| 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 | 44.3 | Very low | 45.3 | Very low | 148 Ų | 148 | 85.5 Ų | 85.5 | 73% | 0.729 | 46% | 0.459 | S | S | * | . | 0 | -51.4 | 0 | -136.7 | 176.5 | 79.6 | 0 | 0 | 111.8 | T4 I5 | M1-T4 VanDerWaalsContact C-OG1 3.24Å; M1-T4 WeakPolarHBondContact CA-OG1 3.25Å; M1-T4 PolarHBondContact O-N 2.94Å; M1-T4 PolarHBondContact O-OG1 2.74Å; M1-I5 WeakPolarHBondContact O-CD1 3.48Å; M1-I5 VanDerWaalsContact O-CG1 3.29Å; M1-I5 WeakPolarHBondContact O-CG1 3.43Å; M1-I5 PolarHBondContact O-N 3.13Å | |||
| 2 | V | 37 | Very low | 46 | Very low | 71 Ų | 71 | 80 Ų | 80 | 43% | 0.43 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -57.4 | -51 | 172.8 | -178.7 | 0 | 0 | 0 | 0 | 111.1 | T4 I5 E6 | V2-T4 VanDerWaalsContact C-N 3.3Å; V2-T4 PolarHBondContact O-N 2.99Å; V2-I5 CarbonylContact O-C 3.47Å; V2-I5 WeakPolarHBondContact O-CA 3.47Å; V2-I5 WeakPolarHBondContact O-CB 3.24Å; V2-I5 PolarHBondContact O-N 3.27Å; V2-E6 HydrophobicContact CG1-CG 4.37Å; V2-E6 WeakPolarHBondContact CG1-OE1 3.48Å; V2-E6 WeakPolarHBondContact O-CG 3.24Å; V2-E6 PolarHBondContact O-N 2.78Å |
| 3 | L | 40.3 | Very low | 46.7 | Very low | 123 Ų | 123 | 75.5 Ų | 75.5 | 64% | 0.644 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -59.9 | -35 | 178.1 | -142 | 84.6 | 0 | 0 | 0 | 114.1 | E6 C7 | L3-E6 PolarHBondContact O-N 3.01Å; L3-C7 WeakPolarHBondContact O-CB 3.45Å; L3-C7 PolarHBondContact O-N 2.75Å; L3-C7 PolarHBondContact O-SG 3.32Å |
| 4 | T | 44.2 | Very low | 47.2 | Very low | 80 Ų | 80 | 82.7 Ų | 82.7 | 49% | 0.491 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -71.2 | -36.2 | 176 | 40.4 | 0 | 0 | 0 | 0 | 111.4 | M1 V2 I8 | M1-T4 VanDerWaalsContact C-OG1 3.24Å; M1-T4 WeakPolarHBondContact CA-OG1 3.25Å; M1-T4 PolarHBondContact O-N 2.94Å; M1-T4 PolarHBondContact O-OG1 2.74Å; V2-T4 VanDerWaalsContact C-N 3.3Å; V2-T4 PolarHBondContact O-N 2.99Å; T4-I8 WeakPolarHBondContact O-CB 3.39Å; T4-I8 WeakPolarHBondContact O-CD1 3.13Å; T4-I8 WeakPolarHBondContact O-CG1 3.43Å; T4-I8 PolarHBondContact O-N 3.25Å |
| 5 | I | 43.6 | Very low | 47.7 | Very low | 55 Ų | 55 | 81.8 Ų | 81.8 | 28% | 0.282 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -68.1 | -42.3 | 173.5 | -66 | 163 | 0 | 0 | 0 | 109.5 | M1 V2 I8 L9 | M1-I5 WeakPolarHBondContact O-CD1 3.48Å; M1-I5 VanDerWaalsContact O-CG1 3.29Å; M1-I5 WeakPolarHBondContact O-CG1 3.43Å; M1-I5 PolarHBondContact O-N 3.13Å; V2-I5 CarbonylContact O-C 3.47Å; V2-I5 WeakPolarHBondContact O-CA 3.47Å; V2-I5 WeakPolarHBondContact O-CB 3.24Å; V2-I5 PolarHBondContact O-N 3.27Å; I5-I8 PolarHBondContact O-N 2.78Å; I5-L9 HydrophobicContact CG2-CD1 3.84Å; I5-L9 HydrophobicContact CG2-CG 4.32Å; I5-L9 WeakPolarHBondContact O-CB 3.17Å; I5-L9 VanDerWaalsContact O-CG 3.23Å; I5-L9 WeakPolarHBondContact O-CG 3.39Å; I5-L9 PolarHBondContact O-N 2.93Å |
| 6 | E | 42.9 | Very low | 48.2 | Very low | 63 Ų | 63 | 76.8 Ų | 76.8 | 29% | 0.294 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.4 | -45.7 | 175 | -72 | 173.1 | 176.8 | 0 | 0 | 112.6 | V2 L3 L9 L10 | V2-E6 HydrophobicContact CG1-CG 4.37Å; V2-E6 WeakPolarHBondContact CG1-OE1 3.48Å; V2-E6 WeakPolarHBondContact O-CG 3.24Å; V2-E6 PolarHBondContact O-N 2.78Å; L3-E6 PolarHBondContact O-N 3.01Å; E6-L9 PolarHBondContact O-N 3.17Å; E6-L10 WeakPolarHBondContact O-CG 3.45Å; E6-L10 PolarHBondContact O-N 3.48Å |
| 7 | C | 45.4 | Very low | 48.7 | Very low | 67 Ų | 67 | 75.3 Ų | 75.3 | 45% | 0.453 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.1 | -42.1 | 175.8 | -78.2 | 0 | 0 | 0 | 0 | 112 | L3 L9 L10 I11 | L3-C7 WeakPolarHBondContact O-CB 3.45Å; L3-C7 PolarHBondContact O-N 2.75Å; L3-C7 PolarHBondContact O-SG 3.32Å; C7-L9 VanDerWaalsContact C-N 3.31Å; C7-L10 PolarHBondContact O-N 3.36Å; C7-I11 WeakPolarHBondContact O-CB 3.37Å; C7-I11 WeakPolarHBondContact O-CD1 3.46Å; C7-I11 WeakPolarHBondContact O-CG1 3.38Å; C7-I11 PolarHBondContact O-N 3.01Å |
| 8 | I | 49.1 | Very low | 49 | Very low | 105 Ų | 105 | 75.9 Ų | 75.9 | 54% | 0.538 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.2 | -44.9 | 174.1 | -69.2 | 164.7 | 0 | 0 | 0 | 109.2 | T4 I5 I11 T12 | T4-I8 WeakPolarHBondContact O-CB 3.39Å; T4-I8 WeakPolarHBondContact O-CD1 3.13Å; T4-I8 WeakPolarHBondContact O-CG1 3.43Å; T4-I8 PolarHBondContact O-N 3.25Å; I5-I8 PolarHBondContact O-N 2.78Å; I8-I11 PolarHBondContact O-N 3.5Å; I8-T12 HydrophobicContact CG2-CG2 4.13Å; I8-T12 WeakPolarHBondContact O-CB 3.47Å; I8-T12 WeakPolarHBondContact O-CG2 3.29Å; I8-T12 PolarHBondContact O-N 2.77Å; I8-T12 PolarHBondContact O-OG1 2.97Å |
| 9 | L | 49.2 | Very low | 49.2 | Very low | 7 Ų | 7 | 74.3 Ų | 74.3 | 4% | 0.037 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.1 | -49.6 | 177.5 | -76.5 | 169.2 | 0 | 0 | 0 | 111.8 | I5 E6 C7 I11 T12 L13 I64 I67 I258 | I5-L9 HydrophobicContact CG2-CD1 3.84Å; I5-L9 HydrophobicContact CG2-CG 4.32Å; I5-L9 WeakPolarHBondContact O-CB 3.17Å; I5-L9 VanDerWaalsContact O-CG 3.23Å; I5-L9 WeakPolarHBondContact O-CG 3.39Å; I5-L9 PolarHBondContact O-N 2.93Å; E6-L9 PolarHBondContact O-N 3.17Å; C7-L9 VanDerWaalsContact C-N 3.31Å; L9-I11 PolarHBondContact O-N 3.13Å; L9-T12 WeakPolarHBondContact CA-OG1 3.46Å; L9-T12 CarbonylContact O-C 3.59Å; L9-T12 PolarHBondContact O-N 3.47Å; L9-T12 PolarHBondContact O-OG1 3.28Å; L9-L13 WeakPolarHBondContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CG 3.47Å; L9-L13 PolarHBondContact O-N 3.04Å; L9-I64 HydrophobicContact CD2-CG1 4.4Å; L9-I67 HydrophobicContact CD2-CG2 4.16Å; L9-I258 HydrophobicContact CD1-CD1 3.81Å |
| 10 | L | 49.9 | Very low | 49.4 | Very low | 118 Ų | 118 | 71.2 Ų | 71.2 | 62% | 0.618 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.3 | -41.1 | 178 | -72 | 173.9 | 0 | 0 | 0 | 112.6 | E6 C7 L13 W14 | E6-L10 WeakPolarHBondContact O-CG 3.45Å; E6-L10 PolarHBondContact O-N 3.48Å; C7-L10 PolarHBondContact O-N 3.36Å; L10-L13 HydrophobicContact CD2-CD1 4.42Å; L10-L13 PolarHBondContact O-N 3.23Å; L10-W14 WeakPolarHBondContact O-CB 3.34Å; L10-W14 PolarHBondContact O-N 3.48Å |
| 11 | I | 52.3 | Low | 49.4 | Very low | 103 Ų | 103 | 74.7 Ų | 74.7 | 53% | 0.528 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.5 | -41.9 | 174.6 | -67.2 | 165.2 | 0 | 0 | 0 | 110.1 | C7 I8 L9 W14 N15 | C7-I11 WeakPolarHBondContact O-CB 3.37Å; C7-I11 WeakPolarHBondContact O-CD1 3.46Å; C7-I11 WeakPolarHBondContact O-CG1 3.38Å; C7-I11 PolarHBondContact O-N 3.01Å; I8-I11 PolarHBondContact O-N 3.5Å; L9-I11 PolarHBondContact O-N 3.13Å; I11-W14 PolarHBondContact O-N 2.91Å; I11-N15 WeakPolarHBondContact O-CB 3.19Å; I11-N15 VanDerWaalsContact O-CG 3.24Å; I11-N15 PolarHBondContact O-N 2.91Å; I11-N15 PolarHBondContact O-ND2 3.2Å; I11-N15 VanDerWaalsContact O-ND2 3.14Å |
| 12 | T | 53.7 | Low | 49.6 | Very low | 20 Ų | 20 | 70.8 Ų | 70.8 | 12% | 0.123 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -68.8 | -33.7 | 177.1 | 56.1 | 0 | 0 | 0 | 0 | 112.6 | I8 L9 G16 Y60 | I8-T12 HydrophobicContact CG2-CG2 4.13Å; I8-T12 WeakPolarHBondContact O-CB 3.47Å; I8-T12 WeakPolarHBondContact O-CG2 3.29Å; I8-T12 PolarHBondContact O-N 2.77Å; I8-T12 PolarHBondContact O-OG1 2.97Å; L9-T12 WeakPolarHBondContact CA-OG1 3.46Å; L9-T12 CarbonylContact O-C 3.59Å; L9-T12 PolarHBondContact O-N 3.47Å; L9-T12 PolarHBondContact O-OG1 3.28Å; T12-G16 WeakPolarHBondContact O-CA 3.2Å; T12-G16 PolarHBondContact O-N 2.8Å; T12-Y60 HydrophobicContact CG2-CD1 4.28Å; T12-Y60 HydrophobicContact CG2-CE1 4.03Å |
| 13 | L | 54.8 | Low | 49.9 | Very low | 21 Ų | 21 | 71.1 Ų | 71.1 | 11% | 0.11 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -67.4 | -48.4 | 174.2 | -76.6 | 167.7 | 0 | 0 | 0 | 110.6 | L9 L10 N15 G16 I17 I64 I258 T262 | L9-L13 WeakPolarHBondContact O-CB 3.23Å; L9-L13 WeakPolarHBondContact O-CG 3.47Å; L9-L13 PolarHBondContact O-N 3.04Å; L10-L13 HydrophobicContact CD2-CD1 4.42Å; L10-L13 PolarHBondContact O-N 3.23Å; L13-N15 VanDerWaalsContact C-N 3.32Å; L13-N15 PolarHBondContact O-N 2.74Å; L13-G16 PolarHBondContact O-N 3.25Å; L13-I17 WeakPolarHBondContact O-CB 3.29Å; L13-I17 WeakPolarHBondContact O-CD1 3.37Å; L13-I17 WeakPolarHBondContact O-CG1 3.5Å; L13-I17 PolarHBondContact O-N 3.31Å; L13-I64 HydrophobicContact CD2-CD1 3.53Å; L13-I64 HydrophobicContact CD2-CG1 4.4Å; L13-I64 HydrophobicContact CG-CD1 4.11Å; L13-I258 HydrophobicContact CD1-CG2 3.73Å; L13-T262 HydrophobicContact CD2-CG2 3.38Å; L13-T262 WeakPolarHBondContact CD2-OG1 3.2Å |
| 14 | W | 53.7 | Low | 49.9 | Very low | 177 Ų | 177 | 71 Ų | 71 | 67% | 0.67 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -57.7 | -47.2 | 175.5 | -173 | -94.1 | 0 | 0 | 0 | 110.9 | L10 I11 N18 | L10-W14 WeakPolarHBondContact O-CB 3.34Å; L10-W14 PolarHBondContact O-N 3.48Å; I11-W14 PolarHBondContact O-N 2.91Å; W14-N18 PolarHBondContact NE1-ND2 3.39Å; W14-N18 VanDerWaalsContact NE1-ND2 3.19Å; W14-N18 PolarHBondContact O-N 2.82Å; W14-N18 VanDerWaalsContact O-N 3.14Å; W14-N18 PolarHBondContact O-ND2 2.94Å |
| 15 | N | 55.5 | Low | 49.7 | Very low | 69 Ų | 69 | 73 Ų | 73 | 37% | 0.369 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.5 | -41.2 | 176.9 | -71.3 | -31.3 | 0 | 0 | 0 | 112.4 | I11 L13 N18 C19 Y60 | I11-N15 WeakPolarHBondContact O-CB 3.19Å; I11-N15 VanDerWaalsContact O-CG 3.24Å; I11-N15 PolarHBondContact O-N 2.91Å; I11-N15 PolarHBondContact O-ND2 3.2Å; I11-N15 VanDerWaalsContact O-ND2 3.14Å; L13-N15 VanDerWaalsContact C-N 3.32Å; L13-N15 PolarHBondContact O-N 2.74Å; N15-N18 PolarHBondContact O-N 3.28Å; N15-C19 VanDerWaalsContact O-CB 3.29Å; N15-C19 WeakPolarHBondContact O-CB 3.38Å; N15-C19 PolarHBondContact O-N 3.23Å; N15-Y60 HydrophobicContact CB-CE1 4.27Å; N15-Y60 HydrophobicContact CB-CE2 4.18Å |
| 16 | G | 54.5 | Low | 49.6 | Very low | 2 Ų | 2 | 73.9 Ų | 73.9 | 2% | 0.021 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -65.2 | -40.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T12 L13 C19 F20 | T12-G16 WeakPolarHBondContact O-CA 3.2Å; T12-G16 PolarHBondContact O-N 2.8Å; L13-G16 PolarHBondContact O-N 3.25Å; G16-C19 CarbonylContact O-C 3.58Å; G16-C19 PolarHBondContact O-N 3.17Å; G16-F20 VanDerWaalsContact O-CB 3.28Å; G16-F20 WeakPolarHBondContact O-CB 3.15Å; G16-F20 PolarHBondContact O-N 3Å |
| 17 | I | 56.7 | Low | 49.4 | Very low | 51 Ų | 51 | 76 Ų | 76 | 26% | 0.262 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.1 | -48.6 | 174.2 | -65.7 | 160.9 | 0 | 0 | 0 | 110.1 | L13 C19 F20 I265 F266 | L13-I17 WeakPolarHBondContact O-CB 3.29Å; L13-I17 WeakPolarHBondContact O-CD1 3.37Å; L13-I17 WeakPolarHBondContact O-CG1 3.5Å; L13-I17 PolarHBondContact O-N 3.31Å; I17-C19 PolarHBondContact O-N 3.04Å; I17-F20 PolarHBondContact O-N 3.25Å; I17-F20 VanDerWaalsContact O-N 3.13Å; I17-I265 HydrophobicContact CD1-CD1 4.24Å; I17-I265 HydrophobicContact CD1-CG2 3.82Å; I17-I265 HydrophobicContact CG1-CG2 3.94Å; I17-F266 HydrophobicContact CG1-CE1 4.2Å |
| 18 | N | 54.1 | Low | 49.1 | Very low | 87 Ų | 87 | 80.1 Ų | 80.1 | 47% | 0.465 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.6 | -28.1 | 176.5 | -74.6 | -63.7 | 0 | 0 | 0 | 112.7 | W14 N15 | W14-N18 PolarHBondContact NE1-ND2 3.39Å; W14-N18 VanDerWaalsContact NE1-ND2 3.19Å; W14-N18 PolarHBondContact O-N 2.82Å; W14-N18 VanDerWaalsContact O-N 3.14Å; W14-N18 PolarHBondContact O-ND2 2.94Å; N15-N18 PolarHBondContact O-N 3.28Å |
| 19 | C | 53.2 | Low | 48.5 | Very low | 45 Ų | 45 | 83.9 Ų | 83.9 | 30% | 0.304 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -85.4 | -19.8 | 176.1 | -128.3 | 0 | 0 | 0 | 0 | 113.6 | N15 G16 I17 E21 S56 | N15-C19 VanDerWaalsContact O-CB 3.29Å; N15-C19 WeakPolarHBondContact O-CB 3.38Å; N15-C19 PolarHBondContact O-N 3.23Å; G16-C19 CarbonylContact O-C 3.58Å; G16-C19 PolarHBondContact O-N 3.17Å; I17-C19 PolarHBondContact O-N 3.04Å; C19-E21 PolarHBondContact O-N 3.13Å; C19-S56 WeakPolarHBondContact SG-CB 3.46Å; C19-S56 PolarHBondContact SG-OG 2.81Å |
| 20 | F | 53 | Low | 48 | Very low | 11 Ų | 11 | 90.5 Ų | 90.5 | 5% | 0.048 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -76.7 | -12 | 177.3 | -169.7 | -99.3 | 0 | 0 | 0 | 112.5 | G16 I17 I22 S57 F125 L215 K219 F266 V270 | G16-F20 VanDerWaalsContact O-CB 3.28Å; G16-F20 WeakPolarHBondContact O-CB 3.15Å; G16-F20 PolarHBondContact O-N 3Å; I17-F20 PolarHBondContact O-N 3.25Å; I17-F20 VanDerWaalsContact O-N 3.13Å; F20-I22 PolarHBondContact O-N 3.06Å; F20-I22 VanDerWaalsContact O-N 3.08Å; F20-S57 WeakPolarHBondContact CD2-OG 3.47Å; F20-F125 HydrophobicContact CE2-CE2 4.45Å; F20-F125 HydrophobicContact CZ-CE2 4.12Å; F20-L215 HydrophobicContact CE2-CD1 3.87Å; F20-K219 VanDerWaalsContact CD2-NZ 3.27Å; F20-F266 HydrophobicContact CB-CD1 4.23Å; F20-F266 HydrophobicContact CB-CE1 3.92Å; F20-F266 HydrophobicContact CD1-CD1 4.04Å; F20-F266 HydrophobicContact CD2-CD1 4.4Å; F20-F266 HydrophobicContact CD2-CE1 4.46Å; F20-F266 AromaticContact CG-CD1 3.96Å; F20-F266 HydrophobicContact CG-CD1 3.96Å; F20-F266 HydrophobicContact CG-CE1 4.07Å; F20-V270 HydrophobicContact CE1-CG2 3.68Å; F20-V270 HydrophobicContact CZ-CG2 3.83Å |
| 21 | E | 49.1 | Very low | 47.8 | Very low | 146 Ų | 146 | 89.3 Ų | 89.3 | 68% | 0.682 | 49% | 0.493 | S | S | * | . | trans | -43.3 | 113.9 | 176.2 | -157.9 | 78.5 | -119.1 | 0 | 0 | 111.2 | C19 | C19-E21 PolarHBondContact O-N 3.13Š| ||
| 22 | I | 49.4 | Very low | 47.8 | Very low | 65 Ų | 65 | 90.6 Ų | 90.6 | 33% | 0.333 | 51% | 0.505 | S | S | . | . | P | Polyproline II helix | trans | -68.1 | 123.7 | -178 | -61.2 | 157.3 | 0 | 0 | 0 | 106.5 | F20 | F20-I22 PolarHBondContact O-N 3.06Å; F20-I22 VanDerWaalsContact O-N 3.08Å |
| 23 | P | 42.7 | Very low | 47.6 | Very low | 79 Ų | 79 | 94.7 Ų | 94.7 | 51% | 0.513 | 54% | 0.541 | S | S | . | . | P | Polyproline II helix | trans | -60.2 | 129.2 | 176.1 | 23.4 | -31.2 | 0 | 0 | 0 | 108.5 | T25 | P23-T25 PolarHBondContact O-N 3.18Š|
| 24 | P | 40.6 | Very low | 47.5 | Very low | 119 Ų | 119 | 101.3 Ų | 101.3 | 77% | 0.773 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 143.7 | 176.4 | 24.1 | -32.6 | 0 | 0 | 0 | 108.9 | G26 | P24-G26 PolarHBondContact O-N 2.85Š|
| 25 | T | 40.7 | Very low | 47.5 | Very low | 123 Ų | 123 | 100.6 Ų | 100.6 | 76% | 0.755 | 58% | 0.581 | S | S | * | * | trans | -30.6 | 104.3 | 176 | -48.4 | 0 | 0 | 0 | 0 | 110.8 | P23 T27 | P23-T25 PolarHBondContact O-N 3.18Å; T25-T27 PolarHBondContact O-N 3.37Å | ||
| 26 | G | 40.9 | Very low | 47.7 | Very low | 74 Ų | 74 | 100.8 Ų | 100.8 | 76% | 0.763 | 58% | 0.582 | S | S | * | * | trans | -64.9 | 89.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | P24 L28 | P24-G26 PolarHBondContact O-N 2.85Å; G26-L28 PolarHBondContact O-N 3.04Å | ||
| 27 | T | 39.5 | Very low | 47.9 | Very low | 108 Ų | 108 | 108.8 Ų | 108.8 | 66% | 0.663 | 62% | 0.619 | S | S | * | * | trans | -58.5 | 110.4 | 168.5 | 47 | 0 | 0 | 0 | 0 | 106.4 | T25 K29 | T25-T27 PolarHBondContact O-N 3.37Å; T27-K29 PolarHBondContact O-N 3.18Å | ||
| 28 | L | 38.2 | Very low | 48 | Very low | 153 Ų | 153 | 108 Ų | 108 | 80% | 0.801 | 62% | 0.617 | S | S | * | * | trans | -66.5 | 77.9 | 173.3 | -159.5 | 145.2 | 0 | 0 | 0 | 107.5 | G26 L30 | G26-L28 PolarHBondContact O-N 3.04Å; L28-L30 HydrophobicContact CD2-CD2 3.97Å; L28-L30 HydrophobicContact CD2-CG 4.49Å; L28-L30 PolarHBondContact O-N 3.31Å; L28-L30 VanDerWaalsContact O-N 3.13Å | ||
