66Å; Y91-M325 HydrophobicContact CE1-CG 3.79Å; Y91-M325 HydrophobicContact CE1-SD 3.38Å; Y91-M325 WeakPolarHBondContact CE1-SD 3.32Å |
| 92 | F | 89.7 | Confident | 84.6 | Confident | 77 Ų | 77 | 40.6 Ų | 40.6 | 34% | 0.338 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.5 | -46.9 | 169.7 | 176.7 | -95.9 | 0 | 0 | 0 | 111.9 | T88 P89 M90 G95 N96 C172 V173 V176 | T88-F92 PolarHBondContact O-N 3.31Å; T88-F92 VanDerWaalsContact O-N 3.1Å; P89-F92 PolarHBondContact O-N 2.89Å; M90-F92 VanDerWaalsContact C-N 3.32Å; F92-G95 PolarHBondContact O-N 2.82Å; F92-N96 PolarHBondContact O-N 2.85Å; F92-N96 PolarHBondContact O-ND2 2.81Å; F92-C172 HydrophobicContact CD1-CB 3.61Å; F92-C172 HydrophobicContact CE1-CB 3.81Å; F92-V173 HydrophobicContact CZ-CG2 4.19Å; F92-V176 HydrophobicContact CE1-CG2 3.77Å; F92-V176 HydrophobicContact CZ-CG2 4.5Å |
| 93 | L | 89.8 | Confident | 85 | Confident | 0 Ų | 0 | 35.6 Ų | 35.6 | 0% | 0 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -63.7 | -41.4 | 175.3 | -68.4 | 172.4 | 0 | 0 | 0 | 111.6 | P89 M90 G95 N96 L97 L145 M149 D152 L175 V176 | P89-L93 WeakPolarHBondContact O-CG 3.26Å; P89-L93 PolarHBondContact O-N 2.96Å; M90-L93 PolarHBondContact O-N 3.13Å; L93-G95 PolarHBondContact O-N 3.39Å; L93-N96 PolarHBondContact O-N 3.37Å; L93-L97 PolarHBondContact O-N 3.36Å; L93-L145 HydrophobicContact CD2-CD2 4.24Å; L93-M149 HydrophobicContact CB-CG 3.69Å; L93-M149 HydrophobicContact CD1-CG 4.08Å; L93-D152 HydrophobicContact CD1-CB 4.44Å; L93-L175 HydrophobicContact CD2-CB 4.36Å; L93-V176 HydrophobicContact CD2-CG2 3.94Å |
| 94 | L | 88 | Confident | 85.2 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.9 | -40.7 | 176.5 | 179.2 | 62.9 | 0 | 0 | 0 | 112.3 | I76 M90 Y91 N96 L97 S98 M149 Y318 | I76-L94 HydrophobicContact CG2-CD2 4.05Å; I76-L94 HydrophobicContact CG2-CG 3.91Å; M90-L94 WeakPolarHBondContact O-CB 3.38Å; M90-L94 PolarHBondContact O-N 3.29Å; Y91-L94 HydrophobicContact CD1-CD2 4.18Å; Y91-L94 PolarHBondContact O-N 2.89Å; L94-N96 VanDerWaalsContact C-N 3.3Å; L94-N96 PolarHBondContact O-N 2.84Å; L94-L97 HydrophobicContact CD1-CD2 4.49Å; L94-L97 PolarHBondContact O-N 2.88Å; L94-S98 PolarHBondContact O-N 2.88Å; L94-S98 PolarHBondContact O-OG 3.15Å; L94-M149 HydrophobicContact CB-CE 3.97Å; L94-M149 HydrophobicContact CD1-CE 4.1Å; L94-Y318 HydrophobicContact CD1-CD1 4.04Å; L94-Y318 HydrophobicContact CD1-CD2 3.38Å; L94-Y318 HydrophobicContact CD1-CE1 4.38Å; L94-Y318 HydrophobicContact CD1-CE2 3.78Å; L94-Y318 HydrophobicContact CD1-CG 3.52Å; L94-Y318 HydrophobicContact CD2-CD1 4.12Å; L94-Y318 HydrophobicContact CD2-CG 3.95Å; L94-Y318 HydrophobicContact CG-CG 4.4Å |
| 95 | G | 90 | Very high | 85.8 | Confident | 6 Ų | 6 | 30.7 Ų | 30.7 | 6% | 0.062 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.5 | -38.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y91 F92 L93 F99 | Y91-G95 PolarHBondContact O-N 3.12Å; F92-G95 PolarHBondContact O-N 2.82Å; L93-G95 PolarHBondContact O-N 3.39Å; G95-F99 PolarHBondContact O-N 2.78Å; G95-F99 VanDerWaalsContact O-N 3.09Å |
| 96 | N | 92.7 | Very high | 86.4 | Confident | 38 Ų | 38 | 26.7 Ų | 26.7 | 20% | 0.203 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -69.2 | -41.4 | 174.2 | -75.8 | -87.6 | 0 | 0 | 0 | 111.9 | F92 L93 L94 F99 V100 L145 V176 | F92-N96 PolarHBondContact O-N 2.85Å; F92-N96 PolarHBondContact O-ND2 2.81Å; L93-N96 PolarHBondContact O-N 3.37Å; L94-N96 VanDerWaalsContact C-N 3.3Å; L94-N96 PolarHBondContact O-N 2.84Å; N96-F99 WeakPolarHBondContact O-CB 3.5Å; N96-F99 PolarHBondContact O-N 2.75Å; N96-V100 WeakPolarHBondContact O-CG2 3.23Å; N96-V100 PolarHBondContact O-N 3.4Å; N96-L145 HydrophobicContact CB-CD1 4.28Å; N96-V176 HydrophobicContact CB-CG2 4.28Å |
| 97 | L | 89.6 | Confident | 86.7 | Confident | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -59.3 | -47.5 | 174.7 | -175 | 66.6 | 0 | 0 | 0 | 111 | L93 L94 F99 V100 D101 E142 L145 L146 M149 Y318 | L93-L97 PolarHBondContact O-N 3.36Å; L94-L97 HydrophobicContact CD1-CD2 4.49Å; L94-L97 PolarHBondContact O-N 2.88Å; L97-F99 VanDerWaalsContact C-N 3.27Å; L97-F99 PolarHBondContact O-N 2.81Å; L97-V100 WeakPolarHBondContact O-CA 3.43Å; L97-V100 WeakPolarHBondContact O-CB 3.39Å; L97-V100 PolarHBondContact O-N 3.41Å; L97-D101 VanDerWaalsContact O-CG 3.31Å; L97-D101 PolarHBondContact O-N 3.12Å; L97-E142 HydrophobicContact CD1-CB 4.43Å; L97-E142 HydrophobicContact CD1-CG 3.73Å; L97-L145 HydrophobicContact CB-CD1 4.39Å; L97-L145 HydrophobicContact CD1-CB 4.14Å; L97-L145 HydrophobicContact CD1-CD1 4.36Å; L97-L146 HydrophobicContact CD1-CG 4.5Å; L97-L146 HydrophobicContact CD2-CD2 3.84Å; L97-M149 HydrophobicContact CD2-SD 3.77Å; L97-Y318 HydrophobicContact CD2-CE2 4.39Å |
| 98 | S | 90.6 | Very high | 86.8 | Confident | 0 Ų | 0 | 23.3 Ų | 23.3 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62 | -32.4 | 175.9 | -73.7 | 0 | 0 | 0 | 0 | 113.5 | N73 I76 L94 M102 | N73-S98 WeakPolarHBondContact CB-O 3.44Å; N73-S98 VanDerWaalsContact OD1-CA 3.32Å; N73-S98 WeakPolarHBondContact OD1-CA 3.46Å; N73-S98 VanDerWaalsContact OD1-CB 3.27Å; N73-S98 WeakPolarHBondContact OD1-CB 3.24Å; N73-S98 PolarHBondContact OD1-OG 3.12Å; I76-S98 WeakPolarHBondContact CD1-OG 3.19Å; I76-S98 WeakPolarHBondContact CG2-OG 3.12Å; L94-S98 PolarHBondContact O-N 2.88Å; L94-S98 PolarHBondContact O-OG 3.15Å; S98-M102 VanDerWaalsContact O-CB 3.26Å; S98-M102 WeakPolarHBondContact O-CB 3.43Å; S98-M102 PolarHBondContact O-N 3.22Å |
| 99 | F | 92.1 | Very high | 86.5 | Confident | 96 Ų | 96 | 21.2 Ų | 21.2 | 42% | 0.421 | 11% | 0.111 | S | C | . | . | H | α-helix | trans | -66.4 | -42.6 | 172.4 | 174 | -98.4 | 0 | 0 | 0 | 111.8 | I77 G95 N96 L97 M102 T103 W180 | I77-F99 HydrophobicContact CD1-CB 4.11Å; G95-F99 PolarHBondContact O-N 2.78Å; G95-F99 VanDerWaalsContact O-N 3.09Å; N96-F99 WeakPolarHBondContact O-CB 3.5Å; N96-F99 PolarHBondContact O-N 2.75Å; L97-F99 VanDerWaalsContact C-N 3.27Å; L97-F99 PolarHBondContact O-N 2.81Å; F99-M102 HydrophobicContact CD2-CE 4.36Å; F99-T103 WeakPolarHBondContact O-CB 3.35Å; F99-T103 PolarHBondContact O-N 2.91Å; F99-T103 PolarHBondContact O-OG1 2.84Å; F99-W180 HydrophobicContact CD1-CZ2 4.33Å; F99-W180 HydrophobicContact CE1-CH2 4.37Å; F99-W180 HydrophobicContact CE1-CZ2 4.13Å |
| 100 | V | 90.9 | Very high | 86.2 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -61.9 | -48.8 | 175.1 | 173.5 | 0 | 0 | 0 | 0 | 110.5 | N96 L97 M102 T103 L104 L138 V141 E142 L145 W180 | N96-V100 WeakPolarHBondContact O-CG2 3.23Å; N96-V100 PolarHBondContact O-N 3.4Å; L97-V100 WeakPolarHBondContact O-CA 3.43Å; L97-V100 WeakPolarHBondContact O-CB 3.39Å; L97-V100 PolarHBondContact O-N 3.41Å; V100-M102 PolarHBondContact O-N 3.5Å; V100-T103 PolarHBondContact O-N 2.9Å; V100-L104 WeakPolarHBondContact O-CB 3.48Å; V100-L104 PolarHBondContact O-N 2.75Å; V100-L138 HydrophobicContact CG1-CB 3.99Å; V100-L138 HydrophobicContact CG1-CD2 4.35Å; V100-L138 WeakPolarHBondContact CG1-O 3.04Å; V100-V141 HydrophobicContact CG2-CB 4.44Å; V100-V141 HydrophobicContact CG2-CG1 3.8Å; V100-E142 HydrophobicContact CG1-CB 4.13Å; V100-L145 HydrophobicContact CG2-CD1 4.08Å; V100-W180 HydrophobicContact CG2-CH2 4.49Å; V100-W180 HydrophobicContact CG2-CZ2 4.11Å |
| 101 | D | 86.9 | Confident | 85.8 | Confident | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.1 | -44.9 | 178.6 | -65 | -10.6 | 0 | 0 | 0 | 112.4 | L97 T103 L104 A105 P311 N314 | L97-D101 VanDerWaalsContact O-CG 3.31Å; L97-D101 PolarHBondContact O-N 3.12Å; D101-T103 VanDerWaalsContact C-N 3.32Å; D101-T103 PolarHBondContact O-N 3.02Å; D101-L104 PolarHBondContact O-N 3.28Å; D101-A105 WeakPolarHBondContact O-CB 3.23Å; D101-A105 PolarHBondContact O-N 3Å; D101-P311 HydrophobicContact CB-CB 4.31Å; D101-N314 PolarHBondContact OD1-ND2 3.4Å; D101-N314 WeakPolarHBondContact OD2-CB 3.31Å; D101-N314 PolarHBondContact OD2-ND2 3.39Å |
| 102 | M | 88.6 | Confident | 85.5 | Confident | 38 Ų | 38 | 25.6 Ų | 25.6 | 19% | 0.187 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.2 | -40.3 | 178.4 | -175 | 176.8 | 69.5 | 0 | 0 | 111.2 | V70 N73 L74 I77 S98 F99 V100 S106 | V70-M102 HydrophobicContact CG1-CG 4.24Å; V70-M102 HydrophobicContact CG1-SD 4.37Å; N73-M102 HydrophobicContact CB-CB 4.03Å; L74-M102 HydrophobicContact CB-SD 4.21Å; I77-M102 HydrophobicContact CD1-CE 4Å; I77-M102 HydrophobicContact CD1-SD 4.42Å; S98-M102 VanDerWaalsContact O-CB 3.26Å; S98-M102 WeakPolarHBondContact O-CB 3.43Å; S98-M102 PolarHBondContact O-N 3.22Å; F99-M102 HydrophobicContact CD2-CE 4.36Å; V100-M102 PolarHBondContact O-N 3.5Å; M102-S106 VanDerWaalsContact O-CB 3.27Å; M102-S106 WeakPolarHBondContact O-CB 3.32Å; M102-S106 PolarHBondContact O-N 3Å; M102-S106 PolarHBondContact O-OG 3.36Å |
| 103 | T | 89.3 | Confident | 85.1 | Confident | 47 Ų | 47 | 22.5 Ų | 22.5 | 29% | 0.288 | 12% | 0.119 | S | C | . | . | H | α-helix | trans | -67.1 | -45.9 | 177.5 | -55.1 | 0 | 0 | 0 | 0 | 110.4 | F99 V100 D101 A105 S106 F107 L138 | F99-T103 WeakPolarHBondContact O-CB 3.35Å; F99-T103 PolarHBondContact O-N 2.91Å; F99-T103 PolarHBondContact O-OG1 2.84Å; V100-T103 PolarHBondContact O-N 2.9Å; D101-T103 VanDerWaalsContact C-N 3.32Å; D101-T103 PolarHBondContact O-N 3.02Å; T103-A105 PolarHBondContact O-N 3Å; T103-S106 PolarHBondContact O-N 3.19Å; T103-F107 VanDerWaalsContact O-CD1 3.3Å; T103-F107 WeakPolarHBondContact O-CD1 3.47Å; T103-F107 PolarHBondContact O-N 3.45Å; T103-F107 VanDerWaalsContact O-N 3.13Å; T103-L138 HydrophobicContact CG2-CD1 3.67Å |
| 104 | L | 83.8 | Confident | 84.7 | Confident | 9 Ų | 9 | 27.2 Ų | 27.2 | 5% | 0.047 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -56.4 | -49.8 | 177 | -179.7 | 61.7 | 0 | 0 | 0 | 111.7 | V100 D101 S106 F107 A108 L135 L138 P311 | V100-L104 WeakPolarHBondContact O-CB 3.48Å; V100-L104 PolarHBondContact O-N 2.75Å; D101-L104 PolarHBondContact O-N 3.28Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.17Å; L104-F107 HydrophobicContact CB-CE1 4.41Å; L104-F107 HydrophobicContact CD1-CE1 3.5Å; L104-F107 HydrophobicContact CD1-CZ 3.77Å; L104-F107 HydrophobicContact CG-CE1 4.47Å; L104-F107 WeakPolarHBondContact O-CD1 3.24Å; L104-A108 PolarHBondContact O-N 3.37Å; L104-L135 HydrophobicContact CD1-CD2 3.79Å; L104-L138 HydrophobicContact CB-CD1 4.01Å; L104-L138 HydrophobicContact CD1-CB 4.37Å; L104-P311 HydrophobicContact CD2-CG 4.14Å |
| 105 | A | 84.3 | Confident | 84.4 | Confident | 2 Ų | 2 | 27.7 Ų | 27.7 | 2% | 0.017 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -61.1 | -37.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y66 T69 D101 T103 T109 P110 | Y66-A105 HydrophobicContact CD2-CB 4.49Å; T69-A105 HydrophobicContact CG2-CB 3.81Å; D101-A105 WeakPolarHBondContact O-CB 3.23Å; D101-A105 PolarHBondContact O-N 3Å; T103-A105 PolarHBondContact O-N 3Å; A105-T109 WeakPolarHBondContact O-CB 3.49Å; A105-T109 PolarHBondContact O-N 3.02Å; A105-T109 PolarHBondContact O-OG1 3.44Å; A105-P110 WeakPolarHBondContact O-CD 3.42Å |
| 106 | S | 84.6 | Confident | 83.9 | Confident | 50 Ų | 50 | 27.7 Ų | 27.7 | 35% | 0.35 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -76.5 | -25.7 | -173.1 | -61.9 | 0 | 0 | 0 | 0 | 115.1 | M102 T103 L104 P110 | M102-S106 VanDerWaalsContact O-CB 3.27Å; M102-S106 WeakPolarHBondContact O-CB 3.32Å; M102-S106 PolarHBondContact O-N 3Å; M102-S106 PolarHBondContact O-OG 3.36Å; T103-S106 PolarHBondContact O-N 3.19Å; L104-S106 VanDerWaalsContact C-N 3.29Å; L104-S106 PolarHBondContact O-N 3.17Å; S106-P110 WeakPolarHBondContact O-CD 3.38Å; S106-P110 VanDerWaalsContact O-CG 3.31Å; S106-P110 WeakPolarHBondContact O-CG 3.44Å |
| 107 | F | 79.1 | Confident | 83.2 | Confident | 46 Ų | 46 | 30.5 Ų | 30.5 | 20% | 0.202 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -93.2 | -38.2 | 178.3 | 85.5 | -98.7 | 0 | 0 | 0 | 112.7 | T103 L104 Q131 L134 L135 L138 | T103-F107 VanDerWaalsContact O-CD1 3.3Å; T103-F107 WeakPolarHBondContact O-CD1 3.47Å; T103-F107 PolarHBondContact O-N 3.45Å; T103-F107 VanDerWaalsContact O-N 3.13Å; L104-F107 HydrophobicContact CB-CE1 4.41Å; L104-F107 HydrophobicContact CD1-CE1 3.5Å; L104-F107 HydrophobicContact CD1-CZ 3.77Å; L104-F107 HydrophobicContact CG-CE1 4.47Å; L104-F107 WeakPolarHBondContact O-CD1 3.24Å; F107-Q131 HydrophobicContact CD2-CG 4.45Å; F107-Q131 HydrophobicContact CE2-CG 4Å; F107-L134 HydrophobicContact CB-CD1 4.4Å; F107-L134 HydrophobicContact CD1-CB 4.19Å; F107-L134 HydrophobicContact CD2-CB 4.03Å; F107-L134 HydrophobicContact CD2-CD1 4.06Å; F107-L134 HydrophobicContact CE1-CB 3.83Å; F107-L134 HydrophobicContact CE2-CB 3.69Å; F107-L134 HydrophobicContact CG-CB 4.3Å; F107-L134 HydrophobicContact CG-CD1 4.09Å; F107-L134 HydrophobicContact CZ-CB 3.59Å; F107-L135 HydrophobicContact CE2-CD2 4.1Å; F107-L135 HydrophobicContact CE2-CG 3.85Å; F107-L135 HydrophobicContact CZ-CB 4.22Å; F107-L135 HydrophobicContact CZ-CD2 3.6Å; F107-L135 HydrophobicContact CZ-CG 3.61Å; F107-L138 HydrophobicContact CD1-CD1 4.02Å; F107-L138 HydrophobicContact CE1-CD1 3.68Å |
| 108 | A | 71.2 | Confident | 82.7 | Confident | 3 Ų | 3 | 36 Ų | 36 | 3% | 0.025 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -86.7 | -45.9 | -174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L104 M112 L135 | L104-A108 PolarHBondContact O-N 3.37Å; A108-M112 WeakPolarHBondContact O-CB 3.34Å; A108-M112 PolarHBondContact O-N 3.01Å; A108-L135 HydrophobicContact CB-CD2 4.22Å |
| 109 | T | 77.3 | Confident | 81.7 | Confident | 6 Ų | 6 | 46.1 Ų | 46.1 | 4% | 0.037 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -72.7 | -42.3 | -167.2 | -44.5 | 0 | 0 | 0 | 0 | 113.6 | Y66 A105 K111 M112 I113 | Y66-T109 HydrophobicContact CD2-CG2 4.15Å; Y66-T109 HydrophobicContact CG-CG2 4.44Å; A105-T109 WeakPolarHBondContact O-CB 3.49Å; A105-T109 PolarHBondContact O-N 3.02Å; A105-T109 PolarHBondContact O-OG1 3.44Å; T109-K111 PolarHBondContact O-N 3.09Å; T109-M112 HydrophobicContact CG2-CE 3.8Å; T109-M112 WeakPolarHBondContact O-CB 3.49Å; T109-M112 PolarHBondContact O-N 3.29Å; T109-I113 HydrophobicContact CG2-CD1 3.73Å; T109-I113 HydrophobicContact CG2-CG1 4.2Å; T109-I113 WeakPolarHBondContact O-CB 3.06Å; T109-I113 VanDerWaalsContact O-CG1 3.26Å; T109-I113 WeakPolarHBondContact O-CG1 3.25Å; T109-I113 PolarHBondContact O-N 3.19Å |
| 110 | P | 79 | Confident | 80.7 | Confident | 36 Ų | 36 | 48.4 Ų | 48.4 | 23% | 0.234 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -61.9 | -41.9 | -179.6 | -28.1 | 36.4 | 0 | 0 | 0 | 113.4 | Y66 A105 S106 I113 L114 | Y66-P110 HydrophobicContact CD2-CG 4.46Å; Y66-P110 HydrophobicContact CE2-CG 3.84Å; A105-P110 WeakPolarHBondContact O-CD 3.42Å; S106-P110 WeakPolarHBondContact O-CD 3.38Å; S106-P110 VanDerWaalsContact O-CG 3.31Å; S106-P110 WeakPolarHBondContact O-CG 3.44Å; P110-I113 PolarHBondContact O-N 2.88Å; P110-L114 WeakPolarHBondContact O-CB 3.3Å; P110-L114 VanDerWaalsContact O-CG 3.29Å; P110-L114 WeakPolarHBondContact O-CG 3.23Å; P110-L114 PolarHBondContact O-N 3.4Å |
| 111 | K | 79.2 | Confident | 80.3 | Confident | 78 Ų | 78 | 49.3 Ų | 49.3 | 34% | 0.339 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -66.9 | -40.8 | 179 | -169.4 | 167.6 | -174.4 | 168.2 | 0 | 111.3 | T109 L114 N115 I123 | T109-K111 PolarHBondContact O-N 3.09Å; K111-L114 PolarHBondContact O-N 2.87Å; K111-N115 WeakPolarHBondContact O-CB 3.37Å; K111-N115 PolarHBondContact O-N 3.4Å; K111-N115 PolarHBondContact O-ND2 2.9Å; K111-N115 PolarHBondContact O-OD1 3.06Å; K111-I123 HydrophobicContact CD-CD1 4.32Å |
| 112 | M | 78.1 | Confident | 80.2 | Confident | 5 Ų | 5 | 52.3 Ų | 52.3 | 3% | 0.025 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 173.4 | 176.7 | -172 | 78.1 | 0 | 0 | 112 | F62 A108 T109 L114 N115 L116 I208 I308 | F62-M112 HydrophobicContact CD2-CE 3.79Å; F62-M112 HydrophobicContact CE2-CE 4.21Å; F62-M112 HydrophobicContact CG-CE 4.28Å; A108-M112 WeakPolarHBondContact O-CB 3.34Å; A108-M112 PolarHBondContact O-N 3.01Å; T109-M112 HydrophobicContact CG2-CE 3.8Å; T109-M112 WeakPolarHBondContact O-CB 3.49Å; T109-M112 PolarHBondContact O-N 3.29Å; M112-L114 PolarHBondContact O-N 3.26Å; M112-N115 WeakPolarHBondContact O-CB 3.22Å; M112-N115 PolarHBondContact O-N 2.92Å; M112-L116 PolarHBondContact O-N 3.23Å; M112-I208 HydrophobicContact CG-CB 4.13Å; M112-I208 HydrophobicContact CG-CD1 4.31Å; M112-I208 HydrophobicContact SD-CB 4.42Å; M112-I208 HydrophobicContact SD-CD1 3.56Å; M112-I208 VanDerWaalsContact SD-CD1 3.56Å; M112-I208 HydrophobicContact SD-CG1 4.2Å; M112-I308 HydrophobicContact CE-CD1 3.36Å; M112-I308 HydrophobicContact CE-CG1 3.91Å; M112-I308 HydrophobicContact SD-CD1 4.22Å |
| 113 | I | 81.6 | Confident | 80.1 | Confident | 12 Ų | 12 | 50.6 Ų | 50.6 | 6% | 0.062 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -59.5 | -47.4 | 176.3 | -71.9 | 168.1 | 0 | 0 | 0 | 110.7 | F59 F62 S63 Y66 T109 P110 N115 L116 | F59-I113 HydrophobicContact CD2-CG2 3.42Å; F59-I113 VanDerWaalsContact CD2-CG2 3.42Å; F59-I113 HydrophobicContact CE2-CG2 3.38Å; F59-I113 HydrophobicContact CZ-CG2 4.49Å; F62-I113 HydrophobicContact CB-CD1 4.22Å; F62-I113 HydrophobicContact CB-CG1 3.82Å; S63-I113 WeakPolarHBondContact OG-CG2 3.35Å; Y66-I113 HydrophobicContact CG-CD1 4.33Å; T109-I113 HydrophobicContact CG2-CD1 3.73Å; T109-I113 HydrophobicContact CG2-CG1 4.2Å; T109-I113 WeakPolarHBondContact O-CB 3.06Å; T109-I113 VanDerWaalsContact O-CG1 3.26Å; T109-I113 WeakPolarHBondContact O-CG1 3.25Å; T109-I113 PolarHBondContact O-N 3.19Å; P110-I113 PolarHBondContact O-N 2.88Å; I113-N115 VanDerWaalsContact C-N 3.27Å; I113-N115 PolarHBondContact O-N 3.46Å; I113-L116 WeakPolarHBondContact O-CB 3.24Å; I113-L116 PolarHBondContact O-N 2.95Å; I113-L116 VanDerWaalsContact O-N 3.15Å |
| 114 | L | 81.3 | Confident | 80.2 | Confident | 100 Ų | 100 | 51.1 Ų | 51.1 | 52% | 0.524 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -63.2 | -34.5 | 178.1 | -72.8 | 170.9 | 0 | 0 | 0 | 112.3 | P110 K111 M112 L116 L117 | P110-L114 WeakPolarHBondContact O-CB 3.3Å; P110-L114 VanDerWaalsContact O-CG 3.29Å; P110-L114 WeakPolarHBondContact O-CG 3.23Å; P110-L114 PolarHBondContact O-N 3.4Å; K111-L114 PolarHBondContact O-N 2.87Å; M112-L114 PolarHBondContact O-N 3.26Å; L114-L116 VanDerWaalsContact C-N 3.26Å; L114-L116 PolarHBondContact O-N 2.84Å; L114-L117 PolarHBondContact O-N 3.44Å; L114-L117 VanDerWaalsContact O-N 3.17Å |
| 115 | N | 82 | Confident | 80.4 | Confident | 10 Ų | 10 | 53.2 Ų | 53.2 | 5% | 0.053 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.9 | -26.1 | 177 | -75.8 | -10.6 | 0 | 0 | 0 | 112.6 | K111 M112 I113 L117 K118 K121 | K111-N115 WeakPolarHBondContact O-CB 3.37Å; K111-N115 PolarHBondContact O-N 3.4Å; K111-N115 PolarHBondContact O-ND2 2.9Å; K111-N115 PolarHBondContact O-OD1 3.06Å; M112-N115 WeakPolarHBondContact O-CB 3.22Å; M112-N115 PolarHBondContact O-N 2.92Å; I113-N115 VanDerWaalsContact C-N 3.27Å; I113-N115 PolarHBondContact O-N 3.46Å; N115-L117 PolarHBondContact O-N 3.49Å; N115-K118 PolarHBondContact O-N 3.5Å; N115-K121 HydrophobicContact CB-CB 4.24Å; N115-K121 HydrophobicContact CB-CD 4.33Å; N115-K121 HydrophobicContact CB-CG 4.03Å; N115-K121 WeakPolarHBondContact O-CE 3.19Å; N115-K121 WeakPolarHBondContact O-CG 3.41Å |
| 116 | L | 79.9 | Confident | 80.6 | Confident | 6 Ų | 6 | 56.1 Ų | 56.1 | 3% | 0.031 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -18.9 | 173.6 | -65.6 | 173.1 | 0 | 0 | 0 | 113.1 | L58 F59 F62 M112 I113 L114 | L58-L116 HydrophobicContact CB-CD1 3.95Å; F59-L116 HydrophobicContact CB-CB 4.29Å; F59-L116 HydrophobicContact CB-CD1 4.35Å; F62-L116 HydrophobicContact CD2-CD1 3.67Å; F62-L116 HydrophobicContact CE2-CD1 4.12Å; M112-L116 PolarHBondContact O-N 3.23Å; I113-L116 WeakPolarHBondContact O-CB 3.24Å; I113-L116 PolarHBondContact O-N 2.95Å; I113-L116 VanDerWaalsContact O-N 3.15Å; L114-L116 VanDerWaalsContact C-N 3.26Å; L114-L116 PolarHBondContact O-N 2.84Å |
| 117 | L | 78.1 | Confident | 80.8 | Confident | 96 Ų | 96 | 54.7 Ų | 54.7 | 50% | 0.503 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | -9.1 | 177.1 | -60.7 | -179.3 | 0 | 0 | 0 | 113.2 | F59 L114 N115 | F59-L117 HydrophobicContact CB-CD2 4.21Å; F59-L117 HydrophobicContact CD1-CD2 4.16Å; F59-L117 HydrophobicContact CD2-CD1 3.77Å; F59-L117 HydrophobicContact CD2-CD2 3.82Å; F59-L117 HydrophobicContact CD2-CG 3.63Å; F59-L117 HydrophobicContact CE1-CD1 4.47Å; F59-L117 HydrophobicContact CE2-CD1 3.42Å; F59-L117 VanDerWaalsContact CE2-CD1 3.42Å; F59-L117 HydrophobicContact CE2-CD2 4.26Å; F59-L117 HydrophobicContact CE2-CG 3.86Å; F59-L117 HydrophobicContact CG-CD1 4.45Å; F59-L117 HydrophobicContact CG-CD2 3.78Å; F59-L117 HydrophobicContact CG-CG 4.14Å; F59-L117 HydrophobicContact CZ-CD1 3.82Å; L114-L117 PolarHBondContact O-N 3.44Å; L114-L117 VanDerWaalsContact O-N 3.17Å; N115-L117 PolarHBondContact O-N 3.49Å |
| 118 | K | 79.7 | Confident | 81.2 | Confident | 116 Ų | 116 | 52.5 Ų | 52.5 | 50% | 0.504 | 27% | 0.272 | S | S | . | . | trans | -99.4 | 133.8 | -175 | -71.2 | -175.9 | 177.8 | -175.3 | 0 | 111.1 | N115 Q120 | N115-K118 PolarHBondContact O-N 3.5Å; K118-Q120 VanDerWaalsContact C-N 3.29Å; K118-Q120 PolarHBondContact O-N 2.83Å | ||
| 119 | K | 68 | Low | 82.1 | Confident | 212 Ų | 212 | 52.8 Ų | 52.8 | 92% | 0.922 | 27% | 0.273 | S | S | * | . | S | Bend | trans | -63.8 | -32.9 | 171.5 | -66.6 | -170.5 | -177.3 | -173.1 | 0 | 113 | ||
| 120 | Q | 72 | Confident | 82.7 | Confident | 145 Ų | 145 | 56.4 Ų | 56.4 | 68% | 0.678 | 30% | 0.295 | S | S | * | . | S | Bend | trans | -121.2 | 119.9 | 173.9 | -73.6 | -178 | -12.3 | 0 | 0 | 109.8 | K118 I122 | K118-Q120 VanDerWaalsContact C-N 3.29Å; K118-Q120 PolarHBondContact O-N 2.83Å; Q120-I122 HydrophobicContact CB-CD1 4.17Å; Q120-I122 HydrophobicContact CB-CG1 4.14Å; Q120-I122 PolarHBondContact O-N 3.24Å |
| 121 | K | 82.6 | Confident | 83.1 | Confident | 19 Ų | 19 | 55.3 Ų | 55.3 | 8% | 0.083 | 29% | 0.287 | C | S | . | . | trans | -102.3 | 71.9 | -173.2 | -57.9 | 172.2 | -171 | 163.2 | 0 | 109.4 | L45 E55 N115 | L45-K121 HydrophobicContact CB-CB 4.03Å; L45-K121 PolarHBondContact N-O 2.78Å; L45-K121 VanDerWaalsContact O-CB 3.31Å; L45-K121 WeakPolarHBondContact O-CB 3.5Å; L45-K121 WeakPolarHBondContact O-CD 3.33Å; E55-K121 WeakPolarHBondContact OE1-CE 3.47Å; E55-K121 IonicContact OE1-NZ 3.93Å; E55-K121 PolarHBondContact OE1-NZ 3.23Å; N115-K121 HydrophobicContact CB-CB 4.24Å; N115-K121 HydrophobicContact CB-CD 4.33Å; N115-K121 HydrophobicContact CB-CG 4.03Å; N115-K121 WeakPolarHBondContact O-CE 3.19Å; N115-K121 WeakPolarHBondContact O-CG 3.41Å | ||
| 122 | I | 84.7 | Confident | 83.5 | Confident | 62 Ų | 62 | 51.6 Ų | 51.6 | 32% | 0.318 | 27% | 0.27 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.3 | 138.8 | -172.7 | -54.3 | 176.1 | 0 | 0 | 0 | 110.5 | E42 F43 Q120 | E42-I122 HydrophobicContact CB-CG2 3.84Å; E42-I122 HydrophobicContact CG-CG2 4.22Å; E42-I122 VanDerWaalsContact OE2-CG2 3.26Å; E42-I122 WeakPolarHBondContact OE2-CG2 3.33Å; F43-I122 WeakPolarHBondContact O-CA 3.37Å; Q120-I122 HydrophobicContact CB-CD1 4.17Å; Q120-I122 HydrophobicContact CB-CG1 4.14Å; Q120-I122 PolarHBondContact O-N 3.24Å |
| 123 | I | 87.1 | Confident | 84.1 | Confident | 3 Ų | 3 | 54.6 Ų | 54.6 | 2% | 0.015 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 132.9 | 170.9 | -174.5 | 161.4 | 0 | 0 | 0 | 109.6 | E42 F43 L45 K111 C128 | E42-I123 CarbonylContact C-O 3.6Å; E42-I123 WeakPolarHBondContact CA-O 3.26Å; F43-I123 HydrophobicContact CB-CG2 3.87Å; F43-I123 PolarHBondContact N-O 3.43Å; F43-I123 PolarHBondContact O-N 3.48Å; L45-I123 HydrophobicContact CD1-CG2 4.14Å; L45-I123 HydrophobicContact CD2-CG2 4.39Å; L45-I123 HydrophobicContact CG-CG2 4.11Å; K111-I123 HydrophobicContact CD-CD1 4.32Å; I123-C128 HydrophobicContact CD1-CB 4.38Å; I123-C128 HydrophobicContact CG1-CB 4.31Å; I123-C128 HydrophobicContact CG2-CB 4.28Å |
| 124 | S | 90.6 | Very high | 84.5 | Confident | 58 Ų | 58 | 56.6 Ų | 56.6 | 41% | 0.406 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.4 | 152.2 | 174.8 | 61.8 | 0 | 0 | 0 | 0 | 111.2 | A126 G127 C128 | S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.97Å; S124-G127 CarbonylContact O-C 3.58Å; S124-G127 WeakPolarHBondContact O-CA 3.19Å; S124-G127 PolarHBondContact O-N 3.5Å; S124-G127 PolarHBondContact OG-N 2.97Å; S124-C128 WeakPolarHBondContact O-CB 3.47Å; S124-C128 PolarHBondContact O-N 3.23Å |
| 125 | F | 87.9 | Confident | 84.7 | Confident | 53 Ų | 53 | 53 Ų | 53 | 23% | 0.232 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -49.1 | -52.3 | 175.5 | 179.9 | -87.6 | 0 | 0 | 0 | 112 | S41 F43 G127 C128 F129 V195 F199 | S41-F125 WeakPolarHBondContact O-CB 3.45Å; S41-F125 PolarHBondContact O-N 3.03Å; F43-F125 HydrophobicContact CE2-CB 4.41Å; F43-F125 AromaticContact CE2-CD2 3.64Å; F43-F125 HydrophobicContact CE2-CD2 3.64Å; F43-F125 HydrophobicContact CE2-CE2 4.34Å; F43-F125 HydrophobicContact CE2-CG 4.36Å; F43-F125 HydrophobicContact CZ-CD2 4.05Å; F43-F125 HydrophobicContact CZ-CE2 4.42Å; F125-G127 VanDerWaalsContact C-N 3.33Å; F125-G127 PolarHBondContact O-N 3.22Å; F125-C128 WeakPolarHBondContact O-CB 3.25Å; F125-C128 PolarHBondContact O-N 2.88Å; F125-C128 VanDerWaalsContact O-N 3.16Å; F125-F129 HydrophobicContact CD1-CD2 4.12Å; F125-F129 HydrophobicContact CD2-CD2 4.27Å; F125-F129 AromaticContact CD2-CE2 3.99Å; F125-F129 HydrophobicContact CD2-CE2 3.99Å; F125-F129 AromaticContact CE1-CD2 3.78Å; F125-F129 HydrophobicContact CE1-CD2 3.78Å; F125-F129 AromaticContact CE1-CE2 3.99Å; F125-F129 HydrophobicContact CE1-CE2 3.99Å; F125-F129 AromaticContact CE2-CD2 3.96Å; F125-F129 HydrophobicContact CE2-CD2 3.96Å; F125-F129 AromaticContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CZ 4.41Å; F125-F129 HydrophobicContact CG-CD2 4.34Å; F125-F129 AromaticContact CZ-CD2 3.69Å; F125-F129 HydrophobicContact CZ-CD2 3.69Å; F125-F129 AromaticContact CZ-CE2 3.39Å; F125-F129 HydrophobicContact CZ-CE2 3.39Å; F125-F129 HydrophobicContact CZ-CZ 4.31Å; F125-F129 WeakPolarHBondContact O-CD2 3.28Å; F125-F129 PolarHBondContact O-N 3.43Å; F125-F129 VanDerWaalsContact O-N 3.11Å; F125-V195 HydrophobicContact CE1-CG1 4.2Å; F125-V195 HydrophobicContact CZ-CG1 4.37Å; F125-F199 AromaticContact CE2-CD2 3.6Å; F125-F199 HydrophobicContact CE2-CD2 3.6Å; F125-F199 AromaticContact CE2-CE2 3.83Å; F125-F199 HydrophobicContact CE2-CE2 3.83Å; F125-F199 HydrophobicContact CE2-CG 4.45Å; F125-F199 HydrophobicContact CZ-CD2 4.31Å; F125-F199 HydrophobicContact CZ-CE2 4.28Å |
| 126 | A | 89.1 | Confident | 84.9 | Confident | 63 Ų | 63 | 53.7 Ų | 53.7 | 52% | 0.521 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.1 | -39.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | S124 C128 T130 | S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.97Å; A126-C128 VanDerWaalsContact C-N 3.31Å; A126-C128 PolarHBondContact O-N 2.92Å; A126-T130 VanDerWaalsContact O-CB 3.31Å; A126-T130 WeakPolarHBondContact O-CB 3.04Å; A126-T130 PolarHBondContact O-N 3.36Å; A126-T130 PolarHBondContact O-OG1 2.94Å |
| 127 | G | 88.2 | Confident | 85.4 | Confident | 19 Ų | 19 | 54.1 Ų | 54.1 | 20% | 0.196 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64 | -37.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S124 F125 Q131 | S124-G127 CarbonylContact O-C 3.58Å; S124-G127 WeakPolarHBondContact O-CA 3.19Å; S124-G127 PolarHBondContact O-N 3.5Å; S124-G127 PolarHBondContact OG-N 2.97Å; F125-G127 VanDerWaalsContact C-N 3.33Å; F125-G127 PolarHBondContact O-N 3.22Å; G127-Q131 WeakPolarHBondContact O-CB 3.47Å; G127-Q131 PolarHBondContact O-N 3.37Å |
| 128 | C | 88.9 | Confident | 86 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65 | -52.1 | 178.3 | -169.3 | 0 | 0 | 0 | 0 | 111 | F43 I123 S124 F125 A126 T130 Q131 I132 C210 | F43-C128 HydrophobicContact CD2-CB 3.85Å; F43-C128 HydrophobicContact CE2-CB 4.23Å; I123-C128 HydrophobicContact CD1-CB 4.38Å; I123-C128 HydrophobicContact CG1-CB 4.31Å; I123-C128 HydrophobicContact CG2-CB 4.28Å; S124-C128 WeakPolarHBondContact O-CB 3.47Å; S124-C128 PolarHBondContact O-N 3.23Å; F125-C128 WeakPolarHBondContact O-CB 3.25Å; F125-C128 PolarHBondContact O-N 2.88Å; F125-C128 VanDerWaalsContact O-N 3.16Å; A126-C128 VanDerWaalsContact C-N 3.31Å; A126-C128 PolarHBondContact O-N 2.92Å; C128-T130 PolarHBondContact O-N 3.29Å; C128-Q131 WeakPolarHBondContact O-CB 3.43Å; C128-Q131 PolarHBondContact O-N 2.86Å; C128-Q131 VanDerWaalsContact O-N 3.17Å; C128-I132 VanDerWaalsContact O-CG1 3.31Å; C128-I132 WeakPolarHBondContact O-CG1 3.21Å; C128-I132 PolarHBondContact O-N 3.4Å; C128-C210 WeakPolarHBondContact CA-SG 3.4Å; C128-C210 HydrophobicContact CB-CB 3.98Å; C128-C210 WeakPolarHBondContact CB-SG 3.04Å; C128-C210 WeakPolarHBondContact SG-CB 3.31Å; C128-C210 CovalentContact SG-SG 2.02Å; C128-C210 PolarHBondContact SG-SG 2.86Å |
| 129 | F | 89.7 | Confident | 86.2 | Confident | 10 Ų | 10 | 45 Ų | 45 | 4% | 0.044 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -70 | -31.2 | 179.2 | -79.9 | -77.5 | 0 | 0 | 0 | 113.8 | F43 F125 Q131 I132 F133 I191 A194 V195 F199 L212 V215 | F43-F129 HydrophobicContact CE2-CE2 4.48Å; F125-F129 HydrophobicContact CD1-CD2 4.12Å; F125-F129 HydrophobicContact CD2-CD2 4.27Å; F125-F129 AromaticContact CD2-CE2 3.99Å; F125-F129 HydrophobicContact CD2-CE2 3.99Å; F125-F129 AromaticContact CE1-CD2 3.78Å; F125-F129 HydrophobicContact CE1-CD2 3.78Å; F125-F129 AromaticContact CE1-CE2 3.99Å; F125-F129 HydrophobicContact CE1-CE2 3.99Å; F125-F129 AromaticContact CE2-CD2 3.96Å; F125-F129 HydrophobicContact CE2-CD2 3.96Å; F125-F129 AromaticContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CE2 3.4Å; F125-F129 HydrophobicContact CE2-CZ 4.41Å; F125-F129 HydrophobicContact CG-CD2 4.34Å; F125-F129 AromaticContact CZ-CD2 3.69Å; F125-F129 HydrophobicContact CZ-CD2 3.69Å; F125-F129 AromaticContact CZ-CE2 3.39Å; F125-F129 HydrophobicContact CZ-CE2 3.39Å; F125-F129 HydrophobicContact CZ-CZ 4.31Å; F125-F129 WeakPolarHBondContact O-CD2 3.28Å; F125-F129 PolarHBondContact O-N 3.43Å; F125-F129 VanDerWaalsContact O-N 3.11Å; F129-Q131 VanDerWaalsContact C-N 3.35Å; F129-I132 HydrophobicContact CD1-CD1 4.22Å; F129-I132 HydrophobicContact CE1-CD1 4.44Å; F129-I132 PolarHBondContact O-N 3.01Å; F129-F133 VanDerWaalsContact O-CB 3.3Å; F129-F133 WeakPolarHBondContact O-CB 3.36Å; F129-F133 PolarHBondContact O-N 3.46Å; F129-I191 HydrophobicContact CD1-CG2 4.39Å; F129-A194 HydrophobicContact CE1-CB 3.79Å; F129-A194 WeakPolarHBondContact CZ-O 3.19Å; F129-V195 HydrophobicContact CB-CG2 3.93Å; F129-V195 HydrophobicContact CD1-CB 4.38Å; F129-V195 HydrophobicContact CD1-CG2 3.26Å; F129-V195 HydrophobicContact CD2-CG2 4.17Å; F129-V195 HydrophobicContact CE1-CB 4.4Å; F129-V195 HydrophobicContact CE1-CG2 3.69Å; F129-V195 HydrophobicContact CG-CG2 3.51Å; F129-V195 HydrophobicContact CZ-CG2 4.3Å; F129-F199 HydrophobicContact CE2-CE2 4.17Å; F129-F199 HydrophobicContact CE2-CZ 4.41Å; F129-F199 AromaticContact CZ-CE2 3.94Å; F129-F199 HydrophobicContact CZ-CE2 3.94Å; F129-F199 AromaticContact CZ-CZ 3.9Å; F129-F199 HydrophobicContact CZ-CZ 3.9Å; F129-L212 HydrophobicContact CE1-CD1 4.47Å; F129-V215 HydrophobicContact CE2-CG1 4.28Å; F129-V215 HydrophobicContact CZ-CG1 3.9Å |
| 130 | T | 89.8 | Confident | 87.1 | Confident | 81 Ų | 81 | 35 Ų | 35 | 50% | 0.497 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -63.3 | -43.1 | 170.1 | -55.8 | 0 | 0 | 0 | 0 | 110.6 | A126 C128 F133 L134 | A126-T130 VanDerWaalsContact O-CB 3.31Å; A126-T130 WeakPolarHBondContact O-CB 3.04Å; A126-T130 PolarHBondContact O-N 3.36Å; A126-T130 PolarHBondContact O-OG1 2.94Å; C128-T130 PolarHBondContact O-N 3.29Å; T130-F133 PolarHBondContact O-N 3.14Å; T130-L134 HydrophobicContact CG2-CD1 4.16Å; T130-L134 WeakPolarHBondContact O-CG 3.26Å; T130-L134 PolarHBondContact O-N 3.35Å |
| 131 | Q | 87.8 | Confident | 88 | Confident | 14 Ų | 14 | 28 Ų | 28 | 7% | 0.065 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.1 | -47.5 | 176.7 | -174.4 | 177.8 | 27.6 | 0 | 0 | 111.2 | F107 G127 C128 F129 F133 L134 L135 | F107-Q131 HydrophobicContact CD2-CG 4.45Å; F107-Q131 HydrophobicContact CE2-CG 4Å; G127-Q131 WeakPolarHBondContact O-CB 3.47Å; G127-Q131 PolarHBondContact O-N 3.37Å; C128-Q131 WeakPolarHBondContact O-CB 3.43Å; C128-Q131 PolarHBondContact O-N 2.86Å; C128-Q131 VanDerWaalsContact O-N 3.17Å; F129-Q131 VanDerWaalsContact C-N 3.35Å; Q131-F133 PolarHBondContact O-N 3.43Å; Q131-L134 PolarHBondContact O-N 3.16Å; Q131-L135 HydrophobicContact CG-CD1 4.14Å; Q131-L135 WeakPolarHBondContact O-CB 3.33Å; Q131-L135 VanDerWaalsContact O-CG 3.29Å; Q131-L135 WeakPolarHBondContact O-CG 3.46Å; Q131-L135 PolarHBondContact O-N 3.47Å |
| 132 | I | 87.1 | Confident | 88.2 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.5 | -43.8 | 179 | -61 | 164.4 | 0 | 0 | 0 | 111.1 | C128 F129 L135 H136 I191 C210 L212 V215 | C128-I132 VanDerWaalsContact O-CG1 3.31Å; C128-I132 WeakPolarHBondContact O-CG1 3.21Å; C128-I132 PolarHBondContact O-N 3.4Å; F129-I132 HydrophobicContact CD1-CD1 4.22Å; F129-I132 HydrophobicContact CE1-CD1 4.44Å; F129-I132 PolarHBondContact O-N 3.01Å; I132-L135 PolarHBondContact O-N 3.47Å; I132-H136 WeakPolarHBondContact CG2-ND1 3.47Å; I132-H136 PolarHBondContact O-N 3Å; I132-H136 PolarHBondContact O-ND1 3.2Å; I132-I191 HydrophobicContact CB-CD1 4.08Å; I132-I191 HydrophobicContact CG2-CD1 3.37Å; I132-C210 HydrophobicContact CD1-CB 3.97Å; I132-C210 HydrophobicContact CG1-CB 3.74Å; I132-C210 WeakPolarHBondContact CG1-O 3.47Å; I132-L212 HydrophobicContact CD1-CD1 4.33Å; I132-L212 HydrophobicContact CG2-CB 3.68Å; I132-L212 HydrophobicContact CG2-CD1 4.01Å; I132-L212 HydrophobicContact CG2-CD2 4.38Å; I132-L212 HydrophobicContact CG2-CG 4.22Å; I132-V215 HydrophobicContact CD1-CB 4.39Å; I132-V215 HydrophobicContact CD1-CG2 4.16Å |
| 133 | F | 90 | Very high | 88.2 | Confident | 68 Ų | 68 | 25.7 Ų | 25.7 | 30% | 0.298 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -59 | -48.3 | 178.4 | 174 | -95.7 | 0 | 0 | 0 | 111.5 | F129 T130 Q131 L135 H136 L137 L184 I191 | F129-F133 VanDerWaalsContact O-CB 3.3Å; F129-F133 WeakPolarHBondContact O-CB 3.36Å; F129-F133 PolarHBondContact O-N 3.46Å; T130-F133 PolarHBondContact O-N 3.14Å; Q131-F133 PolarHBondContact O-N 3.43Å; F133-L135 PolarHBondContact O-N 2.89Å; F133-H136 PolarHBondContact O-N 3.5Å; F133-L137 HydrophobicContact CE1-CD2 3.92Å; F133-L137 HydrophobicContact CZ-CD2 4.24Å; F133-L137 VanDerWaalsContact O-CB 3.23Å; F133-L137 WeakPolarHBondContact O-CB 3.44Å; F133-L137 PolarHBondContact O-N 2.8Å; F133-L184 HydrophobicContact CZ-CD2 4.2Å; F133-I191 HydrophobicContact CB-CG1 4.32Å; F133-I191 HydrophobicContact CD2-CG1 4.24Å |
| 134 | L | 89.6 | Confident | 88.2 | Confident | 54 Ų | 54 | 25.7 Ų | 25.7 | 28% | 0.283 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -65.9 | -37.4 | 178.8 | -69.4 | 174 | 0 | 0 | 0 | 112.3 | F107 T130 Q131 L137 L138 | F107-L134 HydrophobicContact CB-CD1 4.4Å; F107-L134 HydrophobicContact CD1-CB 4.19Å; F107-L134 HydrophobicContact CD2-CB 4.03Å; F107-L134 HydrophobicContact CD2-CD1 4.06Å; F107-L134 HydrophobicContact CE1-CB 3.83Å; F107-L134 HydrophobicContact CE2-CB 3.69Å; F107-L134 HydrophobicContact CG-CB 4.3Å; F107-L134 HydrophobicContact CG-CD1 4.09Å; F107-L134 HydrophobicContact CZ-CB 3.59Å; T130-L134 HydrophobicContact CG2-CD1 4.16Å; T130-L134 WeakPolarHBondContact O-CG 3.26Å; T130-L134 PolarHBondContact O-N 3.35Å; Q131-L134 PolarHBondContact O-N 3.16Å; L134-L137 PolarHBondContact O-N 2.81Å; L134-L138 WeakPolarHBondContact O-CB 3.44Å; L134-L138 WeakPolarHBondContact O-CG 3.27Å; L134-L138 PolarHBondContact O-N 3.13Å |
| 135 | L | 85.6 | Confident | 88.1 | Confident | 25 Ų | 25 | 23 Ų | 23 | 13% | 0.131 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -59.4 | -51.3 | 175.9 | -78 | 169.9 | 0 | 0 | 0 | 111.2 | L104 F107 A108 Q131 I132 F133 G139 F209 T307 | L104-L135 HydrophobicContact CD1-CD2 3.79Å; F107-L135 HydrophobicContact CE2-CD2 4.1Å; F107-L135 HydrophobicContact CE2-CG 3.85Å; F107-L135 HydrophobicContact CZ-CB 4.22Å; F107-L135 HydrophobicContact CZ-CD2 3.6Å; F107-L135 HydrophobicContact CZ-CG 3.61Å; A108-L135 HydrophobicContact CB-CD2 4.22Å; Q131-L135 HydrophobicContact CG-CD1 4.14Å; Q131-L135 WeakPolarHBondContact O-CB 3.33Å; Q131-L135 VanDerWaalsContact O-CG 3.29Å; Q131-L135 WeakPolarHBondContact O-CG 3.46Å; Q131-L135 PolarHBondContact O-N 3.47Å; I132-L135 PolarHBondContact O-N 3.47Å; F133-L135 PolarHBondContact O-N 2.89Å; L135-G139 PolarHBondContact O-N 2.67Å; L135-F209 HydrophobicContact CD1-CD2 3.81Å; L135-F209 HydrophobicContact CD1-CE2 3.99Å; L135-T307 HydrophobicContact CD2-CG2 4.2Å |
| 136 | H | 86.3 | Confident | 87.9 | Confident | 24 Ų | 24 | 20.9 Ų | 20.9 | 11% | 0.111 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -70.4 | -34.1 | -179.2 | -72.6 | 87.7 | 0 | 0 | 0 | 112.4 | I132 F133 G140 H186 S187 Q190 | I132-H136 WeakPolarHBondContact CG2-ND1 3.47Å; I132-H136 PolarHBondContact O-N 3Å; I132-H136 PolarHBondContact O-ND1 3.2Å; F133-H136 PolarHBondContact O-N 3.5Å; H136-G140 PolarHBondContact O-N 3.12Å; H136-H186 AromaticContact CD2-NE2 3.65Å; H136-H186 PolarHBondContact O-CD2 3.43Å; H136-S187 WeakPolarHBondContact CB-OG 2.97Å; H136-Q190 PolarHBondContact CD2-NE2 3.02Å; H136-Q190 PolarHBondContact NE2-NE2 2.96Å |
| 137 | L | 90.8 | Very high | 87.7 | Confident | 14 Ų | 14 | 18 Ų | 18 | 7% | 0.073 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -64 | -58.2 | 179.3 | 169.7 | 57.3 | 0 | 0 | 0 | 109.1 | F133 L134 G139 G140 V141 W180 L184 S187 | F133-L137 HydrophobicContact CE1-CD2 3.92Å; F133-L137 HydrophobicContact CZ-CD2 4.24Å; F133-L137 VanDerWaalsContact O-CB 3.23Å; F133-L137 WeakPolarHBondContact O-CB 3.44Å; F133-L137 PolarHBondContact O-N 2.8Å; L134-L137 PolarHBondContact O-N 2.81Å; L137-G139 PolarHBondContact O-N 3.24Å; L137-G140 PolarHBondContact O-N 2.88Å; L137-V141 HydrophobicContact CD1-CG2 4.16Å; L137-V141 VanDerWaalsContact O-CG2 3.23Å; L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.05Å; L137-W180 HydrophobicContact CD1-CE3 4.46Å; L137-L184 HydrophobicContact CD1-CB 4.3Å; L137-L184 HydrophobicContact CD1-CD2 3.77Å; L137-L184 HydrophobicContact CD1-CG 3.72Å; L137-L184 VanDerWaalsContact CD1-N 3.32Å; L137-L184 HydrophobicContact CD2-CD2 4.05Å; L137-S187 WeakPolarHBondContact CA-OG 3.42Å; L137-S187 PolarHBondContact N-OG 3.48Å |
| 138 | L | 89.8 | Confident | 87.7 | Confident | 5 Ų | 5 | 17 Ų | 17 | 3% | 0.026 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -66.6 | -39.7 | -176.3 | -63.3 | -172.1 | 0 | 0 | 0 | 111.7 | V100 T103 L104 F107 L134 G140 V141 E142 W180 | V100-L138 HydrophobicContact CG1-CB 3.99Å; V100-L138 HydrophobicContact CG1-CD2 4.35Å; V100-L138 WeakPolarHBondContact CG1-O 3.04Å; T103-L138 HydrophobicContact CG2-CD1 3.67Å; L104-L138 HydrophobicContact CB-CD1 4.01Å; L104-L138 HydrophobicContact CD1-CB 4.37Å; F107-L138 HydrophobicContact CD1-CD1 4.02Å; F107-L138 HydrophobicContact CE1-CD1 3.68Å; L134-L138 WeakPolarHBondContact O-CB 3.44Å; L134-L138 WeakPolarHBondContact O-CG 3.27Å; L134-L138 PolarHBondContact O-N 3.13Å; L138-G140 VanDerWaalsContact C-N 3.33Å; L138-G140 PolarHBondContact O-N 2.94Å; L138-V141 PolarHBondContact O-N 2.76Å; L138-E142 VanDerWaalsContact O-CB 3.23Å; L138-E142 WeakPolarHBondContact O-CB 3.31Å; L138-E142 PolarHBondContact O-N 3.1Å; L138-W180 HydrophobicContact CD2-CH2 3.81Å; L138-W180 HydrophobicContact CD2-CZ3 3.89Å |
| 139 | G | 85.2 | Confident | 87.7 | Confident | 17 Ų | 17 | 17 Ų | 17 | 18% | 0.175 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -61.8 | -39.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L135 L137 E142 M143 | L135-G139 PolarHBondContact O-N 2.67Å; L137-G139 PolarHBondContact O-N 3.24Å; G139-E142 PolarHBondContact O-N 2.89Å; G139-M143 WeakPolarHBondContact O-CE 3.2Å; G139-M143 WeakPolarHBondContact O-CG 3.3Å; G139-M143 PolarHBondContact O-N 3.23Å |
| 140 | G | 87.2 | Confident | 87.3 | Confident | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -62.2 | -46.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | H136 L137 L138 E142 M143 V144 | H136-G140 PolarHBondContact O-N 3.12Å; L137-G140 PolarHBondContact O-N 2.88Å; L138-G140 VanDerWaalsContact C-N 3.33Å; L138-G140 PolarHBondContact O-N 2.94Å; G140-E142 VanDerWaalsContact C-N 3.34Å; G140-E142 PolarHBondContact O-N 3.21Å; G140-M143 PolarHBondContact O-N 2.82Å; G140-V144 WeakPolarHBondContact O-CG2 3.37Å; G140-V144 PolarHBondContact O-N 3.4Å |
| 141 | V | 90.4 | Very high | 87.2 | Confident | 0 Ų | 0 | 14.6 Ų | 14.6 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.9 | -46.4 | 175.9 | -178.4 | 0 | 0 | 0 | 0 | 110.8 | V100 L137 L138 V144 L145 W180 | V100-V141 HydrophobicContact CG2-CB 4.44Å; V100-V141 HydrophobicContact CG2-CG1 3.8Å; L137-V141 HydrophobicContact CD1-CG2 4.16Å; L137-V141 VanDerWaalsContact O-CG2 3.23Å; L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.05Å; L138-V141 PolarHBondContact O-N 2.76Å; V141-V144 PolarHBondContact O-N 3.18Å; V141-L145 HydrophobicContact CG1-CD1 3.85Å; V141-L145 HydrophobicContact CG1-CG 4.21Å; V141-L145 WeakPolarHBondContact O-CB 3.49Å; V141-L145 WeakPolarHBondContact O-CG 3.23Å; V141-L145 PolarHBondContact O-N 2.72Å; V141-W180 HydrophobicContact CG1-CD2 4.18Å; V141-W180 HydrophobicContact CG1-CG 4.42Å; V141-W180 HydrophobicContact CG2-CD2 3.95Å; V141-W180 HydrophobicContact CG2-CE3 3.72Å; V141-W180 HydrophobicContact CG2-CG 4.38Å; V141-W180 HydrophobicContact CG2-CZ3 4.16Å |
| 142 | E | 87.6 | Confident | 87.1 | Confident | 9 Ų | 9 | 13.9 Ų | 13.9 | 4% | 0.042 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -57.8 | -50 | -180 | -173.2 | 179.4 | -160.9 | 0 | 0 | 111.9 | L97 V100 L138 G139 G140 V144 L145 L146 F281 | L97-E142 HydrophobicContact CD1-CB 4.43Å; L97-E142 HydrophobicContact CD1-CG 3.73Å; V100-E142 HydrophobicContact CG1-CB 4.13Å; L138-E142 VanDerWaalsContact O-CB 3.23Å; L138-E142 WeakPolarHBondContact O-CB 3.31Å; L138-E142 PolarHBondContact O-N 3.1Å; G139-E142 PolarHBondContact O-N 2.89Å; G140-E142 VanDerWaalsContact C-N 3.34Å; G140-E142 PolarHBondContact O-N 3.21Å; E142-V144 VanDerWaalsContact C-N 3.33Å; E142-V144 PolarHBondContact O-N 3.41Å; E142-L145 PolarHBondContact O-N 2.86Å; E142-L146 WeakPolarHBondContact O-CG 3.32Å; E142-L146 PolarHBondContact O-N 3.15Å; E142-F281 HydrophobicContact CG-CE1 3.84Å; E142-F281 HydrophobicContact CG-CZ 4.19Å; E142-F281 WeakPolarHBondContact OE1-CE1 3.38Å; E142-F281 WeakPolarHBondContact OE1-CZ 3.24Å |
| 143 | M | 83.1 | Confident | 87 | Confident | 23 Ų | 23 | 16.2 Ų | 16.2 | 11% | 0.113 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -56.7 | -45.6 | 176.8 | -75.2 | -173.6 | -76.1 | 0 | 0 | 112 | G139 G140 L146 V147 I237 F282 | G139-M143 WeakPolarHBondContact O-CE 3.2Å; G139-M143 WeakPolarHBondContact O-CG 3.3Å; G139-M143 PolarHBondContact O-N 3.23Å; G140-M143 PolarHBondContact O-N 2.82Å; M143-L146 PolarHBondContact O-N 3.37Å; M143-V147 PolarHBondContact O-N 2.87Å; M143-V147 VanDerWaalsContact O-N 3.14Å; M143-I237 HydrophobicContact CE-CD1 4.07Å; M143-I237 HydrophobicContact CE-CG1 4.14Å; M143-I237 HydrophobicContact CE-CG2 3.88Å; M143-F282 HydrophobicContact CG-CE1 4.31Å; M143-F282 HydrophobicContact CG-CZ 4.22Å; M143-F282 HydrophobicContact SD-CE1 4.27Å |
| 144 | V | 86.6 | Confident | 86.7 | Confident | 3 Ų | 3 | 15.9 Ų | 15.9 | 2% | 0.018 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -70 | -36.1 | -179.5 | 176.4 | 0 | 0 | 0 | 0 | 112 | F5 G140 V141 E142 V147 S148 L182 | F5-V144 HydrophobicContact CE1-CG1 3.44Å; F5-V144 VanDerWaalsContact CE1-CG1 3.44Å; F5-V144 HydrophobicContact CZ-CG1 3.7Å; G140-V144 WeakPolarHBondContact O-CG2 3.37Å; G140-V144 PolarHBondContact O-N 3.4Å; V141-V144 PolarHBondContact O-N 3.18Å; E142-V144 VanDerWaalsContact C-N 3.33Å; E142-V144 PolarHBondContact O-N 3.41Å; V144-V147 PolarHBondContact O-N 2.8Å; V144-S148 WeakPolarHBondContact O-CB 2.87Å; V144-S148 PolarHBondContact O-N 3.38Å; V144-S148 PolarHBondContact O-OG 3.45Å; V144-L182 HydrophobicContact CG1-CD1 4.28Å; V144-L182 HydrophobicContact CG2-CB 4.13Å; V144-L182 HydrophobicContact CG2-CD1 3.91Å |
| 145 | L | 89.1 | Confident | 86.5 | Confident | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -64.2 | -40.5 | 173.8 | -75.6 | 175.7 | 0 | 0 | 0 | 111.4 | L93 N96 L97 V100 V141 E142 V147 S148 M149 V176 | L93-L145 HydrophobicContact CD2-CD2 4.24Å; N96-L145 HydrophobicContact CB-CD1 4.28Å; L97-L145 HydrophobicContact CB-CD1 4.39Å; L97-L145 HydrophobicContact CD1-CB 4.14Å; L97-L145 HydrophobicContact CD1-CD1 4.36Å; V100-L145 HydrophobicContact CG2-CD1 4.08Å; V141-L145 HydrophobicContact CG1-CD1 3.85Å; V141-L145 HydrophobicContact CG1-CG 4.21Å; V141-L145 WeakPolarHBondContact O-CB 3.49Å; V141-L145 WeakPolarHBondContact O-CG 3.23Å; V141-L145 PolarHBondContact O-N 2.72Å; E142-L145 PolarHBondContact O-N 2.86Å; L145-V147 PolarHBondContact O-N 3.01Å; L145-S148 WeakPolarHBondContact O-CB 3.31Å; L145-S148 PolarHBondContact O-N 3.3Å; L145-S148 VanDerWaalsContact O-N 3.16Å; L145-M149 VanDerWaalsContact O-CG 3.32Å; L145-M149 WeakPolarHBondContact O-CG 3.46Å; L145-M149 PolarHBondContact O-N 3Å; L145-V176 HydrophobicContact CD2-CG2 4.07Å |
| 146 | L | 84.1 | Confident | 86.5 | Confident | 9 Ų | 9 | 13.7 Ų | 13.7 | 5% | 0.047 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -61.6 | -42.5 | 175.3 | -71.5 | 172.9 | 0 | 0 | 0 | 112.1 | L97 E142 M143 S148 M149 A150 V277 F281 F282 | L97-L146 HydrophobicContact CD1-CG 4.5Å; L97-L146 HydrophobicContact CD2-CD2 3.84Å; E142-L146 WeakPolarHBondContact O-CG 3.32Å; E142-L146 PolarHBondContact O-N 3.15Å; M143-L146 PolarHBondContact O-N 3.37Å; L146-S148 VanDerWaalsContact C-N 3.34Å; L146-M149 PolarHBondContact O-N 3.3Å; L146-A150 PolarHBondContact O-N 3.45Å; L146-V277 HydrophobicContact CD2-CG1 4.05Å; L146-F281 HydrophobicContact CD1-CD1 3.79Å; L146-F281 HydrophobicContact CD1-CD2 4.42Å; L146-F281 HydrophobicContact CD1-CE1 3.72Å; L146-F281 HydrophobicContact CD1-CE2 4.37Å; L146-F281 HydrophobicContact CD1-CG 4.09Å; L146-F281 HydrophobicContact CD1-CZ 3.98Å; L146-F282 HydrophobicContact CD1-CE2 4.49Å |
| 147 | V | 84.9 | Confident | 86.3 | Confident | 2 Ų | 2 | 14.5 Ų | 14.5 | 1% | 0.012 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -62.2 | -42.7 | 172.9 | 173.8 | 0 | 0 | 0 | 0 | 111 | Y4 M143 V144 L145 M149 A150 F151 C241 I244 L245 | Y4-V147 HydrophobicContact CE1-CG1 4.34Å; M143-V147 PolarHBondContact O-N 2.87Å; M143-V147 VanDerWaalsContact O-N 3.14Å; V144-V147 PolarHBondContact O-N 2.8Å; L145-V147 PolarHBondContact O-N 3.01Å; V147-M149 VanDerWaalsContact C-N 3.32Å; V147-M149 PolarHBondContact O-N 2.79Å; V147-A150 PolarHBondContact O-N 3.45Å; V147-F151 PolarHBondContact O-N 3.48Å; V147-C241 HydrophobicContact CG2-CB 3.74Å; V147-I244 HydrophobicContact CG1-CG2 3.69Å; V147-L245 HydrophobicContact CG2-CD1 4.42Å; V147-L245 HydrophobicContact CG2-CD2 4.42Å; V147-L245 HydrophobicContact CG2-CG 4.22Å |
| 148 | S | 88.8 | Confident | 85.7 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -61.8 | -39.8 | 178 | -60.9 | 0 | 0 | 0 | 0 | 112.2 | V144 L145 L146 F151 D152 | V144-S148 WeakPolarHBondContact O-CB 2.87Å; V144-S148 PolarHBondContact O-N 3.38Å; V144-S148 PolarHBondContact O-OG 3.45Å; L145-S148 WeakPolarHBondContact O-CB 3.31Å; L145-S148 PolarHBondContact O-N 3.3Å; L145-S148 VanDerWaalsContact O-N 3.16Å; L146-S148 VanDerWaalsContact C-N 3.34Å; S148-F151 PolarHBondContact O-N 3.48Å; S148-D152 PolarHBondContact O-N 3.39Å |