| 29 | K | 36.6 | Very low | 48.6 | Very low | 183 Ų | 183 | 109.2 Ų | 109.2 | 80% | 0.796 | 62% | 0.619 | S | S | * | * | trans | -68.4 | 109.6 | 165.8 | -80.9 | -166.8 | 174.9 | -179.9 | 0 | 106 | T27 | T27-K29 PolarHBondContact O-N 3.18Š| ||
| 30 | L | 38.1 | Very low | 49.6 | Very low | 147 Ų | 147 | 111.3 Ų | 111.3 | 77% | 0.77 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 121 | 172.7 | -70.5 | 168.2 | 0 | 0 | 0 | 108.4 | L28 V32 | L28-L30 HydrophobicContact CD2-CD2 3.97Å; L28-L30 HydrophobicContact CD2-CG 4.49Å; L28-L30 PolarHBondContact O-N 3.31Å; L28-L30 VanDerWaalsContact O-N 3.13Å; L30-V32 PolarHBondContact O-N 2.88Å |
| 31 | P | 46.3 | Very low | 50.7 | Low | 92 Ų | 92 | 114.5 Ų | 114.5 | 60% | 0.597 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 126 | -177.7 | 25.3 | -30.3 | 0 | 0 | 0 | 109 | A33 | P31-A33 PolarHBondContact O-N 3.16Š|
| 32 | V | 51.5 | Low | 52.1 | Low | 130 Ų | 130 | 113.5 Ų | 113.5 | 79% | 0.788 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 128.2 | 157.2 | 172.6 | 0 | 0 | 0 | 0 | 106.4 | L30 E34 | L30-V32 PolarHBondContact O-N 2.88Å; V32-E34 VanDerWaalsContact C-N 3.3Å; V32-E34 PolarHBondContact O-N 3.46Å |
| 33 | A | 49.8 | Very low | 53.5 | Low | 106 Ų | 106 | 116.2 Ų | 116.2 | 88% | 0.876 | 66% | 0.657 | S | S | * | * | trans | -69.9 | 87.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | P31 | P31-A33 PolarHBondContact O-N 3.16Š| ||
| 34 | E | 54.1 | Low | 55.5 | Low | 160 Ų | 160 | 117.2 Ų | 117.2 | 75% | 0.748 | 66% | 0.657 | S | S | * | * | trans | -105.2 | 131.7 | 161.5 | -155.1 | 155.6 | -175 | 0 | 0 | 106.8 | V32 D36 | V32-E34 VanDerWaalsContact C-N 3.3Å; V32-E34 PolarHBondContact O-N 3.46Å; E34-D36 PolarHBondContact O-N 2.95Å | ||
| 35 | D | 53 | Low | 57.6 | Low | 162 Ų | 162 | 115.6 Ų | 115.6 | 87% | 0.866 | 64% | 0.642 | S | S | * | * | trans | -69.7 | 62.7 | 177.1 | -174.9 | 40.5 | 0 | 0 | 0 | 109.4 | Q37 | D35-Q37 PolarHBondContact O-N 3.24Š| ||
| 36 | D | 59.1 | Low | 59.6 | Low | 73 Ų | 73 | 112.1 Ų | 112.1 | 39% | 0.39 | 62% | 0.623 | S | S | . | * | trans | -89.8 | 104 | -174 | -170.8 | -2.7 | 0 | 0 | 0 | 107.4 | E34 S38 K39 K42 | E34-D36 PolarHBondContact O-N 2.95Å; D36-S38 PolarHBondContact O-N 3.3Å; D36-S38 WeakPolarHBondContact OD1-CB 3.5Å; D36-S38 PolarHBondContact OD1-N 2.69Å; D36-S38 PolarHBondContact OD1-OG 3.49Å; D36-S38 PolarHBondContact OD2-OG 3.48Å; D36-K39 WeakPolarHBondContact O-CB 3.29Å; D36-K39 PolarHBondContact O-N 3.03Å; D36-K42 IonicContact OD2-NZ 2.63Å; D36-K42 PolarHBondContact OD2-NZ 3.4Å | ||
| 37 | Q | 58.5 | Low | 61.7 | Low | 171 Ų | 171 | 111.2 Ų | 111.2 | 80% | 0.799 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | -12.3 | 170.6 | -72.9 | -164.9 | -17.5 | 0 | 0 | 112.8 | D35 K39 P40 | D35-Q37 PolarHBondContact O-N 3.24Å; Q37-K39 VanDerWaalsContact C-N 3.32Å; Q37-P40 VanDerWaalsContact O-CD 3.24Å; Q37-P40 WeakPolarHBondContact O-CD 3.46Å; Q37-P40 WeakPolarHBondContact O-CG 3.47Å |
| 38 | S | 60.5 | Low | 64 | Low | 33 Ų | 33 | 112.7 Ų | 112.7 | 23% | 0.231 | 60% | 0.601 | C | S | . | * | H | α-helix | trans | -75.6 | -16.1 | 171.1 | 88.9 | 0 | 0 | 0 | 0 | 114.3 | D36 T41 K42 | D36-S38 PolarHBondContact O-N 3.3Å; D36-S38 WeakPolarHBondContact OD1-CB 3.5Å; D36-S38 PolarHBondContact OD1-N 2.69Å; D36-S38 PolarHBondContact OD1-OG 3.49Å; D36-S38 PolarHBondContact OD2-OG 3.48Å; S38-T41 WeakPolarHBondContact O-CB 3.49Å; S38-T41 PolarHBondContact O-N 2.89Å; S38-T41 VanDerWaalsContact O-N 3.11Å; S38-K42 WeakPolarHBondContact O-CG 3.47Å; S38-K42 PolarHBondContact O-N 2.83Å; S38-K42 VanDerWaalsContact OG-CE 3.31Å; S38-K42 WeakPolarHBondContact OG-CE 3.29Å; S38-K42 PolarHBondContact OG-NZ 2.95Å |
| 39 | K | 66.5 | Low | 66.3 | Low | 114 Ų | 114 | 110.3 Ų | 110.3 | 50% | 0.496 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -55.2 | -51.1 | 178.7 | -167.7 | 176.5 | -175.5 | -179.9 | 0 | 112.9 | D36 Q37 T41 K42 E43 | D36-K39 WeakPolarHBondContact O-CB 3.29Å; D36-K39 PolarHBondContact O-N 3.03Å; Q37-K39 VanDerWaalsContact C-N 3.32Å; K39-T41 VanDerWaalsContact C-N 3.26Å; K39-T41 PolarHBondContact O-N 3Å; K39-K42 PolarHBondContact O-N 3.15Å; K39-E43 WeakPolarHBondContact O-CG 3.23Å; K39-E43 PolarHBondContact O-N 2.97Å |
| 40 | P | 73.3 | Confident | 68.6 | Low | 88 Ų | 88 | 106 Ų | 106 | 57% | 0.571 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -58.9 | -36.9 | 175.4 | 22.3 | -34.7 | 0 | 0 | 0 | 112.6 | Q37 L44 | Q37-P40 VanDerWaalsContact O-CD 3.24Å; Q37-P40 WeakPolarHBondContact O-CD 3.46Å; Q37-P40 WeakPolarHBondContact O-CG 3.47Å; P40-L44 VanDerWaalsContact O-CB 3.22Å; P40-L44 WeakPolarHBondContact O-CB 3.45Å; P40-L44 PolarHBondContact O-N 3.25Å |
| 41 | T | 77.3 | Confident | 71 | Confident | 79 Ų | 79 | 101.6 Ų | 101.6 | 49% | 0.485 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68.1 | -41.2 | 178.4 | -46.4 | 0 | 0 | 0 | 0 | 112.1 | S38 K39 N45 | S38-T41 WeakPolarHBondContact O-CB 3.49Å; S38-T41 PolarHBondContact O-N 2.89Å; S38-T41 VanDerWaalsContact O-N 3.11Å; K39-T41 VanDerWaalsContact C-N 3.26Å; K39-T41 PolarHBondContact O-N 3Å; T41-N45 WeakPolarHBondContact O-CB 3.39Å; T41-N45 PolarHBondContact O-N 3.44Å; T41-N45 PolarHBondContact O-ND2 3.47Å |
| 42 | K | 78.5 | Confident | 73 | Confident | 124 Ų | 124 | 101.3 Ų | 101.3 | 54% | 0.539 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -67.1 | -44.7 | 178.5 | -73.9 | 171.6 | -179.6 | 155.9 | 0 | 112 | D36 S38 K39 N45 S46 | D36-K42 IonicContact OD2-NZ 2.63Å; D36-K42 PolarHBondContact OD2-NZ 3.4Å; S38-K42 WeakPolarHBondContact O-CG 3.47Å; S38-K42 PolarHBondContact O-N 2.83Å; S38-K42 VanDerWaalsContact OG-CE 3.31Å; S38-K42 WeakPolarHBondContact OG-CE 3.29Å; S38-K42 PolarHBondContact OG-NZ 2.95Å; K39-K42 PolarHBondContact O-N 3.15Å; K42-N45 PolarHBondContact O-N 3.25Å; K42-S46 PolarHBondContact O-N 3.03Å; K42-S46 PolarHBondContact O-OG 2.74Å |
| 43 | E | 78.1 | Confident | 74.6 | Confident | 123 Ų | 123 | 96.4 Ų | 96.4 | 58% | 0.575 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.1 | -39.7 | 176.2 | -68.1 | -65.8 | 131.6 | 0 | 0 | 111.9 | K39 S46 A47 | K39-E43 WeakPolarHBondContact O-CG 3.23Å; K39-E43 PolarHBondContact O-N 2.97Å; E43-S46 PolarHBondContact O-N 3.22Å; E43-S46 PolarHBondContact O-OG 3.18Å; E43-A47 WeakPolarHBondContact O-CB 3.34Å; E43-A47 PolarHBondContact O-N 3.17Å; E43-A47 VanDerWaalsContact O-N 3.09Å |
| 44 | L | 83.4 | Confident | 76.3 | Confident | 99 Ų | 99 | 91.4 Ų | 91.4 | 52% | 0.518 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.2 | -47.4 | 174.8 | -177.8 | 63.5 | 0 | 0 | 0 | 111.2 | P40 S46 A47 W48 | P40-L44 VanDerWaalsContact O-CB 3.22Å; P40-L44 WeakPolarHBondContact O-CB 3.45Å; P40-L44 PolarHBondContact O-N 3.25Å; L44-S46 PolarHBondContact O-N 3.02Å; L44-A47 PolarHBondContact O-N 3.4Å; L44-W48 PolarHBondContact O-N 2.89Å |
| 45 | N | 86 | Confident | 78.2 | Confident | 85 Ų | 85 | 86.5 Ų | 86.5 | 46% | 0.455 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.8 | -39.2 | 179.4 | -72.1 | -24.4 | 0 | 0 | 0 | 112.1 | T41 K42 W48 N49 | T41-N45 WeakPolarHBondContact O-CB 3.39Å; T41-N45 PolarHBondContact O-N 3.44Å; T41-N45 PolarHBondContact O-ND2 3.47Å; K42-N45 PolarHBondContact O-N 3.25Å; N45-W48 PolarHBondContact O-N 2.92Å; N45-N49 WeakPolarHBondContact O-CB 3.48Å; N45-N49 PolarHBondContact O-N 3.38Å; N45-N49 PolarHBondContact O-ND2 3.35Å; N45-N49 VanDerWaalsContact O-ND2 3.12Å |
| 46 | S | 83.3 | Confident | 79.9 | Confident | 51 Ų | 51 | 79.5 Ų | 79.5 | 36% | 0.357 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.8 | -42.7 | 176.8 | 69.2 | 0 | 0 | 0 | 0 | 111.4 | K42 E43 L44 N49 L50 | K42-S46 PolarHBondContact O-N 3.03Å; K42-S46 PolarHBondContact O-OG 2.74Å; E43-S46 PolarHBondContact O-N 3.22Å; E43-S46 PolarHBondContact O-OG 3.18Å; L44-S46 PolarHBondContact O-N 3.02Å; S46-N49 PolarHBondContact O-N 2.67Å; S46-L50 WeakPolarHBondContact O-CG 3.3Å; S46-L50 PolarHBondContact O-N 2.93Å |
| 47 | A | 83.4 | Confident | 81.1 | Confident | 54 Ų | 54 | 76.1 Ų | 76.1 | 45% | 0.446 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 175 | 0 | 0 | 0 | 0 | 0 | 112.2 | E43 L44 L50 F51 | E43-A47 WeakPolarHBondContact O-CB 3.34Å; E43-A47 PolarHBondContact O-N 3.17Å; E43-A47 VanDerWaalsContact O-N 3.09Å; L44-A47 PolarHBondContact O-N 3.4Å; A47-L50 PolarHBondContact O-N 3.27Å; A47-F51 PolarHBondContact O-N 2.97Å |
| 48 | W | 88 | Confident | 82.6 | Confident | 139 Ų | 139 | 68 Ų | 68 | 53% | 0.527 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.7 | -39.4 | 174.9 | -82 | 110.6 | 0 | 0 | 0 | 112.8 | L44 N45 F51 L52 | L44-W48 PolarHBondContact O-N 2.89Å; N45-W48 PolarHBondContact O-N 2.92Å; W48-F51 HydrophobicContact CE3-CD1 4.1Å; W48-F51 HydrophobicContact CZ3-CD1 4.1Å; W48-F51 HydrophobicContact CZ3-CE1 4.38Å; W48-F51 PolarHBondContact O-N 3.44Å; W48-L52 VanDerWaalsContact O-CB 3.31Å; W48-L52 WeakPolarHBondContact O-CB 3.3Å; W48-L52 VanDerWaalsContact O-CG 3.27Å; W48-L52 WeakPolarHBondContact O-CG 3.34Å; W48-L52 PolarHBondContact O-N 3.12Å |
| 49 | N | 87 | Confident | 84 | Confident | 103 Ų | 103 | 68.4 Ų | 68.4 | 55% | 0.551 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -64.7 | -40.3 | 176.4 | -69.3 | -25.6 | 0 | 0 | 0 | 111.6 | N45 S46 L52 S53 | N45-N49 WeakPolarHBondContact O-CB 3.48Å; N45-N49 PolarHBondContact O-N 3.38Å; N45-N49 PolarHBondContact O-ND2 3.35Å; N45-N49 VanDerWaalsContact O-ND2 3.12Å; S46-N49 PolarHBondContact O-N 2.67Å; N49-L52 PolarHBondContact O-N 3.4Å; N49-S53 VanDerWaalsContact O-CB 3.32Å; N49-S53 WeakPolarHBondContact O-CB 3.36Å; N49-S53 PolarHBondContact O-N 2.71Å; N49-S53 PolarHBondContact O-OG 3.02Å |
| 50 | L | 84.2 | Confident | 85 | Confident | 93 Ų | 93 | 65.1 Ų | 65.1 | 49% | 0.487 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -65.6 | -40 | 174.2 | -69 | 172.1 | 0 | 0 | 0 | 111.9 | S46 A47 S53 G54 S220 | S46-L50 WeakPolarHBondContact O-CG 3.3Å; S46-L50 PolarHBondContact O-N 2.93Å; A47-L50 PolarHBondContact O-N 3.27Å; L50-S53 PolarHBondContact O-OG 3.45Å; L50-G54 PolarHBondContact O-N 2.98Å; L50-S220 WeakPolarHBondContact O-CB 3.16Å; L50-S220 PolarHBondContact O-OG 3.11Å |
| 51 | F | 89.9 | Confident | 85.6 | Confident | 55 Ų | 55 | 61 Ų | 61 | 24% | 0.241 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.6 | -52 | 173 | 177.2 | -95.5 | 0 | 0 | 0 | 111.5 | A47 W48 S53 G54 F55 S220 L222 G223 V226 | A47-F51 PolarHBondContact O-N 2.97Å; W48-F51 HydrophobicContact CE3-CD1 4.1Å; W48-F51 HydrophobicContact CZ3-CD1 4.1Å; W48-F51 HydrophobicContact CZ3-CE1 4.38Å; W48-F51 PolarHBondContact O-N 3.44Å; F51-S53 VanDerWaalsContact C-N 3.34Å; F51-S53 PolarHBondContact O-N 2.88Å; F51-G54 PolarHBondContact O-N 3.39Å; F51-F55 HydrophobicContact CE1-CB 4.38Å; F51-F55 WeakPolarHBondContact O-CB 3.3Å; F51-F55 PolarHBondContact O-N 2.89Å; F51-S220 VanDerWaalsContact CA-OG 3.31Å; F51-S220 WeakPolarHBondContact CA-OG 3.46Å; F51-L222 HydrophobicContact CE2-CB 4.45Å; F51-G223 VanDerWaalsContact CE2-CA 3.49Å; F51-V226 HydrophobicContact CE2-CG2 4.38Å; F51-V226 HydrophobicContact CZ-CB 4.2Å; F51-V226 HydrophobicContact CZ-CG1 4.36Å; F51-V226 HydrophobicContact CZ-CG2 4.33Å |
| 52 | L | 87.6 | Confident | 86.2 | Confident | 86 Ų | 86 | 57.2 Ų | 57.2 | 45% | 0.45 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -63.8 | -37.6 | -178.1 | -74.6 | 169.1 | 0 | 0 | 0 | 112.3 | W48 N49 F55 S56 | W48-L52 VanDerWaalsContact O-CB 3.31Å; W48-L52 WeakPolarHBondContact O-CB 3.3Å; W48-L52 VanDerWaalsContact O-CG 3.27Å; W48-L52 WeakPolarHBondContact O-CG 3.34Å; W48-L52 PolarHBondContact O-N 3.12Å; N49-L52 PolarHBondContact O-N 3.4Å; L52-F55 PolarHBondContact O-N 3.05Å; L52-S56 VanDerWaalsContact O-CB 3.3Å; L52-S56 WeakPolarHBondContact O-CB 3.32Å; L52-S56 PolarHBondContact O-N 3.43Å; L52-S56 PolarHBondContact O-OG 2.94Å |
| 53 | S | 85.6 | Confident | 86.7 | Confident | 27 Ų | 27 | 52.3 Ų | 52.3 | 19% | 0.189 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.6 | -39.6 | 174.6 | 67.6 | 0 | 0 | 0 | 0 | 112.1 | N49 L50 F51 S56 S57 | N49-S53 VanDerWaalsContact O-CB 3.32Å; N49-S53 WeakPolarHBondContact O-CB 3.36Å; N49-S53 PolarHBondContact O-N 2.71Å; N49-S53 PolarHBondContact O-OG 3.02Å; L50-S53 PolarHBondContact O-OG 3.45Å; F51-S53 VanDerWaalsContact C-N 3.34Å; F51-S53 PolarHBondContact O-N 2.88Å; S53-S56 PolarHBondContact O-OG 2.84Å; S53-S57 WeakPolarHBondContact O-CB 3.32Å; S53-S57 PolarHBondContact O-N 2.87Å; S53-S57 VanDerWaalsContact O-N 3.14Å |
| 54 | G | 86 | Confident | 86.9 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.8 | -48.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112 | L50 F51 S57 S58 | L50-G54 PolarHBondContact O-N 2.98Å; F51-G54 PolarHBondContact O-N 3.39Å; G54-S57 PolarHBondContact O-N 3.06Å; G54-S58 PolarHBondContact O-N 3.36Å; G54-S58 PolarHBondContact O-OG 3.47Å |
| 55 | F | 92 | Very high | 86.8 | Confident | 57 Ų | 57 | 42 Ų | 42 | 25% | 0.25 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.5 | -54.9 | 179.5 | 171 | -88.4 | 0 | 0 | 0 | 112.5 | F51 L52 S57 S58 F59 G223 V226 G227 V230 | F51-F55 HydrophobicContact CE1-CB 4.38Å; F51-F55 WeakPolarHBondContact O-CB 3.3Å; F51-F55 PolarHBondContact O-N 2.89Å; L52-F55 PolarHBondContact O-N 3.05Å; F55-S57 VanDerWaalsContact C-N 3.34Å; F55-S57 PolarHBondContact O-N 3.45Å; F55-S58 PolarHBondContact O-N 2.99Å; F55-S58 PolarHBondContact O-OG 3.26Å; F55-F59 WeakPolarHBondContact O-CB 2.96Å; F55-F59 PolarHBondContact O-N 3.27Å; F55-G223 WeakPolarHBondContact CA-O 3.1Å; F55-G223 PolarHBondContact N-O 3.36Å; F55-V226 HydrophobicContact CD2-CB 4.27Å; F55-V226 HydrophobicContact CD2-CG1 3.93Å; F55-V226 HydrophobicContact CE2-CG1 4Å; F55-G227 WeakPolarHBondContact O-CA 3.42Å; F55-V230 HydrophobicContact CE2-CB 4.45Å; F55-V230 HydrophobicContact CE2-CG2 4.31Å |
| 56 | S | 88.9 | Confident | 86.6 | Confident | 15 Ų | 15 | 38.2 Ų | 38.2 | 11% | 0.105 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -64.2 | -42.5 | -178.8 | 52.4 | 0 | 0 | 0 | 0 | 111.3 | C19 L52 S53 S58 F59 Y60 | C19-S56 WeakPolarHBondContact SG-CB 3.46Å; C19-S56 PolarHBondContact SG-OG 2.81Å; L52-S56 VanDerWaalsContact O-CB 3.3Å; L52-S56 WeakPolarHBondContact O-CB 3.32Å; L52-S56 PolarHBondContact O-N 3.43Å; L52-S56 PolarHBondContact O-OG 2.94Å; S53-S56 PolarHBondContact O-OG 2.84Å; S56-S58 PolarHBondContact O-N 3.06Å; S56-F59 PolarHBondContact O-N 3.29Å; S56-Y60 WeakPolarHBondContact O-CD2 3.03Å; S56-Y60 PolarHBondContact O-N 2.95Å |
| 57 | S | 85.1 | Confident | 86.4 | Confident | 3 Ų | 3 | 37 Ų | 37 | 2% | 0.021 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -47.7 | 179.1 | -170.5 | 0 | 0 | 0 | 0 | 111.9 | F20 S53 G54 F55 V61 L215 K219 | F20-S57 WeakPolarHBondContact CD2-OG 3.47Å; S53-S57 WeakPolarHBondContact O-CB 3.32Å; S53-S57 PolarHBondContact O-N 2.87Å; S53-S57 VanDerWaalsContact O-N 3.14Å; G54-S57 PolarHBondContact O-N 3.06Å; F55-S57 VanDerWaalsContact C-N 3.34Å; F55-S57 PolarHBondContact O-N 3.45Å; S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.47Å; S57-V61 PolarHBondContact O-N 3.14Å; S57-L215 WeakPolarHBondContact OG-CD2 3.31Å; S57-K219 PolarHBondContact OG-NZ 3.42Å |