| 149 | M | 88.1 | Confident | 85.4 | Confident | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -66.8 | -40.8 | 174.3 | -69 | 177 | 77.3 | 0 | 0 | 111.9 | L93 L94 L97 L145 L146 V147 F151 D152 R153 Y318 | L93-M149 HydrophobicContact CB-CG 3.69Å; L93-M149 HydrophobicContact CD1-CG 4.08Å; L94-M149 HydrophobicContact CB-CE 3.97Å; L94-M149 HydrophobicContact CD1-CE 4.1Å; L97-M149 HydrophobicContact CD2-SD 3.77Å; L145-M149 VanDerWaalsContact O-CG 3.32Å; L145-M149 WeakPolarHBondContact O-CG 3.46Å; L145-M149 PolarHBondContact O-N 3Å; L146-M149 PolarHBondContact O-N 3.3Å; V147-M149 VanDerWaalsContact C-N 3.32Å; V147-M149 PolarHBondContact O-N 2.79Å; M149-F151 VanDerWaalsContact C-N 3.3Å; M149-F151 PolarHBondContact O-N 2.98Å; M149-D152 WeakPolarHBondContact O-CB 3.45Å; M149-D152 PolarHBondContact O-N 3.04Å; M149-R153 WeakPolarHBondContact O-CG 3.39Å; M149-R153 PolarHBondContact O-N 2.81Å; M149-R153 VanDerWaalsContact O-N 3.08Å; M149-Y318 HydrophobicContact CE-CE1 3.62Å; M149-Y318 HydrophobicContact CE-CE2 4.25Å; M149-Y318 VanDerWaalsContact CE-CZ 3.46Å; M149-Y318 VanDerWaalsContact CE-OH 3.24Å; M149-Y318 WeakPolarHBondContact CE-OH 3.36Å |
| 150 | A | 82.4 | Confident | 85.3 | Confident | 0 Ų | 0 | 23.1 Ų | 23.1 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -64.2 | -37.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L146 V147 R153 Y154 L245 Y249 | L146-A150 PolarHBondContact O-N 3.45Å; V147-A150 PolarHBondContact O-N 3.45Å; A150-R153 PolarHBondContact O-N 2.7Å; A150-Y154 WeakPolarHBondContact O-CB 3.23Å; A150-Y154 PolarHBondContact O-N 2.82Å; A150-L245 HydrophobicContact CB-CD2 3.37Å; A150-Y249 HydrophobicContact CB-CE2 4.24Å |
| 151 | F | 85.8 | Confident | 85.4 | Confident | 39 Ų | 39 | 30.9 Ų | 30.9 | 17% | 0.171 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.8 | -45 | 173.5 | 178.8 | -109.6 | 0 | 0 | 0 | 112 | M1 V147 S148 M149 R153 Y154 V155 I166 M167 | M1-F151 HydrophobicContact CB-CD2 4.31Å; M1-F151 HydrophobicContact CB-CE2 4.04Å; M1-F151 HydrophobicContact CB-CZ 4.16Å; M1-F151 HydrophobicContact CG-CB 4.37Å; M1-F151 HydrophobicContact CG-CD1 4.21Å; M1-F151 HydrophobicContact CG-CD2 3.42Å; M1-F151 VanDerWaalsContact CG-CD2 3.42Å; M1-F151 HydrophobicContact CG-CE1 4.39Å; M1-F151 HydrophobicContact CG-CE2 3.64Å; M1-F151 HydrophobicContact CG-CG 3.73Å; M1-F151 HydrophobicContact CG-CZ 4.13Å; V147-F151 PolarHBondContact O-N 3.48Å; S148-F151 PolarHBondContact O-N 3.48Å; M149-F151 VanDerWaalsContact C-N 3.3Å; M149-F151 PolarHBondContact O-N 2.98Å; F151-R153 VanDerWaalsContact C-N 3.33Å; F151-R153 PolarHBondContact O-N 3.5Å; F151-Y154 HydrophobicContact CD2-CD1 4.47Å; F151-Y154 WeakPolarHBondContact O-CB 3.35Å; F151-Y154 PolarHBondContact O-N 3.04Å; F151-V155 HydrophobicContact CD1-CG2 4.43Å; F151-V155 HydrophobicContact CD2-CG2 4.21Å; F151-V155 HydrophobicContact CE1-CG2 3.99Å; F151-V155 HydrophobicContact CE2-CG2 3.74Å; F151-V155 HydrophobicContact CZ-CG2 3.62Å; F151-V155 WeakPolarHBondContact O-CG2 3.08Å; F151-V155 PolarHBondContact O-N 3.3Å; F151-I166 HydrophobicContact CZ-CG2 4.34Å; F151-M167 HydrophobicContact CD1-SD 3.83Å; F151-M167 HydrophobicContact CE1-SD 3.75Å |
| 152 | D | 87.7 | Confident | 85.3 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -53.5 | -50.2 | 172.7 | 169.2 | 76.8 | 0 | 0 | 0 | 111.7 | P89 M90 L93 S148 M149 Y154 V155 A156 Y163 M167 | P89-D152 WeakPolarHBondContact CB-OD1 3.4Å; M90-D152 WeakPolarHBondContact CB-OD2 3.31Å; L93-D152 HydrophobicContact CD1-CB 4.44Å; S148-D152 PolarHBondContact O-N 3.39Å; M149-D152 WeakPolarHBondContact O-CB 3.45Å; M149-D152 PolarHBondContact O-N 3.04Å; D152-Y154 VanDerWaalsContact C-N 3.33Å; D152-Y154 PolarHBondContact O-N 3.33Å; D152-V155 PolarHBondContact O-N 3.2Å; D152-A156 WeakPolarHBondContact O-CB 3.41Å; D152-A156 PolarHBondContact O-N 2.88Å; D152-Y163 WeakPolarHBondContact OD1-CE2 3.14Å; D152-Y163 PolarHBondContact OD1-OH 2.95Å; D152-M167 HydrophobicContact CB-CE 3.75Å |
| 153 | R | 84.4 | Confident | 85.2 | Confident | 49 Ų | 49 | 37.3 Ų | 37.3 | 19% | 0.185 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -61.4 | -41 | 179 | -64.3 | -65.3 | 93.1 | -177 | 1.3 | 111.9 | M90 M149 A150 F151 A156 I157 I252 | M90-R153 PolarHBondContact SD-NH1 2.96Å; M90-R153 VanDerWaalsContact SD-NH1 3.36Å; M90-R153 PolarHBondContact SD-NH2 3.48Å; M149-R153 WeakPolarHBondContact O-CG 3.39Å; M149-R153 PolarHBondContact O-N 2.81Å; M149-R153 VanDerWaalsContact O-N 3.08Å; A150-R153 PolarHBondContact O-N 2.7Å; F151-R153 VanDerWaalsContact C-N 3.33Å; F151-R153 PolarHBondContact O-N 3.5Å; R153-A156 PolarHBondContact O-N 3.38Å; R153-I157 WeakPolarHBondContact O-CG1 3.16Å; R153-I157 PolarHBondContact O-N 3.48Å; R153-I157 VanDerWaalsContact O-N 3.13Å; R153-I252 HydrophobicContact CB-CD1 4.29Å |
| 154 | Y | 83.4 | Confident | 85.4 | Confident | 61 Ų | 61 | 43.1 Ų | 43.1 | 24% | 0.239 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -59.5 | -51.4 | 175.9 | 167.5 | -95.5 | 0 | 0 | 0 | 111.3 | A150 F151 D152 A156 I157 C158 L251 I252 | A150-Y154 WeakPolarHBondContact O-CB 3.23Å; A150-Y154 PolarHBondContact O-N 2.82Å; F151-Y154 HydrophobicContact CD2-CD1 4.47Å; F151-Y154 WeakPolarHBondContact O-CB 3.35Å; F151-Y154 PolarHBondContact O-N 3.04Å; D152-Y154 VanDerWaalsContact C-N 3.33Å; D152-Y154 PolarHBondContact O-N 3.33Å; Y154-A156 VanDerWaalsContact C-N 3.33Å; Y154-A156 PolarHBondContact O-N 3.47Å; Y154-I157 PolarHBondContact O-N 2.96Å; Y154-C158 HydrophobicContact CD2-CB 4.09Å; Y154-C158 HydrophobicContact CE2-CB 3.78Å; Y154-C158 VanDerWaalsContact O-CB 3.26Å; Y154-C158 WeakPolarHBondContact O-CB 3.34Å; Y154-C158 PolarHBondContact O-N 3.13Å; Y154-L251 HydrophobicContact CD2-CB 4.29Å; Y154-L251 HydrophobicContact CE2-CB 3.96Å; Y154-L251 HydrophobicContact CE2-CD1 3.84Å; Y154-I252 HydrophobicContact CD2-CG1 4.31Å |
| 155 | V | 85.6 | Confident | 85.5 | Confident | 3 Ų | 3 | 48 Ų | 48 | 2% | 0.018 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.2 | -41.1 | -178.8 | -178.6 | 0 | 0 | 0 | 0 | 110.6 | F151 D152 I157 K159 Y163 I166 M167 | F151-V155 HydrophobicContact CD1-CG2 4.43Å; F151-V155 HydrophobicContact CD2-CG2 4.21Å; F151-V155 HydrophobicContact CE1-CG2 3.99Å; F151-V155 HydrophobicContact CE2-CG2 3.74Å; F151-V155 HydrophobicContact CZ-CG2 3.62Å; F151-V155 WeakPolarHBondContact O-CG2 3.08Å; F151-V155 PolarHBondContact O-N 3.3Å; D152-V155 PolarHBondContact O-N 3.2Å; V155-I157 VanDerWaalsContact C-N 3.29Å; V155-I157 PolarHBondContact O-N 3.04Å; V155-K159 HydrophobicContact CG1-CB 4.36Å; V155-K159 CarbonylContact O-C 3.19Å; V155-K159 WeakPolarHBondContact O-CA 3.3Å; V155-K159 PolarHBondContact O-N 3Å; V155-Y163 HydrophobicContact CB-CD2 4.24Å; V155-Y163 HydrophobicContact CG1-CD2 3.94Å; V155-I166 HydrophobicContact CG1-CB 3.86Å; V155-I166 HydrophobicContact CG1-CD1 3.86Å; V155-I166 HydrophobicContact CG1-CG1 4.46Å; V155-I166 HydrophobicContact CG1-CG2 3.8Å; V155-I166 HydrophobicContact CG2-CG2 4.03Å; V155-M167 HydrophobicContact CB-CG 4.18Å; V155-M167 HydrophobicContact CG1-CG 4.29Å; V155-M167 HydrophobicContact CG2-CG 4.43Å |
| 156 | A | 84.9 | Confident | 85.4 | Confident | 29 Ų | 29 | 51 Ų | 51 | 24% | 0.24 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.7 | -38.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113 | D152 R153 Y154 Y163 | D152-A156 WeakPolarHBondContact O-CB 3.41Å; D152-A156 PolarHBondContact O-N 2.88Å; R153-A156 PolarHBondContact O-N 3.38Å; Y154-A156 VanDerWaalsContact C-N 3.33Å; Y154-A156 PolarHBondContact O-N 3.47Å; A156-Y163 VanDerWaalsContact CA-CD2 3.44Å; A156-Y163 HydrophobicContact CB-CD2 3.74Å; A156-Y163 HydrophobicContact CB-CE2 3.66Å; A156-Y163 HydrophobicContact CB-CG 4.41Å |
| 157 | I | 81.6 | Confident | 85.7 | Confident | 42 Ų | 42 | 50.7 Ų | 50.7 | 22% | 0.215 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -91.9 | -47.2 | -175.6 | -64.2 | 169.8 | 0 | 0 | 0 | 111.7 | R153 Y154 V155 I252 T255 I256 | R153-I157 WeakPolarHBondContact O-CG1 3.16Å; R153-I157 PolarHBondContact O-N 3.48Å; R153-I157 VanDerWaalsContact O-N 3.13Å; Y154-I157 PolarHBondContact O-N 2.96Å; V155-I157 VanDerWaalsContact C-N 3.29Å; V155-I157 PolarHBondContact O-N 3.04Å; I157-I252 HydrophobicContact CD1-CG2 3.57Å; I157-I252 HydrophobicContact CG2-CG2 4.26Å; I157-T255 HydrophobicContact CG2-CG2 4.23Å; I157-I256 HydrophobicContact CG2-CG1 4.21Å |
| 158 | C | 80.1 | Confident | 85.9 | Confident | 25 Ų | 25 | 53.3 Ų | 53.3 | 17% | 0.169 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -85.2 | -20.5 | -172.7 | -61.8 | 0 | 0 | 0 | 0 | 113.1 | Y154 T255 | Y154-C158 HydrophobicContact CD2-CB 4.09Å; Y154-C158 HydrophobicContact CE2-CB 3.78Å; Y154-C158 VanDerWaalsContact O-CB 3.26Å; Y154-C158 WeakPolarHBondContact O-CB 3.34Å; Y154-C158 PolarHBondContact O-N 3.13Å; C158-T255 PolarHBondContact SG-OG1 2.93Å |
| 159 | K | 82.4 | Confident | 85.8 | Confident | 108 Ų | 108 | 61.7 Ų | 61.7 | 47% | 0.47 | 31% | 0.31 | S | S | . | . | trans | -136.2 | 53.6 | -178.8 | -60.5 | -67.4 | 179.4 | -177.8 | 0 | 111.9 | V155 L161 H162 Y163 | V155-K159 HydrophobicContact CG1-CB 4.36Å; V155-K159 CarbonylContact O-C 3.19Å; V155-K159 WeakPolarHBondContact O-CA 3.3Å; V155-K159 PolarHBondContact O-N 3Å; K159-L161 VanDerWaalsContact C-N 3.32Å; K159-L161 PolarHBondContact O-N 3.17Å; K159-H162 PolarHBondContact O-N 3.49Å; K159-Y163 PolarHBondContact O-N 3.41Å; K159-Y163 VanDerWaalsContact O-N 3.13Å | ||
| 160 | P | 83.5 | Confident | 85.9 | Confident | 84 Ų | 84 | 70 Ų | 70 | 55% | 0.545 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | -58.9 | -39 | -170.3 | 23.9 | -34.3 | 0 | 0 | 0 | 113.3 | H162 Y163 | P160-H162 PolarHBondContact O-N 3.41Å; P160-Y163 WeakPolarHBondContact O-CB 3.23Å; P160-Y163 PolarHBondContact O-N 2.97Å |
| 161 | L | 88.1 | Confident | 86.3 | Confident | 163 Ų | 163 | 71.9 Ų | 71.9 | 85% | 0.853 | 36% | 0.358 | S | S | * | . | G | 310 helix | trans | -65.6 | -24.2 | 179.6 | -65 | 176.1 | 0 | 0 | 0 | 113.9 | K159 | K159-L161 VanDerWaalsContact C-N 3.32Å; K159-L161 PolarHBondContact O-N 3.17Å |
| 162 | H | 88.6 | Confident | 86.6 | Confident | 112 Ų | 112 | 70.2 Ų | 70.2 | 52% | 0.519 | 35% | 0.351 | S | S | . | . | G | 310 helix | trans | -108.2 | 3.3 | -178.5 | -64.4 | 82.9 | 0 | 0 | 0 | 112.5 | K159 P160 M164 T165 I166 | K159-H162 PolarHBondContact O-N 3.49Å; P160-H162 PolarHBondContact O-N 3.41Å; H162-M164 PolarHBondContact O-N 3.02Å; H162-T165 PolarHBondContact O-N 3.39Å; H162-T165 VanDerWaalsContact O-N 3.17Å; H162-I166 HydrophobicContact CB-CD1 3.73Å; H162-I166 HydrophobicContact CB-CG1 4.29Å; H162-I166 WeakPolarHBondContact O-CG1 3.11Å; H162-I166 PolarHBondContact O-N 2.56Å |
| 163 | Y | 86.8 | Confident | 86.8 | Confident | 32 Ų | 32 | 73.9 Ų | 73.9 | 13% | 0.125 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -56.6 | -50.3 | -172.2 | 174.2 | -109.3 | 0 | 0 | 0 | 112.4 | P89 D152 V155 A156 K159 P160 T165 I166 M167 | P89-Y163 WeakPolarHBondContact CG-OH 3.45Å; D152-Y163 WeakPolarHBondContact OD1-CE2 3.14Å; D152-Y163 PolarHBondContact OD1-OH 2.95Å; V155-Y163 HydrophobicContact CB-CD2 4.24Å; V155-Y163 HydrophobicContact CG1-CD2 3.94Å; A156-Y163 VanDerWaalsContact CA-CD2 3.44Å; A156-Y163 HydrophobicContact CB-CD2 3.74Å; A156-Y163 HydrophobicContact CB-CE2 3.66Å; A156-Y163 HydrophobicContact CB-CG 4.41Å; K159-Y163 PolarHBondContact O-N 3.41Å; K159-Y163 VanDerWaalsContact O-N 3.13Å; P160-Y163 WeakPolarHBondContact O-CB 3.23Å; P160-Y163 PolarHBondContact O-N 2.97Å; Y163-T165 PolarHBondContact O-N 2.99Å; Y163-I166 PolarHBondContact O-N 3.48Å; Y163-M167 HydrophobicContact CD2-CB 4.04Å; Y163-M167 HydrophobicContact CD2-CG 4.22Å; Y163-M167 HydrophobicContact CE2-CB 3.64Å; Y163-M167 HydrophobicContact CE2-CG 3.84Å; Y163-M167 PolarHBondContact O-N 2.91Å |
| 164 | M | 86.3 | Confident | 87.2 | Confident | 144 Ų | 144 | 76.8 Ų | 76.8 | 71% | 0.709 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -68 | -25.2 | -177.1 | -64.4 | -59.6 | -70.3 | 0 | 0 | 113.3 | H162 | H162-M164 PolarHBondContact O-N 3.02Å |
| 165 | T | 89.3 | Confident | 87.5 | Confident | 106 Ų | 106 | 74.3 Ų | 74.3 | 65% | 0.65 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -77.3 | -42.5 | 176.3 | -47.2 | 0 | 0 | 0 | 0 | 110.7 | H162 Y163 N168 | H162-T165 PolarHBondContact O-N 3.39Å; H162-T165 VanDerWaalsContact O-N 3.17Å; Y163-T165 PolarHBondContact O-N 2.99Å; T165-N168 PolarHBondContact O-ND2 2.69Å; T165-N168 VanDerWaalsContact O-ND2 3.13Å |
| 166 | I | 87.6 | Confident | 87.9 | Confident | 63 Ų | 63 | 74.8 Ų | 74.8 | 32% | 0.323 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -78.4 | -51.2 | -177.4 | -63.3 | 167.6 | 0 | 0 | 0 | 111.5 | F151 V155 H162 Y163 N168 V171 | F151-I166 HydrophobicContact CZ-CG2 4.34Å; V155-I166 HydrophobicContact CG1-CB 3.86Å; V155-I166 HydrophobicContact CG1-CD1 3.86Å; V155-I166 HydrophobicContact CG1-CG1 4.46Å; V155-I166 HydrophobicContact CG1-CG2 3.8Å; V155-I166 HydrophobicContact CG2-CG2 4.03Å; H162-I166 HydrophobicContact CB-CD1 3.73Å; H162-I166 HydrophobicContact CB-CG1 4.29Å; H162-I166 WeakPolarHBondContact O-CG1 3.11Å; H162-I166 PolarHBondContact O-N 2.56Å; Y163-I166 PolarHBondContact O-N 3.48Å; I166-N168 PolarHBondContact O-N 3.03Å; I166-V171 WeakPolarHBondContact O-CG2 3.43Å |
| 167 | M | 89 | Confident | 88.4 | Confident | 2 Ų | 2 | 77 Ų | 77 | 1% | 0.01 | 40% | 0.396 | C | S | . | . | S | Bend | trans | -100 | 74.9 | -178.4 | -73 | -61.1 | -59.2 | 0 | 0 | 110.6 | P89 F151 D152 V155 Y163 V171 L175 | P89-M167 HydrophobicContact CB-CB 4.36Å; P89-M167 HydrophobicContact CB-CE 3.8Å; P89-M167 HydrophobicContact CG-CB 4.12Å; P89-M167 VanDerWaalsContact CG-O 3.27Å; P89-M167 WeakPolarHBondContact CG-O 3.27Å; F151-M167 HydrophobicContact CD1-SD 3.83Å; F151-M167 HydrophobicContact CE1-SD 3.75Å; D152-M167 HydrophobicContact CB-CE 3.75Å; V155-M167 HydrophobicContact CB-CG 4.18Å; V155-M167 HydrophobicContact CG1-CG 4.29Å; V155-M167 HydrophobicContact CG2-CG 4.43Å; Y163-M167 HydrophobicContact CD2-CB 4.04Å; Y163-M167 HydrophobicContact CD2-CG 4.22Å; Y163-M167 HydrophobicContact CE2-CB 3.64Å; Y163-M167 HydrophobicContact CE2-CG 3.84Å; Y163-M167 PolarHBondContact O-N 2.91Å; M167-V171 HydrophobicContact SD-CG1 4.15Å; M167-L175 HydrophobicContact CE-CD1 4.03Å; M167-L175 HydrophobicContact SD-CD1 4.39Å |
| 168 | N | 89.4 | Confident | 88.7 | Confident | 58 Ų | 58 | 76.2 Ų | 76.2 | 31% | 0.31 | 39% | 0.393 | S | S | . | . | trans | -103 | 172.5 | 173.5 | 67.4 | 59.1 | 0 | 0 | 0 | 111.7 | T165 I166 K170 V171 C172 | T165-N168 PolarHBondContact O-ND2 2.69Å; T165-N168 VanDerWaalsContact O-ND2 3.13Å; I166-N168 PolarHBondContact O-N 3.03Å; N168-K170 VanDerWaalsContact C-N 3.29Å; N168-K170 PolarHBondContact O-N 3.3Å; N168-K170 WeakPolarHBondContact OD1-CB 2.96Å; N168-K170 PolarHBondContact OD1-N 2.73Å; N168-V171 PolarHBondContact O-N 3.36Å; N168-V171 VanDerWaalsContact O-N 3.11Å; N168-V171 PolarHBondContact OD1-N 3.33Å; N168-V171 VanDerWaalsContact OD1-N 3.17Å; N168-C172 PolarHBondContact O-N 2.66Å; N168-C172 PolarHBondContact O-SG 2.92Å | ||
| 169 | K | 87.6 | Confident | 89.3 | Confident | 175 Ų | 175 | 75 Ų | 75 | 76% | 0.761 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -55.3 | -39.9 | -178.3 | -69.9 | -176.2 | 177.7 | -179.5 | 0 | 113.5 | V171 C172 V173 | K169-V171 VanDerWaalsContact C-N 3.34Å; K169-V171 PolarHBondContact O-N 3.03Å; K169-C172 PolarHBondContact O-N 3.41Å; K169-V173 WeakPolarHBondContact O-CG2 3.23Å; K169-V173 PolarHBondContact O-N 2.82Å |
| 170 | K | 90.3 | Very high | 89.9 | Confident | 174 Ų | 174 | 73.3 Ų | 73.3 | 76% | 0.757 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -64.1 | -42.4 | 180 | -63.7 | -178.9 | 176.9 | -179.9 | 0 | 110.8 | N168 V173 L174 | N168-K170 VanDerWaalsContact C-N 3.29Å; N168-K170 PolarHBondContact O-N 3.3Å; N168-K170 WeakPolarHBondContact OD1-CB 2.96Å; N168-K170 PolarHBondContact OD1-N 2.73Å; K170-V173 PolarHBondContact O-N 2.8Å; K170-L174 WeakPolarHBondContact O-CB 3.47Å; K170-L174 PolarHBondContact O-N 2.96Å |
| 171 | V | 90.3 | Very high | 90.2 | Very high | 41 Ų | 41 | 73.7 Ų | 73.7 | 25% | 0.248 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.5 | -45.9 | 175.8 | 174.3 | 0 | 0 | 0 | 0 | 110.5 | I166 M167 N168 K169 V173 L174 L175 | I166-V171 WeakPolarHBondContact O-CG2 3.43Å; M167-V171 HydrophobicContact SD-CG1 4.15Å; N168-V171 PolarHBondContact O-N 3.36Å; N168-V171 VanDerWaalsContact O-N 3.11Å; N168-V171 PolarHBondContact OD1-N 3.33Å; N168-V171 VanDerWaalsContact OD1-N 3.17Å; K169-V171 VanDerWaalsContact C-N 3.34Å; K169-V171 PolarHBondContact O-N 3.03Å; V171-V173 VanDerWaalsContact C-N 3.34Å; V171-V173 PolarHBondContact O-N 3.46Å; V171-L174 WeakPolarHBondContact O-CB 3.39Å; V171-L174 PolarHBondContact O-N 3.05Å; V171-L174 VanDerWaalsContact O-N 3.14Å; V171-L175 HydrophobicContact CG1-CD1 4.1Å; V171-L175 HydrophobicContact CG1-CG 4.25Å; V171-L175 VanDerWaalsContact O-CG 3.26Å; V171-L175 WeakPolarHBondContact O-CG 3.38Å; V171-L175 PolarHBondContact O-N 3.32Å |
| 172 | C | 91.1 | Very high | 90.2 | Very high | 4 Ų | 4 | 65.9 Ų | 65.9 | 3% | 0.027 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -57.1 | -44.9 | 175.9 | -66.7 | 0 | 0 | 0 | 0 | 113.2 | P89 F92 N168 K169 L174 L175 V176 | P89-C172 WeakPolarHBondContact CB-SG 3.27Å; F92-C172 HydrophobicContact CD1-CB 3.61Å; F92-C172 HydrophobicContact CE1-CB 3.81Å; N168-C172 PolarHBondContact O-N 2.66Å; N168-C172 PolarHBondContact O-SG 2.92Å; K169-C172 PolarHBondContact O-N 3.41Å; C172-L174 VanDerWaalsContact C-N 3.34Å; C172-L175 PolarHBondContact O-N 2.91Å; C172-V176 WeakPolarHBondContact O-CG2 3.07Å; C172-V176 PolarHBondContact O-N 3.45Å; C172-V176 VanDerWaalsContact O-N 3.09Å |
| 173 | V | 92.3 | Very high | 90.2 | Very high | 76 Ų | 76 | 60.6 Ų | 60.6 | 46% | 0.461 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 176.2 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | F92 K169 K170 V171 L175 V176 V177 | F92-V173 HydrophobicContact CZ-CG2 4.19Å; K169-V173 WeakPolarHBondContact O-CG2 3.23Å; K169-V173 PolarHBondContact O-N 2.82Å; K170-V173 PolarHBondContact O-N 2.8Å; V171-V173 VanDerWaalsContact C-N 3.34Å; V171-V173 PolarHBondContact O-N 3.46Å; V173-L175 VanDerWaalsContact C-N 3.34Å; V173-L175 PolarHBondContact O-N 3Å; V173-V176 PolarHBondContact O-N 2.93Å; V173-V177 HydrophobicContact CG1-CG2 4.34Å; V173-V177 WeakPolarHBondContact O-CG2 3.08Å; V173-V177 PolarHBondContact O-N 3.34Å |
| 174 | L | 92.4 | Very high | 90.4 | Very high | 110 Ų | 110 | 62.9 Ų | 62.9 | 58% | 0.576 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -61.2 | -42.1 | 176.9 | -176.2 | 64 | 0 | 0 | 0 | 112 | K170 V171 C172 V176 V177 T178 | K170-L174 WeakPolarHBondContact O-CB 3.47Å; K170-L174 PolarHBondContact O-N 2.96Å; V171-L174 WeakPolarHBondContact O-CB 3.39Å; V171-L174 PolarHBondContact O-N 3.05Å; V171-L174 VanDerWaalsContact O-N 3.14Å; C172-L174 VanDerWaalsContact C-N 3.34Å; L174-V176 VanDerWaalsContact C-N 3.35Å; L174-V176 PolarHBondContact O-N 3.44Å; L174-V177 PolarHBondContact O-N 2.72Å; L174-T178 VanDerWaalsContact O-CB 3.29Å; L174-T178 WeakPolarHBondContact O-CB 3.47Å; L174-T178 PolarHBondContact O-N 3.33Å; L174-T178 PolarHBondContact O-OG1 3.49Å |
| 175 | L | 90.8 | Very high | 90.4 | Very high | 10 Ų | 10 | 59.3 Ų | 59.3 | 5% | 0.052 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 176 | -67.9 | 173.6 | 0 | 0 | 0 | 111.3 | F5 L93 M167 V171 C172 V173 T178 S179 | F5-L175 HydrophobicContact CD2-CD2 4.47Å; F5-L175 HydrophobicContact CE2-CD2 3.51Å; F5-L175 HydrophobicContact CZ-CD2 4.24Å; L93-L175 HydrophobicContact CD2-CB 4.36Å; M167-L175 HydrophobicContact CE-CD1 4.03Å; M167-L175 HydrophobicContact SD-CD1 4.39Å; V171-L175 HydrophobicContact CG1-CD1 4.1Å; V171-L175 HydrophobicContact CG1-CG 4.25Å; V171-L175 VanDerWaalsContact O-CG 3.26Å; V171-L175 WeakPolarHBondContact O-CG 3.38Å; V171-L175 PolarHBondContact O-N 3.32Å; C172-L175 PolarHBondContact O-N 2.91Å; V173-L175 VanDerWaalsContact C-N 3.34Å; V173-L175 PolarHBondContact O-N 3Å; L175-T178 PolarHBondContact O-N 2.92Å; L175-S179 PolarHBondContact O-N 3.11Å |
| 176 | V | 94 | Very high | 90.3 | Very high | 13 Ų | 13 | 54.5 Ų | 54.5 | 8% | 0.079 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.2 | -46 | 176.8 | 173.6 | 0 | 0 | 0 | 0 | 111.4 | F92 L93 N96 L145 C172 V173 L174 T178 S179 W180 | F92-V176 HydrophobicContact CE1-CG2 3.77Å; F92-V176 HydrophobicContact CZ-CG2 4.5Å; L93-V176 HydrophobicContact CD2-CG2 3.94Å; N96-V176 HydrophobicContact CB-CG2 4.28Å; L145-V176 HydrophobicContact CD2-CG2 4.07Å; C172-V176 WeakPolarHBondContact O-CG2 3.07Å; C172-V176 PolarHBondContact O-N 3.45Å; C172-V176 VanDerWaalsContact O-N 3.09Å; V173-V176 PolarHBondContact O-N 2.93Å; L174-V176 VanDerWaalsContact C-N 3.35Å; L174-V176 PolarHBondContact O-N 3.44Å; V176-T178 VanDerWaalsContact C-N 3.26Å; V176-T178 PolarHBondContact O-N 3.25Å; V176-S179 PolarHBondContact O-N 3.1Å; V176-S179 PolarHBondContact O-OG 3.38Å; V176-W180 PolarHBondContact O-N 3.35Å; V176-W180 VanDerWaalsContact O-N 3.12Å |
| 177 | V | 94 | Very high | 90.3 | Very high | 74 Ų | 74 | 51.5 Ų | 51.5 | 45% | 0.448 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.5 | -41.3 | 177.2 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | V173 L174 S179 W180 L181 | V173-V177 HydrophobicContact CG1-CG2 4.34Å; V173-V177 WeakPolarHBondContact O-CG2 3.08Å; V173-V177 PolarHBondContact O-N 3.34Å; L174-V177 PolarHBondContact O-N 2.72Å; V177-S179 VanDerWaalsContact C-N 3.35Å; V177-S179 PolarHBondContact O-N 3.27Å; V177-W180 PolarHBondContact O-N 3.05Å; V177-L181 HydrophobicContact CG1-CD1 3.98Å; V177-L181 HydrophobicContact CG1-CG 4.37Å; V177-L181 WeakPolarHBondContact O-CG 3.41Å; V177-L181 PolarHBondContact O-N 2.9Å |
| 178 | T | 89.4 | Confident | 90.2 | Very high | 26 Ų | 26 | 52.8 Ų | 52.8 | 16% | 0.16 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64.9 | -38.7 | 178 | -55.1 | 0 | 0 | 0 | 0 | 111.6 | F5 L174 L175 V176 W180 L181 L182 | F5-T178 HydrophobicContact CB-CG2 4.12Å; F5-T178 HydrophobicContact CD1-CG2 3.75Å; F5-T178 HydrophobicContact CD2-CG2 4.02Å; F5-T178 HydrophobicContact CE1-CG2 4.12Å; F5-T178 HydrophobicContact CE2-CG2 4.33Å; F5-T178 HydrophobicContact CG-CG2 3.72Å; F5-T178 HydrophobicContact CZ-CG2 4.4Å; L174-T178 VanDerWaalsContact O-CB 3.29Å; L174-T178 WeakPolarHBondContact O-CB 3.47Å; L174-T178 PolarHBondContact O-N 3.33Å; L174-T178 PolarHBondContact O-OG1 3.49Å; L175-T178 PolarHBondContact O-N 2.92Å; V176-T178 VanDerWaalsContact C-N 3.26Å; V176-T178 PolarHBondContact O-N 3.25Å; T178-W180 VanDerWaalsContact C-N 3.35Å; T178-W180 PolarHBondContact O-N 3.19Å; T178-L181 PolarHBondContact O-N 3.01Å; T178-L182 HydrophobicContact CG2-CD1 3.95Å; T178-L182 HydrophobicContact CG2-CG 4.29Å; T178-L182 WeakPolarHBondContact O-CB 3.28Å; T178-L182 WeakPolarHBondContact O-CG 3.41Å; T178-L182 PolarHBondContact O-N 3.2Å |
| 179 | S | 91.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 176.2 | 67.7 | 0 | 0 | 0 | 0 | 111.9 | L175 V176 V177 G183 | L175-S179 PolarHBondContact O-N 3.11Å; V176-S179 PolarHBondContact O-N 3.1Å; V176-S179 PolarHBondContact O-OG 3.38Å; V177-S179 VanDerWaalsContact C-N 3.35Å; V177-S179 PolarHBondContact O-N 3.27Å; S179-G183 PolarHBondContact O-N 3.45Å |