| 58 | S | 89.1 | Confident | 85.7 | Confident | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.007 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -72.3 | -41.8 | 179.4 | 63.1 | 0 | 0 | 0 | 0 | 111.5 | G54 F55 S56 Y60 V61 I62 L215 V224 G227 G228 | G54-S58 PolarHBondContact O-N 3.36Å; G54-S58 PolarHBondContact O-OG 3.47Å; F55-S58 PolarHBondContact O-N 2.99Å; F55-S58 PolarHBondContact O-OG 3.26Å; S56-S58 PolarHBondContact O-N 3.06Å; S58-Y60 VanDerWaalsContact C-N 3.32Å; S58-Y60 PolarHBondContact O-N 3.43Å; S58-V61 PolarHBondContact O-N 2.75Å; S58-I62 WeakPolarHBondContact O-CB 3.44Å; S58-I62 VanDerWaalsContact O-CG1 3.26Å; S58-I62 WeakPolarHBondContact O-CG1 3.28Å; S58-I62 PolarHBondContact O-N 3.05Å; S58-L215 VanDerWaalsContact CA-CD2 3.47Å; S58-V224 VanDerWaalsContact CB-O 3.27Å; S58-V224 WeakPolarHBondContact CB-O 3.42Å; S58-V224 WeakPolarHBondContact OG-CA 3.43Å; S58-V224 PolarHBondContact OG-O 2.84Å; S58-G227 WeakPolarHBondContact OG-CA 3.47Å; S58-G228 PolarHBondContact OG-N 3.32Å; S58-G228 VanDerWaalsContact OG-N 3.14Å |
| 59 | F | 91.1 | Very high | 85.3 | Confident | 41 Ų | 41 | 29 Ų | 29 | 18% | 0.18 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -52.2 | -51.1 | 176.6 | 176.4 | -99.4 | 0 | 0 | 0 | 111.4 | F55 S56 I62 I63 G227 V230 L234 | F55-F59 WeakPolarHBondContact O-CB 2.96Å; F55-F59 PolarHBondContact O-N 3.27Å; S56-F59 PolarHBondContact O-N 3.29Å; F59-I62 PolarHBondContact O-N 3.3Å; F59-I63 HydrophobicContact CD1-CG1 4.47Å; F59-I63 HydrophobicContact CD2-CG1 4.38Å; F59-I63 HydrophobicContact CE1-CG1 4.11Å; F59-I63 HydrophobicContact CE2-CD1 4.25Å; F59-I63 HydrophobicContact CE2-CG1 3.99Å; F59-I63 HydrophobicContact CZ-CD1 4.34Å; F59-I63 HydrophobicContact CZ-CG1 3.85Å; F59-I63 VanDerWaalsContact O-CG1 3.29Å; F59-I63 WeakPolarHBondContact O-CG1 3.41Å; F59-I63 PolarHBondContact O-N 3.27Å; F59-G227 WeakPolarHBondContact CA-O 3.4Å; F59-V230 HydrophobicContact CD2-CB 4.42Å; F59-V230 HydrophobicContact CD2-CG1 4.04Å; F59-V230 HydrophobicContact CE2-CG1 3.92Å; F59-L234 HydrophobicContact CZ-CD1 4.39Å |
| 60 | Y | 87.9 | Confident | 84.7 | Confident | 44 Ų | 44 | 28 Ų | 28 | 17% | 0.173 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -66.5 | -44.2 | -179.2 | -73.6 | -58.3 | 0 | 0 | 0 | 113.1 | T12 N15 S56 S58 I62 I63 I64 | T12-Y60 HydrophobicContact CG2-CD1 4.28Å; T12-Y60 HydrophobicContact CG2-CE1 4.03Å; N15-Y60 HydrophobicContact CB-CE1 4.27Å; N15-Y60 HydrophobicContact CB-CE2 4.18Å; S56-Y60 WeakPolarHBondContact O-CD2 3.03Å; S56-Y60 PolarHBondContact O-N 2.95Å; S58-Y60 VanDerWaalsContact C-N 3.32Å; S58-Y60 PolarHBondContact O-N 3.43Å; Y60-I62 VanDerWaalsContact C-N 3.33Å; Y60-I62 PolarHBondContact O-N 3.07Å; Y60-I63 PolarHBondContact O-N 3.01Å; Y60-I64 WeakPolarHBondContact O-CB 3.33Å; Y60-I64 WeakPolarHBondContact O-CD1 3.23Å; Y60-I64 VanDerWaalsContact O-CG1 3.31Å; Y60-I64 WeakPolarHBondContact O-CG1 3.29Å; Y60-I64 PolarHBondContact O-N 2.81Å |
| 61 | V | 85.5 | Confident | 84.6 | Confident | 2 Ų | 2 | 23.9 Ų | 23.9 | 1% | 0.012 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -56.1 | -51 | 175.6 | 166.2 | 0 | 0 | 0 | 0 | 110.3 | S57 S58 I64 S65 T211 L215 F263 F266 | S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.47Å; S57-V61 PolarHBondContact O-N 3.14Å; S58-V61 PolarHBondContact O-N 2.75Å; V61-I64 PolarHBondContact O-N 3.25Å; V61-S65 WeakPolarHBondContact O-CB 3.36Å; V61-S65 PolarHBondContact O-N 3.13Å; V61-S65 PolarHBondContact O-OG 3.4Å; V61-T211 HydrophobicContact CB-CG2 4.1Å; V61-T211 HydrophobicContact CG1-CG2 3.25Å; V61-T211 HydrophobicContact CG2-CG2 3.87Å; V61-L215 HydrophobicContact CG2-CD2 4.49Å; V61-F263 HydrophobicContact CG1-CE1 4.5Å; V61-F263 HydrophobicContact CG1-CZ 4.27Å; V61-F266 HydrophobicContact CG2-CD2 4.44Å; V61-F266 HydrophobicContact CG2-CE2 3.7Å; V61-F266 HydrophobicContact CG2-CZ 4.4Å |
| 62 | I | 89.8 | Confident | 84.4 | Confident | 0 Ų | 0 | 22.1 Ų | 22.1 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.2 | -47.9 | -177.4 | -66.3 | -49.2 | 0 | 0 | 0 | 109.4 | S58 F59 Y60 I64 S65 E66 S208 H232 | S58-I62 WeakPolarHBondContact O-CB 3.44Å; S58-I62 VanDerWaalsContact O-CG1 3.26Å; S58-I62 WeakPolarHBondContact O-CG1 3.28Å; S58-I62 PolarHBondContact O-N 3.05Å; F59-I62 PolarHBondContact O-N 3.3Å; Y60-I62 VanDerWaalsContact C-N 3.33Å; Y60-I62 PolarHBondContact O-N 3.07Å; I62-I64 VanDerWaalsContact C-N 3.29Å; I62-I64 PolarHBondContact O-N 2.79Å; I62-S65 PolarHBondContact O-N 2.83Å; I62-E66 HydrophobicContact CG2-CB 4.46Å; I62-E66 HydrophobicContact CG2-CG 3.61Å; I62-E66 WeakPolarHBondContact O-CB 3.44Å; I62-E66 WeakPolarHBondContact O-CG 3.14Å; I62-E66 PolarHBondContact O-N 3.09Å; I62-S208 VanDerWaalsContact CD1-CB 3.5Å; I62-H232 HydrophobicContact CG2-CB 4.5Å |
| 63 | I | 88 | Confident | 84.1 | Confident | 21 Ų | 21 | 19.9 Ų | 19.9 | 11% | 0.108 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -55.8 | -46.2 | 177 | -69.2 | -54.4 | 0 | 0 | 0 | 111.5 | F59 Y60 I67 G231 L234 C235 | F59-I63 HydrophobicContact CD1-CG1 4.47Å; F59-I63 HydrophobicContact CD2-CG1 4.38Å; F59-I63 HydrophobicContact CE1-CG1 4.11Å; F59-I63 HydrophobicContact CE2-CD1 4.25Å; F59-I63 HydrophobicContact CE2-CG1 3.99Å; F59-I63 HydrophobicContact CZ-CD1 4.34Å; F59-I63 HydrophobicContact CZ-CG1 3.85Å; F59-I63 VanDerWaalsContact O-CG1 3.29Å; F59-I63 WeakPolarHBondContact O-CG1 3.41Å; F59-I63 PolarHBondContact O-N 3.27Å; Y60-I63 PolarHBondContact O-N 3.01Å; I63-I67 WeakPolarHBondContact O-CB 3.48Å; I63-I67 WeakPolarHBondContact O-CG2 3.27Å; I63-I67 PolarHBondContact O-N 3.35Å; I63-I67 VanDerWaalsContact O-N 3.12Å; I63-G231 WeakPolarHBondContact CD1-O 3.34Å; I63-L234 HydrophobicContact CD1-CB 4.06Å; I63-L234 HydrophobicContact CD1-CD2 3.75Å; I63-L234 HydrophobicContact CD1-CG 4.34Å; I63-C235 WeakPolarHBondContact CD1-SG 3.23Å |
| 64 | I | 83.2 | Confident | 83.8 | Confident | 3 Ų | 3 | 19.6 Ų | 19.6 | 2% | 0.015 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -72.7 | -32.8 | -176.9 | -70.1 | 160.8 | 0 | 0 | 0 | 112.2 | L9 L13 Y60 V61 I62 T262 | L9-I64 HydrophobicContact CD2-CG1 4.4Å; L13-I64 HydrophobicContact CD2-CD1 3.53Å; L13-I64 HydrophobicContact CD2-CG1 4.4Å; L13-I64 HydrophobicContact CG-CD1 4.11Å; Y60-I64 WeakPolarHBondContact O-CB 3.33Å; Y60-I64 WeakPolarHBondContact O-CD1 3.23Å; Y60-I64 VanDerWaalsContact O-CG1 3.31Å; Y60-I64 WeakPolarHBondContact O-CG1 3.29Å; Y60-I64 PolarHBondContact O-N 2.81Å; V61-I64 PolarHBondContact O-N 3.25Å; I62-I64 VanDerWaalsContact C-N 3.29Å; I62-I64 PolarHBondContact O-N 2.79Å; I64-T262 HydrophobicContact CD1-CG2 4.12Å; I64-T262 HydrophobicContact CG2-CG2 4.11Å |
| 65 | S | 80.9 | Confident | 83.8 | Confident | 1 Ų | 1 | 19.9 Ų | 19.9 | 1% | 0.007 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -85.4 | -36 | -176.4 | -54.2 | 0 | 0 | 0 | 0 | 112.2 | V61 I62 R207 F263 | V61-S65 WeakPolarHBondContact O-CB 3.36Å; V61-S65 PolarHBondContact O-N 3.13Å; V61-S65 PolarHBondContact O-OG 3.4Å; I62-S65 PolarHBondContact O-N 2.83Å; S65-R207 PolarHBondContact O-NE 3.31Å; S65-R207 PolarHBondContact O-NH1 2.86Å; S65-R207 PolarHBondContact O-NH2 3.35Å; S65-F263 VanDerWaalsContact OG-CE2 3.24Å; S65-F263 WeakPolarHBondContact OG-CE2 3.43Å; S65-F263 WeakPolarHBondContact OG-CZ 3.49Å |
| 66 | E | 82.5 | Confident | 83.4 | Confident | 6 Ų | 6 | 17.3 Ų | 17.3 | 3% | 0.028 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -86.6 | -29.2 | -177.4 | -66.6 | -62.3 | 156.7 | 0 | 0 | 112.7 | I62 G68 D69 T71 S208 H232 C235 | I62-E66 HydrophobicContact CG2-CB 4.46Å; I62-E66 HydrophobicContact CG2-CG 3.61Å; I62-E66 WeakPolarHBondContact O-CB 3.44Å; I62-E66 WeakPolarHBondContact O-CG 3.14Å; I62-E66 PolarHBondContact O-N 3.09Å; E66-G68 PolarHBondContact O-N 3.5Å; E66-G68 VanDerWaalsContact O-N 3.13Å; E66-D69 PolarHBondContact O-N 3.07Å; E66-D69 VanDerWaalsContact O-N 3.11Å; E66-T71 PolarHBondContact OE2-OG1 2.87Å; E66-S208 WeakPolarHBondContact OE1-CB 3.43Å; E66-S208 PolarHBondContact OE1-OG 3.23Å; E66-H232 IonicContact OE1-CE1 3.81Å; E66-H232 PolarHBondContact OE1-CE1 3.46Å; E66-H232 VanDerWaalsContact OE1-CE1 3.27Å; E66-H232 IonicContact OE1-ND1 3.36Å; E66-C235 HydrophobicContact CB-CB 4Å |
| 67 | I | 79.3 | Confident | 82.9 | Confident | 27 Ų | 27 | 17.1 Ų | 17.1 | 14% | 0.138 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | 125.9 | 177 | -166.9 | 67 | 0 | 0 | 0 | 108.3 | L9 I63 D69 F72 I255 | L9-I67 HydrophobicContact CD2-CG2 4.16Å; I63-I67 WeakPolarHBondContact O-CB 3.48Å; I63-I67 WeakPolarHBondContact O-CG2 3.27Å; I63-I67 PolarHBondContact O-N 3.35Å; I63-I67 VanDerWaalsContact O-N 3.12Å; I67-D69 PolarHBondContact O-N 3.19Å; I67-F72 HydrophobicContact CD1-CD2 4.39Å; I67-F72 HydrophobicContact CD1-CE2 4.02Å; I67-F72 HydrophobicContact CD1-CZ 4.46Å; I67-I255 HydrophobicContact CB-CG2 4.33Å; I67-I255 HydrophobicContact CG1-CG2 4.41Å; I67-I255 HydrophobicContact CG2-CG2 3.57Å; I67-I255 WeakPolarHBondContact O-CG2 3.34Å |
| 68 | G | 68.2 | Low | 82.7 | Confident | 4 Ų | 4 | 17 Ų | 17 | 4% | 0.041 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 68 | 9.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | E66 | E66-G68 PolarHBondContact O-N 3.5Å; E66-G68 VanDerWaalsContact O-N 3.13Å |
| 69 | D | 78.7 | Confident | 82.2 | Confident | 19 Ų | 19 | 17.6 Ų | 17.6 | 10% | 0.102 | 9% | 0.085 | C | C | . | . | S | Bend | trans | -70.1 | 162.5 | 169.2 | -168.7 | 63.8 | 0 | 0 | 0 | 111.6 | E66 I67 T71 F72 F73 R207 | E66-D69 PolarHBondContact O-N 3.07Å; E66-D69 VanDerWaalsContact O-N 3.11Å; I67-D69 PolarHBondContact O-N 3.19Å; D69-T71 PolarHBondContact O-N 2.84Å; D69-T71 PolarHBondContact OD2-N 3.49Å; D69-T71 VanDerWaalsContact OD2-N 3.1Å; D69-T71 PolarHBondContact OD2-OG1 3.47Å; D69-F72 VanDerWaalsContact O-CB 3.29Å; D69-F72 WeakPolarHBondContact O-CB 3.36Å; D69-F72 PolarHBondContact O-N 3.27Å; D69-F72 VanDerWaalsContact O-N 3.07Å; D69-F73 VanDerWaalsContact O-CD2 3.23Å; D69-F73 WeakPolarHBondContact O-CD2 3.48Å; D69-F73 PolarHBondContact O-N 2.88Å; D69-R207 VanDerWaalsContact CB-NH2 3.35Å; D69-R207 IonicContact OD1-CZ 3.18Å; D69-R207 VanDerWaalsContact OD1-CZ 3.26Å; D69-R207 IonicContact OD1-NE 3.27Å; D69-R207 PolarHBondContact OD1-NE 3.26Å; D69-R207 IonicContact OD1-NH2 2.75Å; D69-R207 PolarHBondContact OD1-NH2 2.96Å |
| 70 | K | 76.2 | Confident | 81.4 | Confident | 82 Ų | 82 | 19.4 Ų | 19.4 | 36% | 0.357 | 10% | 0.095 | S | C | . | . | H | α-helix | trans | -52.6 | -36.3 | 174.9 | -61.8 | -167.8 | 179.2 | -155 | 0 | 111.5 | F72 F73 I74 E147 | K70-F72 PolarHBondContact O-N 3.03Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 WeakPolarHBondContact O-CA 3.49Å; K70-F73 WeakPolarHBondContact O-CB 3.33Å; K70-F73 PolarHBondContact O-N 2.98Å; K70-F73 VanDerWaalsContact O-N 3.09Å; K70-I74 VanDerWaalsContact O-CG1 3.27Å; K70-I74 WeakPolarHBondContact O-CG1 3.49Å; K70-I74 PolarHBondContact O-N 3.36Å; K70-E147 WeakPolarHBondContact CE-OE1 3.22Å; K70-E147 IonicContact NZ-OE1 3.26Å; K70-E147 PolarHBondContact NZ-OE1 3.38Å |
| 71 | T | 82.2 | Confident | 80.5 | Confident | 8 Ų | 8 | 21 Ų | 21 | 5% | 0.049 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -69.7 | -34 | -179.7 | 59.8 | 0 | 0 | 0 | 0 | 112.7 | E66 D69 F73 I74 A75 A202 E203 | E66-T71 PolarHBondContact OE2-OG1 2.87Å; D69-T71 PolarHBondContact O-N 2.84Å; D69-T71 PolarHBondContact OD2-N 3.49Å; D69-T71 VanDerWaalsContact OD2-N 3.1Å; D69-T71 PolarHBondContact OD2-OG1 3.47Å; T71-F73 VanDerWaalsContact C-N 3.31Å; T71-F73 PolarHBondContact O-N 2.93Å; T71-I74 PolarHBondContact O-N 2.9Å; T71-A75 VanDerWaalsContact O-CB 3.32Å; T71-A75 WeakPolarHBondContact O-CB 3.17Å; T71-A75 PolarHBondContact O-N 2.87Å; T71-A202 HydrophobicContact CG2-CB 3.56Å; T71-E203 WeakPolarHBondContact CB-OE1 3.41Å; T71-E203 HydrophobicContact CG2-CG 3.56Å; T71-E203 WeakPolarHBondContact CG2-OE1 3.46Å; T71-E203 PolarHBondContact OG1-OE1 3.4Å |
| 72 | F | 84.8 | Confident | 80 | Confident | 18 Ų | 18 | 22.6 Ų | 22.6 | 8% | 0.079 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -59.6 | -42.4 | 167.9 | -178.4 | -84.6 | 0 | 0 | 0 | 111.3 | I67 D69 K70 A76 C235 L238 A239 M242 | I67-F72 HydrophobicContact CD1-CD2 4.39Å; I67-F72 HydrophobicContact CD1-CE2 4.02Å; I67-F72 HydrophobicContact CD1-CZ 4.46Å; D69-F72 VanDerWaalsContact O-CB 3.29Å; D69-F72 WeakPolarHBondContact O-CB 3.36Å; D69-F72 PolarHBondContact O-N 3.27Å; D69-F72 VanDerWaalsContact O-N 3.07Å; K70-F72 PolarHBondContact O-N 3.03Å; F72-A76 WeakPolarHBondContact O-CB 3.45Å; F72-A76 PolarHBondContact O-N 3.35Å; F72-C235 WeakPolarHBondContact CE2-O 3.29Å; F72-L238 HydrophobicContact CE2-CB 4.04Å; F72-A239 HydrophobicContact CD1-CB 4.41Å; F72-A239 HydrophobicContact CD2-CB 3.63Å; F72-A239 HydrophobicContact CE1-CB 4.46Å; F72-A239 HydrophobicContact CE2-CB 3.69Å; F72-A239 HydrophobicContact CG-CB 4Å; F72-A239 HydrophobicContact CZ-CB 4.11Å; F72-A239 WeakPolarHBondContact O-CB 3.43Å; F72-M242 HydrophobicContact CZ-CB 4.45Å; F72-M242 HydrophobicContact CZ-CG 4.15Å |
| 73 | F | 80.2 | Confident | 79.5 | Confident | 39 Ų | 39 | 25.9 Ų | 25.9 | 17% | 0.171 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -67.1 | -46.9 | 176.1 | -75.2 | -76.9 | 0 | 0 | 0 | 112.4 | D69 K70 T71 A75 A76 I77 A144 V252 | D69-F73 VanDerWaalsContact O-CD2 3.23Å; D69-F73 WeakPolarHBondContact O-CD2 3.48Å; D69-F73 PolarHBondContact O-N 2.88Å; K70-F73 CarbonylContact O-C 3.53Å; K70-F73 WeakPolarHBondContact O-CA 3.49Å; K70-F73 WeakPolarHBondContact O-CB 3.33Å; K70-F73 PolarHBondContact O-N 2.98Å; K70-F73 VanDerWaalsContact O-N 3.09Å; T71-F73 VanDerWaalsContact C-N 3.31Å; T71-F73 PolarHBondContact O-N 2.93Å; F73-A75 VanDerWaalsContact C-N 3.32Å; F73-A75 PolarHBondContact O-N 2.92Å; F73-A76 PolarHBondContact O-N 3.3Å; F73-A76 VanDerWaalsContact O-N 3.15Å; F73-I77 VanDerWaalsContact O-CG1 3.29Å; F73-I77 WeakPolarHBondContact O-CG1 3.32Å; F73-I77 WeakPolarHBondContact O-CG2 3.11Å; F73-I77 PolarHBondContact O-N 3.45Å; F73-A144 HydrophobicContact CE1-CB 4.45Å; F73-V252 HydrophobicContact CD2-CG1 4.12Å; F73-V252 HydrophobicContact CE1-CG1 4.02Å; F73-V252 HydrophobicContact CE2-CB 4.2Å; F73-V252 HydrophobicContact CE2-CG1 3.08Å; F73-V252 HydrophobicContact CZ-CB 4.43Å; F73-V252 HydrophobicContact CZ-CG1 3.04Å |
| 74 | I | 80.8 | Confident | 79.2 | Confident | 20 Ų | 20 | 31.3 Ų | 31.3 | 10% | 0.103 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -56.8 | -45.6 | 176.7 | -67.9 | 163.8 | 0 | 0 | 0 | 110.5 | K70 T71 A76 I77 M78 V151 L198 A202 | K70-I74 VanDerWaalsContact O-CG1 3.27Å; K70-I74 WeakPolarHBondContact O-CG1 3.49Å; K70-I74 PolarHBondContact O-N 3.36Å; T71-I74 PolarHBondContact O-N 2.9Å; I74-A76 PolarHBondContact O-N 2.89Å; I74-I77 WeakPolarHBondContact O-CG1 3.29Å; I74-M78 WeakPolarHBondContact O-CB 3.45Å; I74-M78 PolarHBondContact O-N 2.78Å; I74-V151 HydrophobicContact CG1-CG2 4.44Å; I74-L198 HydrophobicContact CG2-CB 4.44Å; I74-A202 HydrophobicContact CD1-CB 4.04Å |