| 180 | W | 95.1 | Very high | 89.5 | Confident | 73 Ų | 73 | 42 Ų | 42 | 28% | 0.277 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -65 | -44.8 | 175.1 | -76.3 | 103.7 | 0 | 0 | 0 | 112.7 | F99 V100 L137 L138 V141 V176 V177 T178 L182 G183 L184 | F99-W180 HydrophobicContact CD1-CZ2 4.33Å; F99-W180 HydrophobicContact CE1-CH2 4.37Å; F99-W180 HydrophobicContact CE1-CZ2 4.13Å; V100-W180 HydrophobicContact CG2-CH2 4.49Å; V100-W180 HydrophobicContact CG2-CZ2 4.11Å; L137-W180 HydrophobicContact CD1-CE3 4.46Å; L138-W180 HydrophobicContact CD2-CH2 3.81Å; L138-W180 HydrophobicContact CD2-CZ3 3.89Å; V141-W180 HydrophobicContact CG1-CD2 4.18Å; V141-W180 HydrophobicContact CG1-CG 4.42Å; V141-W180 HydrophobicContact CG2-CD2 3.95Å; V141-W180 HydrophobicContact CG2-CE3 3.72Å; V141-W180 HydrophobicContact CG2-CG 4.38Å; V141-W180 HydrophobicContact CG2-CZ3 4.16Å; V176-W180 PolarHBondContact O-N 3.35Å; V176-W180 VanDerWaalsContact O-N 3.12Å; V177-W180 PolarHBondContact O-N 3.05Å; T178-W180 VanDerWaalsContact C-N 3.35Å; T178-W180 PolarHBondContact O-N 3.19Å; W180-L182 PolarHBondContact O-N 3.26Å; W180-G183 PolarHBondContact O-N 3.19Å; W180-L184 WeakPolarHBondContact O-CB 3.22Å; W180-L184 WeakPolarHBondContact O-CG 3.5Å; W180-L184 PolarHBondContact O-N 3.48Å |
| 181 | L | 91.1 | Very high | 89.2 | Confident | 91 Ų | 91 | 34.3 Ų | 34.3 | 48% | 0.476 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -62.2 | -43.2 | 177.6 | -69.8 | 173.6 | 0 | 0 | 0 | 111.9 | V177 T178 L184 L185 | V177-L181 HydrophobicContact CG1-CD1 3.98Å; V177-L181 HydrophobicContact CG1-CG 4.37Å; V177-L181 WeakPolarHBondContact O-CG 3.41Å; V177-L181 PolarHBondContact O-N 2.9Å; T178-L181 PolarHBondContact O-N 3.01Å; L181-L184 PolarHBondContact O-N 3.49Å; L181-L185 WeakPolarHBondContact O-CB 3.29Å; L181-L185 VanDerWaalsContact O-CG 3.31Å; L181-L185 WeakPolarHBondContact O-CG 3.46Å; L181-L185 PolarHBondContact O-N 2.95Å |
| 182 | L | 87.4 | Confident | 88.9 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.5 | -39.1 | 177.3 | -74.3 | 176.9 | 0 | 0 | 0 | 112.6 | F5 I8 L9 M12 V144 T178 W180 L185 H186 | F5-L182 HydrophobicContact CD1-CD1 3.58Å; F5-L182 HydrophobicContact CE1-CD1 3.87Å; I8-L182 HydrophobicContact CG2-CD1 4.16Å; I8-L182 HydrophobicContact CG2-CD2 3.65Å; L9-L182 HydrophobicContact CB-CD2 4.46Å; L9-L182 HydrophobicContact CD1-CD2 3.68Å; M12-L182 HydrophobicContact SD-CD2 4.02Å; V144-L182 HydrophobicContact CG1-CD1 4.28Å; V144-L182 HydrophobicContact CG2-CB 4.13Å; V144-L182 HydrophobicContact CG2-CD1 3.91Å; T178-L182 HydrophobicContact CG2-CD1 3.95Å; T178-L182 HydrophobicContact CG2-CG 4.29Å; T178-L182 WeakPolarHBondContact O-CB 3.28Å; T178-L182 WeakPolarHBondContact O-CG 3.41Å; T178-L182 PolarHBondContact O-N 3.2Å; W180-L182 PolarHBondContact O-N 3.26Å; L182-L185 PolarHBondContact O-N 3.18Å; L182-H186 VanDerWaalsContact O-CB 3.23Å; L182-H186 WeakPolarHBondContact O-CB 3.17Å; L182-H186 PolarHBondContact O-N 3.12Å |
| 183 | G | 89.1 | Confident | 88.3 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.1 | -39.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | S179 W180 H186 S187 | S179-G183 PolarHBondContact O-N 3.45Å; W180-G183 PolarHBondContact O-N 3.19Å; G183-H186 PolarHBondContact O-N 2.88Å; G183-S187 PolarHBondContact O-N 3.3Å; G183-S187 PolarHBondContact O-OG 3.43Å |
| 184 | L | 90.7 | Very high | 87.8 | Confident | 81 Ų | 81 | 32.9 Ų | 32.9 | 42% | 0.424 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -64.4 | -45.2 | 175.1 | -79 | 170.5 | 0 | 0 | 0 | 111.5 | F133 L137 W180 L181 S187 G188 | F133-L184 HydrophobicContact CZ-CD2 4.2Å; L137-L184 HydrophobicContact CD1-CB 4.3Å; L137-L184 HydrophobicContact CD1-CD2 3.77Å; L137-L184 HydrophobicContact CD1-CG 3.72Å; L137-L184 VanDerWaalsContact CD1-N 3.32Å; L137-L184 HydrophobicContact CD2-CD2 4.05Å; W180-L184 WeakPolarHBondContact O-CB 3.22Å; W180-L184 WeakPolarHBondContact O-CG 3.5Å; W180-L184 PolarHBondContact O-N 3.48Å; L181-L184 PolarHBondContact O-N 3.49Å; L184-S187 PolarHBondContact O-N 2.93Å; L184-G188 WeakPolarHBondContact O-CA 3.42Å; L184-G188 PolarHBondContact O-N 3.16Å |
| 185 | L | 87.3 | Confident | 87.5 | Confident | 69 Ų | 69 | 30.1 Ų | 30.1 | 36% | 0.361 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.8 | -49.5 | 174.2 | -73.3 | 168.6 | 0 | 0 | 0 | 110.3 | L9 M12 L181 L182 S187 G188 L189 | L9-L185 HydrophobicContact CD1-CD1 3.28Å; L9-L185 HydrophobicContact CG-CD1 4.38Å; M12-L185 HydrophobicContact CE-CB 3.99Å; L181-L185 WeakPolarHBondContact O-CB 3.29Å; L181-L185 VanDerWaalsContact O-CG 3.31Å; L181-L185 WeakPolarHBondContact O-CG 3.46Å; L181-L185 PolarHBondContact O-N 2.95Å; L182-L185 PolarHBondContact O-N 3.18Å; L185-S187 VanDerWaalsContact C-N 3.25Å; L185-S187 PolarHBondContact O-N 2.86Å; L185-G188 PolarHBondContact O-N 3.44Å; L185-L189 VanDerWaalsContact O-CB 3.25Å; L185-L189 WeakPolarHBondContact O-CB 2.95Å; L185-L189 WeakPolarHBondContact O-CG 3.11Å; L185-L189 PolarHBondContact O-N 3.31Å |
| 186 | H | 86.3 | Confident | 87 | Confident | 5 Ų | 5 | 35.1 Ų | 35.1 | 2% | 0.023 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -53 | -43.6 | 179.8 | 177.9 | 52.1 | 0 | 0 | 0 | 112.5 | M12 H136 L182 G183 N233 S234 I237 | M12-H186 VanDerWaalsContact CE-CA 3.41Å; M12-H186 HydrophobicContact CE-CB 3.7Å; M12-H186 VanDerWaalsContact CE-N 3.33Å; H136-H186 AromaticContact CD2-NE2 3.65Å; H136-H186 PolarHBondContact O-CD2 3.43Å; L182-H186 VanDerWaalsContact O-CB 3.23Å; L182-H186 WeakPolarHBondContact O-CB 3.17Å; L182-H186 PolarHBondContact O-N 3.12Å; G183-H186 PolarHBondContact O-N 2.88Å; H186-N233 PolarHBondContact CE1-ND2 3.02Å; H186-N233 VanDerWaalsContact CE1-ND2 3.31Å; H186-N233 PolarHBondContact ND1-ND2 3.39Å; H186-N233 PolarHBondContact ND1-OD1 3.17Å; H186-N233 PolarHBondContact O-ND2 2.85Å; H186-S234 PolarHBondContact CE1-OG 3.29Å; H186-S234 VanDerWaalsContact CE1-OG 3.31Å; H186-I237 HydrophobicContact CB-CD1 4.13Å |
| 187 | S | 88.4 | Confident | 86.5 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -78 | -45.2 | 178.8 | -52.3 | 0 | 0 | 0 | 0 | 112.5 | H136 L137 G183 L184 L185 L189 Q190 I191 | H136-S187 WeakPolarHBondContact CB-OG 2.97Å; L137-S187 WeakPolarHBondContact CA-OG 3.42Å; L137-S187 PolarHBondContact N-OG 3.48Å; G183-S187 PolarHBondContact O-N 3.3Å; G183-S187 PolarHBondContact O-OG 3.43Å; L184-S187 PolarHBondContact O-N 2.93Å; L185-S187 VanDerWaalsContact C-N 3.25Å; L185-S187 PolarHBondContact O-N 2.86Å; S187-L189 PolarHBondContact O-N 3.08Å; S187-Q190 PolarHBondContact O-N 2.98Å; S187-I191 WeakPolarHBondContact O-CB 3.39Å; S187-I191 VanDerWaalsContact O-CG1 3.23Å; S187-I191 WeakPolarHBondContact O-CG1 3.48Å; S187-I191 PolarHBondContact O-N 2.89Å |
| 188 | G | 85.9 | Confident | 86 | Confident | 29 Ų | 29 | 32.9 Ų | 32.9 | 30% | 0.299 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63.9 | -24.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L184 L185 P192 | L184-G188 WeakPolarHBondContact O-CA 3.42Å; L184-G188 PolarHBondContact O-N 3.16Å; L185-G188 PolarHBondContact O-N 3.44Å; G188-P192 WeakPolarHBondContact O-CD 2.96Å; G188-P192 VanDerWaalsContact O-CG 3.27Å; G188-P192 WeakPolarHBondContact O-CG 3.23Å |
| 189 | L | 82.7 | Confident | 85.7 | Confident | 5 Ų | 5 | 32.1 Ų | 32.1 | 3% | 0.026 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.7 | -44.5 | 173.1 | -81.6 | 171.7 | 0 | 0 | 0 | 112.3 | M12 F16 L185 S187 F193 N233 | M12-L189 HydrophobicContact CB-CD1 4.08Å; M12-L189 HydrophobicContact CE-CD1 3.57Å; M12-L189 HydrophobicContact CG-CD1 4.39Å; F16-L189 VanDerWaalsContact CA-CD2 3.43Å; F16-L189 HydrophobicContact CB-CD2 3.19Å; F16-L189 HydrophobicContact CD2-CD2 3.17Å; F16-L189 HydrophobicContact CD2-CG 4.33Å; F16-L189 HydrophobicContact CE2-CD2 4.23Å; F16-L189 HydrophobicContact CG-CD2 3.51Å; L185-L189 VanDerWaalsContact O-CB 3.25Å; L185-L189 WeakPolarHBondContact O-CB 2.95Å; L185-L189 WeakPolarHBondContact O-CG 3.11Å; L185-L189 PolarHBondContact O-N 3.31Å; S187-L189 PolarHBondContact O-N 3.08Å; L189-F193 WeakPolarHBondContact O-CD2 3.48Å; L189-F193 WeakPolarHBondContact O-CE2 3.37Å; L189-N233 VanDerWaalsContact CD1-OD1 3.3Å; L189-N233 WeakPolarHBondContact CD1-OD1 3.22Å |
| 190 | Q | 79.2 | Confident | 85.2 | Confident | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.005 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -107.9 | -27.9 | -165.7 | 63.5 | -176.5 | 28.8 | 0 | 0 | 114.5 | H136 S187 A194 L212 I230 N233 S234 | H136-Q190 PolarHBondContact CD2-NE2 3.02Å; H136-Q190 PolarHBondContact NE2-NE2 2.96Å; S187-Q190 PolarHBondContact O-N 2.98Å; Q190-A194 PolarHBondContact O-N 3.5Å; Q190-L212 HydrophobicContact CB-CD2 4.12Å; Q190-L212 HydrophobicContact CG-CD2 3.69Å; Q190-L212 VanDerWaalsContact NE2-CD2 3.28Å; Q190-I230 HydrophobicContact CB-CG1 4.28Å; Q190-N233 PolarHBondContact OE1-ND2 3.11Å; Q190-S234 PolarHBondContact OE1-OG 2.98Å |
| 191 | I | 85.5 | Confident | 84.1 | Confident | 13 Ų | 13 | 31.9 Ų | 31.9 | 7% | 0.067 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -69.5 | -44.4 | -175.4 | -60.7 | -62.7 | 0 | 0 | 0 | 113.1 | F129 I132 F133 S187 F193 A194 V195 L212 | F129-I191 HydrophobicContact CD1-CG2 4.39Å; I132-I191 HydrophobicContact CB-CD1 4.08Å; I132-I191 HydrophobicContact CG2-CD1 3.37Å; F133-I191 HydrophobicContact CB-CG1 4.32Å; F133-I191 HydrophobicContact CD2-CG1 4.24Å; S187-I191 WeakPolarHBondContact O-CB 3.39Å; S187-I191 VanDerWaalsContact O-CG1 3.23Å; S187-I191 WeakPolarHBondContact O-CG1 3.48Å; S187-I191 PolarHBondContact O-N 2.89Å; I191-F193 VanDerWaalsContact C-N 3.26Å; I191-F193 PolarHBondContact O-N 3.25Å; I191-A194 PolarHBondContact O-N 3.31Å; I191-A194 VanDerWaalsContact O-N 3.11Å; I191-V195 HydrophobicContact CG2-CG2 3.83Å; I191-V195 WeakPolarHBondContact O-CG2 3.21Å; I191-V195 PolarHBondContact O-N 3.1Å; I191-L212 HydrophobicContact CD1-CD1 4.14Å; I191-L212 HydrophobicContact CD1-CD2 4.02Å |
| 192 | P | 83.4 | Confident | 83.5 | Confident | 62 Ų | 62 | 31.9 Ų | 31.9 | 40% | 0.403 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -58.9 | -37.4 | 179.3 | -25.9 | 36.6 | 0 | 0 | 0 | 112.7 | G188 N196 | G188-P192 WeakPolarHBondContact O-CD 2.96Å; G188-P192 VanDerWaalsContact O-CG 3.27Å; G188-P192 WeakPolarHBondContact O-CG 3.23Å; P192-N196 PolarHBondContact O-N 3.47Å; P192-N196 PolarHBondContact O-ND2 3Å |
| 193 | F | 77.5 | Confident | 83.3 | Confident | 29 Ų | 29 | 34.4 Ų | 34.4 | 13% | 0.127 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65 | -43.1 | 176.2 | -61.5 | -63.6 | 0 | 0 | 0 | 111.8 | T20 L23 L189 I191 N196 | T20-F193 HydrophobicContact CG2-CE1 4.36Å; T20-F193 HydrophobicContact CG2-CE2 4.45Å; T20-F193 HydrophobicContact CG2-CZ 3.6Å; L23-F193 HydrophobicContact CB-CD1 3.83Å; L23-F193 HydrophobicContact CB-CE1 3.76Å; L23-F193 HydrophobicContact CD2-CB 4.16Å; L23-F193 HydrophobicContact CD2-CD1 3.9Å; L23-F193 HydrophobicContact CD2-CD2 4.4Å; L23-F193 HydrophobicContact CD2-CE1 4.39Å; L23-F193 HydrophobicContact CD2-CG 3.91Å; L189-F193 WeakPolarHBondContact O-CD2 3.48Å; L189-F193 WeakPolarHBondContact O-CE2 3.37Å; I191-F193 VanDerWaalsContact C-N 3.26Å; I191-F193 PolarHBondContact O-N 3.25Å; F193-N196 PolarHBondContact O-N 3.13Å |
| 194 | A | 82.9 | Confident | 83.1 | Confident | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -70.1 | -35.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | F129 Q190 I191 N196 L197 F199 L212 T216 | F129-A194 HydrophobicContact CE1-CB 3.79Å; F129-A194 WeakPolarHBondContact CZ-O 3.19Å; Q190-A194 PolarHBondContact O-N 3.5Å; I191-A194 PolarHBondContact O-N 3.31Å; I191-A194 VanDerWaalsContact O-N 3.11Å; A194-N196 VanDerWaalsContact C-N 3.31Å; A194-N196 PolarHBondContact O-N 3.12Å; A194-L197 PolarHBondContact O-N 2.99Å; A194-F199 WeakPolarHBondContact O-CE2 3.12Å; A194-L212 HydrophobicContact CB-CD1 3.37Å; A194-L212 HydrophobicContact CB-CG 4.49Å; A194-T216 HydrophobicContact CB-CG2 3.77Å |
| 195 | V | 84.6 | Confident | 82.7 | Confident | 51 Ų | 51 | 33.5 Ų | 33.5 | 31% | 0.309 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -66.7 | -33.1 | 178.4 | 171.4 | 0 | 0 | 0 | 0 | 111.9 | F125 F129 I191 L197 | F125-V195 HydrophobicContact CE1-CG1 4.2Å; F125-V195 HydrophobicContact CZ-CG1 4.37Å; F129-V195 HydrophobicContact CB-CG2 3.93Å; F129-V195 HydrophobicContact CD1-CB 4.38Å; F129-V195 HydrophobicContact CD1-CG2 3.26Å; F129-V195 HydrophobicContact CD2-CG2 4.17Å; F129-V195 HydrophobicContact CE1-CB 4.4Å; F129-V195 HydrophobicContact CE1-CG2 3.69Å; F129-V195 HydrophobicContact CG-CG2 3.51Å; F129-V195 HydrophobicContact CZ-CG2 4.3Å; I191-V195 HydrophobicContact CG2-CG2 3.83Å; I191-V195 WeakPolarHBondContact O-CG2 3.21Å; I191-V195 PolarHBondContact O-N 3.1Å; V195-L197 VanDerWaalsContact C-N 3.29Å; V195-L197 PolarHBondContact O-N 3.22Å |
| 196 | N | 82.2 | Confident | 82.3 | Confident | 115 Ų | 115 | 31.8 Ų | 31.8 | 62% | 0.615 | 20% | 0.198 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -84 | -1.2 | -177.9 | -71.6 | -58.7 | 0 | 0 | 0 | 113.6 | P192 F193 A194 | P192-N196 PolarHBondContact O-N 3.47Å; P192-N196 PolarHBondContact O-ND2 3Å; F193-N196 PolarHBondContact O-N 3.13Å; A194-N196 VanDerWaalsContact C-N 3.31Å; A194-N196 PolarHBondContact O-N 3.12Å |
| 197 | L | 82.8 | Confident | 81.8 | Confident | 11 Ų | 11 | 31.7 Ų | 31.7 | 6% | 0.058 | 20% | 0.197 | C | C | . | . | S | Bend | trans | -67.2 | 142.2 | 175.6 | -75.6 | 171.6 | 0 | 0 | 0 | 111.2 | A194 V195 F199 T216 A219 V221 T223 V226 | A194-L197 PolarHBondContact O-N 2.99Å; V195-L197 VanDerWaalsContact C-N 3.29Å; V195-L197 PolarHBondContact O-N 3.22Å; L197-F199 HydrophobicContact CB-CE2 3.87Å; L197-F199 HydrophobicContact CB-CZ 3.93Å; L197-F199 WeakPolarHBondContact O-CD2 3.45Å; L197-F199 VanDerWaalsContact O-CE2 3.28Å; L197-F199 WeakPolarHBondContact O-CE2 3.18Å; L197-F199 PolarHBondContact O-N 3.3Å; L197-T216 HydrophobicContact CD1-CG2 3.87Å; L197-A219 HydrophobicContact CB-CB 3.89Å; L197-A219 HydrophobicContact CD1-CB 4.04Å; L197-A219 HydrophobicContact CD2-CB 4.44Å; L197-A219 HydrophobicContact CG-CB 4.36Å; L197-V221 HydrophobicContact CD2-CG2 3.9Å; L197-T223 HydrophobicContact CD1-CG2 3.81Å; L197-T223 HydrophobicContact CD2-CG2 4.14Å; L197-V226 HydrophobicContact CD1-CG1 4.26Å; L197-V226 HydrophobicContact CD1-CG2 4.49Å; L197-V226 HydrophobicContact CD2-CG2 4.26Å |
| 198 | P | 82.2 | Confident | 81.1 | Confident | 29 Ų | 29 | 32.1 Ų | 32.1 | 19% | 0.188 | 20% | 0.2 | C | C | . | . | trans | -73.9 | 114.9 | 174.5 | 29.4 | -33.2 | 0 | 0 | 0 | 110.4 | L34 A219 C220 V221 | L34-P198 HydrophobicContact CD1-CG 4.28Å; P198-A219 WeakPolarHBondContact O-CA 2.99Å; P198-C220 PolarHBondContact O-N 2.93Å; P198-V221 HydrophobicContact CG-CB 4.31Å; P198-V221 HydrophobicContact CG-CG1 3.59Å; P198-V221 HydrophobicContact CG-CG2 3.79Å | ||
| 199 | F | 84.3 | Confident | 80.6 | Confident | 11 Ų | 11 | 31.4 Ų | 31.4 | 5% | 0.048 | 19% | 0.188 | C | C | . | . | trans | -103.6 | 107.2 | 172.9 | -61.4 | -82.8 | 0 | 0 | 0 | 109.9 | V40 F43 F125 F129 A194 L197 V215 L218 A219 | V40-F199 HydrophobicContact CB-CB 3.91Å; V40-F199 HydrophobicContact CG2-CB 3.97Å; V40-F199 PolarHBondContact N-O 3.31Å; F43-F199 HydrophobicContact CE1-CD1 4.46Å; F43-F199 HydrophobicContact CZ-CD1 4.28Å; F43-F199 HydrophobicContact CZ-CE1 4.5Å; F43-F199 HydrophobicContact CZ-CG 4.47Å; F125-F199 AromaticContact CE2-CD2 3.6Å; F125-F199 HydrophobicContact CE2-CD2 3.6Å; F125-F199 AromaticContact CE2-CE2 3.83Å; F125-F199 HydrophobicContact CE2-CE2 3.83Å; F125-F199 HydrophobicContact CE2-CG 4.45Å; F125-F199 HydrophobicContact CZ-CD2 4.31Å; F125-F199 HydrophobicContact CZ-CE2 4.28Å; F129-F199 HydrophobicContact CE2-CE2 4.17Å; F129-F199 HydrophobicContact CE2-CZ 4.41Å; F129-F199 AromaticContact CZ-CE2 3.94Å; F129-F199 HydrophobicContact CZ-CE2 3.94Å; F129-F199 AromaticContact CZ-CZ 3.9Å; F129-F199 HydrophobicContact CZ-CZ 3.9Å; A194-F199 WeakPolarHBondContact O-CE2 3.12Å; L197-F199 HydrophobicContact CB-CE2 3.87Å; L197-F199 HydrophobicContact CB-CZ 3.93Å; L197-F199 WeakPolarHBondContact O-CD2 3.45Å; L197-F199 VanDerWaalsContact O-CE2 3.28Å; L197-F199 WeakPolarHBondContact O-CE2 3.18Å; L197-F199 PolarHBondContact O-N 3.3Å; F199-V215 HydrophobicContact CE1-CG1 4.11Å; F199-V215 WeakPolarHBondContact CE1-O 3.27Å; F199-V215 HydrophobicContact CZ-CG1 4.12Å; F199-L218 HydrophobicContact CD1-CB 4.32Å; F199-L218 HydrophobicContact CE1-CB 4.5Å; F199-A219 HydrophobicContact CD1-CB 4.27Å; F199-A219 HydrophobicContact CE1-CB 4.03Å | ||
| 200 | C | 79.9 | Confident | 80.5 | Confident | 40 Ų | 40 | 31.1 Ų | 31.1 | 27% | 0.27 | 19% | 0.187 | S | C | . | . | trans | -113.8 | 5 | -178.6 | 76.5 | 0 | 0 | 0 | 0 | 113.4 | Q37 C220 | Q37-C200 HydrophobicContact CB-CB 3.92Å; Q37-C200 HydrophobicContact CG-CB 4.42Å; Q37-C200 PolarHBondContact OE1-SG 3.34Å; C200-C220 WeakPolarHBondContact CA-SG 3.28Å; C200-C220 HydrophobicContact CB-CB 4.05Å; C200-C220 WeakPolarHBondContact CB-SG 3.35Å; C200-C220 PolarHBondContact N-SG 3.31Å; C200-C220 WeakPolarHBondContact SG-CB 3.22Å; C200-C220 CovalentContact SG-SG 1.99Å; C200-C220 PolarHBondContact SG-SG 2.85Å | ||
| 201 | G | 71.8 | Confident | 80.5 | Confident | 28 Ų | 28 | 33.3 Ų | 33.3 | 29% | 0.289 | 20% | 0.198 | S | C | . | . | S | Bend | trans | 116 | 161.1 | -177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 202 | P | 79.3 | Confident | 80.3 | Confident | 91 Ų | 91 | 32.7 Ų | 32.7 | 59% | 0.591 | 20% | 0.195 | S | C | * | . | cis | -66.8 | 157.4 | -12.8 | 26.7 | -31.3 | 0 | 0 | 0 | 112.8 | L218 | P202-L218 HydrophobicContact CG-CD2 3.95Š| ||
| 203 | N | 84.1 | Confident | 80 | Confident | 53 Ų | 53 | 31.8 Ų | 31.8 | 28% | 0.283 | 19% | 0.19 | S | C | . | . | trans | -104.8 | 18.1 | -179.6 | 71.8 | -27.5 | 0 | 0 | 0 | 113.5 | V40 E42 F43 I44 | V40-N203 HydrophobicContact CG1-CB 3.67Å; V40-N203 HydrophobicContact CG2-CB 4.33Å; E42-N203 VanDerWaalsContact O-CB 3.28Å; E42-N203 WeakPolarHBondContact O-CB 3.09Å; E42-N203 PolarHBondContact O-ND2 3.32Å; F43-N203 CarbonylContact C-O 3.59Å; F43-N203 VanDerWaalsContact CA-O 3.25Å; F43-N203 WeakPolarHBondContact CA-O 3.16Å; F43-N203 HydrophobicContact CD1-CB 4.4Å; I44-N203 PolarHBondContact N-O 3.45Å | ||
| 204 | V | 84 | Confident | 80.1 | Confident | 60 Ų | 60 | 31.4 Ų | 31.4 | 36% | 0.364 | 19% | 0.189 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.2 | 118.9 | -175.5 | -176.7 | 0 | 0 | 0 | 0 | 109.6 | I44 L46 L218 | I44-V204 HydrophobicContact CB-CG2 4.38Å; I44-V204 CarbonylContact O-C 3.58Å; I44-V204 WeakPolarHBondContact O-CA 3.37Å; L46-V204 HydrophobicContact CD1-CG1 3.69Å; L46-V204 HydrophobicContact CG-CG1 4.49Å; V204-L218 WeakPolarHBondContact O-CD2 3.35Å |
| 205 | V | 82.7 | Confident | 80.1 | Confident | 2 Ų | 2 | 31.4 Ų | 31.4 | 1% | 0.012 | 19% | 0.189 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 120.6 | 177 | -178.9 | 0 | 0 | 0 | 0 | 108.2 | F43 I44 L45 L46 S207 L214 V215 L218 | F43-V205 HydrophobicContact CB-CG2 4.15Å; F43-V205 HydrophobicContact CD1-CG2 3.93Å; F43-V205 HydrophobicContact CG-CG2 4.28Å; I44-V205 PolarHBondContact O-N 3.47Å; L45-V205 HydrophobicContact CD2-CB 4.05Å; L45-V205 HydrophobicContact CD2-CG1 4.26Å; L46-V205 PolarHBondContact N-O 2.91Å; V205-S207 PolarHBondContact O-N 3.42Å; V205-L214 HydrophobicContact CG1-CB 4.09Å; V205-V215 HydrophobicContact CG1-CG2 4.45Å; V205-V215 HydrophobicContact CG2-CG2 4Å; V205-L218 HydrophobicContact CG2-CD1 3.62Å |
| 206 | D | 78.4 | Confident | 80 | Confident | 33 Ų | 33 | 29 Ų | 29 | 18% | 0.176 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -78.4 | 55.2 | -179.5 | -167.6 | 29.9 | 0 | 0 | 0 | 113.1 | Y296 K300 | D206-Y296 WeakPolarHBondContact OD2-CD1 3.31Å; D206-K300 VanDerWaalsContact CG-CE 3.48Å; D206-K300 VanDerWaalsContact O-CE 3.31Å; D206-K300 WeakPolarHBondContact O-CE 3.38Å; D206-K300 WeakPolarHBondContact OD1-CE 3.24Å; D206-K300 IonicContact OD1-NZ 3.15Å; D206-K300 PolarHBondContact OD1-NZ 3.48Å; D206-K300 IonicContact OD2-NZ 3.76Å |
| 207 | S | 76.1 | Confident | 79.9 | Confident | 2 Ų | 2 | 29.3 Ų | 29.3 | 1% | 0.014 | 17% | 0.17 | C | C | . | . | S | Bend | trans | -150.9 | 171.9 | 178.4 | -175.9 | 0 | 0 | 0 | 0 | 111.4 | L45 L46 G47 V205 F209 | L45-S207 WeakPolarHBondContact CB-O 3.49Å; L46-S207 PolarHBondContact N-O 3.13Å; G47-S207 PolarHBondContact N-O 3.48Å; V205-S207 PolarHBondContact O-N 3.42Å; S207-F209 WeakPolarHBondContact CB-O 3.26Å; S207-F209 PolarHBondContact OG-N 3.39Å; S207-F209 PolarHBondContact OG-O 3.41Å |
| 208 | I | 72.9 | Confident | 79.9 | Confident | 10 Ų | 10 | 29.7 Ų | 29.7 | 5% | 0.051 | 17% | 0.172 | C | C | . | . | S | Bend | trans | -86.1 | -14.6 | 174.3 | 45.2 | 179.4 | 0 | 0 | 0 | 113.5 | L48 M112 A303 V304 | L48-I208 HydrophobicContact CB-CG2 4.36Å; L48-I208 HydrophobicContact CD1-CD1 4.09Å; L48-I208 HydrophobicContact CD1-CG2 3.97Å; L48-I208 HydrophobicContact CD2-CD1 4.47Å; L48-I208 HydrophobicContact CD2-CG2 4.48Å; L48-I208 HydrophobicContact CG-CD1 4.28Å; L48-I208 HydrophobicContact CG-CG2 3.57Å; M112-I208 HydrophobicContact CG-CB 4.13Å; M112-I208 HydrophobicContact CG-CD1 4.31Å; M112-I208 HydrophobicContact SD-CB 4.42Å; M112-I208 HydrophobicContact SD-CD1 3.56Å; M112-I208 VanDerWaalsContact SD-CD1 3.56Å; M112-I208 HydrophobicContact SD-CG1 4.2Å; I208-A303 HydrophobicContact CG1-CB 4.37Å; I208-V304 HydrophobicContact CD1-CG2 3.65Å |
| 209 | F | 75.5 | Confident | 80.1 | Confident | 13 Ų | 13 | 29 Ų | 29 | 6% | 0.057 | 17% | 0.169 | C | C | . | . | S | Bend | trans | -142.3 | 167.9 | 174.6 | 60.3 | -103.5 | 0 | 0 | 0 | 110.2 | L135 S207 D211 A303 T307 | L135-F209 HydrophobicContact CD1-CD2 3.81Å; L135-F209 HydrophobicContact CD1-CE2 3.99Å; S207-F209 WeakPolarHBondContact CB-O 3.26Å; S207-F209 PolarHBondContact OG-N 3.39Å; S207-F209 PolarHBondContact OG-O 3.41Å; F209-D211 HydrophobicContact CD2-CB 4.22Å; F209-D211 HydrophobicContact CE2-CB 3.79Å; F209-D211 PolarHBondContact O-N 3.48Å; F209-A303 HydrophobicContact CD1-CB 4.15Å; F209-A303 VanDerWaalsContact CE1-CA 3.47Å; F209-A303 HydrophobicContact CE1-CB 3.19Å; F209-A303 WeakPolarHBondContact CE1-O 3.49Å; F209-A303 HydrophobicContact CZ-CB 3.45Å; F209-A303 VanDerWaalsContact CZ-CB 3.45Å; F209-T307 HydrophobicContact CD1-CG2 3.9Å; F209-T307 HydrophobicContact CE1-CG2 3.42Å; F209-T307 VanDerWaalsContact CE1-CG2 3.42Å; F209-T307 HydrophobicContact CZ-CG2 3.92Å |
| 210 | C | 81 | Confident | 80 | Confident | 0 Ų | 0 | 30.5 Ų | 30.5 | 0% | 0 | 18% | 0.18 | C | C | . | . | trans | -72.9 | 112.6 | 173.1 | -77.9 | 0 | 0 | 0 | 0 | 111.1 | C128 I132 V215 | C128-C210 WeakPolarHBondContact CA-SG 3.4Å; C128-C210 HydrophobicContact CB-CB 3.98Å; C128-C210 WeakPolarHBondContact CB-SG 3.04Å; C128-C210 WeakPolarHBondContact SG-CB 3.31Å; C128-C210 CovalentContact SG-SG 2.02Å; C128-C210 PolarHBondContact SG-SG 2.86Å; I132-C210 HydrophobicContact CD1-CB 3.97Å; I132-C210 HydrophobicContact CG1-CB 3.74Å; I132-C210 WeakPolarHBondContact CG1-O 3.47Å; C210-V215 HydrophobicContact CB-CG2 4.44Å | ||
| 211 | D | 79.5 | Confident | 80.1 | Confident | 46 Ų | 46 | 29.6 Ų | 29.6 | 25% | 0.246 | 17% | 0.174 | C | C | . | . | trans | -111.2 | 140.6 | 174.3 | -173.6 | 26 | 0 | 0 | 0 | 110.5 | F209 P213 L214 V215 | F209-D211 HydrophobicContact CD2-CB 4.22Å; F209-D211 HydrophobicContact CE2-CB 3.79Å; F209-D211 PolarHBondContact O-N 3.48Å; D211-P213 WeakPolarHBondContact OD1-CD 3.44Å; D211-L214 HydrophobicContact CB-CB 4.37Å; D211-L214 HydrophobicContact CB-CD1 3.91Å; D211-L214 PolarHBondContact O-N 3.48Å; D211-V215 WeakPolarHBondContact O-CB 3.27Å; D211-V215 VanDerWaalsContact O-CG2 3.31Å; D211-V215 WeakPolarHBondContact O-CG2 3.43Å; D211-V215 PolarHBondContact O-N 2.66Å | ||
| 212 | L | 80.3 | Confident | 80.4 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.9 | -48.4 | -168.4 | -169 | 56.5 | 0 | 0 | 0 | 112.8 | F129 I132 Q190 I191 A194 L214 V215 T216 I230 | F129-L212 HydrophobicContact CE1-CD1 4.47Å; I132-L212 HydrophobicContact CD1-CD1 4.33Å; I132-L212 HydrophobicContact CG2-CB 3.68Å; I132-L212 HydrophobicContact CG2-CD1 4.01Å; I132-L212 HydrophobicContact CG2-CD2 4.38Å; I132-L212 HydrophobicContact CG2-CG 4.22Å; Q190-L212 HydrophobicContact CB-CD2 4.12Å; Q190-L212 HydrophobicContact CG-CD2 3.69Å; Q190-L212 VanDerWaalsContact NE2-CD2 3.28Å; I191-L212 HydrophobicContact CD1-CD1 4.14Å; I191-L212 HydrophobicContact CD1-CD2 4.02Å; A194-L212 HydrophobicContact CB-CD1 3.37Å; A194-L212 HydrophobicContact CB-CG 4.49Å; L212-L214 VanDerWaalsContact C-N 3.3Å; L212-L214 PolarHBondContact O-N 2.89Å; L212-V215 PolarHBondContact O-N 2.77Å; L212-T216 HydrophobicContact CD1-CG2 4.14Å; L212-T216 WeakPolarHBondContact O-CG2 3.4Å; L212-T216 PolarHBondContact O-N 3.33Å; L212-T216 PolarHBondContact O-OG1 2.95Å; L212-T216 VanDerWaalsContact O-OG1 3.1Å; L212-I230 HydrophobicContact CD2-CD1 3.9Å; L212-I230 HydrophobicContact CD2-CG1 3.79Å; L212-I230 HydrophobicContact CD2-CG2 4.08Å; L212-I230 HydrophobicContact CG-CD1 3.73Å; L212-I230 HydrophobicContact CG-CG1 4.2Å; L212-I230 HydrophobicContact CG-CG2 4.45Å |
| 213 | P | 77.4 | Confident | 80.4 | Confident | 44 Ų | 44 | 30.1 Ų | 30.1 | 29% | 0.286 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.6 | -32.3 | 178.7 | -20.6 | 34.6 | 0 | 0 | 0 | 113.6 | D211 T216 K217 I230 | D211-P213 WeakPolarHBondContact OD1-CD 3.44Å; P213-T216 PolarHBondContact O-OG1 2.92Å; P213-K217 WeakPolarHBondContact O-CG 3.47Å; P213-K217 PolarHBondContact O-N 3.2Å; P213-I230 HydrophobicContact CG-CG2 4.29Å |
| 214 | L | 79.9 | Confident | 80.2 | Confident | 21 Ų | 21 | 34.5 Ų | 34.5 | 11% | 0.11 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -73.7 | -41.2 | 178.3 | -80.3 | 157.7 | 0 | 0 | 0 | 111.5 | V205 D211 L212 | V205-L214 HydrophobicContact CG1-CB 4.09Å; D211-L214 HydrophobicContact CB-CB 4.37Å; D211-L214 HydrophobicContact CB-CD1 3.91Å; D211-L214 PolarHBondContact O-N 3.48Å; L212-L214 VanDerWaalsContact C-N 3.3Å; L212-L214 PolarHBondContact O-N 2.89Å |
| 215 | V | 83.9 | Confident | 79.8 | Confident | 0 Ų | 0 | 34.8 Ų | 34.8 | 0% | 0 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -68.9 | -43.5 | 178.3 | 171.1 | 0 | 0 | 0 | 0 | 110.8 | F43 F129 I132 F199 V205 C210 D211 L212 K217 L218 | F43-V215 HydrophobicContact CE1-CG1 4.39Å; F43-V215 HydrophobicContact CZ-CG1 4.05Å; F129-V215 HydrophobicContact CE2-CG1 4.28Å; F129-V215 HydrophobicContact CZ-CG1 3.9Å; I132-V215 HydrophobicContact CD1-CB 4.39Å; I132-V215 HydrophobicContact CD1-CG2 4.16Å; F199-V215 HydrophobicContact CE1-CG1 4.11Å; F199-V215 WeakPolarHBondContact CE1-O 3.27Å; F199-V215 HydrophobicContact CZ-CG1 4.12Å; V205-V215 HydrophobicContact CG1-CG2 4.45Å; V205-V215 HydrophobicContact CG2-CG2 4Å; C210-V215 HydrophobicContact CB-CG2 4.44Å; D211-V215 WeakPolarHBondContact O-CB 3.27Å; D211-V215 VanDerWaalsContact O-CG2 3.31Å; D211-V215 WeakPolarHBondContact O-CG2 3.43Å; D211-V215 PolarHBondContact O-N 2.66Å; L212-V215 PolarHBondContact O-N 2.77Å; V215-K217 VanDerWaalsContact C-N 3.27Å; V215-K217 PolarHBondContact O-N 2.91Å; V215-L218 WeakPolarHBondContact O-CB 3.17Å; V215-L218 PolarHBondContact O-N 2.9Å |
| 216 | T | 81.3 | Confident | 79.5 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.6 | -29.4 | -179.2 | 53.4 | 0 | 0 | 0 | 0 | 113.3 | A194 L197 L212 P213 L218 A219 T223 V226 I230 | A194-T216 HydrophobicContact CB-CG2 3.77Å; L197-T216 HydrophobicContact CD1-CG2 3.87Å; L212-T216 HydrophobicContact CD1-CG2 4.14Å; L212-T216 WeakPolarHBondContact O-CG2 3.4Å; L212-T216 PolarHBondContact O-N 3.33Å; L212-T216 PolarHBondContact O-OG1 2.95Å; L212-T216 VanDerWaalsContact O-OG1 3.1Å; P213-T216 PolarHBondContact O-OG1 2.92Å; T216-L218 PolarHBondContact O-N 2.72Å; T216-L218 VanDerWaalsContact O-N 3.14Å; T216-A219 WeakPolarHBondContact O-CB 3.31Å; T216-A219 PolarHBondContact O-N 2.9Å; T216-A219 VanDerWaalsContact O-N 3.1Å; T216-T223 VanDerWaalsContact O-CG2 3.24Å; T216-T223 WeakPolarHBondContact O-CG2 3.08Å; T216-V226 HydrophobicContact CG2-CG1 4.15Å; T216-I230 HydrophobicContact CG2-CD1 3.91Å |
| 217 | K | 81.6 | Confident | 79.4 | Confident | 122 Ų | 122 | 36.5 Ų | 36.5 | 53% | 0.53 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.5 | -17.2 | 172.5 | -78.1 | 175.6 | -179.3 | 177.7 | 0 | 114.3 | P213 V215 A219 | P213-K217 WeakPolarHBondContact O-CG 3.47Å; P213-K217 PolarHBondContact O-N 3.2Å; V215-K217 VanDerWaalsContact C-N 3.27Å; V215-K217 PolarHBondContact O-N 2.91Å; K217-A219 VanDerWaalsContact C-N 3.34Å |
| 218 | L | 82.6 | Confident | 79.4 | Confident | 19 Ų | 19 | 40 Ų | 40 | 10% | 0.099 | 20% | 0.203 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | -2.5 | 177.8 | -57.8 | 175 | 0 | 0 | 0 | 113.3 | F43 F199 P202 V204 V205 V215 T216 | F43-L218 HydrophobicContact CD1-CD1 3.97Å; F43-L218 HydrophobicContact CE1-CD1 3.92Å; F199-L218 HydrophobicContact CD1-CB 4.32Å; F199-L218 HydrophobicContact CE1-CB 4.5Å; P202-L218 HydrophobicContact CG-CD2 3.95Å; V204-L218 WeakPolarHBondContact O-CD2 3.35Å; V205-L218 HydrophobicContact CG2-CD1 3.62Å; V215-L218 WeakPolarHBondContact O-CB 3.17Å; V215-L218 PolarHBondContact O-N 2.9Å; T216-L218 PolarHBondContact O-N 2.72Å; T216-L218 VanDerWaalsContact O-N 3.14Å |
| 219 | A | 85.1 | Confident | 79.7 | Confident | 15 Ų | 15 | 40.5 Ų | 40.5 | 12% | 0.124 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -72 | 156.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L197 P198 F199 T216 K217 T223 | L197-A219 HydrophobicContact CB-CB 3.89Å; L197-A219 HydrophobicContact CD1-CB 4.04Å; L197-A219 HydrophobicContact CD2-CB 4.44Å; L197-A219 HydrophobicContact CG-CB 4.36Å; P198-A219 WeakPolarHBondContact O-CA 2.99Å; F199-A219 HydrophobicContact CD1-CB 4.27Å; F199-A219 HydrophobicContact CE1-CB 4.03Å; T216-A219 WeakPolarHBondContact O-CB 3.31Å; T216-A219 PolarHBondContact O-N 2.9Å; T216-A219 VanDerWaalsContact O-N 3.1Å; K217-A219 VanDerWaalsContact C-N 3.34Å; A219-T223 HydrophobicContact CB-CG2 3.65Å |
| 220 | C | 82.8 | Confident | 79.8 | Confident | 42 Ų | 42 | 40 Ų | 40 | 28% | 0.284 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -90.6 | -2.8 | -172.2 | -61.8 | 0 | 0 | 0 | 0 | 114.8 | P198 C200 | P198-C220 PolarHBondContact O-N 2.93Å; C200-C220 WeakPolarHBondContact CA-SG 3.28Å; C200-C220 HydrophobicContact CB-CB 4.05Å; C200-C220 WeakPolarHBondContact CB-SG 3.35Å; C200-C220 PolarHBondContact N-SG 3.31Å; C200-C220 WeakPolarHBondContact SG-CB 3.22Å; C200-C220 CovalentContact SG-SG 1.99Å; C200-C220 PolarHBondContact SG-SG 2.85Å |
| 221 | V | 81.9 | Confident | 79.5 | Confident | 21 Ų | 21 | 42.6 Ų | 42.6 | 13% | 0.127 | 22% | 0.22 | C | C | . | . | S | Bend | trans | -113.5 | 164.4 | 177.5 | -64.1 | 0 | 0 | 0 | 0 | 109.3 | E30 L34 L197 P198 T223 | E30-V221 HydrophobicContact CB-CG1 4.13Å; L34-V221 HydrophobicContact CD1-CG1 3.58Å; L197-V221 HydrophobicContact CD2-CG2 3.9Å; P198-V221 HydrophobicContact CG-CB 4.31Å; P198-V221 HydrophobicContact CG-CG1 3.59Å; P198-V221 HydrophobicContact CG-CG2 3.79Å; V221-T223 PolarHBondContact O-N 2.97Å; V221-T223 VanDerWaalsContact O-N 3.12Å |
| 222 | D | 78.7 | Confident | 79.4 | Confident | 119 Ų | 119 | 42 Ų | 42 | 64% | 0.636 | 22% | 0.222 | S | C | * | . | trans | -62.5 | 118.3 | 175 | -175.7 | 11.1 | 0 | 0 | 0 | 110.1 | Y224 | D222-Y224 VanDerWaalsContact OD1-CB 3.25Å; D222-Y224 WeakPolarHBondContact OD1-CB 3.39Å; D222-Y224 PolarHBondContact OD1-N 3.3Å | ||
| 223 | T | 79.8 | Confident | 79.4 | Confident | 10 Ų | 10 | 42.2 Ų | 42.2 | 6% | 0.061 | 22% | 0.223 | C | C | . | . | trans | -97.2 | 8.7 | 179.9 | 56.4 | 0 | 0 | 0 | 0 | 113.3 | L197 T216 A219 V221 L225 V226 Q227 | L197-T223 HydrophobicContact CD1-CG2 3.81Å; L197-T223 HydrophobicContact CD2-CG2 4.14Å; T216-T223 VanDerWaalsContact O-CG2 3.24Å; T216-T223 WeakPolarHBondContact O-CG2 3.08Å; A219-T223 HydrophobicContact CB-CG2 3.65Å; V221-T223 PolarHBondContact O-N 2.97Å; V221-T223 VanDerWaalsContact O-N 3.12Å; T223-L225 VanDerWaalsContact C-N 3.32Å; T223-L225 PolarHBondContact O-N 3.45Å; T223-V226 PolarHBondContact O-N 3.28Å; T223-Q227 WeakPolarHBondContact O-CB 3.33Å; T223-Q227 WeakPolarHBondContact O-CG 3.34Å; T223-Q227 PolarHBondContact O-N 3.3Å; T223-Q227 PolarHBondContact OG1-NE2 2.99Å | ||
| 224 | Y | 78.1 | Confident | 79.5 | Confident | 146 Ų | 146 | 40.2 Ų | 40.2 | 57% | 0.573 | 21% | 0.21 | S | C | * | . | H | α-helix | trans | -48.9 | -49.4 | -178.2 | -178.8 | -107.4 | 0 | 0 | 0 | 113.1 | D222 Q227 I228 | D222-Y224 VanDerWaalsContact OD1-CB 3.25Å; D222-Y224 WeakPolarHBondContact OD1-CB 3.39Å; D222-Y224 PolarHBondContact OD1-N 3.3Å; Y224-Q227 PolarHBondContact O-N 3.45Å; Y224-I228 HydrophobicContact CD1-CD1 3.83Å; Y224-I228 HydrophobicContact CD2-CD1 4.49Å; Y224-I228 HydrophobicContact CE1-CD1 3.3Å; Y224-I228 HydrophobicContact CE1-CG1 4.48Å; Y224-I228 HydrophobicContact CE2-CD1 4.04Å; Y224-I228 HydrophobicContact CG-CD1 4.4Å; Y224-I228 VanDerWaalsContact CZ-CD1 3.43Å; Y224-I228 WeakPolarHBondContact O-CG1 3.17Å; Y224-I228 PolarHBondContact O-N 2.85Å |
| 225 | L | 76 | Confident | 79.3 | Confident | 66 Ų | 66 | 39.9 Ų | 39.9 | 35% | 0.346 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.6 | -41.6 | 178.9 | -68.3 | 174.1 | 0 | 0 | 0 | 112.6 | Y22 T223 I228 V229 | Y22-L225 HydrophobicContact CD1-CD1 4.36Å; Y22-L225 HydrophobicContact CE1-CD1 3.72Å; Y22-L225 HydrophobicContact CE1-CD2 4.24Å; T223-L225 VanDerWaalsContact C-N 3.32Å; T223-L225 PolarHBondContact O-N 3.45Å; L225-I228 PolarHBondContact O-N 3.08Å; L225-V229 WeakPolarHBondContact O-CG2 3.38Å; L225-V229 PolarHBondContact O-N 3.32Å |
| 226 | V | 77.6 | Confident | 79 | Confident | 15 Ų | 15 | 44.2 Ų | 44.2 | 9% | 0.091 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.3 | -42.9 | 177.4 | 177.4 | 0 | 0 | 0 | 0 | 110.4 | L23 L197 T216 T223 V229 I230 | L23-V226 HydrophobicContact CD2-CG2 3.77Å; L197-V226 HydrophobicContact CD1-CG1 4.26Å; L197-V226 HydrophobicContact CD1-CG2 4.49Å; L197-V226 HydrophobicContact CD2-CG2 4.26Å; T216-V226 HydrophobicContact CG2-CG1 4.15Å; T223-V226 PolarHBondContact O-N 3.28Å; V226-V229 PolarHBondContact O-N 2.98Å; V226-I230 HydrophobicContact CG1-CD1 3.75Å; V226-I230 HydrophobicContact CG1-CG1 4.43Å; V226-I230 WeakPolarHBondContact O-CD1 3.39Å; V226-I230 VanDerWaalsContact O-CG1 3.24Å; V226-I230 WeakPolarHBondContact O-CG1 3.39Å; V226-I230 PolarHBondContact O-N 3.01Å |
| 227 | Q | 75.7 | Confident | 78.9 | Confident | 56 Ų | 56 | 44.4 Ų | 44.4 | 26% | 0.262 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.4 | -41.5 | 176.5 | -70.6 | -176.6 | 27 | 0 | 0 | 111.7 | T223 Y224 V229 I230 V231 | T223-Q227 WeakPolarHBondContact O-CB 3.33Å; T223-Q227 WeakPolarHBondContact O-CG 3.34Å; T223-Q227 PolarHBondContact O-N 3.3Å; T223-Q227 PolarHBondContact OG1-NE2 2.99Å; Y224-Q227 PolarHBondContact O-N 3.45Å; Q227-V229 PolarHBondContact O-N 3.18Å; Q227-I230 PolarHBondContact O-N 3.2Å; Q227-V231 WeakPolarHBondContact O-CB 3.38Å; Q227-V231 VanDerWaalsContact O-CG2 3.3Å; Q227-V231 WeakPolarHBondContact O-CG2 3.46Å; Q227-V231 PolarHBondContact O-N 3.33Å |
| 228 | I | 76.7 | Confident | 78.6 | Confident | 76 Ų | 76 | 38.8 Ų | 38.8 | 39% | 0.39 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.7 | -46.2 | 173.1 | -73.9 | 172.6 | 0 | 0 | 0 | 110.8 | Y224 L225 I230 V231 A232 | Y224-I228 HydrophobicContact CD1-CD1 3.83Å; Y224-I228 HydrophobicContact CD2-CD1 4.49Å; Y224-I228 HydrophobicContact CE1-CD1 3.3Å; Y224-I228 HydrophobicContact CE1-CG1 4.48Å; Y224-I228 HydrophobicContact CE2-CD1 4.04Å; Y224-I228 HydrophobicContact CG-CD1 4.4Å; Y224-I228 VanDerWaalsContact CZ-CD1 3.43Å; Y224-I228 WeakPolarHBondContact O-CG1 3.17Å; Y224-I228 PolarHBondContact O-N 2.85Å; L225-I228 PolarHBondContact O-N 3.08Å; I228-I230 VanDerWaalsContact C-N 3.34Å; I228-I230 PolarHBondContact O-N 3.33Å; I228-V231 PolarHBondContact O-N 3.29Å; I228-A232 WeakPolarHBondContact O-CB 3.47Å; I228-A232 PolarHBondContact O-N 3.48Å |
| 229 | V | 77.9 | Confident | 78.3 | Confident | 19 Ų | 19 | 42.2 Ų | 42.2 | 12% | 0.115 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.2 | -44 | 178.9 | 170.4 | 0 | 0 | 0 | 0 | 111 | L23 L225 V226 Q227 N233 | L23-V229 HydrophobicContact CD1-CG2 3.78Å; L23-V229 HydrophobicContact CD2-CG2 4.28Å; L225-V229 WeakPolarHBondContact O-CG2 3.38Å; L225-V229 PolarHBondContact O-N 3.32Å; V226-V229 PolarHBondContact O-N 2.98Å; Q227-V229 PolarHBondContact O-N 3.18Å; V229-N233 WeakPolarHBondContact O-CB 3.47Å; V229-N233 PolarHBondContact O-N 3.35Å |
| 230 | I | 77.6 | Confident | 78 | Confident | 4 Ų | 4 | 42.6 Ų | 42.6 | 2% | 0.021 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.6 | -51.3 | 177.3 | -67.5 | 159.8 | 0 | 0 | 0 | 110.7 | Q190 L212 P213 T216 V226 Q227 I228 A232 N233 S234 | Q190-I230 HydrophobicContact CB-CG1 4.28Å; L212-I230 HydrophobicContact CD2-CD1 3.9Å; L212-I230 HydrophobicContact CD2-CG1 3.79Å; L212-I230 HydrophobicContact CD2-CG2 4.08Å; L212-I230 HydrophobicContact CG-CD1 3.73Å; L212-I230 HydrophobicContact CG-CG1 4.2Å; L212-I230 HydrophobicContact CG-CG2 4.45Å; P213-I230 HydrophobicContact CG-CG2 4.29Å; T216-I230 HydrophobicContact CG2-CD1 3.91Å; V226-I230 HydrophobicContact CG1-CD1 3.75Å; V226-I230 HydrophobicContact CG1-CG1 4.43Å; V226-I230 WeakPolarHBondContact O-CD1 3.39Å; V226-I230 VanDerWaalsContact O-CG1 3.24Å; V226-I230 WeakPolarHBondContact O-CG1 3.39Å; V226-I230 PolarHBondContact O-N 3.01Å; Q227-I230 PolarHBondContact O-N 3.2Å; I228-I230 VanDerWaalsContact C-N 3.34Å; I228-I230 PolarHBondContact O-N 3.33Å; I230-A232 PolarHBondContact O-N 3.44Å; I230-N233 PolarHBondContact O-N 3.35Å; I230-S234 WeakPolarHBondContact O-CB 3.24Å; I230-S234 PolarHBondContact O-N 3Å; I230-S234 PolarHBondContact O-OG 2.97Å |
| 231 | V | 75.1 | Confident | 77.8 | Confident | 54 Ų | 54 | 40.6 Ų | 40.6 | 33% | 0.327 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -64 | -41.6 | -178.9 | 168.8 | 0 | 0 | 0 | 0 | 111.1 | Q227 I228 G235 Y289 | Q227-V231 WeakPolarHBondContact O-CB 3.38Å; Q227-V231 VanDerWaalsContact O-CG2 3.3Å; Q227-V231 WeakPolarHBondContact O-CG2 3.46Å; Q227-V231 PolarHBondContact O-N 3.33Å; I228-V231 PolarHBondContact O-N 3.29Å; V231-G235 VanDerWaalsContact O-CA 3.26Å; V231-G235 WeakPolarHBondContact O-CA 3.31Å; V231-G235 PolarHBondContact O-N 2.94Å; V231-Y289 HydrophobicContact CG1-CD1 4.25Å |
| 232 | A | 78.1 | Confident | 77.5 | Confident | 33 Ų | 33 | 41.7 Ų | 41.7 | 27% | 0.273 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -67.6 | -48.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | I228 I230 G235 I236 | I228-A232 WeakPolarHBondContact O-CB 3.47Å; I228-A232 PolarHBondContact O-N 3.48Å; I230-A232 PolarHBondContact O-N 3.44Å; A232-G235 PolarHBondContact O-N 3.46Å; A232-I236 VanDerWaalsContact O-CB 3.24Å; A232-I236 WeakPolarHBondContact O-CB 3.33Å; A232-I236 WeakPolarHBondContact O-CD1 3.29Å; A232-I236 WeakPolarHBondContact O-CG1 3.47Å; A232-I236 PolarHBondContact O-N 3.46Å |
| 233 | N | 80.3 | Confident | 77.5 | Confident | 4 Ų | 4 | 39.8 Ų | 39.8 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59 | -52 | 179.6 | 178.7 | 45.6 | 0 | 0 | 0 | 111.3 | L15 H186 L189 Q190 V229 I230 I237 | L15-N233 HydrophobicContact CD2-CB 4.3Å; H186-N233 PolarHBondContact CE1-ND2 3.02Å; H186-N233 VanDerWaalsContact CE1-ND2 3.31Å; H186-N233 PolarHBondContact ND1-ND2 3.39Å; H186-N233 PolarHBondContact ND1-OD1 3.17Å; H186-N233 PolarHBondContact O-ND2 2.85Å; L189-N233 VanDerWaalsContact CD1-OD1 3.3Å; L189-N233 WeakPolarHBondContact CD1-OD1 3.22Å; Q190-N233 PolarHBondContact OE1-ND2 3.11Å; V229-N233 WeakPolarHBondContact O-CB 3.47Å; V229-N233 PolarHBondContact O-N 3.35Å; I230-N233 PolarHBondContact O-N 3.35Å; N233-I237 WeakPolarHBondContact O-CG2 3.49Å; N233-I237 PolarHBondContact O-N 3.16Å |
| 234 | S | 78.3 | Confident | 77.4 | Confident | 2 Ų | 2 | 40.8 Ų | 40.8 | 1% | 0.014 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -72.3 | -33.6 | 179.9 | -55.2 | 0 | 0 | 0 | 0 | 113.2 | H186 Q190 I230 I237 S238 Y289 | H186-S234 PolarHBondContact CE1-OG 3.29Å; H186-S234 VanDerWaalsContact CE1-OG 3.31Å; Q190-S234 PolarHBondContact OE1-OG 2.98Å; I230-S234 WeakPolarHBondContact O-CB 3.24Å; I230-S234 PolarHBondContact O-N 3Å; I230-S234 PolarHBondContact O-OG 2.97Å; S234-I237 WeakPolarHBondContact O-CG2 3.15Å; S234-S238 VanDerWaalsContact O-CB 3.25Å; S234-S238 WeakPolarHBondContact O-CB 3.29Å; S234-S238 PolarHBondContact O-N 3.3Å; S234-S238 VanDerWaalsContact O-N 3.1Å; S234-Y289 VanDerWaalsContact CB-CE1 3.5Å; S234-Y289 WeakPolarHBondContact CB-OH 3.19Å |
| 235 | G | 75.9 | Confident | 77.3 | Confident | 14 Ų | 14 | 33.9 Ų | 33.9 | 14% | 0.144 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.4 | -44.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V231 A232 S238 L239 | V231-G235 VanDerWaalsContact O-CA 3.26Å; V231-G235 WeakPolarHBondContact O-CA 3.31Å; V231-G235 PolarHBondContact O-N 2.94Å; A232-G235 PolarHBondContact O-N 3.46Å; G235-S238 PolarHBondContact O-N 2.9Å; G235-L239 WeakPolarHBondContact O-CB 3.44Å; G235-L239 PolarHBondContact O-N 3.4Å |
| 236 | I | 78.6 | Confident | 77.4 | Confident | 91 Ų | 91 | 34.6 Ų | 34.6 | 47% | 0.467 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -63.2 | -48.5 | 179.1 | -71.7 | 163.9 | 0 | 0 | 0 | 110.8 | L15 A232 S238 S240 | L15-I236 HydrophobicContact CD2-CD1 4.37Å; A232-I236 VanDerWaalsContact O-CB 3.24Å; A232-I236 WeakPolarHBondContact O-CB 3.33Å; A232-I236 WeakPolarHBondContact O-CD1 3.29Å; A232-I236 WeakPolarHBondContact O-CG1 3.47Å; A232-I236 PolarHBondContact O-N 3.46Å; I236-S238 PolarHBondContact O-N 3.45Å; I236-S240 WeakPolarHBondContact O-CB 3.5Å; I236-S240 PolarHBondContact O-N 3.48Å; I236-S240 PolarHBondContact O-OG 3.33Å |
| 237 | I | 78.4 | Confident | 77.4 | Confident | 5 Ų | 5 | 38.3 Ų | 38.3 | 3% | 0.026 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.9 | -44.4 | 179.4 | -169.8 | 170.6 | 0 | 0 | 0 | 111.1 | M143 H186 N233 S234 S240 C241 | M143-I237 HydrophobicContact CE-CD1 4.07Å; M143-I237 HydrophobicContact CE-CG1 4.14Å; M143-I237 HydrophobicContact CE-CG2 3.88Å; H186-I237 HydrophobicContact CB-CD1 4.13Å; N233-I237 WeakPolarHBondContact O-CG2 3.49Å; N233-I237 PolarHBondContact O-N 3.16Å; S234-I237 WeakPolarHBondContact O-CG2 3.15Å; I237-S240 PolarHBondContact O-OG 3.22Å; I237-C241 WeakPolarHBondContact O-CB 3.49Å; I237-C241 PolarHBondContact O-N 3.32Å; I237-C241 VanDerWaalsContact O-N 3.12Å; I237-C241 PolarHBondContact O-SG 3.49Å |
| 238 | S | 75.5 | Confident | 77.6 | Confident | 3 Ų | 3 | 36.4 Ų | 36.4 | 2% | 0.021 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -64.8 | -51.3 | 178.9 | 172.5 | 0 | 0 | 0 | 0 | 112.1 | S234 G235 I236 S240 C241 F242 F282 C285 | S234-S238 VanDerWaalsContact O-CB 3.25Å; S234-S238 WeakPolarHBondContact O-CB 3.29Å; S234-S238 PolarHBondContact O-N 3.3Å; S234-S238 VanDerWaalsContact O-N 3.1Å; G235-S238 PolarHBondContact O-N 2.9Å; I236-S238 PolarHBondContact O-N 3.45Å; S238-S240 PolarHBondContact O-N 2.96Å; S238-C241 PolarHBondContact O-N 3.12Å; S238-F242 WeakPolarHBondContact O-CB 3.44Å; S238-F242 PolarHBondContact O-N 3.4Å; S238-F282 WeakPolarHBondContact O-CE1 3.42Å; S238-C285 VanDerWaalsContact OG-CB 3.32Å; S238-C285 WeakPolarHBondContact OG-CB 3.45Å |
| 239 | L | 75.3 | Confident | 77.4 | Confident | 91 Ų | 91 | 33.2 Ų | 33.2 | 48% | 0.476 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -64.3 | -42.3 | -177.1 | -178.1 | 62.6 | 0 | 0 | 0 | 111.6 | G235 F242 I243 | G235-L239 WeakPolarHBondContact O-CB 3.44Å; G235-L239 PolarHBondContact O-N 3.4Å; L239-F242 PolarHBondContact O-N 3.47Å; L239-I243 HydrophobicContact CD1-CD1 4.08Å; L239-I243 HydrophobicContact CD1-CG1 4.28Å; L239-I243 HydrophobicContact CG-CD1 3.9Å; L239-I243 HydrophobicContact CG-CG1 4.48Å; L239-I243 VanDerWaalsContact O-CG1 3.31Å; L239-I243 WeakPolarHBondContact O-CG1 3.36Å; L239-I243 PolarHBondContact O-N 3.38Å |
| 240 | S | 79.1 | Confident | 77.2 | Confident | 23 Ų | 23 | 35.1 Ų | 35.1 | 16% | 0.161 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -63.7 | -42.8 | 177.9 | 64.4 | 0 | 0 | 0 | 0 | 112 | I8 I236 I237 S238 I244 | I8-S240 WeakPolarHBondContact CD1-OG 3.29Å; I236-S240 WeakPolarHBondContact O-CB 3.5Å; I236-S240 PolarHBondContact O-N 3.48Å; I236-S240 PolarHBondContact O-OG 3.33Å; I237-S240 PolarHBondContact O-OG 3.22Å; S238-S240 PolarHBondContact O-N 2.96Å; S240-I244 PolarHBondContact O-N 3.03Å |
| 241 | C | 79.8 | Confident | 77.2 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.2 | -46.3 | 173.9 | -70.7 | 0 | 0 | 0 | 0 | 111.1 | V147 I237 S238 I244 L245 F282 | V147-C241 HydrophobicContact CG2-CB 3.74Å; I237-C241 WeakPolarHBondContact O-CB 3.49Å; I237-C241 PolarHBondContact O-N 3.32Å; I237-C241 VanDerWaalsContact O-N 3.12Å; I237-C241 PolarHBondContact O-SG 3.49Å; S238-C241 PolarHBondContact O-N 3.12Å; C241-I244 PolarHBondContact O-N 3.11Å; C241-L245 WeakPolarHBondContact O-CD1 3.32Å; C241-L245 VanDerWaalsContact O-CG 3.23Å; C241-L245 WeakPolarHBondContact O-CG 3.38Å; C241-L245 PolarHBondContact O-N 2.9Å; C241-F282 HydrophobicContact CB-CE1 3.54Å; C241-F282 HydrophobicContact CB-CZ 3.64Å |
| 242 | F | 76.1 | Confident | 77.3 | Confident | 44 Ų | 44 | 35.8 Ų | 35.8 | 19% | 0.193 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.1 | -48.1 | 179.1 | 179.7 | -110.9 | 0 | 0 | 0 | 113 | S238 L239 I244 L245 L246 V278 F282 I286 | S238-F242 WeakPolarHBondContact O-CB 3.44Å; S238-F242 PolarHBondContact O-N 3.4Å; L239-F242 PolarHBondContact O-N 3.47Å; F242-I244 VanDerWaalsContact C-N 3.27Å; F242-I244 PolarHBondContact O-N 2.82Å; F242-L245 PolarHBondContact O-N 2.93Å; F242-L246 HydrophobicContact CD1-CD1 3.84Å; F242-L246 HydrophobicContact CD1-CG 4.35Å; F242-L246 HydrophobicContact CE1-CD1 3.28Å; F242-L246 HydrophobicContact CE1-CG 4Å; F242-L246 HydrophobicContact CE2-CD1 4.31Å; F242-L246 HydrophobicContact CE2-CD2 4.36Å; F242-L246 HydrophobicContact CE2-CG 4.19Å; F242-L246 HydrophobicContact CZ-CD1 3.56Å; F242-L246 HydrophobicContact CZ-CD2 4.14Å; F242-L246 HydrophobicContact CZ-CG 3.92Å; F242-L246 WeakPolarHBondContact O-CG 3.39Å; F242-L246 PolarHBondContact O-N 3.5Å; F242-V278 HydrophobicContact CD2-CG1 4.31Å; F242-V278 HydrophobicContact CE2-CG1 4.46Å; F242-F282 HydrophobicContact CB-CB 4.31Å; F242-F282 HydrophobicContact CB-CD1 3.86Å; F242-F282 HydrophobicContact CB-CE1 4.47Å; F242-F282 HydrophobicContact CB-CG 4.13Å; F242-F282 HydrophobicContact CD2-CB 3.5Å; F242-F282 VanDerWaalsContact CD2-CB 3.5Å; F242-F282 AromaticContact CD2-CG 3.96Å; F242-F282 HydrophobicContact CD2-CG 3.96Å; F242-F282 HydrophobicContact CE2-CB 4.16Å; F242-F282 HydrophobicContact CG-CB 4.24Å; F242-I286 HydrophobicContact CB-CD1 4.19Å; F242-I286 HydrophobicContact CD1-CD1 3.47Å; F242-I286 VanDerWaalsContact CD1-CD1 3.47Å; F242-I286 HydrophobicContact CD2-CD1 3.73Å; F242-I286 HydrophobicContact CE1-CD1 3.57Å; F242-I286 HydrophobicContact CE2-CD1 3.85Å; F242-I286 HydrophobicContact CG-CD1 3.53Å; F242-I286 HydrophobicContact CZ-CD1 3.76Å |
| 243 | I | 77.2 | Confident | 76.9 | Confident | 79 Ų | 79 | 38.3 Ų | 38.3 | 41% | 0.405 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -58 | -42.7 | 178.8 | -72.2 | 170 | 0 | 0 | 0 | 110.6 | L239 L246 I247 | L239-I243 HydrophobicContact CD1-CD1 4.08Å; L239-I243 HydrophobicContact CD1-CG1 4.28Å; L239-I243 HydrophobicContact CG-CD1 3.9Å; L239-I243 HydrophobicContact CG-CG1 4.48Å; L239-I243 VanDerWaalsContact O-CG1 3.31Å; L239-I243 WeakPolarHBondContact O-CG1 3.36Å; L239-I243 PolarHBondContact O-N 3.38Å; I243-L246 WeakPolarHBondContact O-CB 3.49Å; I243-L246 PolarHBondContact O-N 3.29Å; I243-I247 HydrophobicContact CG2-CD1 3.69Å; I243-I247 HydrophobicContact CG2-CG1 4.39Å; I243-I247 VanDerWaalsContact O-CG1 3.31Å; I243-I247 WeakPolarHBondContact O-CG1 3.38Å; I243-I247 PolarHBondContact O-N 2.89Å |