| 75 | A | 85.4 | Confident | 79.3 | Confident | 6 Ų | 6 | 34.1 Ų | 34.1 | 5% | 0.05 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.9 | -40.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | T71 F73 S79 A239 | T71-A75 VanDerWaalsContact O-CB 3.32Å; T71-A75 WeakPolarHBondContact O-CB 3.17Å; T71-A75 PolarHBondContact O-N 2.87Å; F73-A75 VanDerWaalsContact C-N 3.32Å; F73-A75 PolarHBondContact O-N 2.92Å; A75-S79 WeakPolarHBondContact O-CB 3.32Å; A75-S79 PolarHBondContact O-N 3.34Å; A75-S79 VanDerWaalsContact O-N 3.11Å; A75-A239 HydrophobicContact CB-CB 3.79Å |
| 76 | A | 83.8 | Confident | 79.5 | Confident | 4 Ų | 4 | 36.3 Ų | 36.3 | 3% | 0.033 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.1 | -46.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | F72 F73 I74 S79 A239 | F72-A76 WeakPolarHBondContact O-CB 3.45Å; F72-A76 PolarHBondContact O-N 3.35Å; F73-A76 PolarHBondContact O-N 3.3Å; F73-A76 VanDerWaalsContact O-N 3.15Å; I74-A76 PolarHBondContact O-N 2.89Å; A76-S79 PolarHBondContact O-N 3.49Å; A76-S79 PolarHBondContact O-OG 3.02Å; A76-A239 WeakPolarHBondContact CA-O 3.29Å; A76-A239 HydrophobicContact CB-CB 4.29Å; A76-A239 VanDerWaalsContact CB-O 3.3Å; A76-A239 WeakPolarHBondContact CB-O 3.27Å |
| 77 | I | 79.3 | Confident | 79.7 | Confident | 11 Ų | 11 | 36.1 Ų | 36.1 | 6% | 0.056 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -73.8 | -39.8 | -177.7 | 64.7 | -160.2 | 0 | 0 | 0 | 112.2 | F73 I74 S79 M80 F148 V151 | F73-I77 VanDerWaalsContact O-CG1 3.29Å; F73-I77 WeakPolarHBondContact O-CG1 3.32Å; F73-I77 WeakPolarHBondContact O-CG2 3.11Å; F73-I77 PolarHBondContact O-N 3.45Å; I74-I77 WeakPolarHBondContact O-CG1 3.29Å; I77-S79 PolarHBondContact O-N 3.14Å; I77-M80 WeakPolarHBondContact O-CB 3.21Å; I77-M80 PolarHBondContact O-N 2.95Å; I77-F148 HydrophobicContact CB-CD2 4.47Å; I77-F148 HydrophobicContact CG2-CD2 3.28Å; I77-F148 HydrophobicContact CG2-CE2 3.58Å; I77-F148 HydrophobicContact CG2-CG 4.26Å; I77-V151 HydrophobicContact CD1-CB 3.4Å; I77-V151 HydrophobicContact CD1-CG1 3.45Å; I77-V151 VanDerWaalsContact CD1-CG1 3.45Å; I77-V151 HydrophobicContact CD1-CG2 3.85Å; I77-V151 HydrophobicContact CG1-CB 4.25Å; I77-V151 HydrophobicContact CG1-CG1 3.76Å |
| 78 | M | 79.3 | Confident | 80.3 | Confident | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.4 | -33.7 | 175 | -173.5 | 160.6 | -92.2 | 0 | 0 | 110.9 | I74 M80 H82 V87 L155 E194 A195 L198 | I74-M78 WeakPolarHBondContact O-CB 3.45Å; I74-M78 PolarHBondContact O-N 2.78Å; M78-M80 VanDerWaalsContact C-N 3.28Å; M78-M80 PolarHBondContact O-N 3.02Å; M78-H82 VanDerWaalsContact O-CB 3.32Å; M78-H82 WeakPolarHBondContact O-CB 3.35Å; M78-H82 PolarHBondContact O-CD2 2.86Å; M78-H82 PolarHBondContact O-N 3.28Å; M78-V87 HydrophobicContact CB-CG1 3.91Å; M78-V87 HydrophobicContact CG-CB 4.43Å; M78-V87 HydrophobicContact CG-CG1 3.76Å; M78-V87 HydrophobicContact CG-CG2 3.79Å; M78-V87 HydrophobicContact SD-CG1 4.32Å; M78-L155 HydrophobicContact CE-CD2 3.5Å; M78-L155 VanDerWaalsContact CE-CD2 3.5Å; M78-E194 HydrophobicContact CE-CG 3.91Å; M78-A195 WeakPolarHBondContact SD-CA 3.28Å; M78-A195 HydrophobicContact SD-CB 3.52Å; M78-A195 VanDerWaalsContact SD-CB 3.52Å; M78-L198 HydrophobicContact CE-CD1 3.51Å |
| 79 | S | 79.1 | Confident | 81.4 | Confident | 12 Ų | 12 | 41.4 Ų | 41.4 | 8% | 0.084 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.8 | -15.4 | 175.4 | 82 | 0 | 0 | 0 | 0 | 115.7 | A75 A76 I77 V240 | A75-S79 WeakPolarHBondContact O-CB 3.32Å; A75-S79 PolarHBondContact O-N 3.34Å; A75-S79 VanDerWaalsContact O-N 3.11Å; A76-S79 PolarHBondContact O-N 3.49Å; A76-S79 PolarHBondContact O-OG 3.02Å; I77-S79 PolarHBondContact O-N 3.14Å; S79-V240 PolarHBondContact OG-O 3.22Å |
| 80 | M | 75 | Confident | 81.8 | Confident | 80 Ų | 80 | 40.5 Ų | 40.5 | 39% | 0.394 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -76.1 | -36.1 | 177 | -67.2 | -176.5 | 177.6 | 0 | 0 | 112.1 | I77 M78 F148 G243 V246 | I77-M80 WeakPolarHBondContact O-CB 3.21Å; I77-M80 PolarHBondContact O-N 2.95Å; M78-M80 VanDerWaalsContact C-N 3.28Å; M78-M80 PolarHBondContact O-N 3.02Å; M80-F148 HydrophobicContact CE-CE2 4.4Å; M80-F148 HydrophobicContact SD-CE2 4.26Å; M80-G243 VanDerWaalsContact CE-O 3.24Å; M80-G243 WeakPolarHBondContact CE-O 3.15Å; M80-G243 WeakPolarHBondContact CG-O 3.43Å; M80-V246 HydrophobicContact CE-CB 3.68Å; M80-V246 HydrophobicContact CE-CG1 3.81Å |
| 81 | Q | 69.2 | Low | 82.5 | Confident | 76 Ų | 76 | 36.7 Ų | 36.7 | 36% | 0.355 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -100.6 | -25.5 | -176 | -62 | -169.9 | 7.2 | 0 | 0 | 113.1 | H152 | Q81-H152 PolarHBondContact NE2-CD2 3.04Å; Q81-H152 PolarHBondContact NE2-NE2 3.25Å |
| 82 | H | 73.6 | Confident | 83 | Confident | 36 Ų | 36 | 37.3 Ų | 37.3 | 17% | 0.167 | 19% | 0.194 | C | C | . | . | S | Bend | trans | -106.3 | 157.5 | -179.8 | -66.9 | -71.3 | 0 | 0 | 0 | 112.3 | M78 R84 V87 I191 | M78-H82 VanDerWaalsContact O-CB 3.32Å; M78-H82 WeakPolarHBondContact O-CB 3.35Å; M78-H82 PolarHBondContact O-CD2 2.86Å; M78-H82 PolarHBondContact O-N 3.28Å; H82-R84 PolarHBondContact O-N 2.97Å; H82-V87 HydrophobicContact CB-CG2 3.49Å; H82-V87 VanDerWaalsContact CB-CG2 3.49Å; H82-I191 HydrophobicContact CB-CG2 3.56Å; H82-I191 WeakPolarHBondContact ND1-CD1 3.47Å; H82-I191 VanDerWaalsContact ND1-CG1 3.28Å; H82-I191 WeakPolarHBondContact ND1-CG1 3.35Å; H82-I191 VanDerWaalsContact ND1-CG2 3.31Å; H82-I191 WeakPolarHBondContact ND1-CG2 3.02Å |
| 83 | P | 80.6 | Confident | 83.4 | Confident | 70 Ų | 70 | 42 Ų | 42 | 46% | 0.455 | 22% | 0.215 | S | C | . | . | trans | -57.7 | 109.3 | 170.9 | 25.6 | -35.8 | 0 | 0 | 0 | 109.8 | A85 L86 V87 | P83-A85 PolarHBondContact O-N 2.87Å; P83-L86 HydrophobicContact CB-CD1 4.47Å; P83-L86 HydrophobicContact CB-CG 4.48Å; P83-L86 HydrophobicContact CG-CB 4.16Å; P83-L86 HydrophobicContact CG-CD1 3.54Å; P83-L86 HydrophobicContact CG-CG 3.93Å; P83-L86 PolarHBondContact O-N 2.89Å; P83-V87 PolarHBondContact O-N 3.08Å | ||
| 84 | R | 81.7 | Confident | 84 | Confident | 135 Ų | 135 | 40.1 Ų | 40.1 | 51% | 0.509 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -41.2 | -36.7 | -178.7 | 58.1 | 179.7 | 179.8 | 178.4 | -0.2 | 116 | H82 Y88 V240 R244 | H82-R84 PolarHBondContact O-N 2.97Å; R84-Y88 WeakPolarHBondContact O-CB 3.47Å; R84-Y88 PolarHBondContact O-N 3.44Å; R84-V240 HydrophobicContact CB-CG1 3.52Å; R84-R244 VanDerWaalsContact NH1-NH1 3.18Å |
| 85 | A | 84.6 | Confident | 84.6 | Confident | 62 Ų | 62 | 39.5 Ų | 39.5 | 51% | 0.512 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -67.7 | -37.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112 | P83 C89 | P83-A85 PolarHBondContact O-N 2.87Å; A85-C89 WeakPolarHBondContact O-CB 3.3Å; A85-C89 PolarHBondContact O-N 3.28Å; A85-C89 PolarHBondContact O-SG 3.16Å |
| 86 | L | 85.3 | Confident | 85 | Confident | 47 Ų | 47 | 41 Ų | 41 | 25% | 0.246 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -72.5 | -41.3 | 178.2 | -62.7 | -178.4 | 0 | 0 | 0 | 111.3 | P83 C89 G90 T189 | P83-L86 HydrophobicContact CB-CD1 4.47Å; P83-L86 HydrophobicContact CB-CG 4.48Å; P83-L86 HydrophobicContact CG-CB 4.16Å; P83-L86 HydrophobicContact CG-CD1 3.54Å; P83-L86 HydrophobicContact CG-CG 3.93Å; P83-L86 PolarHBondContact O-N 2.89Å; L86-C89 PolarHBondContact O-N 3.49Å; L86-G90 PolarHBondContact O-N 3.03Å; L86-T189 HydrophobicContact CD1-CG2 4.01Å |
| 87 | V | 86.8 | Confident | 85.5 | Confident | 1 Ų | 1 | 43 Ų | 43 | 1% | 0.006 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.1 | -49.7 | 174.7 | -178.6 | 0 | 0 | 0 | 0 | 110.4 | M78 H82 P83 C89 G90 A91 I191 A195 | M78-V87 HydrophobicContact CB-CG1 3.91Å; M78-V87 HydrophobicContact CG-CB 4.43Å; M78-V87 HydrophobicContact CG-CG1 3.76Å; M78-V87 HydrophobicContact CG-CG2 3.79Å; M78-V87 HydrophobicContact SD-CG1 4.32Å; H82-V87 HydrophobicContact CB-CG2 3.49Å; H82-V87 VanDerWaalsContact CB-CG2 3.49Å; P83-V87 PolarHBondContact O-N 3.08Å; V87-C89 PolarHBondContact O-N 2.92Å; V87-G90 PolarHBondContact O-N 3.28Å; V87-A91 WeakPolarHBondContact O-CB 3.3Å; V87-A91 PolarHBondContact O-N 3.05Å; V87-I191 HydrophobicContact CG2-CG2 4.48Å; V87-A195 HydrophobicContact CG1-CB 4.47Å |
| 88 | Y | 91 | Very high | 86.1 | Confident | 79 Ų | 79 | 42.5 Ų | 42.5 | 31% | 0.31 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -57.2 | -48.6 | 176 | 176.7 | -96.6 | 0 | 0 | 0 | 111.7 | R84 G90 M92 T236 | R84-Y88 WeakPolarHBondContact O-CB 3.47Å; R84-Y88 PolarHBondContact O-N 3.44Å; Y88-G90 PolarHBondContact O-N 2.83Å; Y88-M92 HydrophobicContact CD1-CG 4.18Å; Y88-M92 HydrophobicContact CD2-CG 4.13Å; Y88-M92 HydrophobicContact CE1-CG 3.79Å; Y88-M92 HydrophobicContact CE2-CG 3.73Å; Y88-M92 HydrophobicContact CE2-SD 4.28Å; Y88-M92 HydrophobicContact CG-CG 4.34Å; Y88-M92 WeakPolarHBondContact O-CB 3.44Å; Y88-M92 VanDerWaalsContact O-CG 3.22Å; Y88-M92 WeakPolarHBondContact O-CG 3.27Å; Y88-M92 PolarHBondContact O-N 3.28Å; Y88-T236 HydrophobicContact CD2-CG2 3.83Å; Y88-T236 HydrophobicContact CE2-CG2 4.28Å |
| 89 | C | 91 | Very high | 86.7 | Confident | 63 Ų | 63 | 42.5 Ų | 42.5 | 43% | 0.426 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -63.8 | -40.7 | 179.1 | -71.5 | 0 | 0 | 0 | 0 | 112.6 | A85 L86 V87 F93 F192 | A85-C89 WeakPolarHBondContact O-CB 3.3Å; A85-C89 PolarHBondContact O-N 3.28Å; A85-C89 PolarHBondContact O-SG 3.16Å; L86-C89 PolarHBondContact O-N 3.49Å; V87-C89 PolarHBondContact O-N 2.92Å; C89-F93 VanDerWaalsContact O-CB 3.28Å; C89-F93 WeakPolarHBondContact O-CB 3.46Å; C89-F93 PolarHBondContact O-N 3.25Å; C89-F192 HydrophobicContact CB-CD2 4.3Å; C89-F192 HydrophobicContact CB-CE2 3.98Å |
| 90 | G | 88 | Confident | 87.4 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.8 | -49.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L86 V87 Y88 F93 A94 F192 | L86-G90 PolarHBondContact O-N 3.03Å; V87-G90 PolarHBondContact O-N 3.28Å; Y88-G90 PolarHBondContact O-N 2.83Å; G90-F93 PolarHBondContact O-N 2.97Å; G90-A94 PolarHBondContact O-N 2.86Å; G90-F192 VanDerWaalsContact N-CE2 3.35Å |
| 91 | A | 90.9 | Very high | 88.2 | Confident | 2 Ų | 2 | 45.7 Ų | 45.7 | 2% | 0.017 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.8 | -46.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | V87 F93 A94 L95 T199 T236 | V87-A91 WeakPolarHBondContact O-CB 3.3Å; V87-A91 PolarHBondContact O-N 3.05Å; A91-F93 VanDerWaalsContact C-N 3.28Å; A91-F93 PolarHBondContact O-N 3.31Å; A91-A94 WeakPolarHBondContact O-CB 3.47Å; A91-A94 PolarHBondContact O-N 3.22Å; A91-A94 VanDerWaalsContact O-N 3.15Å; A91-L95 WeakPolarHBondContact O-CB 3.42Å; A91-L95 VanDerWaalsContact O-CG 3.29Å; A91-L95 WeakPolarHBondContact O-CG 3.02Å; A91-L95 PolarHBondContact O-N 3.47Å; A91-T199 HydrophobicContact CB-CG2 4.28Å; A91-T236 HydrophobicContact CB-CG2 3.8Å |
| 92 | M | 92.7 | Very high | 89.2 | Confident | 21 Ų | 21 | 42.1 Ų | 42.1 | 10% | 0.103 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.1 | -37 | 177.2 | -79.5 | -55.1 | -59.2 | 0 | 0 | 112.9 | Y88 T96 V229 H232 A233 | Y88-M92 HydrophobicContact CD1-CG 4.18Å; Y88-M92 HydrophobicContact CD2-CG 4.13Å; Y88-M92 HydrophobicContact CE1-CG 3.79Å; Y88-M92 HydrophobicContact CE2-CG 3.73Å; Y88-M92 HydrophobicContact CE2-SD 4.28Å; Y88-M92 HydrophobicContact CG-CG 4.34Å; Y88-M92 WeakPolarHBondContact O-CB 3.44Å; Y88-M92 VanDerWaalsContact O-CG 3.22Å; Y88-M92 WeakPolarHBondContact O-CG 3.27Å; Y88-M92 PolarHBondContact O-N 3.28Å; M92-T96 WeakPolarHBondContact O-CB 3.21Å; M92-T96 PolarHBondContact O-N 2.98Å; M92-T96 PolarHBondContact O-OG1 2.99Å; M92-V229 HydrophobicContact CE-CG1 4.22Å; M92-H232 HydrophobicContact SD-CB 4.49Å; M92-A233 HydrophobicContact CE-CB 3.66Å; M92-A233 WeakPolarHBondContact SD-CA 3.2Å; M92-A233 HydrophobicContact SD-CB 3.99Å |
| 93 | F | 93.9 | Very high | 90 | Very high | 116 Ų | 116 | 40.5 Ų | 40.5 | 51% | 0.509 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -67.3 | -40.9 | 176.5 | -170.5 | -114.2 | 0 | 0 | 0 | 111.6 | C89 G90 A91 T97 F192 F196 | C89-F93 VanDerWaalsContact O-CB 3.28Å; C89-F93 WeakPolarHBondContact O-CB 3.46Å; C89-F93 PolarHBondContact O-N 3.25Å; G90-F93 PolarHBondContact O-N 2.97Å; A91-F93 VanDerWaalsContact C-N 3.28Å; A91-F93 PolarHBondContact O-N 3.31Å; F93-T97 WeakPolarHBondContact O-CB 3.35Å; F93-T97 PolarHBondContact O-N 3Å; F93-T97 PolarHBondContact O-OG1 3.44Å; F93-F192 HydrophobicContact CB-CZ 4.1Å; F93-F192 HydrophobicContact CD1-CZ 4.16Å; F93-F192 HydrophobicContact CG-CZ 4.29Å; F93-F196 HydrophobicContact CB-CD2 4.28Å; F93-F196 AromaticContact CD1-CD2 3.49Å; F93-F196 HydrophobicContact CD1-CD2 3.49Å; F93-F196 VanDerWaalsContact CD1-CD2 3.49Å; F93-F196 AromaticContact CD1-CE2 3.4Å; F93-F196 HydrophobicContact CD1-CE2 3.4Å; F93-F196 HydrophobicContact CD1-CZ 4.42Å; F93-F196 HydrophobicContact CE1-CD2 4.3Å; F93-F196 AromaticContact CE1-CE2 3.84Å; F93-F196 HydrophobicContact CE1-CE2 3.84Å; F93-F196 HydrophobicContact CG-CD2 4.32Å; F93-F196 HydrophobicContact CG-CE2 4.33Å |
| 94 | A | 92.4 | Very high | 90.4 | Very high | 1 Ų | 1 | 42.5 Ų | 42.5 | 1% | 0.008 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.4 | -53.8 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | G90 A91 T96 T97 M98 F196 T199 F200 | G90-A94 PolarHBondContact O-N 2.86Å; A91-A94 WeakPolarHBondContact O-CB 3.47Å; A91-A94 PolarHBondContact O-N 3.22Å; A91-A94 VanDerWaalsContact O-N 3.15Å; A94-T96 PolarHBondContact O-N 3.48Å; A94-T97 PolarHBondContact O-N 3.42Å; A94-M98 WeakPolarHBondContact O-CB 2.91Å; A94-M98 PolarHBondContact O-N 2.99Å; A94-F196 VanDerWaalsContact CA-CE2 3.48Å; A94-F196 HydrophobicContact CB-CD2 3.6Å; A94-F196 HydrophobicContact CB-CE2 3.9Å; A94-F196 HydrophobicContact CB-CG 4.26Å; A94-T199 HydrophobicContact CB-CG2 4.03Å; A94-F200 HydrophobicContact CB-CB 4.01Å |
| 95 | L | 92.6 | Very high | 90.6 | Very high | 6 Ų | 6 | 40.5 Ų | 40.5 | 3% | 0.031 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.6 | -41.2 | -177.8 | -66 | 171 | 0 | 0 | 0 | 112 | A91 M98 T99 T199 E203 H232 T236 | A91-L95 WeakPolarHBondContact O-CB 3.42Å; A91-L95 VanDerWaalsContact O-CG 3.29Å; A91-L95 WeakPolarHBondContact O-CG 3.02Å; A91-L95 PolarHBondContact O-N 3.47Å; L95-M98 PolarHBondContact O-N 3.42Å; L95-T99 WeakPolarHBondContact O-CB 3.34Å; L95-T99 PolarHBondContact O-N 2.72Å; L95-T99 PolarHBondContact O-OG1 2.73Å; L95-T199 HydrophobicContact CD1-CG2 4.4Å; L95-T199 HydrophobicContact CD2-CG2 3.91Å; L95-T199 HydrophobicContact CG-CG2 3.87Å; L95-E203 HydrophobicContact CD2-CG 3.71Å; L95-H232 HydrophobicContact CB-CB 4.08Å; L95-H232 HydrophobicContact CD1-CB 3.91Å; L95-T236 VanDerWaalsContact CD1-OG1 3.23Å; L95-T236 WeakPolarHBondContact CD1-OG1 3.41Å |
| 96 | T | 94.9 | Very high | 90.6 | Very high | 39 Ų | 39 | 37.5 Ų | 37.5 | 24% | 0.239 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -65.1 | -45.7 | 176.3 | -57.9 | 0 | 0 | 0 | 0 | 111.2 | M92 A94 M98 T99 M100 V229 | M92-T96 WeakPolarHBondContact O-CB 3.21Å; M92-T96 PolarHBondContact O-N 2.98Å; M92-T96 PolarHBondContact O-OG1 2.99Å; A94-T96 PolarHBondContact O-N 3.48Å; T96-M98 VanDerWaalsContact C-N 3.28Å; T96-M98 PolarHBondContact O-N 2.63Å; T96-T99 PolarHBondContact O-N 3.17Å; T96-M100 HydrophobicContact CG2-CE 4.37Å; T96-M100 HydrophobicContact CG2-CG 4.5Å; T96-M100 VanDerWaalsContact O-CG 3.23Å; T96-M100 WeakPolarHBondContact O-CG 3.42Å; T96-M100 PolarHBondContact O-N 3.18Å; T96-V229 HydrophobicContact CG2-CG2 3.99Å |