| 244 | I | 78.4 | Confident | 76.8 | Confident | 32 Ų | 32 | 43 Ų | 43 | 16% | 0.164 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -70.4 | -37.5 | -179.6 | -79.6 | 162.1 | 0 | 0 | 0 | 112.7 | Y4 V147 S240 C241 F242 L246 I247 S248 | Y4-I244 HydrophobicContact CD1-CD1 3.77Å; Y4-I244 HydrophobicContact CD2-CD1 3.2Å; Y4-I244 HydrophobicContact CE1-CD1 3.49Å; Y4-I244 VanDerWaalsContact CE1-CD1 3.49Å; Y4-I244 HydrophobicContact CE2-CD1 2.9Å; Y4-I244 HydrophobicContact CE2-CG1 4.32Å; Y4-I244 HydrophobicContact CG-CD1 3.59Å; Y4-I244 WeakPolarHBondContact OH-CD1 3.29Å; V147-I244 HydrophobicContact CG1-CG2 3.69Å; S240-I244 PolarHBondContact O-N 3.03Å; C241-I244 PolarHBondContact O-N 3.11Å; F242-I244 VanDerWaalsContact C-N 3.27Å; F242-I244 PolarHBondContact O-N 2.82Å; I244-L246 VanDerWaalsContact C-N 3.33Å; I244-I247 PolarHBondContact O-N 3.45Å; I244-S248 WeakPolarHBondContact O-CB 3.24Å; I244-S248 PolarHBondContact O-N 3.22Å; I244-S248 PolarHBondContact O-OG 2.97Å |
| 245 | L | 76.5 | Confident | 76.6 | Confident | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -60.2 | -48.3 | 172.7 | -68.5 | 165.3 | 0 | 0 | 0 | 109.5 | V147 A150 C241 F242 I247 S248 Y249 V278 F282 | V147-L245 HydrophobicContact CG2-CD1 4.42Å; V147-L245 HydrophobicContact CG2-CD2 4.42Å; V147-L245 HydrophobicContact CG2-CG 4.22Å; A150-L245 HydrophobicContact CB-CD2 3.37Å; C241-L245 WeakPolarHBondContact O-CD1 3.32Å; C241-L245 VanDerWaalsContact O-CG 3.23Å; C241-L245 WeakPolarHBondContact O-CG 3.38Å; C241-L245 PolarHBondContact O-N 2.9Å; F242-L245 PolarHBondContact O-N 2.93Å; L245-I247 PolarHBondContact O-N 2.85Å; L245-S248 PolarHBondContact O-N 3.46Å; L245-Y249 HydrophobicContact CB-CD2 4.28Å; L245-Y249 HydrophobicContact CB-CE2 4.1Å; L245-Y249 HydrophobicContact CD2-CE2 3.92Å; L245-Y249 WeakPolarHBondContact O-CB 3.31Å; L245-Y249 WeakPolarHBondContact O-CD2 3.02Å; L245-Y249 PolarHBondContact O-N 2.92Å; L245-V278 HydrophobicContact CB-CG1 3.87Å; L245-V278 HydrophobicContact CB-CG2 4.27Å; L245-V278 HydrophobicContact CD1-CG1 3.93Å; L245-V278 HydrophobicContact CD1-CG2 4.04Å; L245-V278 HydrophobicContact CD2-CG2 4.18Å; L245-V278 HydrophobicContact CG-CG1 4.47Å; L245-V278 HydrophobicContact CG-CG2 4.39Å; L245-F282 HydrophobicContact CD1-CD2 3.81Å; L245-F282 HydrophobicContact CD1-CE2 3.16Å; L245-F282 HydrophobicContact CD1-CZ 3.63Å |
| 246 | L | 76.8 | Confident | 76.4 | Confident | 82 Ų | 82 | 44.4 Ų | 44.4 | 43% | 0.429 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -57.7 | -48.4 | 176.7 | -75 | -177.8 | 0 | 0 | 0 | 112.9 | F242 I243 I244 S250 | F242-L246 HydrophobicContact CD1-CD1 3.84Å; F242-L246 HydrophobicContact CD1-CG 4.35Å; F242-L246 HydrophobicContact CE1-CD1 3.28Å; F242-L246 HydrophobicContact CE1-CG 4Å; F242-L246 HydrophobicContact CE2-CD1 4.31Å; F242-L246 HydrophobicContact CE2-CD2 4.36Å; F242-L246 HydrophobicContact CE2-CG 4.19Å; F242-L246 HydrophobicContact CZ-CD1 3.56Å; F242-L246 HydrophobicContact CZ-CD2 4.14Å; F242-L246 HydrophobicContact CZ-CG 3.92Å; F242-L246 WeakPolarHBondContact O-CG 3.39Å; F242-L246 PolarHBondContact O-N 3.5Å; I243-L246 WeakPolarHBondContact O-CB 3.49Å; I243-L246 PolarHBondContact O-N 3.29Å; I244-L246 VanDerWaalsContact C-N 3.33Å; L246-S250 VanDerWaalsContact O-CB 3.26Å; L246-S250 WeakPolarHBondContact O-CB 3.18Å; L246-S250 PolarHBondContact O-N 3.32Å; L246-S250 PolarHBondContact O-OG 3.02Å |
| 247 | I | 78.9 | Confident | 76 | Confident | 93 Ų | 93 | 48.1 Ų | 48.1 | 48% | 0.477 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.8 | -48.8 | 178.8 | -68.8 | 167.9 | 0 | 0 | 0 | 109.9 | I243 I244 L245 Y249 S250 L251 | I243-I247 HydrophobicContact CG2-CD1 3.69Å; I243-I247 HydrophobicContact CG2-CG1 4.39Å; I243-I247 VanDerWaalsContact O-CG1 3.31Å; I243-I247 WeakPolarHBondContact O-CG1 3.38Å; I243-I247 PolarHBondContact O-N 2.89Å; I244-I247 PolarHBondContact O-N 3.45Å; L245-I247 PolarHBondContact O-N 2.85Å; I247-Y249 PolarHBondContact O-N 3.17Å; I247-S250 PolarHBondContact O-N 2.92Å; I247-L251 HydrophobicContact CG2-CD1 4.02Å; I247-L251 HydrophobicContact CG2-CG 4.47Å; I247-L251 WeakPolarHBondContact O-CG 3.46Å; I247-L251 PolarHBondContact O-N 3.17Å |
| 248 | S | 78.8 | Confident | 75.6 | Confident | 15 Ų | 15 | 54.4 Ų | 54.4 | 11% | 0.105 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -59.4 | -47.4 | -178.4 | -58.9 | 0 | 0 | 0 | 0 | 111.2 | I244 L245 L251 I252 | I244-S248 WeakPolarHBondContact O-CB 3.24Å; I244-S248 PolarHBondContact O-N 3.22Å; I244-S248 PolarHBondContact O-OG 2.97Å; L245-S248 PolarHBondContact O-N 3.46Å; S248-L251 PolarHBondContact O-N 3.4Å; S248-I252 WeakPolarHBondContact O-CD1 3.13Å; S248-I252 WeakPolarHBondContact O-CG1 3.39Å; S248-I252 PolarHBondContact O-N 3.48Å |
| 249 | Y | 72.4 | Confident | 75.4 | Confident | 10 Ų | 10 | 58.6 Ų | 58.6 | 4% | 0.039 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -69.9 | -36 | 179.3 | -70.3 | -56.9 | 0 | 0 | 0 | 113.2 | A150 L245 I247 I252 L253 L271 H274 I275 V278 | A150-Y249 HydrophobicContact CB-CE2 4.24Å; L245-Y249 HydrophobicContact CB-CD2 4.28Å; L245-Y249 HydrophobicContact CB-CE2 4.1Å; L245-Y249 HydrophobicContact CD2-CE2 3.92Å; L245-Y249 WeakPolarHBondContact O-CB 3.31Å; L245-Y249 WeakPolarHBondContact O-CD2 3.02Å; L245-Y249 PolarHBondContact O-N 2.92Å; I247-Y249 PolarHBondContact O-N 3.17Å; Y249-I252 HydrophobicContact CD1-CD1 4.08Å; Y249-I252 HydrophobicContact CE1-CD1 4.42Å; Y249-I252 PolarHBondContact O-N 3.48Å; Y249-L253 WeakPolarHBondContact O-CB 3.38Å; Y249-L253 WeakPolarHBondContact O-CG 3.33Å; Y249-L253 PolarHBondContact O-N 3.34Å; Y249-L271 HydrophobicContact CD1-CD1 3.46Å; Y249-L271 VanDerWaalsContact CD1-CD1 3.46Å; Y249-L271 HydrophobicContact CD1-CG 4.19Å; Y249-L271 HydrophobicContact CE1-CD1 3.91Å; Y249-H274 HydrophobicContact CE1-CB 3.78Å; Y249-H274 VanDerWaalsContact OH-CB 3.28Å; Y249-H274 WeakPolarHBondContact OH-CB 3.25Å; Y249-H274 PolarHBondContact OH-ND1 2.88Å; Y249-I275 HydrophobicContact CD1-CG1 4.1Å; Y249-I275 HydrophobicContact CD2-CG1 4.18Å; Y249-I275 HydrophobicContact CG-CD1 4.43Å; Y249-I275 HydrophobicContact CG-CG1 3.9Å; Y249-V278 HydrophobicContact CD2-CG2 4.33Å; Y249-V278 HydrophobicContact CE2-CG2 3.53Å |
| 250 | S | 74.6 | Confident | 74.9 | Confident | 58 Ų | 58 | 57.7 Ų | 57.7 | 41% | 0.406 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 174.9 | -60.9 | 0 | 0 | 0 | 0 | 111.1 | L246 I247 I252 L253 I254 | L246-S250 VanDerWaalsContact O-CB 3.26Å; L246-S250 WeakPolarHBondContact O-CB 3.18Å; L246-S250 PolarHBondContact O-N 3.32Å; L246-S250 PolarHBondContact O-OG 3.02Å; I247-S250 PolarHBondContact O-N 2.92Å; S250-I252 PolarHBondContact O-N 3.34Å; S250-L253 PolarHBondContact O-N 2.84Å; S250-I254 WeakPolarHBondContact O-CD1 3.32Å; S250-I254 VanDerWaalsContact O-CG1 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.46Å; S250-I254 PolarHBondContact O-N 3.23Å |
| 251 | L | 78.1 | Confident | 74.1 | Confident | 73 Ų | 73 | 61.3 Ų | 61.3 | 38% | 0.382 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -64.4 | -39.3 | 176.2 | -67 | 175.8 | 0 | 0 | 0 | 112.3 | Y154 I247 S248 I254 T255 | Y154-L251 HydrophobicContact CD2-CB 4.29Å; Y154-L251 HydrophobicContact CE2-CB 3.96Å; Y154-L251 HydrophobicContact CE2-CD1 3.84Å; I247-L251 HydrophobicContact CG2-CD1 4.02Å; I247-L251 HydrophobicContact CG2-CG 4.47Å; I247-L251 WeakPolarHBondContact O-CG 3.46Å; I247-L251 PolarHBondContact O-N 3.17Å; S248-L251 PolarHBondContact O-N 3.4Å; L251-I254 PolarHBondContact O-N 2.99Å; L251-T255 WeakPolarHBondContact O-CB 3.14Å; L251-T255 PolarHBondContact O-N 3.44Å; L251-T255 PolarHBondContact O-OG1 2.99Å |
| 252 | I | 75.8 | Confident | 73 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -62.6 | -46.4 | 174.7 | -68.7 | 162.9 | 0 | 0 | 0 | 110.5 | R153 Y154 I157 S248 Y249 S250 I254 T255 I256 L271 | R153-I252 HydrophobicContact CB-CD1 4.29Å; Y154-I252 HydrophobicContact CD2-CG1 4.31Å; I157-I252 HydrophobicContact CD1-CG2 3.57Å; I157-I252 HydrophobicContact CG2-CG2 4.26Å; S248-I252 WeakPolarHBondContact O-CD1 3.13Å; S248-I252 WeakPolarHBondContact O-CG1 3.39Å; S248-I252 PolarHBondContact O-N 3.48Å; Y249-I252 HydrophobicContact CD1-CD1 4.08Å; Y249-I252 HydrophobicContact CE1-CD1 4.42Å; Y249-I252 PolarHBondContact O-N 3.48Å; S250-I252 PolarHBondContact O-N 3.34Å; I252-I254 PolarHBondContact O-N 3.47Å; I252-T255 PolarHBondContact O-N 3.31Å; I252-I256 HydrophobicContact CG2-CD1 3.51Å; I252-I256 HydrophobicContact CG2-CG1 4.2Å; I252-I256 WeakPolarHBondContact O-CB 3.09Å; I252-I256 VanDerWaalsContact O-CG1 3.24Å; I252-I256 WeakPolarHBondContact O-CG1 3.22Å; I252-I256 PolarHBondContact O-N 3.21Å; I252-L271 HydrophobicContact CB-CD1 4.08Å; I252-L271 HydrophobicContact CD1-CD1 4.23Å; I252-L271 HydrophobicContact CG2-CD1 3.39Å; I252-L271 HydrophobicContact CG2-CD2 4.14Å; I252-L271 HydrophobicContact CG2-CG 4.42Å |
| 253 | L | 71.1 | Confident | 72.2 | Confident | 86 Ų | 86 | 66.2 Ų | 66.2 | 45% | 0.45 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -58.8 | -46.8 | 177.3 | -78.4 | 172.3 | 0 | 0 | 0 | 112 | Y249 S250 T255 I256 K257 L271 | Y249-L253 WeakPolarHBondContact O-CB 3.38Å; Y249-L253 WeakPolarHBondContact O-CG 3.33Å; Y249-L253 PolarHBondContact O-N 3.34Å; S250-L253 PolarHBondContact O-N 2.84Å; L253-T255 VanDerWaalsContact C-N 3.3Å; L253-T255 PolarHBondContact O-N 3.36Å; L253-I256 PolarHBondContact O-N 3.46Å; L253-K257 PolarHBondContact O-N 2.86Å; L253-L271 HydrophobicContact CD2-CD2 3.21Å; L253-L271 HydrophobicContact CG-CD2 3.57Å |
| 254 | I | 76.7 | Confident | 71.3 | Confident | 102 Ų | 102 | 64.6 Ų | 64.6 | 52% | 0.523 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.8 | -45.6 | 177.1 | -69.9 | 161 | 0 | 0 | 0 | 110.2 | S250 L251 I252 K257 | S250-I254 WeakPolarHBondContact O-CD1 3.32Å; S250-I254 VanDerWaalsContact O-CG1 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.46Å; S250-I254 PolarHBondContact O-N 3.23Å; L251-I254 PolarHBondContact O-N 2.99Å; I252-I254 PolarHBondContact O-N 3.47Å; I254-K257 WeakPolarHBondContact O-CB 3.26Å; I254-K257 PolarHBondContact O-N 3.24Å |
| 255 | T | 74.4 | Confident | 70.3 | Confident | 39 Ų | 39 | 66.8 Ų | 66.8 | 24% | 0.239 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -63.3 | -47.3 | 179.1 | -54.9 | 0 | 0 | 0 | 0 | 110.9 | I157 C158 L251 I252 L253 K257 N258 H259 | I157-T255 HydrophobicContact CG2-CG2 4.23Å; C158-T255 PolarHBondContact SG-OG1 2.93Å; L251-T255 WeakPolarHBondContact O-CB 3.14Å; L251-T255 PolarHBondContact O-N 3.44Å; L251-T255 PolarHBondContact O-OG1 2.99Å; I252-T255 PolarHBondContact O-N 3.31Å; L253-T255 VanDerWaalsContact C-N 3.3Å; L253-T255 PolarHBondContact O-N 3.36Å; T255-K257 VanDerWaalsContact C-N 3.27Å; T255-K257 PolarHBondContact O-N 3.49Å; T255-N258 WeakPolarHBondContact O-CB 3.39Å; T255-N258 PolarHBondContact O-N 2.78Å; T255-H259 PolarHBondContact O-CD2 2.82Å; T255-H259 VanDerWaalsContact O-CD2 3.29Å |
| 256 | I | 72.6 | Confident | 69.4 | Low | 7 Ų | 7 | 74.5 Ų | 74.5 | 4% | 0.036 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -58.9 | -37.9 | 179.9 | -70.4 | 165.8 | 0 | 0 | 0 | 111.7 | I157 I252 L253 N258 H259 Q264 A267 R268 L271 | I157-I256 HydrophobicContact CG2-CG1 4.21Å; I252-I256 HydrophobicContact CG2-CD1 3.51Å; I252-I256 HydrophobicContact CG2-CG1 4.2Å; I252-I256 WeakPolarHBondContact O-CB 3.09Å; I252-I256 VanDerWaalsContact O-CG1 3.24Å; I252-I256 WeakPolarHBondContact O-CG1 3.22Å; I252-I256 PolarHBondContact O-N 3.21Å; L253-I256 PolarHBondContact O-N 3.46Å; I256-N258 PolarHBondContact O-N 2.93Å; I256-H259 WeakPolarHBondContact O-CB 3.4Å; I256-H259 PolarHBondContact O-N 3.33Å; I256-Q264 HydrophobicContact CG2-CB 4.19Å; I256-Q264 HydrophobicContact CG2-CG 4.04Å; I256-Q264 WeakPolarHBondContact O-CG 3.45Å; I256-A267 HydrophobicContact CD1-CB 3.52Å; I256-A267 HydrophobicContact CG1-CB 3.73Å; I256-A267 HydrophobicContact CG2-CB 4.22Å; I256-R268 HydrophobicContact CG2-CG 4.48Å; I256-L271 HydrophobicContact CD1-CD2 4.03Å |
| 257 | K | 69.8 | Low | 68.6 | Low | 169 Ų | 169 | 71.7 Ų | 71.7 | 74% | 0.735 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -55.5 | -26.3 | 178 | -169.8 | 177.5 | 176.2 | -177.3 | 0 | 112.6 | L253 I254 T255 | L253-K257 PolarHBondContact O-N 2.86Å; I254-K257 WeakPolarHBondContact O-CB 3.26Å; I254-K257 PolarHBondContact O-N 3.24Å; T255-K257 VanDerWaalsContact C-N 3.27Å; T255-K257 PolarHBondContact O-N 3.49Å |
| 258 | N | 69.9 | Low | 67.6 | Low | 136 Ų | 136 | 73.1 Ų | 73.1 | 73% | 0.727 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.3 | -1.5 | -179.9 | -58.8 | -25 | 0 | 0 | 0 | 113.8 | T255 I256 | T255-N258 WeakPolarHBondContact O-CB 3.39Å; T255-N258 PolarHBondContact O-N 2.78Å; I256-N258 PolarHBondContact O-N 2.93Å |
| 259 | H | 71.7 | Confident | 66.5 | Low | 92 Ų | 92 | 75.9 Ų | 75.9 | 43% | 0.426 | 42% | 0.417 | S | S | . | . | S | Bend | trans | -88.7 | 166.4 | 176.9 | -80.2 | -92.8 | 0 | 0 | 0 | 113 | T255 I256 Q264 | T255-H259 PolarHBondContact O-CD2 2.82Å; T255-H259 VanDerWaalsContact O-CD2 3.29Å; I256-H259 WeakPolarHBondContact O-CB 3.4Å; I256-H259 PolarHBondContact O-N 3.33Å; H259-Q264 HydrophobicContact CB-CG 4.39Å; H259-Q264 PolarHBondContact O-NE2 3.39Å |
| 260 | S | 64.1 | Low | 66 | Low | 72 Ų | 72 | 78.2 Ų | 78.2 | 50% | 0.503 | 43% | 0.432 | S | S | . | . | trans | -62.3 | 154.1 | 174.1 | 71.8 | 0 | 0 | 0 | 0 | 112.8 | T262 G263 Q264 | S260-T262 PolarHBondContact O-N 3.42Å; S260-T262 VanDerWaalsContact O-N 3.12Å; S260-G263 WeakPolarHBondContact O-CA 3.45Å; S260-G263 PolarHBondContact O-N 2.88Å; S260-Q264 WeakPolarHBondContact O-CG 3.4Å; S260-Q264 PolarHBondContact O-N 2.84Å | ||
| 261 | P | 62.8 | Low | 65.5 | Low | 99 Ų | 99 | 75.8 Ų | 75.8 | 64% | 0.643 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -54.1 | -36.2 | -175.5 | -26.4 | 33.7 | 0 | 0 | 0 | 114.5 | Q264 S265 | P261-Q264 WeakPolarHBondContact O-CB 3.29Å; P261-Q264 PolarHBondContact O-N 3.17Å; P261-S265 PolarHBondContact O-N 3.24Å; P261-S265 VanDerWaalsContact O-N 3.16Å |
| 262 | T | 56.2 | Low | 64.5 | Low | 117 Ų | 117 | 75.8 Ų | 75.8 | 72% | 0.718 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -71.7 | -40.1 | 177.7 | -36.8 | 0 | 0 | 0 | 0 | 112.1 | S260 Q264 S265 | S260-T262 PolarHBondContact O-N 3.42Å; S260-T262 VanDerWaalsContact O-N 3.12Å; T262-Q264 VanDerWaalsContact C-N 3.35Å; T262-S265 PolarHBondContact O-N 2.78Å |
| 263 | G | 59.1 | Low | 63.7 | Low | 30 Ų | 30 | 76.3 Ų | 76.3 | 31% | 0.309 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.8 | -37.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | S260 A267 | S260-G263 WeakPolarHBondContact O-CA 3.45Å; S260-G263 PolarHBondContact O-N 2.88Å; G263-A267 WeakPolarHBondContact O-CB 3.26Å; G263-A267 PolarHBondContact O-N 2.7Å; G263-A267 VanDerWaalsContact O-N 3.13Å |
| 264 | Q | 59.3 | Low | 63.2 | Low | 44 Ų | 44 | 72.5 Ų | 72.5 | 21% | 0.206 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.6 | -40.6 | 176.1 | -69.7 | 179.4 | 18.6 | 0 | 0 | 113.1 | I256 H259 S260 P261 T262 R268 | I256-Q264 HydrophobicContact CG2-CB 4.19Å; I256-Q264 HydrophobicContact CG2-CG 4.04Å; I256-Q264 WeakPolarHBondContact O-CG 3.45Å; H259-Q264 HydrophobicContact CB-CG 4.39Å; H259-Q264 PolarHBondContact O-NE2 3.39Å; S260-Q264 WeakPolarHBondContact O-CG 3.4Å; S260-Q264 PolarHBondContact O-N 2.84Å; P261-Q264 WeakPolarHBondContact O-CB 3.29Å; P261-Q264 PolarHBondContact O-N 3.17Å; T262-Q264 VanDerWaalsContact C-N 3.35Å; Q264-R268 WeakPolarHBondContact O-CB 3.47Å; Q264-R268 WeakPolarHBondContact O-CG 3.47Å; Q264-R268 PolarHBondContact O-N 3.43Å; Q264-R268 PolarHBondContact O-NE 3.5Å; Q264-R268 VanDerWaalsContact O-NE 3.08Å |
| 265 | S | 57.2 | Low | 62.4 | Low | 78 Ų | 78 | 69.9 Ų | 69.9 | 55% | 0.545 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.9 | -45.6 | -179.2 | 174.1 | 0 | 0 | 0 | 0 | 112.2 | P261 T262 S269 | P261-S265 PolarHBondContact O-N 3.24Å; P261-S265 VanDerWaalsContact O-N 3.16Å; T262-S265 PolarHBondContact O-N 2.78Å; S265-S269 PolarHBondContact O-N 3.36Å |
| 266 | K | 57.2 | Low | 61.7 | Low | 163 Ų | 163 | 70.3 Ų | 70.3 | 71% | 0.709 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -70.8 | -37.3 | -179.2 | -165.9 | 164.3 | -179.5 | -178.7 | 0 | 112.6 | T270 | K266-T270 PolarHBondContact O-OG1 3.48Å |
| 267 | A | 58.9 | Low | 61.1 | Low | 23 Ų | 23 | 70 Ų | 70 | 19% | 0.19 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -70.6 | -42.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | I256 G263 S269 T270 L271 | I256-A267 HydrophobicContact CD1-CB 3.52Å; I256-A267 HydrophobicContact CG1-CB 3.73Å; I256-A267 HydrophobicContact CG2-CB 4.22Å; G263-A267 WeakPolarHBondContact O-CB 3.26Å; G263-A267 PolarHBondContact O-N 2.7Å; G263-A267 VanDerWaalsContact O-N 3.13Å; A267-S269 PolarHBondContact O-N 2.86Å; A267-T270 PolarHBondContact O-N 2.95Å; A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.39Å; A267-L271 VanDerWaalsContact O-N 3.12Å |
| 268 | R | 58.8 | Low | 60.6 | Low | 123 Ų | 123 | 62.5 Ų | 62.5 | 46% | 0.464 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.6 | -44.5 | 177.3 | -80.7 | -178.5 | -76.1 | -167.1 | -4.8 | 113 | I256 Q264 T270 L271 T272 | I256-R268 HydrophobicContact CG2-CG 4.48Å; Q264-R268 WeakPolarHBondContact O-CB 3.47Å; Q264-R268 WeakPolarHBondContact O-CG 3.47Å; Q264-R268 PolarHBondContact O-N 3.43Å; Q264-R268 PolarHBondContact O-NE 3.5Å; Q264-R268 VanDerWaalsContact O-NE 3.08Å; R268-T270 VanDerWaalsContact C-N 3.33Å; R268-T270 PolarHBondContact O-N 3.46Å; R268-L271 WeakPolarHBondContact O-CB 3.43Å; R268-L271 PolarHBondContact O-N 3.4Å; R268-T272 PolarHBondContact O-N 2.83Å; R268-T272 PolarHBondContact O-OG1 2.91Å |
| 269 | S | 56.8 | Low | 60.1 | Low | 73 Ų | 73 | 61.1 Ų | 61.1 | 51% | 0.51 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.5 | -36 | -179.1 | 177.1 | 0 | 0 | 0 | 0 | 113.7 | S265 A267 | S265-S269 PolarHBondContact O-N 3.36Å; A267-S269 PolarHBondContact O-N 2.86Å |
| 270 | T | 60.7 | Low | 59.5 | Low | 58 Ų | 58 | 59.6 Ų | 59.6 | 36% | 0.356 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -74.7 | -34 | 177.5 | -46.8 | 0 | 0 | 0 | 0 | 111 | K266 A267 R268 H274 | K266-T270 PolarHBondContact O-OG1 3.48Å; A267-T270 PolarHBondContact O-N 2.95Å; R268-T270 VanDerWaalsContact C-N 3.33Å; R268-T270 PolarHBondContact O-N 3.46Å; T270-H274 PolarHBondContact O-N 3.29Å |
| 271 | L | 63.8 | Low | 59.3 | Low | 8 Ų | 8 | 56.5 Ų | 56.5 | 4% | 0.042 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -72.3 | -42.3 | -180 | -156.7 | 73.6 | 0 | 0 | 0 | 113.1 | Y249 I252 L253 I256 A267 R268 A273 H274 I275 | Y249-L271 HydrophobicContact CD1-CD1 3.46Å; Y249-L271 VanDerWaalsContact CD1-CD1 3.46Å; Y249-L271 HydrophobicContact CD1-CG 4.19Å; Y249-L271 HydrophobicContact CE1-CD1 3.91Å; I252-L271 HydrophobicContact CB-CD1 4.08Å; I252-L271 HydrophobicContact CD1-CD1 4.23Å; I252-L271 HydrophobicContact CG2-CD1 3.39Å; I252-L271 HydrophobicContact CG2-CD2 4.14Å; I252-L271 HydrophobicContact CG2-CG 4.42Å; L253-L271 HydrophobicContact CD2-CD2 3.21Å; L253-L271 HydrophobicContact CG-CD2 3.57Å; I256-L271 HydrophobicContact CD1-CD2 4.03Å; A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.39Å; A267-L271 VanDerWaalsContact O-N 3.12Å; R268-L271 WeakPolarHBondContact O-CB 3.43Å; R268-L271 PolarHBondContact O-N 3.4Å; L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 3.43Å; L271-H274 PolarHBondContact O-N 3.07Å; L271-I275 HydrophobicContact CD2-CD1 4.13Å; L271-I275 HydrophobicContact CG-CD1 3.81Å; L271-I275 HydrophobicContact CG-CG1 4.46Å; L271-I275 WeakPolarHBondContact O-CB 3.49Å; L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 2.99Å; L271-I275 PolarHBondContact O-N 3.29Å |
| 272 | T | 57.4 | Low | 59 | Low | 72 Ų | 72 | 51.8 Ų | 51.8 | 44% | 0.442 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.1 | -38 | 178 | -42.9 | 0 | 0 | 0 | 0 | 111.1 | R268 T276 | R268-T272 PolarHBondContact O-N 2.83Å; R268-T272 PolarHBondContact O-OG1 2.91Å; T272-T276 WeakPolarHBondContact O-CB 3.45Å; T272-T276 PolarHBondContact O-N 3.36Å; T272-T276 PolarHBondContact O-OG1 2.79Å |
| 273 | A | 58.7 | Low | 59.2 | Low | 11 Ų | 11 | 48 Ų | 48 | 9% | 0.091 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -60.2 | -49.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | L271 T276 V277 I317 | L271-A273 VanDerWaalsContact C-N 3.27Å; L271-A273 PolarHBondContact O-N 3.43Å; A273-T276 PolarHBondContact O-N 3.41Å; A273-V277 WeakPolarHBondContact O-CG2 3.19Å; A273-V277 PolarHBondContact O-N 3Å; A273-V277 VanDerWaalsContact O-N 3.11Å; A273-I317 HydrophobicContact CB-CG2 3.74Å |
| 274 | H | 61.1 | Low | 59.1 | Low | 7 Ų | 7 | 47.6 Ų | 47.6 | 3% | 0.032 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.4 | -42 | 178 | -93.9 | -60.6 | 0 | 0 | 0 | 113.4 | M90 Y249 T270 L271 T276 V277 V278 Y318 | M90-H274 WeakPolarHBondContact CE-NE2 2.93Å; Y249-H274 HydrophobicContact CE1-CB 3.78Å; Y249-H274 VanDerWaalsContact OH-CB 3.28Å; Y249-H274 WeakPolarHBondContact OH-CB 3.25Å; Y249-H274 PolarHBondContact OH-ND1 2.88Å; T270-H274 PolarHBondContact O-N 3.29Å; L271-H274 PolarHBondContact O-N 3.07Å; H274-T276 VanDerWaalsContact C-N 3.3Å; H274-T276 PolarHBondContact O-N 3.45Å; H274-V277 WeakPolarHBondContact O-CB 3.45Å; H274-V277 PolarHBondContact O-N 3.42Å; H274-V278 WeakPolarHBondContact O-CG2 3.34Å; H274-V278 PolarHBondContact O-N 2.98Å; H274-Y318 AromaticContact CE1-CE1 3.59Å; H274-Y318 AromaticContact CE1-CZ 3.62Å; H274-Y318 PolarHBondContact CE1-OH 3.31Å; H274-Y318 AromaticContact ND1-CZ 4Å; H274-Y318 PolarHBondContact ND1-OH 3.23Å; H274-Y318 VanDerWaalsContact ND1-OH 3.1Å; H274-Y318 AromaticContact NE2-CE1 3.87Å |
| 275 | I | 60.6 | Low | 58.9 | Low | 47 Ų | 47 | 46.1 Ų | 46.1 | 24% | 0.241 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 175.7 | -70.4 | 170.1 | 0 | 0 | 0 | 110.7 | Y249 L271 V278 I279 | Y249-I275 HydrophobicContact CD1-CG1 4.1Å; Y249-I275 HydrophobicContact CD2-CG1 4.18Å; Y249-I275 HydrophobicContact CG-CD1 4.43Å; Y249-I275 HydrophobicContact CG-CG1 3.9Å; L271-I275 HydrophobicContact CD2-CD1 4.13Å; L271-I275 HydrophobicContact CG-CD1 3.81Å; L271-I275 HydrophobicContact CG-CG1 4.46Å; L271-I275 WeakPolarHBondContact O-CB 3.49Å; L271-I275 VanDerWaalsContact O-CG1 3.29Å; L271-I275 WeakPolarHBondContact O-CG1 2.99Å; L271-I275 PolarHBondContact O-N 3.29Å; I275-V278 PolarHBondContact O-N 2.66Å; I275-I279 HydrophobicContact CG2-CD1 3.67Å; I275-I279 HydrophobicContact CG2-CG1 4.31Å; I275-I279 WeakPolarHBondContact O-CG1 3.47Å; I275-I279 PolarHBondContact O-N 3.15Å |
| 276 | T | 59.2 | Low | 59 | Low | 48 Ų | 48 | 44.2 Ų | 44.2 | 29% | 0.294 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -63.4 | -41.3 | 173.7 | -61.6 | 0 | 0 | 0 | 0 | 112 | T272 A273 H274 L280 | T272-T276 WeakPolarHBondContact O-CB 3.45Å; T272-T276 PolarHBondContact O-N 3.36Å; T272-T276 PolarHBondContact O-OG1 2.79Å; A273-T276 PolarHBondContact O-N 3.41Å; H274-T276 VanDerWaalsContact C-N 3.3Å; H274-T276 PolarHBondContact O-N 3.45Å; T276-L280 HydrophobicContact CG2-CD1 3.65Å; T276-L280 HydrophobicContact CG2-CG 4.42Å; T276-L280 WeakPolarHBondContact O-CB 3.31Å; T276-L280 WeakPolarHBondContact O-CG 3.47Å; T276-L280 PolarHBondContact O-N 2.9Å |