| 97 | T | 92.9 | Very high | 90.4 | Very high | 45 Ų | 45 | 42.8 Ų | 42.8 | 28% | 0.276 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -59.8 | -43.7 | 178 | -59.1 | 0 | 0 | 0 | 0 | 110.6 | F93 A94 M100 L101 | F93-T97 WeakPolarHBondContact O-CB 3.35Å; F93-T97 PolarHBondContact O-N 3Å; F93-T97 PolarHBondContact O-OG1 3.44Å; A94-T97 PolarHBondContact O-N 3.42Å; T97-M100 PolarHBondContact O-N 3.44Å; T97-L101 HydrophobicContact CG2-CD1 4.25Å; T97-L101 WeakPolarHBondContact O-CG 3.21Å; T97-L101 PolarHBondContact O-N 3.36Å |
| 98 | M | 91.9 | Very high | 90 | Very high | 1 Ų | 1 | 45.2 Ų | 45.2 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -68.3 | -41.5 | 179.1 | -178.6 | -97.1 | -93.8 | 0 | 0 | 112.4 | A94 L95 T96 M100 L101 S102 E203 Q209 | A94-M98 WeakPolarHBondContact O-CB 2.91Å; A94-M98 PolarHBondContact O-N 2.99Å; L95-M98 PolarHBondContact O-N 3.42Å; T96-M98 VanDerWaalsContact C-N 3.28Å; T96-M98 PolarHBondContact O-N 2.63Å; M98-M100 VanDerWaalsContact C-N 3.29Å; M98-M100 PolarHBondContact O-N 2.95Å; M98-L101 PolarHBondContact O-N 2.9Å; M98-S102 WeakPolarHBondContact O-CB 3.32Å; M98-S102 PolarHBondContact O-N 3.42Å; M98-S102 PolarHBondContact O-OG 3.46Å; M98-E203 HydrophobicContact CE-CB 3.37Å; M98-E203 HydrophobicContact CE-CG 4.13Å; M98-E203 WeakPolarHBondContact CE-O 3.01Å; M98-Q209 HydrophobicContact CE-CB 4.16Å; M98-Q209 HydrophobicContact CE-CG 4.49Å; M98-Q209 HydrophobicContact CG-CG 4.06Å; M98-Q209 HydrophobicContact SD-CB 3.77Å; M98-Q209 HydrophobicContact SD-CG 3.65Å |
| 99 | T | 92.6 | Very high | 89.1 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.2 | -43.3 | 173.6 | -59.5 | 0 | 0 | 0 | 0 | 111 | L95 T96 S102 A103 T212 V229 H232 | L95-T99 WeakPolarHBondContact O-CB 3.34Å; L95-T99 PolarHBondContact O-N 2.72Å; L95-T99 PolarHBondContact O-OG1 2.73Å; T96-T99 PolarHBondContact O-N 3.17Å; T99-S102 PolarHBondContact O-N 3.19Å; T99-A103 VanDerWaalsContact O-CB 3.3Å; T99-A103 WeakPolarHBondContact O-CB 3.38Å; T99-A103 PolarHBondContact O-N 3.1Å; T99-T212 HydrophobicContact CG2-CG2 4.24Å; T99-V229 HydrophobicContact CG2-CG2 4.36Å; T99-H232 PolarHBondContact OG1-CD2 3.45Å; T99-H232 PolarHBondContact OG1-NE2 3.27Å |
| 100 | M | 93.9 | Very high | 88.1 | Confident | 86 Ų | 86 | 43.9 Ų | 43.9 | 42% | 0.424 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -64.5 | -45.7 | 178.1 | -70 | -69.4 | 170.9 | 0 | 0 | 112.3 | T96 T97 M98 S102 A103 L104 I225 | T96-M100 HydrophobicContact CG2-CE 4.37Å; T96-M100 HydrophobicContact CG2-CG 4.5Å; T96-M100 VanDerWaalsContact O-CG 3.23Å; T96-M100 WeakPolarHBondContact O-CG 3.42Å; T96-M100 PolarHBondContact O-N 3.18Å; T97-M100 PolarHBondContact O-N 3.44Å; M98-M100 VanDerWaalsContact C-N 3.29Å; M98-M100 PolarHBondContact O-N 2.95Å; M100-S102 VanDerWaalsContact C-N 3.33Å; M100-S102 PolarHBondContact O-N 3.11Å; M100-A103 PolarHBondContact O-N 2.91Å; M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.18Å; M100-L104 PolarHBondContact O-N 2.78Å; M100-I225 HydrophobicContact CE-CB 4.5Å; M100-I225 HydrophobicContact CE-CG2 3.11Å; M100-I225 HydrophobicContact SD-CD1 3.87Å; M100-I225 HydrophobicContact SD-CG1 4.2Å; M100-I225 HydrophobicContact SD-CG2 3.63Å |
| 101 | L | 91 | Very high | 87.2 | Confident | 74 Ų | 74 | 51.2 Ų | 51.2 | 39% | 0.387 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.1 | -44 | 176.6 | -72.6 | 173.3 | 0 | 0 | 0 | 111.1 | T97 M98 L104 L105 | T97-L101 HydrophobicContact CG2-CD1 4.25Å; T97-L101 WeakPolarHBondContact O-CG 3.21Å; T97-L101 PolarHBondContact O-N 3.36Å; M98-L101 PolarHBondContact O-N 2.9Å; L101-L104 PolarHBondContact O-N 3Å; L101-L105 VanDerWaalsContact O-CG 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.19Å; L101-L105 PolarHBondContact O-N 3.12Å |
| 102 | S | 90.8 | Very high | 86 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.1 | -46.3 | 178.5 | -55.9 | 0 | 0 | 0 | 0 | 112 | M98 T99 M100 L104 L105 G106 Q209 I213 | M98-S102 WeakPolarHBondContact O-CB 3.32Å; M98-S102 PolarHBondContact O-N 3.42Å; M98-S102 PolarHBondContact O-OG 3.46Å; T99-S102 PolarHBondContact O-N 3.19Å; M100-S102 VanDerWaalsContact C-N 3.33Å; M100-S102 PolarHBondContact O-N 3.11Å; S102-L104 VanDerWaalsContact C-N 3.32Å; S102-L104 PolarHBondContact O-N 3.25Å; S102-L105 PolarHBondContact O-N 3.26Å; S102-G106 PolarHBondContact O-N 2.63Å; S102-Q209 WeakPolarHBondContact OG-CG 3.45Å; S102-I213 VanDerWaalsContact O-CG1 3.32Å; S102-I213 WeakPolarHBondContact O-CG1 3.35Å |
| 103 | A | 89.8 | Confident | 85 | Confident | 2 Ų | 2 | 57.8 Ų | 57.8 | 2% | 0.017 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -65.8 | -37 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | T99 M100 G106 Y107 A216 I225 | T99-A103 VanDerWaalsContact O-CB 3.3Å; T99-A103 WeakPolarHBondContact O-CB 3.38Å; T99-A103 PolarHBondContact O-N 3.1Å; M100-A103 PolarHBondContact O-N 2.91Å; A103-G106 PolarHBondContact O-N 2.85Å; A103-Y107 WeakPolarHBondContact O-CB 3.4Å; A103-Y107 PolarHBondContact O-N 2.79Å; A103-A216 HydrophobicContact CB-CB 4.07Å; A103-I225 HydrophobicContact CB-CD1 3.57Å; A103-I225 HydrophobicContact CB-CG1 3.29Å |
| 104 | L | 89.9 | Confident | 83.9 | Confident | 113 Ų | 113 | 61.1 Ų | 61.1 | 59% | 0.592 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -66.4 | -42 | 175.3 | -173.4 | 147.8 | 0 | 0 | 0 | 111.7 | M100 L101 S102 Y107 A108 | M100-L104 VanDerWaalsContact O-CB 3.29Å; M100-L104 WeakPolarHBondContact O-CB 3.18Å; M100-L104 PolarHBondContact O-N 2.78Å; L101-L104 PolarHBondContact O-N 3Å; S102-L104 VanDerWaalsContact C-N 3.32Å; S102-L104 PolarHBondContact O-N 3.25Å; L104-Y107 PolarHBondContact O-N 3.37Å; L104-A108 WeakPolarHBondContact O-CB 3.37Å; L104-A108 PolarHBondContact O-N 2.67Å |
| 105 | L | 85.5 | Confident | 83 | Confident | 92 Ų | 92 | 63.7 Ų | 63.7 | 48% | 0.482 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -64 | -41.2 | 173.6 | -70.8 | 174.4 | 0 | 0 | 0 | 111.6 | L101 S102 A108 T109 I213 | L101-L105 VanDerWaalsContact O-CG 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.19Å; L101-L105 PolarHBondContact O-N 3.12Å; S102-L105 PolarHBondContact O-N 3.26Å; L105-A108 PolarHBondContact O-N 3.47Å; L105-T109 WeakPolarHBondContact O-CB 3.21Å; L105-T109 PolarHBondContact O-N 3.05Å; L105-T109 PolarHBondContact O-OG1 3.41Å; L105-I213 HydrophobicContact CB-CG1 4.33Å; L105-I213 HydrophobicContact CD1-CD1 4.39Å |
| 106 | G | 83.7 | Confident | 82.2 | Confident | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.1 | -43.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | S102 A103 T109 T110 I213 A217 | S102-G106 PolarHBondContact O-N 2.63Å; A103-G106 PolarHBondContact O-N 2.85Å; G106-T109 WeakPolarHBondContact O-CB 2.95Å; G106-T109 PolarHBondContact O-N 3.29Å; G106-T109 VanDerWaalsContact O-N 3.15Å; G106-T110 PolarHBondContact O-N 3.15Å; G106-I213 VanDerWaalsContact CA-O 3.23Å; G106-I213 WeakPolarHBondContact CA-O 3.23Å; G106-A217 WeakPolarHBondContact O-CA 3.26Å; G106-A217 WeakPolarHBondContact O-CB 3.13Å |
| 107 | Y | 82.6 | Confident | 81.3 | Confident | 158 Ų | 158 | 65.7 Ų | 65.7 | 62% | 0.62 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -63.4 | -41.7 | 173.6 | -178.4 | -99.4 | 0 | 0 | 0 | 112.1 | A103 L104 T109 T110 | A103-Y107 WeakPolarHBondContact O-CB 3.4Å; A103-Y107 PolarHBondContact O-N 2.79Å; L104-Y107 PolarHBondContact O-N 3.37Å; Y107-T109 PolarHBondContact O-N 2.81Å; Y107-T110 WeakPolarHBondContact O-CB 2.97Å; Y107-T110 WeakPolarHBondContact O-CG2 3.16Å; Y107-T110 PolarHBondContact O-N 3.03Å; Y107-T110 PolarHBondContact O-OG1 2.86Å |
| 108 | A | 78.8 | Confident | 80.6 | Confident | 51 Ų | 51 | 65.3 Ų | 65.3 | 42% | 0.421 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.7 | -29.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L104 L105 T110 I111 | L104-A108 WeakPolarHBondContact O-CB 3.37Å; L104-A108 PolarHBondContact O-N 2.67Å; L105-A108 PolarHBondContact O-N 3.47Å; A108-T110 PolarHBondContact O-N 3.4Å; A108-I111 WeakPolarHBondContact O-CG1 3.18Å |
| 109 | T | 72.1 | Confident | 80.2 | Confident | 38 Ų | 38 | 69.8 Ų | 69.8 | 23% | 0.233 | 36% | 0.36 | C | S | . | . | G | 310 helix | trans | -71.1 | -12.7 | 177.9 | -54.8 | 0 | 0 | 0 | 0 | 112.6 | L105 G106 Y107 I111 I112 | L105-T109 WeakPolarHBondContact O-CB 3.21Å; L105-T109 PolarHBondContact O-N 3.05Å; L105-T109 PolarHBondContact O-OG1 3.41Å; G106-T109 WeakPolarHBondContact O-CB 2.95Å; G106-T109 PolarHBondContact O-N 3.29Å; G106-T109 VanDerWaalsContact O-N 3.15Å; Y107-T109 PolarHBondContact O-N 2.81Å; T109-I111 PolarHBondContact O-N 3.4Å; T109-I112 HydrophobicContact CG2-CB 4.41Å; T109-I112 HydrophobicContact CG2-CD1 3.67Å; T109-I112 HydrophobicContact CG2-CG1 4.12Å; T109-I112 VanDerWaalsContact O-CB 3.28Å; T109-I112 WeakPolarHBondContact O-CB 3.11Å; T109-I112 WeakPolarHBondContact O-CG1 2.98Å; T109-I112 PolarHBondContact O-N 2.92Å |
| 110 | T | 69.1 | Low | 79.6 | Confident | 76 Ų | 76 | 74.1 Ų | 74.1 | 47% | 0.466 | 38% | 0.383 | S | S | . | . | G | 310 helix | trans | -65.4 | -7.7 | 177.2 | 67.4 | 0 | 0 | 0 | 0 | 113.7 | G106 Y107 A108 I112 | G106-T110 PolarHBondContact O-N 3.15Å; Y107-T110 WeakPolarHBondContact O-CB 2.97Å; Y107-T110 WeakPolarHBondContact O-CG2 3.16Å; Y107-T110 PolarHBondContact O-N 3.03Å; Y107-T110 PolarHBondContact O-OG1 2.86Å; A108-T110 PolarHBondContact O-N 3.4Å; T110-I112 PolarHBondContact O-N 3.42Å |
| 111 | I | 69 | Low | 78.8 | Confident | 154 Ų | 154 | 70.2 Ų | 70.2 | 79% | 0.79 | 36% | 0.363 | S | S | * | . | G | 310 helix | trans | -69.3 | -19.4 | 169.3 | -58.3 | 172 | 0 | 0 | 0 | 111 | A108 T109 | A108-I111 WeakPolarHBondContact O-CG1 3.18Å; T109-I111 PolarHBondContact O-N 3.4Å |
| 112 | I | 65.5 | Low | 78.6 | Confident | 76 Ų | 76 | 66.7 Ų | 66.7 | 39% | 0.39 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -82.7 | 139.4 | 177.7 | -56.2 | -171.7 | 0 | 0 | 0 | 110.3 | T109 T110 R114 V116 | T109-I112 HydrophobicContact CG2-CB 4.41Å; T109-I112 HydrophobicContact CG2-CD1 3.67Å; T109-I112 HydrophobicContact CG2-CG1 4.12Å; T109-I112 VanDerWaalsContact O-CB 3.28Å; T109-I112 WeakPolarHBondContact O-CB 3.11Å; T109-I112 WeakPolarHBondContact O-CG1 2.98Å; T109-I112 PolarHBondContact O-N 2.92Å; T110-I112 PolarHBondContact O-N 3.42Å; I112-R114 PolarHBondContact O-N 2.72Å; I112-V116 HydrophobicContact CG2-CB 4Å; I112-V116 HydrophobicContact CG2-CG1 3.98Å |
| 113 | P | 71.1 | Confident | 78.4 | Confident | 85 Ų | 85 | 68.5 Ų | 68.5 | 55% | 0.552 | 36% | 0.36 | S | S | * | . | trans | -56.6 | 137.1 | 178.1 | 21.8 | -34.5 | 0 | 0 | 0 | 112.8 | S115 V116 T117 | P113-S115 VanDerWaalsContact C-N 3.31Å; P113-S115 PolarHBondContact O-N 2.85Å; P113-V116 HydrophobicContact CG-CB 4.23Å; P113-V116 HydrophobicContact CG-CG2 3.8Å; P113-V116 WeakPolarHBondContact O-CB 3.48Å; P113-V116 PolarHBondContact O-N 2.89Å; P113-T117 PolarHBondContact O-N 3.31Å; P113-T117 PolarHBondContact O-OG1 3.31Å | ||
| 114 | R | 71.4 | Confident | 78.2 | Confident | 186 Ų | 186 | 71.1 Ų | 71.1 | 70% | 0.702 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -54.3 | -39.4 | -174.6 | -78.5 | -124.5 | 176.6 | 144.1 | -2.9 | 114.4 | I112 V116 T117 L118 | I112-R114 PolarHBondContact O-N 2.72Å; R114-V116 VanDerWaalsContact C-N 3.3Å; R114-V116 PolarHBondContact O-N 3.15Å; R114-T117 PolarHBondContact O-N 3.05Å; R114-L118 WeakPolarHBondContact O-CG 3.44Å; R114-L118 PolarHBondContact O-N 3.49Å |
| 115 | S | 74.1 | Confident | 78.1 | Confident | 55 Ų | 55 | 65.9 Ų | 65.9 | 39% | 0.385 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -60.3 | -41.8 | 178.5 | -51.5 | 0 | 0 | 0 | 0 | 111.2 | P113 L118 Y119 | P113-S115 VanDerWaalsContact C-N 3.31Å; P113-S115 PolarHBondContact O-N 2.85Å; S115-L118 PolarHBondContact O-N 3.32Å; S115-Y119 WeakPolarHBondContact O-CD2 3.23Å; S115-Y119 PolarHBondContact O-N 3.46Å |
| 116 | V | 74.7 | Confident | 78.4 | Confident | 73 Ų | 73 | 65 Ų | 65 | 44% | 0.442 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.1 | -44.1 | 176.8 | 178.7 | 0 | 0 | 0 | 0 | 110.6 | I112 P113 R114 L118 Y119 L120 | I112-V116 HydrophobicContact CG2-CB 4Å; I112-V116 HydrophobicContact CG2-CG1 3.98Å; P113-V116 HydrophobicContact CG-CB 4.23Å; P113-V116 HydrophobicContact CG-CG2 3.8Å; P113-V116 WeakPolarHBondContact O-CB 3.48Å; P113-V116 PolarHBondContact O-N 2.89Å; R114-V116 VanDerWaalsContact C-N 3.3Å; R114-V116 PolarHBondContact O-N 3.15Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.9Å; V116-Y119 PolarHBondContact O-N 3.35Å; V116-L120 WeakPolarHBondContact O-CB 3.2Å; V116-L120 PolarHBondContact O-N 3.49Å |
| 117 | T | 77.3 | Confident | 78.7 | Confident | 14 Ų | 14 | 70.3 Ų | 70.3 | 9% | 0.086 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59.4 | -37.8 | 177.6 | -52.4 | 0 | 0 | 0 | 0 | 112.1 | P113 R114 S121 A217 T218 | P113-T117 PolarHBondContact O-N 3.31Å; P113-T117 PolarHBondContact O-OG1 3.31Å; R114-T117 PolarHBondContact O-N 3.05Å; T117-S121 WeakPolarHBondContact O-CB 3.34Å; T117-S121 PolarHBondContact O-N 3.5Å; T117-A217 HydrophobicContact CG2-CB 3.85Å; T117-T218 HydrophobicContact CG2-CG2 3.97Å |
| 118 | L | 78 | Confident | 78.9 | Confident | 37 Ų | 37 | 64.1 Ų | 64.1 | 19% | 0.194 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -70.2 | -46.3 | 176.7 | -69.1 | 172.2 | 0 | 0 | 0 | 112.1 | R114 S115 V116 L120 S121 G122 T218 V270 N274 | R114-L118 WeakPolarHBondContact O-CG 3.44Å; R114-L118 PolarHBondContact O-N 3.49Å; S115-L118 PolarHBondContact O-N 3.32Å; V116-L118 VanDerWaalsContact C-N 3.27Å; V116-L118 PolarHBondContact O-N 2.9Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.26Å; L118-S121 WeakPolarHBondContact O-CB 3.35Å; L118-S121 PolarHBondContact O-N 3.47Å; L118-G122 PolarHBondContact O-N 3.23Å; L118-T218 HydrophobicContact CD2-CG2 4.39Å; L118-V270 HydrophobicContact CB-CG1 4.38Å; L118-V270 WeakPolarHBondContact O-CG1 3.48Å; L118-N274 WeakPolarHBondContact CD1-OD1 3.21Å |
| 119 | Y | 82.7 | Confident | 79.4 | Confident | 96 Ų | 96 | 61.7 Ų | 61.7 | 38% | 0.376 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.5 | -40.6 | 174.8 | -77.8 | -67.3 | 0 | 0 | 0 | 112.2 | S115 V116 G122 A123 F271 | S115-Y119 WeakPolarHBondContact O-CD2 3.23Å; S115-Y119 PolarHBondContact O-N 3.46Å; V116-Y119 PolarHBondContact O-N 3.35Å; Y119-G122 PolarHBondContact O-N 2.91Å; Y119-A123 VanDerWaalsContact O-CB 3.27Å; Y119-A123 WeakPolarHBondContact O-CB 3.12Å; Y119-A123 PolarHBondContact O-N 3.29Å; Y119-F271 HydrophobicContact CD1-CD1 4.49Å; Y119-F271 HydrophobicContact CD1-CE1 4.25Å |
| 120 | L | 79.9 | Confident | 80.4 | Confident | 91 Ų | 91 | 63.6 Ų | 63.6 | 48% | 0.476 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64 | -45.3 | 177.1 | -163.2 | 81.3 | 0 | 0 | 0 | 110.9 | V116 L118 A123 L124 | V116-L120 WeakPolarHBondContact O-CB 3.2Å; V116-L120 PolarHBondContact O-N 3.49Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.26Å; L120-A123 PolarHBondContact O-N 3.45Å; L120-L124 HydrophobicContact CD2-CD1 4.26Å; L120-L124 HydrophobicContact CG-CD1 4.01Å; L120-L124 HydrophobicContact CG-CG 4.42Å; L120-L124 VanDerWaalsContact O-CB 3.24Å; L120-L124 WeakPolarHBondContact O-CB 3.4Å; L120-L124 WeakPolarHBondContact O-CG 3.17Å; L120-L124 PolarHBondContact O-N 3.07Å |
| 121 | S | 78.5 | Confident | 81.4 | Confident | 3 Ų | 3 | 66.1 Ų | 66.1 | 2% | 0.021 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -55.4 | -53.6 | 174 | 172.8 | 0 | 0 | 0 | 0 | 111.8 | T117 L118 A123 L124 F125 V214 | T117-S121 WeakPolarHBondContact O-CB 3.34Å; T117-S121 PolarHBondContact O-N 3.5Å; L118-S121 WeakPolarHBondContact O-CB 3.35Å; L118-S121 PolarHBondContact O-N 3.47Å; S121-A123 PolarHBondContact O-N 3.34Å; S121-L124 PolarHBondContact O-N 3.4Å; S121-F125 WeakPolarHBondContact O-CD2 3.48Å; S121-F125 WeakPolarHBondContact O-CG 3.45Å; S121-F125 PolarHBondContact O-N 3.41Å; S121-F125 WeakPolarHBondContact OG-CE2 3.22Å; S121-V214 WeakPolarHBondContact OG-CG1 3.36Å |
| 122 | G | 85.5 | Confident | 82.2 | Confident | 0 Ų | 0 | 58.8 Ų | 58.8 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L118 Y119 F126 A267 | L118-G122 PolarHBondContact O-N 3.23Å; Y119-G122 PolarHBondContact O-N 2.91Å; G122-F126 WeakPolarHBondContact O-CB 3.19Å; G122-F126 PolarHBondContact O-N 2.94Å; G122-A267 VanDerWaalsContact O-CB 3.25Å; G122-A267 WeakPolarHBondContact O-CB 3.12Å |
| 123 | A | 87.9 | Confident | 83.3 | Confident | 39 Ų | 39 | 57.6 Ų | 57.6 | 32% | 0.322 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -64.6 | -42.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y119 L120 S121 F126 I127 | Y119-A123 VanDerWaalsContact O-CB 3.27Å; Y119-A123 WeakPolarHBondContact O-CB 3.12Å; Y119-A123 PolarHBondContact O-N 3.29Å; L120-A123 PolarHBondContact O-N 3.45Å; S121-A123 PolarHBondContact O-N 3.34Å; A123-F126 PolarHBondContact O-N 3.49Å; A123-I127 WeakPolarHBondContact O-CB 3.27Å; A123-I127 VanDerWaalsContact O-CG1 3.26Å; A123-I127 WeakPolarHBondContact O-CG1 3.28Å; A123-I127 PolarHBondContact O-N 2.94Å |
| 124 | L | 85.1 | Confident | 84.3 | Confident | 56 Ų | 56 | 61.3 Ų | 61.3 | 29% | 0.293 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.7 | -48.1 | 177.9 | -77.6 | 172.7 | 0 | 0 | 0 | 111.2 | L120 S121 F126 I127 F128 I210 V214 | L120-L124 HydrophobicContact CD2-CD1 4.26Å; L120-L124 HydrophobicContact CG-CD1 4.01Å; L120-L124 HydrophobicContact CG-CG 4.42Å; L120-L124 VanDerWaalsContact O-CB 3.24Å; L120-L124 WeakPolarHBondContact O-CB 3.4Å; L120-L124 WeakPolarHBondContact O-CG 3.17Å; L120-L124 PolarHBondContact O-N 3.07Å; S121-L124 PolarHBondContact O-N 3.4Å; L124-F126 VanDerWaalsContact C-N 3.27Å; L124-F126 PolarHBondContact O-N 2.9Å; L124-I127 PolarHBondContact O-N 3.16Å; L124-F128 WeakPolarHBondContact O-CB 3.35Å; L124-F128 PolarHBondContact O-N 3.05Å; L124-I210 HydrophobicContact CB-CG2 4.5Å; L124-I210 HydrophobicContact CD1-CG2 3.98Å; L124-I210 HydrophobicContact CD2-CG2 4.38Å; L124-V214 HydrophobicContact CD1-CG2 3.92Å |
| 125 | F | 87.7 | Confident | 84.9 | Confident | 3 Ų | 3 | 54.9 Ų | 54.9 | 1% | 0.013 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -60.8 | -37.9 | 175.6 | -72.3 | -34.4 | 0 | 0 | 0 | 112.4 | F20 S121 G129 T211 V214 L215 F263 F266 A267 | F20-F125 HydrophobicContact CE2-CE2 4.45Å; F20-F125 HydrophobicContact CZ-CE2 4.12Å; S121-F125 WeakPolarHBondContact O-CD2 3.48Å; S121-F125 WeakPolarHBondContact O-CG 3.45Å; S121-F125 PolarHBondContact O-N 3.41Å; S121-F125 WeakPolarHBondContact OG-CE2 3.22Å; F125-G129 PolarHBondContact O-N 2.74Å; F125-T211 HydrophobicContact CE1-CG2 3.38Å; F125-T211 HydrophobicContact CZ-CG2 3.65Å; F125-V214 HydrophobicContact CE2-CG1 4.08Å; F125-V214 HydrophobicContact CZ-CB 4.47Å; F125-V214 HydrophobicContact CZ-CG1 3.93Å; F125-L215 HydrophobicContact CZ-CD1 4.26Å; F125-F263 HydrophobicContact CB-CD1 4.46Å; F125-F263 WeakPolarHBondContact CB-O 3.42Å; F125-F263 AromaticContact CD1-CD1 3.43Å; F125-F263 HydrophobicContact CD1-CD1 3.43Å; F125-F263 VanDerWaalsContact CD1-CD1 3.43Å; F125-F263 AromaticContact CD1-CE1 3.72Å; F125-F263 HydrophobicContact CD1-CE1 3.72Å; F125-F263 AromaticContact CE1-CD1 3.97Å; F125-F263 HydrophobicContact CE1-CD1 3.97Å; F125-F263 AromaticContact CE1-CE1 3.8Å; F125-F263 HydrophobicContact CE1-CE1 3.8Å; F125-F263 HydrophobicContact CG-CD1 4.22Å; F125-F266 HydrophobicContact CD2-CB 3.97Å; F125-F266 HydrophobicContact CE2-CB 4.34Å; F125-F266 HydrophobicContact CG-CB 4.34Å; F125-A267 HydrophobicContact CB-CB 3.85Å |
| 126 | F | 92.1 | Very high | 85.4 | Confident | 74 Ų | 74 | 52.3 Ų | 52.3 | 33% | 0.325 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -66.6 | -51.9 | 178.1 | -172.6 | -107 | 0 | 0 | 0 | 111.9 | G122 A123 L124 F128 G129 L130 A267 F268 | G122-F126 WeakPolarHBondContact O-CB 3.19Å; G122-F126 PolarHBondContact O-N 2.94Å; A123-F126 PolarHBondContact O-N 3.49Å; L124-F126 VanDerWaalsContact C-N 3.27Å; L124-F126 PolarHBondContact O-N 2.9Å; F126-F128 VanDerWaalsContact C-N 3.29Å; F126-F128 PolarHBondContact O-N 2.7Å; F126-G129 PolarHBondContact O-N 3.45Å; F126-L130 HydrophobicContact CD1-CD1 3.87Å; F126-L130 HydrophobicContact CE1-CD1 3.36Å; F126-L130 HydrophobicContact CE1-CG 4.28Å; F126-L130 HydrophobicContact CE2-CD1 4.41Å; F126-L130 HydrophobicContact CZ-CD1 3.68Å; F126-L130 HydrophobicContact CZ-CG 4.28Å; F126-L130 WeakPolarHBondContact O-CB 3.21Å; F126-L130 WeakPolarHBondContact O-CG 3.35Å; F126-L130 PolarHBondContact O-N 3.43Å; F126-A267 HydrophobicContact CB-CB 3.7Å; F126-A267 HydrophobicContact CD2-CB 4.33Å; F126-F268 HydrophobicContact CE2-CE2 4.41Å; F126-F268 HydrophobicContact CE2-CZ 4.28Å |
| 127 | I | 90.5 | Very high | 86 | Confident | 111 Ų | 111 | 58 Ų | 58 | 57% | 0.569 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -60.2 | -43.9 | 179.4 | -69.1 | 166.7 | 0 | 0 | 0 | 110.2 | A123 L124 L130 K131 | A123-I127 WeakPolarHBondContact O-CB 3.27Å; A123-I127 VanDerWaalsContact O-CG1 3.26Å; A123-I127 WeakPolarHBondContact O-CG1 3.28Å; A123-I127 PolarHBondContact O-N 2.94Å; L124-I127 PolarHBondContact O-N 3.16Å; I127-L130 PolarHBondContact O-N 2.91Å; I127-K131 WeakPolarHBondContact O-CB 3.45Å; I127-K131 PolarHBondContact O-N 2.74Å |
| 128 | F | 86.2 | Confident | 86.4 | Confident | 29 Ų | 29 | 61 Ų | 61 | 13% | 0.127 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69 | -43.4 | -178.4 | -168.5 | -93.6 | 0 | 0 | 0 | 112 | L124 F126 L130 K131 M132 R207 F263 | L124-F128 WeakPolarHBondContact O-CB 3.35Å; L124-F128 PolarHBondContact O-N 3.05Å; F126-F128 VanDerWaalsContact C-N 3.29Å; F126-F128 PolarHBondContact O-N 2.7Å; F128-L130 VanDerWaalsContact C-N 3.33Å; F128-L130 PolarHBondContact O-N 3.48Å; F128-K131 PolarHBondContact O-N 2.73Å; F128-M132 HydrophobicContact CD1-CG 4.12Å; F128-M132 HydrophobicContact CD1-SD 4Å; F128-M132 HydrophobicContact CE1-CG 3.45Å; F128-M132 VanDerWaalsContact CE1-CG 3.45Å; F128-M132 HydrophobicContact CE1-SD 3.28Å; F128-M132 WeakPolarHBondContact CE1-SD 3.4Å; F128-M132 HydrophobicContact CZ-CG 3.78Å; F128-M132 HydrophobicContact CZ-SD 4.07Å; F128-M132 WeakPolarHBondContact O-CG 3.4Å; F128-M132 PolarHBondContact O-N 3.24Å; F128-R207 HydrophobicContact CD1-CB 4.2Å; F128-R207 HydrophobicContact CE1-CB 3.18Å; F128-R207 HydrophobicContact CE1-CG 3.67Å; F128-R207 HydrophobicContact CE2-CB 4.08Å; F128-R207 HydrophobicContact CE2-CG 4.31Å; F128-R207 HydrophobicContact CZ-CB 3.15Å; F128-R207 HydrophobicContact CZ-CG 3.27Å; F128-F263 HydrophobicContact CD1-CD1 4.33Å; F128-F263 AromaticContact CD1-CD2 3.77Å; F128-F263 HydrophobicContact CD1-CD2 3.77Å; F128-F263 HydrophobicContact CD1-CE1 4.4Å; F128-F263 AromaticContact CD1-CE2 3.85Å; F128-F263 HydrophobicContact CD1-CE2 3.85Å; F128-F263 HydrophobicContact CD1-CG 4.02Å; F128-F263 HydrophobicContact CD1-CZ 4.16Å; F128-F263 HydrophobicContact CE1-CD2 4.01Å; F128-F263 AromaticContact CE1-CE2 3.79Å; F128-F263 HydrophobicContact CE1-CE2 3.79Å; F128-F263 HydrophobicContact CE1-CZ 4.28Å |
| 129 | G | 89.2 | Confident | 86.3 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60.7 | -40.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | F125 F126 M132 L133 G260 | F125-G129 PolarHBondContact O-N 2.74Å; F126-G129 PolarHBondContact O-N 3.45Å; G129-M132 PolarHBondContact O-N 3.19Å; G129-L133 WeakPolarHBondContact O-CB 3.5Å; G129-L133 PolarHBondContact O-N 3.27Å; G129-G260 WeakPolarHBondContact CA-O 3.12Å; G129-G260 WeakPolarHBondContact O-CA 3.22Å |
| 130 | L | 93.1 | Very high | 85.7 | Confident | 77 Ų | 77 | 58.5 Ų | 58.5 | 40% | 0.403 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -65.8 | -43.3 | 173 | -74.7 | 178.6 | 0 | 0 | 0 | 112.8 | F126 I127 F128 M132 L133 Y134 I264 | F126-L130 HydrophobicContact CD1-CD1 3.87Å; F126-L130 HydrophobicContact CE1-CD1 3.36Å; F126-L130 HydrophobicContact CE1-CG 4.28Å; F126-L130 HydrophobicContact CE2-CD1 4.41Å; F126-L130 HydrophobicContact CZ-CD1 3.68Å; F126-L130 HydrophobicContact CZ-CG 4.28Å; F126-L130 WeakPolarHBondContact O-CB 3.21Å; F126-L130 WeakPolarHBondContact O-CG 3.35Å; F126-L130 PolarHBondContact O-N 3.43Å; I127-L130 PolarHBondContact O-N 2.91Å; F128-L130 VanDerWaalsContact C-N 3.33Å; F128-L130 PolarHBondContact O-N 3.48Å; L130-M132 VanDerWaalsContact C-N 3.32Å; L130-M132 PolarHBondContact O-N 2.85Å; L130-L133 PolarHBondContact O-N 3.25Å; L130-Y134 WeakPolarHBondContact O-CB 3.49Å; L130-Y134 PolarHBondContact O-N 2.95Å; L130-I264 HydrophobicContact CD2-CD1 4.01Å; L130-I264 HydrophobicContact CG-CD1 4.45Å |
| 131 | K | 89.6 | Confident | 85 | Confident | 129 Ų | 129 | 59.3 Ų | 59.3 | 56% | 0.561 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -58 | -47.1 | 175.7 | 178.4 | -176.2 | 171.1 | -177.2 | 0 | 110.7 | I127 F128 L133 Y134 E135 | I127-K131 WeakPolarHBondContact O-CB 3.45Å; I127-K131 PolarHBondContact O-N 2.74Å; F128-K131 PolarHBondContact O-N 2.73Å; K131-L133 PolarHBondContact O-N 2.8Å; K131-Y134 PolarHBondContact O-N 3.27Å; K131-E135 WeakPolarHBondContact O-CB 3.39Å; K131-E135 PolarHBondContact O-N 3.34Å |
| 132 | M | 85.3 | Confident | 84.6 | Confident | 1 Ų | 1 | 61 Ų | 61 | 1% | 0.005 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 176.2 | -79.9 | -167.5 | 68.2 | 0 | 0 | 112.9 | F128 G129 L130 Y134 E135 A136 T256 F263 | F128-M132 HydrophobicContact CD1-CG 4.12Å; F128-M132 HydrophobicContact CD1-SD 4Å; F128-M132 HydrophobicContact CE1-CG 3.45Å; F128-M132 VanDerWaalsContact CE1-CG 3.45Å; F128-M132 HydrophobicContact CE1-SD 3.28Å; F128-M132 WeakPolarHBondContact CE1-SD 3.4Å; F128-M132 HydrophobicContact CZ-CG 3.78Å; F128-M132 HydrophobicContact CZ-SD 4.07Å; F128-M132 WeakPolarHBondContact O-CG 3.4Å; F128-M132 PolarHBondContact O-N 3.24Å; G129-M132 PolarHBondContact O-N 3.19Å; L130-M132 VanDerWaalsContact C-N 3.32Å; L130-M132 PolarHBondContact O-N 2.85Å; M132-Y134 VanDerWaalsContact C-N 3.31Å; M132-Y134 PolarHBondContact O-N 2.78Å; M132-E135 PolarHBondContact O-N 3.03Å; M132-A136 WeakPolarHBondContact O-CB 3.28Å; M132-A136 PolarHBondContact O-N 3.06Å; M132-T256 HydrophobicContact CB-CG2 4.46Å; M132-T256 HydrophobicContact CE-CG2 3.88Å; M132-T256 WeakPolarHBondContact CE-O 3.48Å; M132-F263 HydrophobicContact SD-CD2 3.58Å; M132-F263 VanDerWaalsContact SD-CD2 3.58Å; M132-F263 HydrophobicContact SD-CE2 3.78Å |
| 133 | L | 89.9 | Confident | 83.9 | Confident | 50 Ų | 50 | 62.6 Ų | 62.6 | 26% | 0.262 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -65.6 | -39 | 179.2 | -160.5 | 68.9 | 0 | 0 | 0 | 111.2 | G129 L130 K131 Y137 F257 V261 I264 | G129-L133 WeakPolarHBondContact O-CB 3.5Å; G129-L133 PolarHBondContact O-N 3.27Å; L130-L133 PolarHBondContact O-N 3.25Å; K131-L133 PolarHBondContact O-N 2.8Å; L133-Y137 PolarHBondContact O-N 3.29Å; L133-F257 HydrophobicContact CD1-CD2 3.34Å; L133-F257 HydrophobicContact CD1-CE2 3.39Å; L133-F257 HydrophobicContact CD1-CG 4.12Å; L133-F257 HydrophobicContact CD1-CZ 4.2Å; L133-F257 HydrophobicContact CG-CD2 4.48Å; L133-F257 HydrophobicContact CG-CE2 4.44Å; L133-V261 HydrophobicContact CD1-CG2 4.07Å; L133-I264 HydrophobicContact CD2-CD1 4.23Å |
| 134 | Y | 91.1 | Very high | 82.9 | Confident | 164 Ų | 164 | 61.7 Ų | 61.7 | 64% | 0.643 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -65.2 | -45.9 | 172.7 | -179.8 | -96.4 | 0 | 0 | 0 | 111.6 | L130 K131 M132 A136 Y137 T138 | L130-Y134 WeakPolarHBondContact O-CB 3.49Å; L130-Y134 PolarHBondContact O-N 2.95Å; K131-Y134 PolarHBondContact O-N 3.27Å; M132-Y134 VanDerWaalsContact C-N 3.31Å; M132-Y134 PolarHBondContact O-N 2.78Å; Y134-A136 VanDerWaalsContact C-N 3.35Å; Y134-A136 PolarHBondContact O-N 3.34Å; Y134-Y137 WeakPolarHBondContact O-CB 3.42Å; Y134-Y137 PolarHBondContact O-N 2.94Å; Y134-T138 HydrophobicContact CD1-CG2 4.17Å; Y134-T138 HydrophobicContact CE1-CG2 3.68Å; Y134-T138 HydrophobicContact CE2-CG2 4.1Å; Y134-T138 WeakPolarHBondContact O-CG2 3.43Å; Y134-T138 PolarHBondContact O-N 3.38Å; Y134-T138 PolarHBondContact O-OG1 2.8Å |
| 135 | E | 84.9 | Confident | 82.3 | Confident | 50 Ų | 50 | 63.6 Ų | 63.6 | 23% | 0.234 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -57.5 | -48.1 | 175.9 | -178.5 | 168.3 | -176.8 | 0 | 0 | 111 | K131 M132 Y137 T138 M139 T256 | K131-E135 WeakPolarHBondContact O-CB 3.39Å; K131-E135 PolarHBondContact O-N 3.34Å; M132-E135 PolarHBondContact O-N 3.03Å; E135-Y137 VanDerWaalsContact C-N 3.26Å; E135-Y137 PolarHBondContact O-N 3.45Å; E135-T138 WeakPolarHBondContact CA-OG1 2.91Å; E135-T138 CarbonylContact O-C 3.23Å; E135-T138 PolarHBondContact O-N 2.86Å; E135-T138 VanDerWaalsContact O-N 3.08Å; E135-T138 PolarHBondContact O-OG1 2.86Å; E135-M139 HydrophobicContact CG-CE 3.41Å; E135-M139 VanDerWaalsContact CG-CE 3.41Å; E135-M139 HydrophobicContact CG-CG 4.27Å; E135-M139 HydrophobicContact CG-SD 4.06Å; E135-M139 WeakPolarHBondContact O-CB 3.29Å; E135-M139 VanDerWaalsContact O-CG 3.27Å; E135-M139 WeakPolarHBondContact O-CG 3.17Å; E135-M139 PolarHBondContact O-N 3.41Å; E135-M139 WeakPolarHBondContact OE1-CE 3.39Å; E135-T256 HydrophobicContact CG-CG2 4.45Å |
| 136 | A | 84.7 | Confident | 81.9 | Confident | 1 Ų | 1 | 68.8 Ų | 68.8 | 1% | 0.008 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -60 | -32.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | M132 Y134 Q253 T256 F257 | M132-A136 WeakPolarHBondContact O-CB 3.28Å; M132-A136 PolarHBondContact O-N 3.06Å; Y134-A136 VanDerWaalsContact C-N 3.35Å; Y134-A136 PolarHBondContact O-N 3.34Å; A136-Q253 WeakPolarHBondContact O-CG 3.17Å; A136-Q253 PolarHBondContact O-NE2 3.36Å; A136-T256 HydrophobicContact CB-CG2 3.97Å; A136-F257 HydrophobicContact CB-CB 3.93Å |
| 137 | Y | 87.3 | Confident | 81 | Confident | 192 Ų | 192 | 67.6 Ų | 67.6 | 75% | 0.753 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -73.4 | -35.8 | 174.6 | -177.1 | -100.3 | 0 | 0 | 0 | 112.3 | L133 Y134 E135 | L133-Y137 PolarHBondContact O-N 3.29Å; Y134-Y137 WeakPolarHBondContact O-CB 3.42Å; Y134-Y137 PolarHBondContact O-N 2.94Å; E135-Y137 VanDerWaalsContact C-N 3.26Å; E135-Y137 PolarHBondContact O-N 3.45Å |