| 277 | V | 59 | Low | 58.8 | Low | 1 Ų | 1 | 41.9 Ų | 41.9 | 1% | 0.006 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59 | -48.6 | 172.4 | 178.8 | 0 | 0 | 0 | 0 | 110.1 | L146 A273 H274 I279 L280 F281 I317 | L146-V277 HydrophobicContact CD2-CG1 4.05Å; A273-V277 WeakPolarHBondContact O-CG2 3.19Å; A273-V277 PolarHBondContact O-N 3Å; A273-V277 VanDerWaalsContact O-N 3.11Å; H274-V277 WeakPolarHBondContact O-CB 3.45Å; H274-V277 PolarHBondContact O-N 3.42Å; V277-I279 PolarHBondContact O-N 2.95Å; V277-L280 PolarHBondContact O-N 2.02Å; V277-F281 HydrophobicContact CG1-CD2 3.63Å; V277-F281 HydrophobicContact CG1-CE2 3.79Å; V277-F281 VanDerWaalsContact O-CB 3.31Å; V277-F281 WeakPolarHBondContact O-CB 3.12Å; V277-F281 WeakPolarHBondContact O-CD2 3.41Å; V277-F281 PolarHBondContact O-N 3Å; V277-I317 HydrophobicContact CB-CD1 4.4Å; V277-I317 HydrophobicContact CG2-CB 4.14Å; V277-I317 HydrophobicContact CG2-CD1 3.34Å; V277-I317 HydrophobicContact CG2-CG1 4.28Å; V277-I317 HydrophobicContact CG2-CG2 3.77Å |
| 278 | V | 60 | Low | 58.5 | Low | 10 Ų | 10 | 43 Ų | 43 | 6% | 0.061 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.7 | -45.3 | -176.9 | 175.5 | 0 | 0 | 0 | 0 | 111.6 | F242 L245 Y249 H274 I275 F282 | F242-V278 HydrophobicContact CD2-CG1 4.31Å; F242-V278 HydrophobicContact CE2-CG1 4.46Å; L245-V278 HydrophobicContact CB-CG1 3.87Å; L245-V278 HydrophobicContact CB-CG2 4.27Å; L245-V278 HydrophobicContact CD1-CG1 3.93Å; L245-V278 HydrophobicContact CD1-CG2 4.04Å; L245-V278 HydrophobicContact CD2-CG2 4.18Å; L245-V278 HydrophobicContact CG-CG1 4.47Å; L245-V278 HydrophobicContact CG-CG2 4.39Å; Y249-V278 HydrophobicContact CD2-CG2 4.33Å; Y249-V278 HydrophobicContact CE2-CG2 3.53Å; H274-V278 WeakPolarHBondContact O-CG2 3.34Å; H274-V278 PolarHBondContact O-N 2.98Å; I275-V278 PolarHBondContact O-N 2.66Å; V278-F282 HydrophobicContact CG1-CD2 4.06Å; V278-F282 WeakPolarHBondContact O-CB 3.18Å; V278-F282 WeakPolarHBondContact O-CD2 3.48Å; V278-F282 PolarHBondContact O-N 3.02Å |
| 279 | I | 59.1 | Low | 58 | Low | 108 Ų | 108 | 40.6 Ų | 40.6 | 55% | 0.554 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -67.1 | -41.9 | 179.4 | -68.2 | 170.3 | 0 | 0 | 0 | 110.9 | I275 V277 G283 | I275-I279 HydrophobicContact CG2-CD1 3.67Å; I275-I279 HydrophobicContact CG2-CG1 4.31Å; I275-I279 WeakPolarHBondContact O-CG1 3.47Å; I275-I279 PolarHBondContact O-N 3.15Å; V277-I279 PolarHBondContact O-N 2.95Å; I279-G283 WeakPolarHBondContact O-CA 3.44Å; I279-G283 PolarHBondContact O-N 3.46Å |
| 280 | L | 58.9 | Low | 57.5 | Low | 59 Ų | 59 | 43.2 Ų | 43.2 | 31% | 0.309 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -69.7 | -36.2 | 179.2 | -74 | 167.5 | 0 | 0 | 0 | 112.3 | T276 V277 P284 F305 L313 | T276-L280 HydrophobicContact CG2-CD1 3.65Å; T276-L280 HydrophobicContact CG2-CG 4.42Å; T276-L280 WeakPolarHBondContact O-CB 3.31Å; T276-L280 WeakPolarHBondContact O-CG 3.47Å; T276-L280 PolarHBondContact O-N 2.9Å; V277-L280 PolarHBondContact O-N 2.02Å; L280-P284 WeakPolarHBondContact O-CD 3.32Å; L280-P284 WeakPolarHBondContact O-CG 3.1Å; L280-F305 HydrophobicContact CD2-CZ 4.26Å; L280-F305 WeakPolarHBondContact O-CE1 3.3Å; L280-F305 WeakPolarHBondContact O-CZ 3.38Å; L280-L313 HydrophobicContact CB-CD1 3.87Å; L280-L313 HydrophobicContact CD1-CD1 3.83Å; L280-L313 HydrophobicContact CD1-CD2 3.95Å; L280-L313 HydrophobicContact CG-CD1 4.38Å |
| 281 | F | 59.4 | Low | 57 | Low | 7 Ų | 7 | 47.8 Ų | 47.8 | 3% | 0.031 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -73.7 | -53.2 | 177.6 | -101.1 | -104.2 | 0 | 0 | 0 | 113.2 | E142 L146 V277 C285 T310 | E142-F281 HydrophobicContact CG-CE1 3.84Å; E142-F281 HydrophobicContact CG-CZ 4.19Å; E142-F281 WeakPolarHBondContact OE1-CE1 3.38Å; E142-F281 WeakPolarHBondContact OE1-CZ 3.24Å; L146-F281 HydrophobicContact CD1-CD1 3.79Å; L146-F281 HydrophobicContact CD1-CD2 4.42Å; L146-F281 HydrophobicContact CD1-CE1 3.72Å; L146-F281 HydrophobicContact CD1-CE2 4.37Å; L146-F281 HydrophobicContact CD1-CG 4.09Å; L146-F281 HydrophobicContact CD1-CZ 3.98Å; V277-F281 HydrophobicContact CG1-CD2 3.63Å; V277-F281 HydrophobicContact CG1-CE2 3.79Å; V277-F281 VanDerWaalsContact O-CB 3.31Å; V277-F281 WeakPolarHBondContact O-CB 3.12Å; V277-F281 WeakPolarHBondContact O-CD2 3.41Å; V277-F281 PolarHBondContact O-N 3Å; F281-C285 PolarHBondContact O-SG 3.03Å; F281-T310 HydrophobicContact CD1-CG2 3.6Å; F281-T310 HydrophobicContact CD2-CG2 3.95Å; F281-T310 HydrophobicContact CE1-CG2 3.01Å; F281-T310 HydrophobicContact CE2-CG2 3.42Å; F281-T310 VanDerWaalsContact CE2-CG2 3.42Å; F281-T310 HydrophobicContact CG-CG2 4.05Å; F281-T310 HydrophobicContact CZ-CG2 2.95Å |
| 282 | F | 56.9 | Low | 56.1 | Low | 1 Ų | 1 | 50.9 Ų | 50.9 | 0% | 0.004 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -88.9 | -22.6 | -168.9 | -70.8 | -86.2 | 0 | 0 | 0 | 112.6 | M143 L146 S238 C241 F242 L245 V278 C285 I286 | M143-F282 HydrophobicContact CG-CE1 4.31Å; M143-F282 HydrophobicContact CG-CZ 4.22Å; M143-F282 HydrophobicContact SD-CE1 4.27Å; L146-F282 HydrophobicContact CD1-CE2 4.49Å; S238-F282 WeakPolarHBondContact O-CE1 3.42Å; C241-F282 HydrophobicContact CB-CE1 3.54Å; C241-F282 HydrophobicContact CB-CZ 3.64Å; F242-F282 HydrophobicContact CB-CB 4.31Å; F242-F282 HydrophobicContact CB-CD1 3.86Å; F242-F282 HydrophobicContact CB-CE1 4.47Å; F242-F282 HydrophobicContact CB-CG 4.13Å; F242-F282 HydrophobicContact CD2-CB 3.5Å; F242-F282 VanDerWaalsContact CD2-CB 3.5Å; F242-F282 AromaticContact CD2-CG 3.96Å; F242-F282 HydrophobicContact CD2-CG 3.96Å; F242-F282 HydrophobicContact CE2-CB 4.16Å; F242-F282 HydrophobicContact CG-CB 4.24Å; L245-F282 HydrophobicContact CD1-CD2 3.81Å; L245-F282 HydrophobicContact CD1-CE2 3.16Å; L245-F282 HydrophobicContact CD1-CZ 3.63Å; V278-F282 HydrophobicContact CG1-CD2 4.06Å; V278-F282 WeakPolarHBondContact O-CB 3.18Å; V278-F282 WeakPolarHBondContact O-CD2 3.48Å; V278-F282 PolarHBondContact O-N 3.02Å; F282-C285 PolarHBondContact O-N 3.06Å; F282-C285 VanDerWaalsContact O-N 3.12Å; F282-I286 HydrophobicContact CB-CD1 4.22Å; F282-I286 WeakPolarHBondContact O-CB 3.41Å; F282-I286 WeakPolarHBondContact O-CD1 3.34Å; F282-I286 WeakPolarHBondContact O-CG1 3.28Å; F282-I286 PolarHBondContact O-N 2.82Å |
| 283 | G | 60.4 | Low | 55.5 | Low | 36 Ų | 36 | 56.2 Ų | 56.2 | 37% | 0.371 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -55.5 | -53.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | I279 C285 F287 | I279-G283 WeakPolarHBondContact O-CA 3.44Å; I279-G283 PolarHBondContact O-N 3.46Å; G283-C285 VanDerWaalsContact C-N 3.31Å; G283-C285 PolarHBondContact O-N 2.93Å; G283-F287 PolarHBondContact O-N 2.89Å; G283-F287 VanDerWaalsContact O-N 3.11Å |
| 284 | P | 57.3 | Low | 54.7 | Low | 22 Ų | 22 | 57.5 Ų | 57.5 | 14% | 0.143 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.8 | -34.8 | 173.7 | -23.3 | 35.2 | 0 | 0 | 0 | 112.9 | L280 F287 I288 L302 F305 Y306 | L280-P284 WeakPolarHBondContact O-CD 3.32Å; L280-P284 WeakPolarHBondContact O-CG 3.1Å; P284-F287 PolarHBondContact O-N 3Å; P284-I288 WeakPolarHBondContact O-CD1 3.42Å; P284-I288 WeakPolarHBondContact O-CG1 3.35Å; P284-I288 PolarHBondContact O-N 3.33Å; P284-L302 HydrophobicContact CB-CD2 3.86Å; P284-F305 HydrophobicContact CB-CD1 4.3Å; P284-F305 HydrophobicContact CG-CD1 3.8Å; P284-F305 HydrophobicContact CG-CE1 3.6Å; P284-F305 HydrophobicContact CG-CE2 4.45Å; P284-F305 HydrophobicContact CG-CG 4.34Å; P284-F305 HydrophobicContact CG-CZ 3.93Å; P284-Y306 HydrophobicContact CB-CE2 4.36Å; P284-Y306 WeakPolarHBondContact CB-OH 3.3Å |
| 285 | C | 55.9 | Low | 54.1 | Low | 14 Ų | 14 | 63.1 Ų | 63.1 | 10% | 0.095 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.5 | -45.2 | -177.2 | -75.1 | 0 | 0 | 0 | 0 | 109.9 | S238 F281 F282 G283 F287 I288 Y289 Y306 | S238-C285 VanDerWaalsContact OG-CB 3.32Å; S238-C285 WeakPolarHBondContact OG-CB 3.45Å; F281-C285 PolarHBondContact O-SG 3.03Å; F282-C285 PolarHBondContact O-N 3.06Å; F282-C285 VanDerWaalsContact O-N 3.12Å; G283-C285 VanDerWaalsContact C-N 3.31Å; G283-C285 PolarHBondContact O-N 2.93Å; C285-F287 VanDerWaalsContact C-N 3.3Å; C285-F287 PolarHBondContact O-N 3.38Å; C285-I288 WeakPolarHBondContact O-CB 3.38Å; C285-I288 PolarHBondContact O-N 3.33Å; C285-Y289 HydrophobicContact CB-CE2 4.46Å; C285-Y289 WeakPolarHBondContact O-CD2 3.46Å; C285-Y289 PolarHBondContact O-N 2.71Å; C285-Y289 VanDerWaalsContact O-N 3.08Å; C285-Y306 WeakPolarHBondContact CA-OH 3.41Å; C285-Y306 WeakPolarHBondContact CB-OH 3.16Å; C285-Y306 PolarHBondContact N-OH 3.38Å; C285-Y306 WeakPolarHBondContact SG-CE1 3.33Å; C285-Y306 VanDerWaalsContact SG-CZ 3.52Å; C285-Y306 PolarHBondContact SG-OH 2.94Å |
| 286 | I | 58 | Low | 53.5 | Low | 37 Ų | 37 | 69 Ų | 69 | 19% | 0.19 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -65 | -39.2 | 179 | -68.7 | 166.4 | 0 | 0 | 0 | 109.9 | F242 F282 I288 Y289 I290 | F242-I286 HydrophobicContact CB-CD1 4.19Å; F242-I286 HydrophobicContact CD1-CD1 3.47Å; F242-I286 VanDerWaalsContact CD1-CD1 3.47Å; F242-I286 HydrophobicContact CD2-CD1 3.73Å; F242-I286 HydrophobicContact CE1-CD1 3.57Å; F242-I286 HydrophobicContact CE2-CD1 3.85Å; F242-I286 HydrophobicContact CG-CD1 3.53Å; F242-I286 HydrophobicContact CZ-CD1 3.76Å; F282-I286 HydrophobicContact CB-CD1 4.22Å; F282-I286 WeakPolarHBondContact O-CB 3.41Å; F282-I286 WeakPolarHBondContact O-CD1 3.34Å; F282-I286 WeakPolarHBondContact O-CG1 3.28Å; F282-I286 PolarHBondContact O-N 2.82Å; I286-I288 VanDerWaalsContact C-N 3.34Å; I286-I288 PolarHBondContact O-N 3.1Å; I286-Y289 PolarHBondContact O-N 3.43Å; I286-I290 HydrophobicContact CG2-CD1 3.42Å; I286-I290 VanDerWaalsContact CG2-CD1 3.42Å; I286-I290 HydrophobicContact CG2-CG1 4.16Å; I286-I290 VanDerWaalsContact O-CB 3.3Å; I286-I290 WeakPolarHBondContact O-CB 3.36Å; I286-I290 VanDerWaalsContact O-CG1 3.27Å; I286-I290 WeakPolarHBondContact O-CG1 3.4Å; I286-I290 PolarHBondContact O-N 3.29Å |
| 287 | F | 54.4 | Low | 52.8 | Low | 114 Ų | 114 | 70.9 Ų | 70.9 | 50% | 0.5 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | 175.7 | -161.6 | -94.7 | 0 | 0 | 0 | 112.2 | G283 P284 C285 W291 V298 | G283-F287 PolarHBondContact O-N 2.89Å; G283-F287 VanDerWaalsContact O-N 3.11Å; P284-F287 PolarHBondContact O-N 3Å; C285-F287 VanDerWaalsContact C-N 3.3Å; C285-F287 PolarHBondContact O-N 3.38Å; F287-W291 WeakPolarHBondContact O-CB 3.05Å; F287-W291 PolarHBondContact O-N 3.38Å; F287-W291 VanDerWaalsContact O-N 3.11Å; F287-V298 HydrophobicContact CE1-CG1 4.44Å |
| 288 | I | 51 | Low | 52.3 | Low | 48 Ų | 48 | 72.8 Ų | 72.8 | 25% | 0.246 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -61.7 | -48.1 | 175.5 | -74.6 | 159.2 | 0 | 0 | 0 | 112.6 | P284 C285 I286 L302 Y306 | P284-I288 WeakPolarHBondContact O-CD1 3.42Å; P284-I288 WeakPolarHBondContact O-CG1 3.35Å; P284-I288 PolarHBondContact O-N 3.33Å; C285-I288 WeakPolarHBondContact O-CB 3.38Å; C285-I288 PolarHBondContact O-N 3.33Å; I286-I288 VanDerWaalsContact C-N 3.34Å; I286-I288 PolarHBondContact O-N 3.1Å; I288-L302 HydrophobicContact CD1-CB 4.16Å; I288-L302 HydrophobicContact CD1-CD1 3.8Å; I288-L302 HydrophobicContact CD1-CD2 3.84Å; I288-L302 HydrophobicContact CD1-CG 4.15Å; I288-L302 HydrophobicContact CG1-CD1 3.37Å; I288-L302 HydrophobicContact CG1-CD2 3.99Å; I288-L302 HydrophobicContact CG1-CG 4.19Å; I288-Y306 HydrophobicContact CD1-CD2 4.4Å; I288-Y306 HydrophobicContact CD1-CE2 3.34Å; I288-Y306 WeakPolarHBondContact CD1-OH 3.49Å |
| 289 | Y | 49.1 | Very low | 51.9 | Low | 72 Ų | 72 | 74.7 Ų | 74.7 | 28% | 0.282 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -83.6 | -22 | -172.2 | -65.6 | -62.1 | 0 | 0 | 0 | 113.5 | V231 S234 C285 I286 | V231-Y289 HydrophobicContact CG1-CD1 4.25Å; S234-Y289 VanDerWaalsContact CB-CE1 3.5Å; S234-Y289 WeakPolarHBondContact CB-OH 3.19Å; C285-Y289 HydrophobicContact CB-CE2 4.46Å; C285-Y289 WeakPolarHBondContact O-CD2 3.46Å; C285-Y289 PolarHBondContact O-N 2.71Å; C285-Y289 VanDerWaalsContact O-N 3.08Å; I286-Y289 PolarHBondContact O-N 3.43Å |
| 290 | I | 47.1 | Very low | 51.8 | Low | 127 Ų | 127 | 71.2 Ų | 71.2 | 65% | 0.651 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -85.1 | -27.9 | 174.5 | -65.2 | -179 | 0 | 0 | 0 | 111.7 | I286 P292 | I286-I290 HydrophobicContact CG2-CD1 3.42Å; I286-I290 VanDerWaalsContact CG2-CD1 3.42Å; I286-I290 HydrophobicContact CG2-CG1 4.16Å; I286-I290 VanDerWaalsContact O-CB 3.3Å; I286-I290 WeakPolarHBondContact O-CB 3.36Å; I286-I290 VanDerWaalsContact O-CG1 3.27Å; I286-I290 WeakPolarHBondContact O-CG1 3.4Å; I286-I290 PolarHBondContact O-N 3.29Å; I290-P292 WeakPolarHBondContact O-CD 2.9Å |
| 291 | W | 49.1 | Very low | 51.5 | Low | 154 Ų | 154 | 74.7 Ų | 74.7 | 58% | 0.583 | 37% | 0.373 | S | S | * | . | trans | -115.9 | 71.8 | -179.4 | -155.2 | -69.6 | 0 | 0 | 0 | 112.2 | F287 F293 | F287-W291 WeakPolarHBondContact O-CB 3.05Å; F287-W291 PolarHBondContact O-N 3.38Å; F287-W291 VanDerWaalsContact O-N 3.11Å; W291-F293 VanDerWaalsContact CD1-C 3.44Å; W291-F293 PolarHBondContact NE1-O 3Å; W291-F293 PolarHBondContact O-N 3.12Å | ||
| 292 | P | 45.4 | Very low | 51.2 | Low | 73 Ų | 73 | 75 Ų | 75 | 47% | 0.474 | 38% | 0.375 | S | S | . | . | S | Bend | trans | -69.5 | -0 | -179 | 28.9 | -34.5 | 0 | 0 | 0 | 114.2 | I290 | I290-P292 WeakPolarHBondContact O-CD 2.9Š|
| 293 | F | 45.5 | Very low | 51.3 | Low | 184 Ų | 184 | 75.1 Ų | 75.1 | 81% | 0.807 | 38% | 0.377 | S | S | * | . | S | Bend | trans | -123 | 56.2 | -178.1 | -57.5 | -70.5 | 0 | 0 | 0 | 112.2 | W291 | W291-F293 VanDerWaalsContact CD1-C 3.44Å; W291-F293 PolarHBondContact NE1-O 3Å; W291-F293 PolarHBondContact O-N 3.12Å |
| 294 | S | 40.8 | Very low | 51.2 | Low | 38 Ų | 38 | 74.6 Ų | 74.6 | 27% | 0.266 | 37% | 0.366 | S | S | . | . | trans | -108.2 | 148.7 | 177.3 | -170 | 0 | 0 | 0 | 0 | 112 | V298 | S294-V298 WeakPolarHBondContact OG-CB 3.1Å; S294-V298 VanDerWaalsContact OG-CG2 3.3Å; S294-V298 WeakPolarHBondContact OG-CG2 3.45Å | ||
| 295 | N | 48.8 | Very low | 51.3 | Low | 125 Ų | 125 | 74.6 Ų | 74.6 | 67% | 0.668 | 36% | 0.364 | S | S | * | . | trans | -64.1 | 151.3 | -176.8 | -68.4 | -54 | 0 | 0 | 0 | 113.1 | S297 V298 | N295-S297 PolarHBondContact O-N 3.28Å; N295-V298 PolarHBondContact O-N 3.01Å | ||
| 296 | Y | 47.8 | Very low | 51.5 | Low | 171 Ų | 171 | 76.7 Ų | 76.7 | 67% | 0.671 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -42.1 | -25.8 | -178.9 | -64.8 | -84.7 | 0 | 0 | 0 | 117.1 | D206 | D206-Y296 WeakPolarHBondContact OD2-CD1 3.31Å |
| 297 | S | 44.5 | Very low | 51.6 | Low | 88 Ų | 88 | 75.1 Ų | 75.1 | 62% | 0.615 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -76.9 | -25.1 | -179.9 | 53.1 | 0 | 0 | 0 | 0 | 114.3 | N295 | N295-S297 PolarHBondContact O-N 3.28Å |
| 298 | V | 48.1 | Very low | 51.9 | Low | 40 Ų | 40 | 70 Ų | 70 | 24% | 0.242 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -77.4 | -40.2 | -177.9 | 176.5 | 0 | 0 | 0 | 0 | 110.4 | F287 S294 N295 K300 F301 L302 | F287-V298 HydrophobicContact CE1-CG1 4.44Å; S294-V298 WeakPolarHBondContact OG-CB 3.1Å; S294-V298 VanDerWaalsContact OG-CG2 3.3Å; S294-V298 WeakPolarHBondContact OG-CG2 3.45Å; N295-V298 PolarHBondContact O-N 3.01Å; V298-K300 VanDerWaalsContact C-N 3.3Å; V298-K300 PolarHBondContact O-N 3.42Å; V298-F301 PolarHBondContact O-N 3.3Å; V298-L302 HydrophobicContact CG1-CD1 3.54Å; V298-L302 HydrophobicContact CG1-CG 4.17Å; V298-L302 WeakPolarHBondContact O-CB 3.24Å; V298-L302 VanDerWaalsContact O-CD1 3.32Å; V298-L302 WeakPolarHBondContact O-CD1 3.44Å; V298-L302 WeakPolarHBondContact O-CG 2.99Å; V298-L302 PolarHBondContact O-N 3.11Å |
| 299 | D | 52.4 | Low | 52.5 | Low | 50 Ų | 50 | 70.6 Ų | 70.6 | 27% | 0.267 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.2 | -37.5 | 178.9 | -63.5 | -19.3 | 0 | 0 | 0 | 112.5 | A303 | D299-A303 WeakPolarHBondContact O-CB 3.2Å; D299-A303 PolarHBondContact O-N 2.99Å |
| 300 | K | 56.3 | Low | 53.2 | Low | 35 Ų | 35 | 67.2 Ų | 67.2 | 15% | 0.152 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -71 | -39.6 | 177.1 | -66.9 | -174.6 | -175.4 | -171.2 | 0 | 113.4 | G47 L48 D206 V298 L302 A303 V304 | G47-K300 PolarHBondContact O-NZ 3.08Å; L48-K300 HydrophobicContact CD2-CB 4.2Å; D206-K300 VanDerWaalsContact CG-CE 3.48Å; D206-K300 VanDerWaalsContact O-CE 3.31Å; D206-K300 WeakPolarHBondContact O-CE 3.38Å; D206-K300 WeakPolarHBondContact OD1-CE 3.24Å; D206-K300 IonicContact OD1-NZ 3.15Å; D206-K300 PolarHBondContact OD1-NZ 3.48Å; D206-K300 IonicContact OD2-NZ 3.76Å; V298-K300 VanDerWaalsContact C-N 3.3Å; V298-K300 PolarHBondContact O-N 3.42Å; K300-L302 VanDerWaalsContact C-N 3.34Å; K300-A303 WeakPolarHBondContact O-CB 3.38Å; K300-V304 WeakPolarHBondContact O-CG2 3.45Å; K300-V304 PolarHBondContact O-N 3.04Å; K300-V304 VanDerWaalsContact O-N 3.16Å |
| 301 | F | 52.5 | Low | 53.9 | Low | 133 Ų | 133 | 61.2 Ų | 61.2 | 58% | 0.583 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -65.4 | -41.5 | 175.3 | 176 | -97.3 | 0 | 0 | 0 | 111 | V298 V304 F305 | V298-F301 PolarHBondContact O-N 3.3Å; F301-V304 PolarHBondContact O-N 3.23Å; F301-F305 HydrophobicContact CE1-CD2 4.4Å; F301-F305 HydrophobicContact CZ-CD2 4.43Å; F301-F305 WeakPolarHBondContact O-CB 3.5Å; F301-F305 PolarHBondContact O-N 2.94Å |
| 302 | L | 54.3 | Low | 54.6 | Low | 13 Ų | 13 | 55.3 Ų | 55.3 | 7% | 0.068 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -67.1 | -42.6 | 177.8 | -67.8 | 164.6 | 0 | 0 | 0 | 111.8 | P284 I288 V298 K300 V304 F305 Y306 | P284-L302 HydrophobicContact CB-CD2 3.86Å; I288-L302 HydrophobicContact CD1-CB 4.16Å; I288-L302 HydrophobicContact CD1-CD1 3.8Å; I288-L302 HydrophobicContact CD1-CD2 3.84Å; I288-L302 HydrophobicContact CD1-CG 4.15Å; I288-L302 HydrophobicContact CG1-CD1 3.37Å; I288-L302 HydrophobicContact CG1-CD2 3.99Å; I288-L302 HydrophobicContact CG1-CG 4.19Å; V298-L302 HydrophobicContact CG1-CD1 3.54Å; V298-L302 HydrophobicContact CG1-CG 4.17Å; V298-L302 WeakPolarHBondContact O-CB 3.24Å; V298-L302 VanDerWaalsContact O-CD1 3.32Å; V298-L302 WeakPolarHBondContact O-CD1 3.44Å; V298-L302 WeakPolarHBondContact O-CG 2.99Å; V298-L302 PolarHBondContact O-N 3.11Å; K300-L302 VanDerWaalsContact C-N 3.34Å; L302-V304 VanDerWaalsContact C-N 3.32Å; L302-V304 PolarHBondContact O-N 2.81Å; L302-F305 WeakPolarHBondContact O-CA 3.42Å; L302-F305 WeakPolarHBondContact O-CB 3.38Å; L302-F305 PolarHBondContact O-N 2.87Å; L302-Y306 HydrophobicContact CB-CE2 4.44Å; L302-Y306 WeakPolarHBondContact O-CD2 3.27Å; L302-Y306 PolarHBondContact O-N 3.27Å |
| 303 | A | 59.2 | Low | 55.5 | Low | 4 Ų | 4 | 53 Ų | 53 | 3% | 0.033 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -51.7 | -49.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I208 F209 D299 K300 F305 T307 | I208-A303 HydrophobicContact CG1-CB 4.37Å; F209-A303 HydrophobicContact CD1-CB 4.15Å; F209-A303 VanDerWaalsContact CE1-CA 3.47Å; F209-A303 HydrophobicContact CE1-CB 3.19Å; F209-A303 WeakPolarHBondContact CE1-O 3.49Å; F209-A303 HydrophobicContact CZ-CB 3.45Å; F209-A303 VanDerWaalsContact CZ-CB 3.45Å; D299-A303 WeakPolarHBondContact O-CB 3.2Å; D299-A303 PolarHBondContact O-N 2.99Å; K300-A303 WeakPolarHBondContact O-CB 3.38Å; A303-F305 VanDerWaalsContact C-N 3.34Å; A303-T307 WeakPolarHBondContact O-CB 3.35Å; A303-T307 WeakPolarHBondContact O-CG2 3.33Å; A303-T307 PolarHBondContact O-N 2.99Å; A303-T307 VanDerWaalsContact O-N 3.15Å; A303-T307 PolarHBondContact O-OG1 3.42Å |
| 304 | V | 57.3 | Low | 56.4 | Low | 24 Ų | 24 | 44.2 Ų | 44.2 | 15% | 0.145 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.2 | -40.9 | 174.7 | 168.6 | 0 | 0 | 0 | 0 | 111.3 | L48 F62 I208 K300 F301 L302 I308 I309 | L48-V304 HydrophobicContact CD1-CG2 4.13Å; L48-V304 HydrophobicContact CD2-CG2 3.98Å; F62-V304 HydrophobicContact CE1-CG1 4.41Å; F62-V304 HydrophobicContact CZ-CG1 4.34Å; F62-V304 HydrophobicContact CZ-CG2 4.17Å; I208-V304 HydrophobicContact CD1-CG2 3.65Å; K300-V304 WeakPolarHBondContact O-CG2 3.45Å; K300-V304 PolarHBondContact O-N 3.04Å; K300-V304 VanDerWaalsContact O-N 3.16Å; F301-V304 PolarHBondContact O-N 3.23Å; L302-V304 VanDerWaalsContact C-N 3.32Å; L302-V304 PolarHBondContact O-N 2.81Å; V304-I308 HydrophobicContact CG1-CD1 4.12Å; V304-I308 WeakPolarHBondContact O-CB 3.31Å; V304-I308 PolarHBondContact O-N 3.27Å; V304-I309 PolarHBondContact O-N 3.17Å |
| 305 | F | 59.9 | Low | 57.3 | Low | 22 Ų | 22 | 42.9 Ų | 42.9 | 10% | 0.096 | 21% | 0.214 | C | C | . | . | I | π-helix | trans | -61.3 | -51.2 | -179.3 | -161.6 | -79 | 0 | 0 | 0 | 111.9 | L280 P284 F301 L302 A303 I309 T310 | L280-F305 HydrophobicContact CD2-CZ 4.26Å; L280-F305 WeakPolarHBondContact O-CE1 3.3Å; L280-F305 WeakPolarHBondContact O-CZ 3.38Å; P284-F305 HydrophobicContact CB-CD1 4.3Å; P284-F305 HydrophobicContact CG-CD1 3.8Å; P284-F305 HydrophobicContact CG-CE1 3.6Å; P284-F305 HydrophobicContact CG-CE2 4.45Å; P284-F305 HydrophobicContact CG-CG 4.34Å; P284-F305 HydrophobicContact CG-CZ 3.93Å; F301-F305 HydrophobicContact CE1-CD2 4.4Å; F301-F305 HydrophobicContact CZ-CD2 4.43Å; F301-F305 WeakPolarHBondContact O-CB 3.5Å; F301-F305 PolarHBondContact O-N 2.94Å; L302-F305 WeakPolarHBondContact O-CA 3.42Å; L302-F305 WeakPolarHBondContact O-CB 3.38Å; L302-F305 PolarHBondContact O-N 2.87Å; A303-F305 VanDerWaalsContact C-N 3.34Å; F305-I309 HydrophobicContact CD2-CB 4.24Å; F305-I309 HydrophobicContact CD2-CD1 3.65Å; F305-I309 HydrophobicContact CD2-CG1 4.46Å; F305-I309 HydrophobicContact CD2-CG2 4.25Å; F305-I309 HydrophobicContact CE1-CG2 4.35Å; F305-I309 HydrophobicContact CE2-CB 4.42Å; F305-I309 HydrophobicContact CE2-CD1 4.1Å; F305-I309 HydrophobicContact CE2-CG2 3.93Å; F305-I309 HydrophobicContact CG-CB 4.28Å; F305-I309 HydrophobicContact CG-CD1 4.29Å; F305-I309 HydrophobicContact CZ-CG2 3.99Å; F305-I309 WeakPolarHBondContact O-CA 3.36Å; F305-I309 WeakPolarHBondContact O-CB 3.39Å; F305-I309 PolarHBondContact O-N 3.4Å; F305-T310 PolarHBondContact O-N 3.15Å; F305-T310 PolarHBondContact O-OG1 3.26Å; F305-T310 VanDerWaalsContact O-OG1 3.12Å |
| 306 | Y | 59.4 | Low | 58 | Low | 58 Ų | 58 | 40.6 Ų | 40.6 | 23% | 0.227 | 20% | 0.201 | C | C | . | . | I | π-helix | trans | -68.9 | -38.3 | -179.7 | -73.5 | -69.6 | 0 | 0 | 0 | 114.7 | P284 C285 I288 L302 T310 | P284-Y306 HydrophobicContact CB-CE2 4.36Å; P284-Y306 WeakPolarHBondContact CB-OH 3.3Å; C285-Y306 WeakPolarHBondContact CA-OH 3.41Å; C285-Y306 WeakPolarHBondContact CB-OH 3.16Å; C285-Y306 PolarHBondContact N-OH 3.38Å; C285-Y306 WeakPolarHBondContact SG-CE1 3.33Å; C285-Y306 VanDerWaalsContact SG-CZ 3.52Å; C285-Y306 PolarHBondContact SG-OH 2.94Å; I288-Y306 HydrophobicContact CD1-CD2 4.4Å; I288-Y306 HydrophobicContact CD1-CE2 3.34Å; I288-Y306 WeakPolarHBondContact CD1-OH 3.49Å; L302-Y306 HydrophobicContact CB-CE2 4.44Å; L302-Y306 WeakPolarHBondContact O-CD2 3.27Å; L302-Y306 PolarHBondContact O-N 3.27Å; Y306-T310 WeakPolarHBondContact O-CB 3.4Å |
| 307 | T | 59.8 | Low | 58.8 | Low | 5 Ų | 5 | 33 Ų | 33 | 3% | 0.031 | 17% | 0.172 | C | C | . | . | I | π-helix | trans | -88 | -17.7 | -172.8 | 58.7 | 0 | 0 | 0 | 0 | 113.3 | L135 F209 A303 | L135-T307 HydrophobicContact CD2-CG2 4.2Å; F209-T307 HydrophobicContact CD1-CG2 3.9Å; F209-T307 HydrophobicContact CE1-CG2 3.42Å; F209-T307 VanDerWaalsContact CE1-CG2 3.42Å; F209-T307 HydrophobicContact CZ-CG2 3.92Å; A303-T307 WeakPolarHBondContact O-CB 3.35Å; A303-T307 WeakPolarHBondContact O-CG2 3.33Å; A303-T307 PolarHBondContact O-N 2.99Å; A303-T307 VanDerWaalsContact O-N 3.15Å; A303-T307 PolarHBondContact O-OG1 3.42Å |
| 308 | I | 62.2 | Low | 59.7 | Low | 6 Ų | 6 | 29.2 Ų | 29.2 | 3% | 0.031 | 14% | 0.144 | C | C | . | . | I | π-helix | trans | -126.6 | -47.7 | -171.5 | -50.4 | -172.7 | 0 | 0 | 0 | 112 | F62 I65 M112 V304 | F62-I308 HydrophobicContact CD1-CD1 3.43Å; F62-I308 VanDerWaalsContact CD1-CD1 3.43Å; F62-I308 HydrophobicContact CD1-CG2 4.37Å; F62-I308 HydrophobicContact CD2-CD1 3.89Å; F62-I308 HydrophobicContact CE1-CD1 3.32Å; F62-I308 HydrophobicContact CE2-CD1 3.79Å; F62-I308 HydrophobicContact CG-CD1 3.73Å; F62-I308 HydrophobicContact CZ-CD1 3.51Å; I65-I308 HydrophobicContact CB-CG2 4.13Å; I65-I308 HydrophobicContact CD1-CG2 3.76Å; I65-I308 HydrophobicContact CG2-CG2 3.43Å; I65-I308 VanDerWaalsContact CG2-CG2 3.43Å; M112-I308 HydrophobicContact CE-CD1 3.36Å; M112-I308 HydrophobicContact CE-CG1 3.91Å; M112-I308 HydrophobicContact SD-CD1 4.22Å; V304-I308 HydrophobicContact CG1-CD1 4.12Å; V304-I308 WeakPolarHBondContact O-CB 3.31Å; V304-I308 PolarHBondContact O-N 3.27Å |