| 138 | T | 85.9 | Confident | 80.1 | Confident | 79 Ų | 79 | 64.2 Ų | 64.2 | 49% | 0.485 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -84 | -18.8 | 179.9 | 58.5 | 0 | 0 | 0 | 0 | 114.5 | Y134 E135 S140 | Y134-T138 HydrophobicContact CD1-CG2 4.17Å; Y134-T138 HydrophobicContact CE1-CG2 3.68Å; Y134-T138 HydrophobicContact CE2-CG2 4.1Å; Y134-T138 WeakPolarHBondContact O-CG2 3.43Å; Y134-T138 PolarHBondContact O-N 3.38Å; Y134-T138 PolarHBondContact O-OG1 2.8Å; E135-T138 WeakPolarHBondContact CA-OG1 2.91Å; E135-T138 CarbonylContact O-C 3.23Å; E135-T138 PolarHBondContact O-N 2.86Å; E135-T138 VanDerWaalsContact O-N 3.08Å; E135-T138 PolarHBondContact O-OG1 2.86Å; T138-S140 PolarHBondContact O-N 3.14Å |
| 139 | M | 75.9 | Confident | 79.8 | Confident | 22 Ų | 22 | 66.6 Ų | 66.6 | 11% | 0.108 | 34% | 0.335 | C | S | . | . | trans | -68.1 | 116.7 | 179.7 | -84.2 | 175 | 171.9 | 0 | 0 | 111.3 | E135 V252 T256 | E135-M139 HydrophobicContact CG-CE 3.41Å; E135-M139 VanDerWaalsContact CG-CE 3.41Å; E135-M139 HydrophobicContact CG-CG 4.27Å; E135-M139 HydrophobicContact CG-SD 4.06Å; E135-M139 WeakPolarHBondContact O-CB 3.29Å; E135-M139 VanDerWaalsContact O-CG 3.27Å; E135-M139 WeakPolarHBondContact O-CG 3.17Å; E135-M139 PolarHBondContact O-N 3.41Å; E135-M139 WeakPolarHBondContact OE1-CE 3.39Å; M139-V252 HydrophobicContact SD-CG2 4.49Å; M139-T256 HydrophobicContact SD-CG2 4.42Å | ||
| 140 | S | 69.3 | Low | 79.5 | Confident | 58 Ų | 58 | 71.5 Ų | 71.5 | 41% | 0.406 | 36% | 0.358 | S | S | . | . | trans | -73.5 | 151.7 | 165.1 | 171.8 | 0 | 0 | 0 | 0 | 109.6 | T138 S142 T143 | T138-S140 PolarHBondContact O-N 3.14Å; S140-S142 PolarHBondContact O-N 3.32Å; S140-S142 PolarHBondContact OG-N 3.45Å; S140-S142 PolarHBondContact OG-OG 2.86Å; S140-T143 PolarHBondContact N-OG1 3.01Å; S140-T143 WeakPolarHBondContact O-CB 3.31Å; S140-T143 PolarHBondContact O-N 3.38Å; S140-T143 PolarHBondContact O-OG1 2.94Å | ||
| 141 | S | 65.3 | Low | 78.5 | Confident | 108 Ų | 108 | 68.3 Ų | 68.3 | 76% | 0.755 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.2 | -18.5 | 170.5 | 55.7 | 0 | 0 | 0 | 0 | 113.2 | ||
| 142 | S | 70 | Confident | 77.9 | Confident | 39 Ų | 39 | 66.4 Ų | 66.4 | 27% | 0.273 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | -19.2 | 175 | 63.5 | 0 | 0 | 0 | 0 | 114 | S140 A144 K145 E146 | S140-S142 PolarHBondContact O-N 3.32Å; S140-S142 PolarHBondContact OG-N 3.45Å; S140-S142 PolarHBondContact OG-OG 2.86Å; S142-A144 VanDerWaalsContact C-N 3.31Å; S142-A144 PolarHBondContact O-N 3.4Å; S142-K145 CarbonylContact O-C 3.5Å; S142-K145 VanDerWaalsContact O-CA 3.29Å; S142-K145 WeakPolarHBondContact O-CA 3.2Å; S142-K145 VanDerWaalsContact O-CB 3.25Å; S142-K145 WeakPolarHBondContact O-CB 3.1Å; S142-K145 PolarHBondContact O-N 2.92Å; S142-E146 WeakPolarHBondContact CB-OE1 3.39Å; S142-E146 PolarHBondContact O-N 3.42Å; S142-E146 PolarHBondContact OG-OE1 3.43Å |
| 143 | T | 71 | Confident | 77.8 | Confident | 32 Ų | 32 | 72.4 Ų | 72.4 | 20% | 0.196 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -59 | -42.8 | -175.1 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | S140 K145 E146 E147 | S140-T143 PolarHBondContact N-OG1 3.01Å; S140-T143 WeakPolarHBondContact O-CB 3.31Å; S140-T143 PolarHBondContact O-N 3.38Å; S140-T143 PolarHBondContact O-OG1 2.94Å; T143-K145 PolarHBondContact O-N 3.13Å; T143-E146 PolarHBondContact O-N 3.11Å; T143-E147 HydrophobicContact CG2-CG 4.35Å; T143-E147 WeakPolarHBondContact O-CB 3.17Å; T143-E147 WeakPolarHBondContact O-CG 3.36Å; T143-E147 PolarHBondContact O-N 3.41Å |
| 144 | A | 66.4 | Low | 77.2 | Confident | 20 Ų | 20 | 73.8 Ų | 73.8 | 17% | 0.165 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62.9 | -28.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | F73 S142 F148 V252 | F73-A144 HydrophobicContact CE1-CB 4.45Å; S142-A144 VanDerWaalsContact C-N 3.31Å; S142-A144 PolarHBondContact O-N 3.4Å; A144-F148 WeakPolarHBondContact O-CB 3.4Å; A144-F148 PolarHBondContact O-N 2.8Å; A144-F148 VanDerWaalsContact O-N 3.13Å; A144-V252 HydrophobicContact CB-CG1 3.75Å; A144-V252 HydrophobicContact CB-CG2 4.09Å |
| 145 | K | 72.9 | Confident | 76.5 | Confident | 97 Ų | 97 | 66.3 Ų | 66.3 | 42% | 0.422 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -78.8 | -38.3 | 176.2 | -171.7 | -179.8 | 171.2 | 60.6 | 0 | 111.7 | S142 T143 F148 D149 | S142-K145 CarbonylContact O-C 3.5Å; S142-K145 VanDerWaalsContact O-CA 3.29Å; S142-K145 WeakPolarHBondContact O-CA 3.2Å; S142-K145 VanDerWaalsContact O-CB 3.25Å; S142-K145 WeakPolarHBondContact O-CB 3.1Å; S142-K145 PolarHBondContact O-N 2.92Å; T143-K145 PolarHBondContact O-N 3.13Å; K145-F148 WeakPolarHBondContact O-CB 3.28Å; K145-F148 PolarHBondContact O-N 3Å; K145-D149 WeakPolarHBondContact O-CB 3.29Å; K145-D149 VanDerWaalsContact O-CG 3.24Å; K145-D149 PolarHBondContact O-N 2.69Å |
| 146 | E | 79.4 | Confident | 76.2 | Confident | 111 Ų | 111 | 67.4 Ų | 67.4 | 52% | 0.519 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65 | -47.7 | 175.6 | -71.5 | 161.2 | -146.8 | 0 | 0 | 110.8 | S142 T143 F148 D149 E150 | S142-E146 WeakPolarHBondContact CB-OE1 3.39Å; S142-E146 PolarHBondContact O-N 3.42Å; S142-E146 PolarHBondContact OG-OE1 3.43Å; T143-E146 PolarHBondContact O-N 3.11Å; E146-F148 VanDerWaalsContact C-N 3.26Å; E146-F148 PolarHBondContact O-N 2.92Å; E146-D149 PolarHBondContact O-N 2.91Å; E146-E150 WeakPolarHBondContact O-CB 3.18Å; E146-E150 PolarHBondContact O-N 3.49Å |
| 147 | E | 72.5 | Confident | 75.9 | Confident | 49 Ų | 49 | 72.4 Ų | 72.4 | 23% | 0.229 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -60.8 | -37.1 | 173.3 | -63 | -86 | 178.7 | 0 | 0 | 111 | K70 T143 V151 | K70-E147 WeakPolarHBondContact CE-OE1 3.22Å; K70-E147 IonicContact NZ-OE1 3.26Å; K70-E147 PolarHBondContact NZ-OE1 3.38Å; T143-E147 HydrophobicContact CG2-CG 4.35Å; T143-E147 WeakPolarHBondContact O-CB 3.17Å; T143-E147 WeakPolarHBondContact O-CG 3.36Å; T143-E147 PolarHBondContact O-N 3.41Å; E147-V151 WeakPolarHBondContact O-CG2 3.37Å; E147-V151 PolarHBondContact O-N 2.83Å |
| 148 | F | 72.7 | Confident | 75.3 | Confident | 41 Ų | 41 | 65.6 Ų | 65.6 | 18% | 0.18 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -63.3 | -47.1 | 173.6 | 178.6 | -80.1 | 0 | 0 | 0 | 112 | I77 M80 A144 K145 E146 H152 | I77-F148 HydrophobicContact CB-CD2 4.47Å; I77-F148 HydrophobicContact CG2-CD2 3.28Å; I77-F148 HydrophobicContact CG2-CE2 3.58Å; I77-F148 HydrophobicContact CG2-CG 4.26Å; M80-F148 HydrophobicContact CE-CE2 4.4Å; M80-F148 HydrophobicContact SD-CE2 4.26Å; A144-F148 WeakPolarHBondContact O-CB 3.4Å; A144-F148 PolarHBondContact O-N 2.8Å; A144-F148 VanDerWaalsContact O-N 3.13Å; K145-F148 WeakPolarHBondContact O-CB 3.28Å; K145-F148 PolarHBondContact O-N 3Å; E146-F148 VanDerWaalsContact C-N 3.26Å; E146-F148 PolarHBondContact O-N 2.92Å; F148-H152 WeakPolarHBondContact O-CB 3.37Å; F148-H152 PolarHBondContact O-N 3.42Å |
| 149 | D | 79.8 | Confident | 74.6 | Confident | 79 Ų | 79 | 70 Ų | 70 | 42% | 0.422 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -70.5 | -37.5 | -177.2 | -69.6 | -23.1 | 0 | 0 | 0 | 111.3 | K145 E146 M153 | K145-D149 WeakPolarHBondContact O-CB 3.29Å; K145-D149 VanDerWaalsContact O-CG 3.24Å; K145-D149 PolarHBondContact O-N 2.69Å; E146-D149 PolarHBondContact O-N 2.91Å; D149-M153 WeakPolarHBondContact O-CB 3.2Å; D149-M153 PolarHBondContact O-N 3.23Å |
| 150 | E | 82.1 | Confident | 74.5 | Confident | 103 Ų | 103 | 71.1 Ų | 71.1 | 48% | 0.481 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.4 | -52.1 | 176.8 | -177.1 | 177.5 | 168.5 | 0 | 0 | 112 | E146 H152 M153 Q154 | E146-E150 WeakPolarHBondContact O-CB 3.18Å; E146-E150 PolarHBondContact O-N 3.49Å; E150-H152 VanDerWaalsContact C-N 3.33Å; E150-H152 PolarHBondContact O-N 2.74Å; E150-M153 WeakPolarHBondContact O-CB 3.24Å; E150-M153 PolarHBondContact O-N 3.02Å; E150-M153 VanDerWaalsContact O-N 3.16Å; E150-Q154 WeakPolarHBondContact O-CG 3.42Å; E150-Q154 PolarHBondContact O-N 2.95Å; E150-Q154 PolarHBondContact OE1-NE2 3.22Å |
| 151 | V | 71.6 | Confident | 74.6 | Confident | 10 Ų | 10 | 71.6 Ų | 71.6 | 6% | 0.061 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -67 | -38.3 | -179.8 | 175.7 | 0 | 0 | 0 | 0 | 110.5 | I74 I77 E147 M153 Q154 L155 | I74-V151 HydrophobicContact CG1-CG2 4.44Å; I77-V151 HydrophobicContact CD1-CB 3.4Å; I77-V151 HydrophobicContact CD1-CG1 3.45Å; I77-V151 VanDerWaalsContact CD1-CG1 3.45Å; I77-V151 HydrophobicContact CD1-CG2 3.85Å; I77-V151 HydrophobicContact CG1-CB 4.25Å; I77-V151 HydrophobicContact CG1-CG1 3.76Å; E147-V151 WeakPolarHBondContact O-CG2 3.37Å; E147-V151 PolarHBondContact O-N 2.83Å; V151-M153 PolarHBondContact O-N 3.32Å; V151-Q154 PolarHBondContact O-N 2.91Å; V151-L155 HydrophobicContact CG1-CD1 3.99Å; V151-L155 HydrophobicContact CG1-CG 4.2Å; V151-L155 VanDerWaalsContact O-CG 3.23Å; V151-L155 WeakPolarHBondContact O-CG 3.29Å; V151-L155 PolarHBondContact O-N 2.94Å |
| 152 | H | 78.4 | Confident | 74.6 | Confident | 88 Ų | 88 | 70.5 Ų | 70.5 | 41% | 0.407 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -60.3 | -36 | 174.5 | -170.2 | -81.7 | 0 | 0 | 0 | 112.2 | Q81 F148 E150 T156 | Q81-H152 PolarHBondContact NE2-CD2 3.04Å; Q81-H152 PolarHBondContact NE2-NE2 3.25Å; F148-H152 WeakPolarHBondContact O-CB 3.37Å; F148-H152 PolarHBondContact O-N 3.42Å; E150-H152 VanDerWaalsContact C-N 3.33Å; E150-H152 PolarHBondContact O-N 2.74Å; H152-T156 WeakPolarHBondContact O-CB 3.09Å; H152-T156 PolarHBondContact O-N 3.15Å; H152-T156 VanDerWaalsContact O-N 3.13Å; H152-T156 PolarHBondContact O-OG1 3.48Å |
| 153 | M | 82.4 | Confident | 74.3 | Confident | 128 Ų | 128 | 74.3 Ų | 74.3 | 63% | 0.631 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -69.4 | -45.6 | 174.5 | -175.8 | 178.2 | 65.5 | 0 | 0 | 112 | D149 E150 V151 L155 T156 Q157 | D149-M153 WeakPolarHBondContact O-CB 3.2Å; D149-M153 PolarHBondContact O-N 3.23Å; E150-M153 WeakPolarHBondContact O-CB 3.24Å; E150-M153 PolarHBondContact O-N 3.02Å; E150-M153 VanDerWaalsContact O-N 3.16Å; V151-M153 PolarHBondContact O-N 3.32Å; M153-L155 VanDerWaalsContact C-N 3.34Å; M153-L155 PolarHBondContact O-N 3.43Å; M153-T156 PolarHBondContact O-N 3.39Å; M153-Q157 WeakPolarHBondContact O-CB 3.11Å; M153-Q157 PolarHBondContact O-N 2.88Å |
| 154 | Q | 78.7 | Confident | 73.9 | Confident | 79 Ų | 79 | 80.8 Ų | 80.8 | 37% | 0.369 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -58.1 | -45.3 | 176.7 | -70.1 | 178.9 | 4.9 | 0 | 0 | 111.5 | E150 V151 T156 Q157 S158 | E150-Q154 WeakPolarHBondContact O-CG 3.42Å; E150-Q154 PolarHBondContact O-N 2.95Å; E150-Q154 PolarHBondContact OE1-NE2 3.22Å; V151-Q154 PolarHBondContact O-N 2.91Å; Q154-T156 PolarHBondContact O-N 2.85Å; Q154-Q157 PolarHBondContact O-N 2.92Å; Q154-S158 PolarHBondContact O-N 3.46Å; Q154-S158 PolarHBondContact O-OG 2.95Å |
| 155 | L | 75.2 | Confident | 73.6 | Confident | 6 Ų | 6 | 85 Ų | 85 | 3% | 0.031 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 177.9 | -63.4 | 174.2 | 0 | 0 | 0 | 112.8 | M78 V151 M153 Q157 R159 E194 | M78-L155 HydrophobicContact CE-CD2 3.5Å; M78-L155 VanDerWaalsContact CE-CD2 3.5Å; V151-L155 HydrophobicContact CG1-CD1 3.99Å; V151-L155 HydrophobicContact CG1-CG 4.2Å; V151-L155 VanDerWaalsContact O-CG 3.23Å; V151-L155 WeakPolarHBondContact O-CG 3.29Å; V151-L155 PolarHBondContact O-N 2.94Å; M153-L155 VanDerWaalsContact C-N 3.34Å; M153-L155 PolarHBondContact O-N 3.43Å; L155-Q157 VanDerWaalsContact C-N 3.32Å; L155-R159 WeakPolarHBondContact O-CB 3.25Å; L155-R159 PolarHBondContact O-N 3.44Å; L155-R159 VanDerWaalsContact O-N 3.12Å; L155-E194 WeakPolarHBondContact CD2-OE1 3.28Å |
| 156 | T | 78.2 | Confident | 72.5 | Confident | 73 Ų | 73 | 82.8 Ų | 82.8 | 45% | 0.448 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.4 | -38.9 | 176.8 | -56.7 | 0 | 0 | 0 | 0 | 111 | H152 M153 Q154 A160 | H152-T156 WeakPolarHBondContact O-CB 3.09Å; H152-T156 PolarHBondContact O-N 3.15Å; H152-T156 VanDerWaalsContact O-N 3.13Å; H152-T156 PolarHBondContact O-OG1 3.48Å; M153-T156 PolarHBondContact O-N 3.39Å; Q154-T156 PolarHBondContact O-N 2.85Å; T156-A160 PolarHBondContact O-N 3.41Å |
| 157 | Q | 80 | Confident | 71.1 | Confident | 106 Ų | 106 | 82.2 Ų | 82.2 | 50% | 0.495 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.7 | -50.3 | 176.6 | -179.5 | 62 | 29.5 | 0 | 0 | 111.7 | M153 Q154 L155 R159 A160 D161 | M153-Q157 WeakPolarHBondContact O-CB 3.11Å; M153-Q157 PolarHBondContact O-N 2.88Å; Q154-Q157 PolarHBondContact O-N 2.92Å; L155-Q157 VanDerWaalsContact C-N 3.32Å; Q157-R159 PolarHBondContact O-N 3.31Å; Q157-A160 WeakPolarHBondContact O-CA 3.19Å; Q157-A160 WeakPolarHBondContact O-CB 3.33Å; Q157-A160 PolarHBondContact O-N 2.92Å; Q157-D161 PolarHBondContact NE2-OD1 3.44Å; Q157-D161 PolarHBondContact NE2-OD2 2.86Å; Q157-D161 PolarHBondContact O-N 3.35Å |
| 158 | S | 72.8 | Confident | 69.5 | Low | 49 Ų | 49 | 89.1 Ų | 89.1 | 34% | 0.343 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -58.3 | -35.4 | 178.2 | -64.8 | 0 | 0 | 0 | 0 | 112.3 | Q154 D161 D162 | Q154-S158 PolarHBondContact O-N 3.46Å; Q154-S158 PolarHBondContact O-OG 2.95Å; S158-D161 PolarHBondContact O-N 2.84Å; S158-D162 PolarHBondContact O-N 2.7Å |
| 159 | R | 71.2 | Confident | 68.3 | Low | 171 Ų | 171 | 93.1 Ų | 93.1 | 65% | 0.645 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.8 | -36.8 | 172.9 | -179.7 | 177.6 | 169.4 | 77.4 | 5.1 | 113.1 | L155 Q157 I163 | L155-R159 WeakPolarHBondContact O-CB 3.25Å; L155-R159 PolarHBondContact O-N 3.44Å; L155-R159 VanDerWaalsContact O-N 3.12Å; Q157-R159 PolarHBondContact O-N 3.31Å; R159-I163 HydrophobicContact CG-CD1 4.27Å; R159-I163 WeakPolarHBondContact O-CD1 3.39Å; R159-I163 VanDerWaalsContact O-CG1 3.29Å; R159-I163 WeakPolarHBondContact O-CG1 3.45Å; R159-I163 PolarHBondContact O-N 2.75Å |
| 160 | A | 75.7 | Confident | 66.1 | Low | 47 Ų | 47 | 94.8 Ų | 94.8 | 39% | 0.388 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.8 | -42.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | T156 Q157 D162 I163 E164 | T156-A160 PolarHBondContact O-N 3.41Å; Q157-A160 WeakPolarHBondContact O-CA 3.19Å; Q157-A160 WeakPolarHBondContact O-CB 3.33Å; Q157-A160 PolarHBondContact O-N 2.92Å; A160-D162 PolarHBondContact O-N 3.14Å; A160-I163 PolarHBondContact O-N 3.4Å; A160-E164 PolarHBondContact O-N 2.85Å |
| 161 | D | 70.6 | Confident | 63.8 | Low | 67 Ų | 67 | 97.4 Ų | 97.4 | 36% | 0.358 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -38.3 | 177.8 | -61.8 | -25.7 | 0 | 0 | 0 | 111.9 | Q157 S158 I163 E164 T165 | Q157-D161 PolarHBondContact NE2-OD1 3.44Å; Q157-D161 PolarHBondContact NE2-OD2 2.86Å; Q157-D161 PolarHBondContact O-N 3.35Å; S158-D161 PolarHBondContact O-N 2.84Å; D161-I163 VanDerWaalsContact C-N 3.33Å; D161-I163 PolarHBondContact O-N 3.3Å; D161-E164 PolarHBondContact O-N 3.1Å; D161-T165 VanDerWaalsContact O-CB 3.3Å; D161-T165 WeakPolarHBondContact O-CB 3.49Å; D161-T165 PolarHBondContact O-N 2.72Å; D161-T165 PolarHBondContact O-OG1 3.1Å |
| 162 | D | 65.1 | Low | 61.8 | Low | 85 Ų | 85 | 102 Ų | 102 | 46% | 0.455 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -64.1 | -35.4 | 175.2 | -82.9 | -21.1 | 0 | 0 | 0 | 112.9 | S158 A160 | S158-D162 PolarHBondContact O-N 2.7Å; A160-D162 PolarHBondContact O-N 3.14Å |