| 309 | I | 62.2 | Low | 60.4 | Low | 60 Ų | 60 | 28.4 Ų | 28.4 | 31% | 0.308 | 14% | 0.139 | S | C | . | . | I | π-helix | trans | -79.6 | -44.3 | -174.1 | -61.7 | -178.6 | 0 | 0 | 0 | 110.6 | V304 F305 I312 L313 | V304-I309 PolarHBondContact O-N 3.17Å; F305-I309 HydrophobicContact CD2-CB 4.24Å; F305-I309 HydrophobicContact CD2-CD1 3.65Å; F305-I309 HydrophobicContact CD2-CG1 4.46Å; F305-I309 HydrophobicContact CD2-CG2 4.25Å; F305-I309 HydrophobicContact CE1-CG2 4.35Å; F305-I309 HydrophobicContact CE2-CB 4.42Å; F305-I309 HydrophobicContact CE2-CD1 4.1Å; F305-I309 HydrophobicContact CE2-CG2 3.93Å; F305-I309 HydrophobicContact CG-CB 4.28Å; F305-I309 HydrophobicContact CG-CD1 4.29Å; F305-I309 HydrophobicContact CZ-CG2 3.99Å; F305-I309 WeakPolarHBondContact O-CA 3.36Å; F305-I309 WeakPolarHBondContact O-CB 3.39Å; F305-I309 PolarHBondContact O-N 3.4Å; I309-I312 WeakPolarHBondContact O-CG2 3.27Å; I309-I312 PolarHBondContact O-N 3.23Å; I309-L313 HydrophobicContact CG2-CD1 3.82Å; I309-L313 HydrophobicContact CG2-CG 4.16Å; I309-L313 VanDerWaalsContact O-CG 3.24Å; I309-L313 WeakPolarHBondContact O-CG 3.41Å; I309-L313 PolarHBondContact O-N 3.22Å |
| 310 | T | 64 | Low | 60.6 | Low | 2 Ų | 2 | 30.9 Ų | 30.9 | 1% | 0.012 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.5 | -49.1 | -179.2 | -60 | 0 | 0 | 0 | 0 | 113.1 | F281 F305 Y306 I312 L313 | F281-T310 HydrophobicContact CD1-CG2 3.6Å; F281-T310 HydrophobicContact CD2-CG2 3.95Å; F281-T310 HydrophobicContact CE1-CG2 3.01Å; F281-T310 HydrophobicContact CE2-CG2 3.42Å; F281-T310 VanDerWaalsContact CE2-CG2 3.42Å; F281-T310 HydrophobicContact CG-CG2 4.05Å; F281-T310 HydrophobicContact CZ-CG2 2.95Å; F305-T310 PolarHBondContact O-N 3.15Å; F305-T310 PolarHBondContact O-OG1 3.26Å; F305-T310 VanDerWaalsContact O-OG1 3.12Å; Y306-T310 WeakPolarHBondContact O-CB 3.4Å; T310-I312 VanDerWaalsContact C-N 3.34Å; T310-I312 PolarHBondContact O-N 3.37Å; T310-L313 PolarHBondContact O-N 2.82Å |
| 311 | P | 62.6 | Low | 60.7 | Low | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -71 | -21.9 | -178.5 | -21.6 | 36.6 | 0 | 0 | 0 | 114.9 | T69 N73 D101 L104 P315 | T69-P311 HydrophobicContact CG2-CB 3.71Å; N73-P311 PolarHBondContact ND2-O 2.62Å; D101-P311 HydrophobicContact CB-CB 4.31Å; L104-P311 HydrophobicContact CD2-CG 4.14Å; P311-P315 WeakPolarHBondContact O-CD 3.25Å |
| 312 | I | 64.7 | Low | 61.4 | Low | 30 Ų | 30 | 31 Ų | 31 | 15% | 0.154 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -85.1 | -23.3 | 178.3 | -163.5 | 159.5 | 0 | 0 | 0 | 112.4 | I65 V68 I309 T310 P315 I316 | I65-I312 HydrophobicContact CG2-CD1 3.91Å; V68-I312 HydrophobicContact CB-CD1 4.29Å; V68-I312 HydrophobicContact CG1-CD1 3.81Å; V68-I312 HydrophobicContact CG1-CG1 4.39Å; I309-I312 WeakPolarHBondContact O-CG2 3.27Å; I309-I312 PolarHBondContact O-N 3.23Å; T310-I312 VanDerWaalsContact C-N 3.34Å; T310-I312 PolarHBondContact O-N 3.37Å; I312-P315 WeakPolarHBondContact O-CD 3.25Å; I312-I316 HydrophobicContact CG1-CD1 4.04Å; I312-I316 WeakPolarHBondContact O-CG1 3.41Å; I312-I316 PolarHBondContact O-N 2.9Å |
| 313 | L | 63.3 | Low | 62 | Low | 25 Ų | 25 | 38.4 Ų | 38.4 | 13% | 0.131 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -67.8 | -37.8 | 179.8 | -74.4 | 171.2 | 0 | 0 | 0 | 112 | L280 I309 T310 I316 I317 | L280-L313 HydrophobicContact CB-CD1 3.87Å; L280-L313 HydrophobicContact CD1-CD1 3.83Å; L280-L313 HydrophobicContact CD1-CD2 3.95Å; L280-L313 HydrophobicContact CG-CD1 4.38Å; I309-L313 HydrophobicContact CG2-CD1 3.82Å; I309-L313 HydrophobicContact CG2-CG 4.16Å; I309-L313 VanDerWaalsContact O-CG 3.24Å; I309-L313 WeakPolarHBondContact O-CG 3.41Å; I309-L313 PolarHBondContact O-N 3.22Å; T310-L313 PolarHBondContact O-N 2.82Å; L313-I316 PolarHBondContact O-N 2.79Å; L313-I317 HydrophobicContact CB-CD1 4.13Å; L313-I317 HydrophobicContact CD2-CD1 4.42Å; L313-I317 VanDerWaalsContact O-CB 3.29Å; L313-I317 WeakPolarHBondContact O-CB 3.37Å; L313-I317 WeakPolarHBondContact O-CD1 3.26Å; L313-I317 WeakPolarHBondContact O-CG1 3.43Å; L313-I317 PolarHBondContact O-N 3.27Å |
| 314 | N | 64.9 | Low | 62.4 | Low | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.3 | -52 | 179.7 | -75.1 | -20.4 | 0 | 0 | 0 | 111.9 | D101 I316 I317 Y318 | D101-N314 PolarHBondContact OD1-ND2 3.4Å; D101-N314 WeakPolarHBondContact OD2-CB 3.31Å; D101-N314 PolarHBondContact OD2-ND2 3.39Å; N314-I316 PolarHBondContact O-N 2.82Å; N314-I317 PolarHBondContact O-N 2.84Å; N314-Y318 HydrophobicContact CB-CD2 4.48Å; N314-Y318 VanDerWaalsContact O-CD2 3.23Å; N314-Y318 WeakPolarHBondContact O-CD2 3.47Å; N314-Y318 PolarHBondContact O-N 3.27Å |
| 315 | P | 60.3 | Low | 63.1 | Low | 9 Ų | 9 | 41.9 Ų | 41.9 | 6% | 0.058 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.6 | -45.2 | 173.3 | -26.3 | 32.7 | 0 | 0 | 0 | 114.6 | N73 I76 P311 I312 I317 T319 | N73-P315 WeakPolarHBondContact ND2-CG 3.28Å; I76-P315 HydrophobicContact CD1-CB 4.09Å; I76-P315 HydrophobicContact CD1-CG 4.25Å; P311-P315 WeakPolarHBondContact O-CD 3.25Å; I312-P315 WeakPolarHBondContact O-CD 3.25Å; P315-I317 VanDerWaalsContact C-N 3.31Å; P315-I317 PolarHBondContact O-N 2.94Å; P315-T319 WeakPolarHBondContact O-CB 3.49Å; P315-T319 VanDerWaalsContact O-CG2 3.24Å; P315-T319 WeakPolarHBondContact O-CG2 2.98Å; P315-T319 PolarHBondContact O-N 3.33Å; P315-T319 PolarHBondContact O-OG1 2.87Å |
| 316 | I | 62.3 | Low | 63.7 | Low | 77 Ų | 77 | 45.3 Ų | 45.3 | 40% | 0.395 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -60.5 | -45 | -179.6 | -72.2 | 173.4 | 0 | 0 | 0 | 110.3 | I312 L313 N314 L320 | I312-I316 HydrophobicContact CG1-CD1 4.04Å; I312-I316 WeakPolarHBondContact O-CG1 3.41Å; I312-I316 PolarHBondContact O-N 2.9Å; L313-I316 PolarHBondContact O-N 2.79Å; N314-I316 PolarHBondContact O-N 2.82Å; I316-L320 HydrophobicContact CG2-CD1 4.17Å; I316-L320 WeakPolarHBondContact O-CB 3.39Å; I316-L320 PolarHBondContact O-N 3.38Å |
| 317 | I | 64.3 | Low | 64.5 | Low | 11 Ų | 11 | 47 Ų | 47 | 6% | 0.056 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -74.9 | -47.8 | -173 | -66.8 | 167.9 | 0 | 0 | 0 | 110.6 | A273 V277 L313 N314 P315 R321 | A273-I317 HydrophobicContact CB-CG2 3.74Å; V277-I317 HydrophobicContact CB-CD1 4.4Å; V277-I317 HydrophobicContact CG2-CB 4.14Å; V277-I317 HydrophobicContact CG2-CD1 3.34Å; V277-I317 HydrophobicContact CG2-CG1 4.28Å; V277-I317 HydrophobicContact CG2-CG2 3.77Å; L313-I317 HydrophobicContact CB-CD1 4.13Å; L313-I317 HydrophobicContact CD2-CD1 4.42Å; L313-I317 VanDerWaalsContact O-CB 3.29Å; L313-I317 WeakPolarHBondContact O-CB 3.37Å; L313-I317 WeakPolarHBondContact O-CD1 3.26Å; L313-I317 WeakPolarHBondContact O-CG1 3.43Å; L313-I317 PolarHBondContact O-N 3.27Å; N314-I317 PolarHBondContact O-N 2.84Å; P315-I317 VanDerWaalsContact C-N 3.31Å; P315-I317 PolarHBondContact O-N 2.94Å; I317-R321 WeakPolarHBondContact O-CB 3.46Å; I317-R321 PolarHBondContact O-N 3.48Å |
| 318 | Y | 62.9 | Low | 65.3 | Low | 9 Ų | 9 | 47.3 Ų | 47.3 | 4% | 0.035 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -80.9 | -23.2 | -177.1 | -67.4 | -75.2 | 0 | 0 | 0 | 114.3 | M90 L94 L97 M149 H274 N314 N322 | M90-Y318 HydrophobicContact CE-CD1 4.28Å; M90-Y318 HydrophobicContact CE-CE1 3.93Å; L94-Y318 HydrophobicContact CD1-CD1 4.04Å; L94-Y318 HydrophobicContact CD1-CD2 3.38Å; L94-Y318 HydrophobicContact CD1-CE1 4.38Å; L94-Y318 HydrophobicContact CD1-CE2 3.78Å; L94-Y318 HydrophobicContact CD1-CG 3.52Å; L94-Y318 HydrophobicContact CD2-CD1 4.12Å; L94-Y318 HydrophobicContact CD2-CG 3.95Å; L94-Y318 HydrophobicContact CG-CG 4.4Å; L97-Y318 HydrophobicContact CD2-CE2 4.39Å; M149-Y318 HydrophobicContact CE-CE1 3.62Å; M149-Y318 HydrophobicContact CE-CE2 4.25Å; M149-Y318 VanDerWaalsContact CE-CZ 3.46Å; M149-Y318 VanDerWaalsContact CE-OH 3.24Å; M149-Y318 WeakPolarHBondContact CE-OH 3.36Å; H274-Y318 AromaticContact CE1-CE1 3.59Å; H274-Y318 AromaticContact CE1-CZ 3.62Å; H274-Y318 PolarHBondContact CE1-OH 3.31Å; H274-Y318 AromaticContact ND1-CZ 4Å; H274-Y318 PolarHBondContact ND1-OH 3.23Å; H274-Y318 VanDerWaalsContact ND1-OH 3.1Å; H274-Y318 AromaticContact NE2-CE1 3.87Å; N314-Y318 HydrophobicContact CB-CD2 4.48Å; N314-Y318 VanDerWaalsContact O-CD2 3.23Å; N314-Y318 WeakPolarHBondContact O-CD2 3.47Å; N314-Y318 PolarHBondContact O-N 3.27Å; Y318-N322 WeakPolarHBondContact O-CB 3Å |
| 319 | T | 63.1 | Low | 66.2 | Low | 23 Ų | 23 | 48.4 Ų | 48.4 | 14% | 0.141 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -94 | -43.4 | 177 | 72.2 | 0 | 0 | 0 | 0 | 112.6 | I76 P315 K326 M329 | I76-T319 HydrophobicContact CD1-CG2 3.68Å; I76-T319 HydrophobicContact CG1-CG2 3.54Å; P315-T319 WeakPolarHBondContact O-CB 3.49Å; P315-T319 VanDerWaalsContact O-CG2 3.24Å; P315-T319 WeakPolarHBondContact O-CG2 2.98Å; P315-T319 PolarHBondContact O-N 3.33Å; P315-T319 PolarHBondContact O-OG1 2.87Å; T319-K326 WeakPolarHBondContact O-CE 3.45Å; T319-K326 VanDerWaalsContact O-CG 3.23Å; T319-K326 WeakPolarHBondContact O-CG 3.2Å; T319-M329 HydrophobicContact CG2-CE 3.44Å; T319-M329 VanDerWaalsContact CG2-CE 3.44Å; T319-M329 HydrophobicContact CG2-SD 4.15Å |
| 320 | L | 57.8 | Low | 67 | Low | 103 Ų | 103 | 52.1 Ų | 52.1 | 54% | 0.539 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -84.7 | -19.3 | -174.7 | -56.6 | 178.3 | 0 | 0 | 0 | 113.3 | I316 K326 | I316-L320 HydrophobicContact CG2-CD1 4.17Å; I316-L320 WeakPolarHBondContact O-CB 3.39Å; I316-L320 PolarHBondContact O-N 3.38Å; L320-K326 VanDerWaalsContact C-CE 3.4Å; L320-K326 WeakPolarHBondContact O-CE 3.14Å; L320-K326 PolarHBondContact O-NZ 3.1Å |
| 321 | R | 58.7 | Low | 67.7 | Low | 141 Ų | 141 | 58.5 Ų | 58.5 | 53% | 0.532 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -102.7 | -23.5 | 175.5 | -60.5 | -168.3 | 170.7 | -154.7 | 0.1 | 113.9 | I317 K323 | I317-R321 WeakPolarHBondContact O-CB 3.46Å; I317-R321 PolarHBondContact O-N 3.48Å; R321-K323 PolarHBondContact O-N 3.16Å |
| 322 | N | 66.5 | Low | 68.6 | Low | 28 Ų | 28 | 60.9 Ų | 60.9 | 15% | 0.15 | 28% | 0.284 | C | S | . | . | trans | -85.6 | 113.9 | -180 | -167 | -33.3 | 0 | 0 | 0 | 112.2 | Y91 Y318 E324 M325 K326 | Y91-N322 PolarHBondContact OH-ND2 3.42Å; Y91-N322 PolarHBondContact OH-OD1 3.46Å; Y318-N322 WeakPolarHBondContact O-CB 3Å; N322-E324 VanDerWaalsContact C-N 3.32Å; N322-E324 PolarHBondContact O-N 3.39Å; N322-E324 WeakPolarHBondContact OD1-CB 3.33Å; N322-E324 PolarHBondContact OD1-N 3.37Å; N322-M325 HydrophobicContact CB-CB 4.15Å; N322-M325 HydrophobicContact CB-CG 4.11Å; N322-M325 PolarHBondContact O-N 2.98Å; N322-M325 PolarHBondContact OD1-N 2.91Å; N322-K326 PolarHBondContact O-N 1.99Å; N322-K326 VanDerWaalsContact O-N 3.09Å | ||
| 323 | K | 66.8 | Low | 69.3 | Low | 169 Ų | 169 | 67.5 Ų | 67.5 | 74% | 0.735 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -61.1 | -37.3 | 178.7 | -69.5 | -177.3 | 178.9 | -179.6 | 0 | 112.7 | R321 K326 I327 | R321-K323 PolarHBondContact O-N 3.16Å; K323-K326 PolarHBondContact O-N 3.02Å; K323-I327 WeakPolarHBondContact O-CD1 3.33Å; K323-I327 VanDerWaalsContact O-CG1 3.24Å; K323-I327 WeakPolarHBondContact O-CG1 3.44Å; K323-I327 PolarHBondContact O-N 3.03Å |
| 324 | E | 66.8 | Low | 70.2 | Confident | 101 Ų | 101 | 74.5 Ų | 74.5 | 47% | 0.472 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -69.1 | -40 | -179.2 | -63.9 | 178 | 173.9 | 0 | 0 | 111.3 | L86 Y91 N322 I327 S328 | L86-E324 HydrophobicContact CD2-CB 4.38Å; Y91-E324 WeakPolarHBondContact CE2-OE2 3.48Å; Y91-E324 WeakPolarHBondContact OH-CB 3.36Å; Y91-E324 PolarHBondContact OH-OE2 2.81Å; N322-E324 VanDerWaalsContact C-N 3.32Å; N322-E324 PolarHBondContact O-N 3.39Å; N322-E324 WeakPolarHBondContact OD1-CB 3.33Å; N322-E324 PolarHBondContact OD1-N 3.37Å; E324-I327 PolarHBondContact O-N 2.89Å; E324-S328 WeakPolarHBondContact O-CB 3.4Å; E324-S328 PolarHBondContact O-N 3.29Å; E324-S328 PolarHBondContact O-OG 3.12Å |
| 325 | M | 71.9 | Confident | 70.7 | Confident | 1 Ų | 1 | 77.3 Ų | 77.3 | 1% | 0.005 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -64.5 | -45 | 173.1 | -69.2 | -44.4 | -63.9 | 0 | 0 | 111.9 | T79 L86 Y91 N322 I327 S328 M329 | T79-M325 HydrophobicContact CG2-CE 3.43Å; T79-M325 VanDerWaalsContact CG2-CE 3.43Å; L86-M325 HydrophobicContact CD1-CE 3.68Å; L86-M325 HydrophobicContact CD1-SD 3.45Å; L86-M325 WeakPolarHBondContact CD1-SD 3.36Å; L86-M325 HydrophobicContact CD2-SD 3.89Å; L86-M325 HydrophobicContact CG-SD 4.32Å; Y91-M325 HydrophobicContact CD1-CG 4.48Å; Y91-M325 HydrophobicContact CD1-SD 3.66Å; Y91-M325 HydrophobicContact CE1-CG 3.79Å; Y91-M325 HydrophobicContact CE1-SD 3.38Å; Y91-M325 WeakPolarHBondContact CE1-SD 3.32Å; N322-M325 HydrophobicContact CB-CB 4.15Å; N322-M325 HydrophobicContact CB-CG 4.11Å; N322-M325 PolarHBondContact O-N 2.98Å; N322-M325 PolarHBondContact OD1-N 2.91Å; M325-I327 VanDerWaalsContact C-N 3.32Å; M325-I327 PolarHBondContact O-N 3.05Å; M325-S328 PolarHBondContact O-N 3.47Å; M325-M329 HydrophobicContact CE-CE 4.02Å; M325-M329 WeakPolarHBondContact O-CB 3.25Å; M325-M329 VanDerWaalsContact O-CG 3.28Å; M325-M329 WeakPolarHBondContact O-CG 3.13Å; M325-M329 PolarHBondContact O-N 2.91Å |
| 326 | K | 72.5 | Confident | 71.5 | Confident | 94 Ų | 94 | 81.8 Ų | 81.8 | 41% | 0.409 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -57.2 | -44.9 | 176 | -73 | -173 | 179.1 | 177.4 | 0 | 112.7 | T319 L320 N322 K323 K330 | T319-K326 WeakPolarHBondContact O-CE 3.45Å; T319-K326 VanDerWaalsContact O-CG 3.23Å; T319-K326 WeakPolarHBondContact O-CG 3.2Å; L320-K326 VanDerWaalsContact C-CE 3.4Å; L320-K326 WeakPolarHBondContact O-CE 3.14Å; L320-K326 PolarHBondContact O-NZ 3.1Å; N322-K326 PolarHBondContact O-N 1.99Å; N322-K326 VanDerWaalsContact O-N 3.09Å; K323-K326 PolarHBondContact O-N 3.02Å; K326-K330 WeakPolarHBondContact O-CB 3.46Å; K326-K330 WeakPolarHBondContact O-CG 3.45Å; K326-K330 PolarHBondContact O-N 3.03Å |
| 327 | I | 77.9 | Confident | 72.3 | Confident | 94 Ų | 94 | 80.4 Ų | 80.4 | 48% | 0.482 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.1 | -45.1 | -180 | -69.5 | 164.8 | 0 | 0 | 0 | 110 | K323 E324 M325 K330 K331 | K323-I327 WeakPolarHBondContact O-CD1 3.33Å; K323-I327 VanDerWaalsContact O-CG1 3.24Å; K323-I327 WeakPolarHBondContact O-CG1 3.44Å; K323-I327 PolarHBondContact O-N 3.03Å; E324-I327 PolarHBondContact O-N 2.89Å; M325-I327 VanDerWaalsContact C-N 3.32Å; M325-I327 PolarHBondContact O-N 3.05Å; I327-K330 PolarHBondContact O-N 3.14Å; I327-K331 HydrophobicContact CG2-CD 4.41Å; I327-K331 WeakPolarHBondContact O-CG 3.27Å; I327-K331 PolarHBondContact O-N 3.47Å |
| 328 | S | 76.7 | Confident | 72.8 | Confident | 10 Ų | 10 | 84.3 Ų | 84.3 | 7% | 0.07 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -65.1 | -44.4 | -179.1 | -56.4 | 0 | 0 | 0 | 0 | 111.9 | E324 M325 K330 K331 L332 | E324-S328 WeakPolarHBondContact O-CB 3.4Å; E324-S328 PolarHBondContact O-N 3.29Å; E324-S328 PolarHBondContact O-OG 3.12Å; M325-S328 PolarHBondContact O-N 3.47Å; S328-K330 PolarHBondContact O-N 3.27Å; S328-K331 PolarHBondContact O-N 3.11Å; S328-L332 PolarHBondContact O-N 3.36Å |
| 329 | M | 79.8 | Confident | 73.2 | Confident | 29 Ų | 29 | 87.3 Ų | 87.3 | 14% | 0.143 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 175.2 | -71.2 | 179.6 | 173.9 | 0 | 0 | 112.2 | L75 I76 T79 T319 M325 K331 L332 W333 | L75-M329 HydrophobicContact CD2-CE 3.9Å; L75-M329 HydrophobicContact CD2-CG 4.39Å; L75-M329 HydrophobicContact CD2-SD 3.69Å; L75-M329 HydrophobicContact CG-CE 3.79Å; L75-M329 HydrophobicContact CG-CG 4.42Å; L75-M329 HydrophobicContact CG-SD 4.1Å; I76-M329 HydrophobicContact CG1-CE 3.98Å; T79-M329 HydrophobicContact CG2-CG 3.97Å; T319-M329 HydrophobicContact CG2-CE 3.44Å; T319-M329 VanDerWaalsContact CG2-CE 3.44Å; T319-M329 HydrophobicContact CG2-SD 4.15Å; M325-M329 HydrophobicContact CE-CE 4.02Å; M325-M329 WeakPolarHBondContact O-CB 3.25Å; M325-M329 VanDerWaalsContact O-CG 3.28Å; M325-M329 WeakPolarHBondContact O-CG 3.13Å; M325-M329 PolarHBondContact O-N 2.91Å; M329-K331 VanDerWaalsContact C-N 3.33Å; M329-K331 PolarHBondContact O-N 2.93Å; M329-L332 PolarHBondContact O-N 3.04Å; M329-W333 WeakPolarHBondContact O-CB 3.48Å; M329-W333 PolarHBondContact O-N 3.42Å |
| 330 | K | 79.8 | Confident | 73.1 | Confident | 139 Ų | 139 | 94 Ų | 94 | 60% | 0.604 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.8 | -39.7 | 174.5 | -78.5 | -178 | -179.4 | -172.5 | 0 | 112.2 | K326 I327 S328 R334 | K326-K330 WeakPolarHBondContact O-CB 3.46Å; K326-K330 WeakPolarHBondContact O-CG 3.45Å; K326-K330 PolarHBondContact O-N 3.03Å; I327-K330 PolarHBondContact O-N 3.14Å; S328-K330 PolarHBondContact O-N 3.27Å; K330-R334 VanDerWaalsContact O-CG 3.29Å; K330-R334 WeakPolarHBondContact O-CG 3.04Å; K330-R334 PolarHBondContact O-N 3.16Å |
| 331 | K | 79.3 | Confident | 73.1 | Confident | 136 Ų | 136 | 96.8 Ų | 96.8 | 59% | 0.591 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -65.9 | -46.1 | 176.6 | -75.2 | -179.4 | 177.7 | -174.9 | 0 | 111.3 | I327 S328 M329 W333 R334 A335 | I327-K331 HydrophobicContact CG2-CD 4.41Å; I327-K331 WeakPolarHBondContact O-CG 3.27Å; I327-K331 PolarHBondContact O-N 3.47Å; S328-K331 PolarHBondContact O-N 3.11Å; M329-K331 VanDerWaalsContact C-N 3.33Å; M329-K331 PolarHBondContact O-N 2.93Å; K331-W333 VanDerWaalsContact C-N 3.35Å; K331-W333 PolarHBondContact O-N 3.29Å; K331-R334 PolarHBondContact O-N 3.44Å; K331-A335 PolarHBondContact O-N 3.37Å |
| 332 | L | 79.9 | Confident | 72.7 | Confident | 50 Ų | 50 | 96.9 Ų | 96.9 | 26% | 0.262 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.8 | -44.4 | 177.3 | -172.2 | 71.3 | 0 | 0 | 0 | 111.5 | V78 K82 S328 M329 R334 A335 F336 | V78-L332 HydrophobicContact CG1-CD2 3.91Å; K82-L332 HydrophobicContact CB-CD1 4.15Å; S328-L332 PolarHBondContact O-N 3.36Å; M329-L332 PolarHBondContact O-N 3.04Å; L332-R334 PolarHBondContact O-N 3.5Å; L332-A335 PolarHBondContact O-N 2.89Å; L332-F336 WeakPolarHBondContact O-CB 3.31Å; L332-F336 PolarHBondContact O-N 2.64Å |
| 333 | W | 80.6 | Confident | 71.7 | Confident | 169 Ų | 169 | 103.3 Ų | 103.3 | 64% | 0.64 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60 | -45.8 | 175.7 | -178.3 | -97.8 | 0 | 0 | 0 | 112.3 | M329 K331 A335 F336 V337 | M329-W333 WeakPolarHBondContact O-CB 3.48Å; M329-W333 PolarHBondContact O-N 3.42Å; K331-W333 VanDerWaalsContact C-N 3.35Å; K331-W333 PolarHBondContact O-N 3.29Å; W333-A335 PolarHBondContact O-N 3.41Å; W333-F336 PolarHBondContact O-N 2.95Å; W333-V337 HydrophobicContact CD2-CG2 4.33Å; W333-V337 HydrophobicContact CG-CG2 4.47Å; W333-V337 HydrophobicContact CZ2-CG2 4.22Å; W333-V337 WeakPolarHBondContact O-CB 3.4Å; W333-V337 VanDerWaalsContact O-CG2 3.32Å; W333-V337 WeakPolarHBondContact O-CG2 3.45Å; W333-V337 PolarHBondContact O-N 2.97Å |
| 334 | R | 81.1 | Confident | 71.9 | Confident | 171 Ų | 171 | 100 Ų | 100 | 65% | 0.645 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.3 | -44.2 | 176.2 | -74.2 | 175.8 | -174.5 | -173.5 | -0.2 | 112 | K330 K331 L332 F336 V337 N338 | K330-R334 VanDerWaalsContact O-CG 3.29Å; K330-R334 WeakPolarHBondContact O-CG 3.04Å; K330-R334 PolarHBondContact O-N 3.16Å; K331-R334 PolarHBondContact O-N 3.44Å; L332-R334 PolarHBondContact O-N 3.5Å; R334-F336 VanDerWaalsContact C-N 3.32Å; R334-F336 PolarHBondContact O-N 2.85Å; R334-V337 PolarHBondContact O-N 2.68Å; R334-N338 WeakPolarHBondContact O-CB 3.36Å; R334-N338 PolarHBondContact O-N 3.22Å; R334-N338 PolarHBondContact O-ND2 3.06Å; R334-N338 PolarHBondContact O-OD1 2.97Å |
| 335 | A | 76.8 | Confident | 72.2 | Confident | 59 Ų | 59 | 99.9 Ų | 99.9 | 49% | 0.488 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -61.7 | -41.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K331 L332 W333 N338 S339 | K331-A335 PolarHBondContact O-N 3.37Å; L332-A335 PolarHBondContact O-N 2.89Å; W333-A335 PolarHBondContact O-N 3.41Å; A335-N338 PolarHBondContact O-N 3.31Å; A335-S339 WeakPolarHBondContact O-CB 3.3Å; A335-S339 PolarHBondContact O-N 2.84Å |
| 336 | F | 76.8 | Confident | 72.2 | Confident | 103 Ų | 103 | 105.4 Ų | 105.4 | 45% | 0.452 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.5 | -41.1 | 177.5 | -179.5 | -113.3 | 0 | 0 | 0 | 113.4 | L332 W333 R334 N338 R340 | L332-F336 WeakPolarHBondContact O-CB 3.31Å; L332-F336 PolarHBondContact O-N 2.64Å; W333-F336 PolarHBondContact O-N 2.95Å; R334-F336 VanDerWaalsContact C-N 3.32Å; R334-F336 PolarHBondContact O-N 2.85Å; F336-N338 VanDerWaalsContact C-N 3.35Å; F336-R340 PolarHBondContact O-N 3Å |
| 337 | V | 78.3 | Confident | 72.2 | Confident | 49 Ų | 49 | 106.1 Ų | 106.1 | 30% | 0.297 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 174.9 | 170 | 0 | 0 | 0 | 0 | 111.1 | W333 R334 R340 K341 | W333-V337 HydrophobicContact CD2-CG2 4.33Å; W333-V337 HydrophobicContact CG-CG2 4.47Å; W333-V337 HydrophobicContact CZ2-CG2 4.22Å; W333-V337 WeakPolarHBondContact O-CB 3.4Å; W333-V337 VanDerWaalsContact O-CG2 3.32Å; W333-V337 WeakPolarHBondContact O-CG2 3.45Å; W333-V337 PolarHBondContact O-N 2.97Å; R334-V337 PolarHBondContact O-N 2.68Å; V337-R340 PolarHBondContact O-N 3.37Å; V337-K341 PolarHBondContact O-N 3.49Å |
| 338 | N | 75.4 | Confident | 71.8 | Confident | 92 Ų | 92 | 106.9 Ų | 106.9 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.6 | -43.3 | 177.8 | -68.9 | -6.7 | 0 | 0 | 0 | 111.5 | R334 A335 F336 R340 K341 D342 | R334-N338 WeakPolarHBondContact O-CB 3.36Å; R334-N338 PolarHBondContact O-N 3.22Å; R334-N338 PolarHBondContact O-ND2 3.06Å; R334-N338 PolarHBondContact O-OD1 2.97Å; A335-N338 PolarHBondContact O-N 3.31Å; F336-N338 VanDerWaalsContact C-N 3.35Å; N338-R340 PolarHBondContact O-N 3.02Å; N338-R340 VanDerWaalsContact O-N 3.12Å; N338-K341 WeakPolarHBondContact O-CB 3.42Å; N338-K341 PolarHBondContact O-N 3.15Å; N338-D342 PolarHBondContact O-N 3.33Å |
| 339 | S | 70.3 | Confident | 71.5 | Confident | 73 Ų | 73 | 113.3 Ų | 113.3 | 51% | 0.51 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.4 | -23.2 | 175 | -178.3 | 0 | 0 | 0 | 0 | 113.6 | A335 T343 | A335-S339 WeakPolarHBondContact O-CB 3.3Å; A335-S339 PolarHBondContact O-N 2.84Å; S339-T343 PolarHBondContact O-OG1 3.29Å |
| 340 | R | 60.8 | Low | 70.9 | Confident | 163 Ų | 163 | 119.4 Ų | 119.4 | 62% | 0.615 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | -12.9 | 174.8 | -107.7 | -160.5 | -101.1 | -167.7 | -10.8 | 114.3 | F336 V337 N338 | F336-R340 PolarHBondContact O-N 3Å; V337-R340 PolarHBondContact O-N 3.37Å; N338-R340 PolarHBondContact O-N 3.02Å; N338-R340 VanDerWaalsContact O-N 3.12Å |
| 341 | K | 57.8 | Low | 70.2 | Confident | 161 Ų | 161 | 117.8 Ų | 117.8 | 70% | 0.7 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -19.8 | 173.7 | -74.4 | -177.4 | 174.3 | -174.1 | 0 | 112.3 | V337 N338 | V337-K341 PolarHBondContact O-N 3.49Å; N338-K341 WeakPolarHBondContact O-CB 3.42Å; N338-K341 PolarHBondContact O-N 3.15Å |
| 342 | D | 51.1 | Low | 69.5 | Low | 143 Ų | 143 | 116.3 Ų | 116.3 | 77% | 0.765 | 57% | 0.572 | S | S | * | * | trans | -95.6 | 3.4 | -179.4 | -60 | -31.2 | 0 | 0 | 0 | 113.2 | N338 | N338-D342 PolarHBondContact O-N 3.33Š| ||
| 343 | T | 45 | Very low | 68.5 | Low | 163 Ų | 163 | 122.4 Ų | 122.4 | 100% | 1 | 60% | 0.6 | S | S | * | * | trans | -117.5 | 0 | 173.5 | 47.8 | 0 | 0 | 0 | 0 | 110.6 | S339 | S339-T343 PolarHBondContact O-OG1 3.29Š|
Retrieved 343 of 343 residues in 89.9 ms
(Link to these results)