| 163 | I | 62.9 | Low | 59.7 | Low | 119 Ų | 119 | 103.8 Ų | 103.8 | 61% | 0.61 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -71.3 | -43.1 | 177 | -67.7 | 166.3 | 0 | 0 | 0 | 109.9 | R159 A160 D161 G166 | R159-I163 HydrophobicContact CG-CD1 4.27Å; R159-I163 WeakPolarHBondContact O-CD1 3.39Å; R159-I163 VanDerWaalsContact O-CG1 3.29Å; R159-I163 WeakPolarHBondContact O-CG1 3.45Å; R159-I163 PolarHBondContact O-N 2.75Å; A160-I163 PolarHBondContact O-N 3.4Å; D161-I163 VanDerWaalsContact C-N 3.33Å; D161-I163 PolarHBondContact O-N 3.3Å; I163-G166 PolarHBondContact O-N 3.07Å |
| 164 | E | 63.8 | Low | 57.4 | Low | 169 Ų | 169 | 106.9 Ų | 106.9 | 79% | 0.79 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.9 | -38.1 | 178.7 | -166.7 | 174.7 | 173.9 | 0 | 0 | 112 | A160 D161 G166 | A160-E164 PolarHBondContact O-N 2.85Å; D161-E164 PolarHBondContact O-N 3.1Å; E164-G166 PolarHBondContact O-N 2.96Å; E164-G166 VanDerWaalsContact O-N 3.13Å |
| 165 | T | 58.7 | Low | 55 | Low | 107 Ų | 107 | 105.7 Ų | 105.7 | 66% | 0.656 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | 0.8 | -177 | -48 | 0 | 0 | 0 | 0 | 113.3 | D161 T167 | D161-T165 VanDerWaalsContact O-CB 3.3Å; D161-T165 WeakPolarHBondContact O-CB 3.49Å; D161-T165 PolarHBondContact O-N 2.72Å; D161-T165 PolarHBondContact O-OG1 3.1Å; T165-T167 VanDerWaalsContact C-N 3.35Å; T165-T167 PolarHBondContact O-N 2.75Å |
| 166 | G | 50.6 | Low | 53.1 | Low | 51 Ų | 51 | 114 Ų | 114 | 53% | 0.526 | 65% | 0.645 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 63.3 | 36.4 | 166 | 0 | 0 | 0 | 0 | 0 | 114.2 | I163 E164 K168 | I163-G166 PolarHBondContact O-N 3.07Å; E164-G166 PolarHBondContact O-N 2.96Å; E164-G166 VanDerWaalsContact O-N 3.13Å; G166-K168 VanDerWaalsContact C-N 3.35Å; G166-K168 PolarHBondContact O-N 3.14Å |
| 167 | T | 49.9 | Very low | 51.2 | Low | 100 Ų | 100 | 118.1 Ų | 118.1 | 61% | 0.613 | 66% | 0.663 | S | S | * | * | trans | -66 | 99 | 170 | -63.2 | 0 | 0 | 0 | 0 | 108.4 | T165 T169 | T165-T167 VanDerWaalsContact C-N 3.35Å; T165-T167 PolarHBondContact O-N 2.75Å; T167-T169 PolarHBondContact O-N 2.86Å | ||
| 168 | K | 38.5 | Very low | 49 | Very low | 194 Ų | 194 | 117.6 Ų | 117.6 | 84% | 0.843 | 67% | 0.672 | S | S | * | * | trans | -48.8 | 89.4 | 176.6 | -62.5 | 172.9 | 178.9 | 173 | 0 | 111.6 | G166 S170 | G166-K168 VanDerWaalsContact C-N 3.35Å; G166-K168 PolarHBondContact O-N 3.14Å; K168-S170 PolarHBondContact O-N 3.44Å | ||
| 169 | T | 48.1 | Very low | 47.3 | Very low | 124 Ų | 124 | 123.3 Ų | 123.3 | 76% | 0.761 | 69% | 0.69 | S | S | * | * | trans | -89 | 85.6 | 165.4 | 55.4 | 0 | 0 | 0 | 0 | 107.8 | T167 D171 | T167-T169 PolarHBondContact O-N 2.86Å; T169-D171 PolarHBondContact O-N 3.49Å | ||
| 170 | S | 34.4 | Very low | 45.9 | Very low | 114 Ų | 114 | 119.1 Ų | 119.1 | 80% | 0.797 | 69% | 0.687 | S | S | * | * | trans | -55.2 | 123.9 | 171.9 | -68.9 | 0 | 0 | 0 | 0 | 110.7 | K168 | K168-S170 PolarHBondContact O-N 3.44Š| ||
| 171 | D | 32.6 | Very low | 44.5 | Very low | 158 Ų | 158 | 124 Ų | 124 | 85% | 0.845 | 71% | 0.706 | S | S | * | * | trans | -52.5 | 128.7 | 166.6 | -63.9 | -54.7 | 0 | 0 | 0 | 111.7 | T169 | T169-D171 PolarHBondContact O-N 3.49Š| ||
| 172 | S | 29.9 | Very low | 43.3 | Very low | 108 Ų | 108 | 125.4 Ų | 125.4 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | trans | -160.5 | 116.2 | 139.2 | 66 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 173 | P | 35.1 | Very low | 42.5 | Very low | 125 Ų | 125 | 125.2 Ų | 125.2 | 81% | 0.812 | 72% | 0.715 | S | S | * | * | trans | -99.2 | 75.2 | 179.2 | 35.1 | -29.5 | 0 | 0 | 0 | 110.8 | ||||
| 174 | Q | 33.2 | Very low | 41.9 | Very low | 192 Ų | 192 | 124.5 Ų | 124.5 | 90% | 0.897 | 72% | 0.717 | S | S | * | * | trans | -147.6 | 125.6 | 170.2 | -63.7 | -173.3 | 6.2 | 0 | 0 | 111.9 | ||||
| 175 | G | 28.4 | Very low | 41.1 | Very low | 55 Ų | 55 | 127.8 Ų | 127.8 | 57% | 0.567 | 72% | 0.722 | S | S | * | * | trans | 106.7 | 79.4 | 162.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | L177 S178 | G175-L177 PolarHBondContact O-N 3.5Å; G175-S178 PolarHBondContact O-N 3.45Å | ||
| 176 | L | 35.2 | Very low | 40.6 | Very low | 181 Ų | 181 | 127 Ų | 127 | 95% | 0.948 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | -7.8 | 176.8 | -170.8 | 140.4 | 0 | 0 | 0 | 114.8 | ||
| 177 | L | 38.2 | Very low | 40.6 | Very low | 158 Ų | 158 | 128 Ų | 128 | 83% | 0.827 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.7 | -24.6 | -177.2 | -127.3 | 177.6 | 0 | 0 | 0 | 115.4 | G175 K179 | G175-L177 PolarHBondContact O-N 3.5Å; L177-K179 VanDerWaalsContact C-N 3.3Å; L177-K179 PolarHBondContact O-N 3.24Å |
| 178 | S | 33.5 | Very low | 41 | Very low | 96 Ų | 96 | 130.7 Ų | 130.7 | 67% | 0.671 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -81.9 | -9.4 | 178.9 | -73.1 | 0 | 0 | 0 | 0 | 113.8 | G175 S180 L181 | G175-S178 PolarHBondContact O-N 3.45Å; S178-S180 PolarHBondContact O-N 2.9Å; S178-L181 PolarHBondContact O-N 3.27Å |
| 179 | K | 36.6 | Very low | 42.5 | Very low | 168 Ų | 168 | 122.2 Ų | 122.2 | 73% | 0.73 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -66.8 | -9 | -177.3 | -136.1 | 177.6 | -174.1 | 179.1 | 0 | 113.8 | L177 I183 | L177-K179 VanDerWaalsContact C-N 3.3Å; L177-K179 PolarHBondContact O-N 3.24Å; K179-I183 WeakPolarHBondContact O-CD1 3.15Å; K179-I183 WeakPolarHBondContact O-CG1 3.38Å |
| 180 | S | 43.4 | Very low | 44 | Very low | 83 Ų | 83 | 120 Ų | 120 | 58% | 0.58 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -77.9 | -22.9 | 178.3 | -167 | 0 | 0 | 0 | 0 | 114.3 | S178 | S178-S180 PolarHBondContact O-N 2.9Š|
| 181 | L | 46.1 | Very low | 46.2 | Very low | 151 Ų | 151 | 116.2 Ų | 116.2 | 79% | 0.791 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.8 | -13 | -176.5 | -70.4 | 174.8 | 0 | 0 | 0 | 114.4 | S178 | S178-L181 PolarHBondContact O-N 3.27Š|
| 182 | T | 44.1 | Very low | 48.7 | Very low | 95 Ų | 95 | 109.7 Ų | 109.7 | 58% | 0.583 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -78.5 | -9.3 | 165.9 | -47 | 0 | 0 | 0 | 0 | 112.2 | T184 R185 | T182-T184 PolarHBondContact O-N 2.7Å; T182-T184 VanDerWaalsContact O-N 3.16Å; T182-R185 PolarHBondContact O-N 2.99Å |
| 183 | I | 49.3 | Very low | 51.2 | Low | 81 Ų | 81 | 107.4 Ų | 107.4 | 42% | 0.415 | 58% | 0.578 | S | S | . | * | G | 310 helix | trans | -56.5 | -34.1 | -179.3 | -58 | -170.9 | 0 | 0 | 0 | 111.5 | K179 R185 N186 I187 | K179-I183 WeakPolarHBondContact O-CD1 3.15Å; K179-I183 WeakPolarHBondContact O-CG1 3.38Å; I183-R185 VanDerWaalsContact C-N 3.35Å; I183-R185 PolarHBondContact O-N 3.49Å; I183-N186 CarbonylContact O-C 3.59Å; I183-N186 VanDerWaalsContact O-C 3.23Å; I183-N186 VanDerWaalsContact O-CA 3.3Å; I183-N186 WeakPolarHBondContact O-CA 3.45Å; I183-N186 WeakPolarHBondContact O-CB 3.09Å; I183-N186 PolarHBondContact O-N 2.89Å; I183-I187 HydrophobicContact CG2-CG1 3.97Å; I183-I187 VanDerWaalsContact O-CG1 3.3Å; I183-I187 WeakPolarHBondContact O-CG1 3.38Å; I183-I187 PolarHBondContact O-N 3.37Å |
| 184 | T | 50.5 | Low | 53.6 | Low | 104 Ų | 104 | 103.6 Ų | 103.6 | 64% | 0.638 | 55% | 0.549 | S | S | * | . | G | 310 helix | trans | -66.7 | -30.8 | -169.8 | -12.5 | 0 | 0 | 0 | 0 | 114.1 | T182 N186 I187 | T182-T184 PolarHBondContact O-N 2.7Å; T182-T184 VanDerWaalsContact O-N 3.16Å; T184-N186 VanDerWaalsContact C-N 3.27Å; T184-I187 HydrophobicContact CG2-CD1 4.18Å |
| 185 | R | 46.2 | Very low | 56.1 | Low | 238 Ų | 238 | 94.4 Ų | 94.4 | 90% | 0.898 | 51% | 0.506 | S | S | * | . | G | 310 helix | trans | -83.4 | -7.5 | 172.7 | -133.7 | -178.7 | 110 | 113.9 | 2.1 | 113.2 | T182 I183 | T182-R185 PolarHBondContact O-N 2.99Å; I183-R185 VanDerWaalsContact C-N 3.35Å; I183-R185 PolarHBondContact O-N 3.49Å |
| 186 | N | 48 | Very low | 59.1 | Low | 92 Ų | 92 | 94 Ų | 94 | 49% | 0.492 | 49% | 0.489 | S | S | . | . | G | 310 helix | trans | -111.7 | 3.3 | -179.9 | -94.8 | 68.9 | 0 | 0 | 0 | 113.3 | I183 T184 F188 T189 | I183-N186 CarbonylContact O-C 3.59Å; I183-N186 VanDerWaalsContact O-C 3.23Å; I183-N186 VanDerWaalsContact O-CA 3.3Å; I183-N186 WeakPolarHBondContact O-CA 3.45Å; I183-N186 WeakPolarHBondContact O-CB 3.09Å; I183-N186 PolarHBondContact O-N 2.89Å; T184-N186 VanDerWaalsContact C-N 3.27Å; N186-F188 VanDerWaalsContact C-N 3.29Å; N186-F188 PolarHBondContact O-N 3.29Å; N186-T189 HydrophobicContact CB-CG2 4.38Å; N186-T189 WeakPolarHBondContact O-CG2 3.37Å; N186-T189 PolarHBondContact O-N 3.22Å |
| 187 | I | 52 | Low | 61.6 | Low | 70 Ų | 70 | 88.2 Ų | 88.2 | 36% | 0.359 | 46% | 0.461 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.2 | -41.6 | 177.5 | -65 | -173.9 | 0 | 0 | 0 | 109.6 | I183 T184 T189 F192 | I183-I187 HydrophobicContact CG2-CG1 3.97Å; I183-I187 VanDerWaalsContact O-CG1 3.3Å; I183-I187 WeakPolarHBondContact O-CG1 3.38Å; I183-I187 PolarHBondContact O-N 3.37Å; T184-I187 HydrophobicContact CG2-CD1 4.18Å; I187-T189 PolarHBondContact O-N 2.64Å; I187-F192 WeakPolarHBondContact O-CB 3.49Å; I187-F192 WeakPolarHBondContact O-CG 3.18Å |
| 188 | F | 57.9 | Low | 63.9 | Low | 157 Ų | 157 | 82.9 Ų | 82.9 | 69% | 0.689 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.5 | 52.5 | 167 | -64.2 | -75.4 | 0 | 0 | 0 | 111 | N186 F192 V193 | N186-F188 VanDerWaalsContact C-N 3.29Å; N186-F188 PolarHBondContact O-N 3.29Å; F188-F192 HydrophobicContact CD1-CD1 4.43Å; F188-V193 HydrophobicContact CB-CG2 4.28Å; F188-V193 HydrophobicContact CD1-CG2 3.66Å; F188-V193 HydrophobicContact CG-CG2 4.47Å |
| 189 | T | 70.3 | Confident | 66.5 | Low | 16 Ų | 16 | 78.7 Ų | 78.7 | 10% | 0.098 | 40% | 0.403 | C | S | . | . | trans | -56.5 | 142.2 | 157.8 | 46.9 | 0 | 0 | 0 | 0 | 107.6 | L86 N186 I187 I191 F192 V193 | L86-T189 HydrophobicContact CD1-CG2 4.01Å; N186-T189 HydrophobicContact CB-CG2 4.38Å; N186-T189 WeakPolarHBondContact O-CG2 3.37Å; N186-T189 PolarHBondContact O-N 3.22Å; I187-T189 PolarHBondContact O-N 2.64Å; T189-I191 PolarHBondContact O-N 3.5Å; T189-F192 PolarHBondContact O-N 3.23Å; T189-F192 PolarHBondContact OG1-N 3.21Å; T189-V193 PolarHBondContact O-N 2.7Å | ||
| 190 | P | 78.6 | Confident | 69 | Low | 78 Ų | 78 | 72.8 Ų | 72.8 | 51% | 0.506 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -49.3 | -36.6 | 176.9 | 18.2 | -30.5 | 0 | 0 | 0 | 110.7 | F192 V193 E194 | P190-F192 PolarHBondContact O-N 3.14Å; P190-V193 PolarHBondContact O-N 2.88Å; P190-E194 WeakPolarHBondContact O-CB 3.44Å; P190-E194 PolarHBondContact O-N 2.88Å |
| 191 | I | 81.2 | Confident | 71 | Confident | 34 Ų | 34 | 74.3 Ų | 74.3 | 17% | 0.174 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -57.1 | -46 | 174.8 | -53.1 | 166.7 | 0 | 0 | 0 | 114 | H82 V87 T189 A195 | H82-I191 HydrophobicContact CB-CG2 3.56Å; H82-I191 WeakPolarHBondContact ND1-CD1 3.47Å; H82-I191 VanDerWaalsContact ND1-CG1 3.28Å; H82-I191 WeakPolarHBondContact ND1-CG1 3.35Å; H82-I191 VanDerWaalsContact ND1-CG2 3.31Å; H82-I191 WeakPolarHBondContact ND1-CG2 3.02Å; V87-I191 HydrophobicContact CG2-CG2 4.48Å; T189-I191 PolarHBondContact O-N 3.5Å; I191-A195 VanDerWaalsContact O-CB 3.28Å; I191-A195 WeakPolarHBondContact O-CB 3.24Å; I191-A195 PolarHBondContact O-N 3.49Å |
| 192 | F | 84.2 | Confident | 72.8 | Confident | 22 Ų | 22 | 69.2 Ų | 69.2 | 10% | 0.096 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.7 | -43.8 | 178.8 | 173.8 | -86.3 | 0 | 0 | 0 | 110.5 | C89 G90 F93 I187 F188 T189 P190 E194 F196 | C89-F192 HydrophobicContact CB-CD2 4.3Å; C89-F192 HydrophobicContact CB-CE2 3.98Å; G90-F192 VanDerWaalsContact N-CE2 3.35Å; F93-F192 HydrophobicContact CB-CZ 4.1Å; F93-F192 HydrophobicContact CD1-CZ 4.16Å; F93-F192 HydrophobicContact CG-CZ 4.29Å; I187-F192 WeakPolarHBondContact O-CB 3.49Å; I187-F192 WeakPolarHBondContact O-CG 3.18Å; F188-F192 HydrophobicContact CD1-CD1 4.43Å; T189-F192 PolarHBondContact O-N 3.23Å; T189-F192 PolarHBondContact OG1-N 3.21Å; P190-F192 PolarHBondContact O-N 3.14Å; F192-E194 VanDerWaalsContact C-N 3.35Å; F192-F196 VanDerWaalsContact O-CB 3.27Å; F192-F196 WeakPolarHBondContact O-CB 3.1Å; F192-F196 PolarHBondContact O-N 3.29Å |
| 193 | V | 84.4 | Confident | 74.7 | Confident | 59 Ų | 59 | 64.8 Ų | 64.8 | 36% | 0.358 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -65.3 | -43.1 | 178.3 | 177.9 | 0 | 0 | 0 | 0 | 110.2 | F188 T189 P190 F196 V197 | F188-V193 HydrophobicContact CB-CG2 4.28Å; F188-V193 HydrophobicContact CD1-CG2 3.66Å; F188-V193 HydrophobicContact CG-CG2 4.47Å; T189-V193 PolarHBondContact O-N 2.7Å; P190-V193 PolarHBondContact O-N 2.88Å; V193-F196 PolarHBondContact O-N 2.85Å; V193-V197 HydrophobicContact CG1-CG2 4.1Å; V193-V197 WeakPolarHBondContact O-CB 3.5Å; V193-V197 VanDerWaalsContact O-CG2 3.24Å; V193-V197 WeakPolarHBondContact O-CG2 3.28Å; V193-V197 PolarHBondContact O-N 3.46Å |
| 194 | E | 84.7 | Confident | 76.1 | Confident | 45 Ų | 45 | 68.1 Ų | 68.1 | 21% | 0.21 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.2 | -50.2 | 176.9 | -169.6 | -174.8 | 176.2 | 0 | 0 | 111.2 | M78 L155 P190 F192 F196 V197 L198 | M78-E194 HydrophobicContact CE-CG 3.91Å; L155-E194 WeakPolarHBondContact CD2-OE1 3.28Å; P190-E194 WeakPolarHBondContact O-CB 3.44Å; P190-E194 PolarHBondContact O-N 2.88Å; F192-E194 VanDerWaalsContact C-N 3.35Å; E194-F196 VanDerWaalsContact C-N 3.31Å; E194-F196 PolarHBondContact O-N 2.9Å; E194-V197 PolarHBondContact O-N 2.82Å; E194-L198 HydrophobicContact CG-CD1 4.14Å; E194-L198 HydrophobicContact CG-CG 4.46Å; E194-L198 WeakPolarHBondContact O-CB 3.23Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å |
| 195 | A | 86.2 | Confident | 77.4 | Confident | 0 Ų | 0 | 65.2 Ų | 65.2 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -58.7 | -43 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | M78 V87 I191 T199 | M78-A195 WeakPolarHBondContact SD-CA 3.28Å; M78-A195 HydrophobicContact SD-CB 3.52Å; M78-A195 VanDerWaalsContact SD-CB 3.52Å; V87-A195 HydrophobicContact CG1-CB 4.47Å; I191-A195 VanDerWaalsContact O-CB 3.28Å; I191-A195 WeakPolarHBondContact O-CB 3.24Å; I191-A195 PolarHBondContact O-N 3.49Å; A195-T199 WeakPolarHBondContact O-CB 3.23Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 PolarHBondContact O-OG1 3.41Å |
| 196 | F | 89.9 | Confident | 79.1 | Confident | 46 Ų | 46 | 54.7 Ų | 54.7 | 20% | 0.202 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.2 | -52.2 | 176.3 | 173 | -90.7 | 0 | 0 | 0 | 111.5 | F93 A94 F192 V193 E194 T199 F200 | F93-F196 HydrophobicContact CB-CD2 4.28Å; F93-F196 AromaticContact CD1-CD2 3.49Å; F93-F196 HydrophobicContact CD1-CD2 3.49Å; F93-F196 VanDerWaalsContact CD1-CD2 3.49Å; F93-F196 AromaticContact CD1-CE2 3.4Å; F93-F196 HydrophobicContact CD1-CE2 3.4Å; F93-F196 HydrophobicContact CD1-CZ 4.42Å; F93-F196 HydrophobicContact CE1-CD2 4.3Å; F93-F196 AromaticContact CE1-CE2 3.84Å; F93-F196 HydrophobicContact CE1-CE2 3.84Å; F93-F196 HydrophobicContact CG-CD2 4.32Å; F93-F196 HydrophobicContact CG-CE2 4.33Å; A94-F196 VanDerWaalsContact CA-CE2 3.48Å; A94-F196 HydrophobicContact CB-CD2 3.6Å; A94-F196 HydrophobicContact CB-CE2 3.9Å; A94-F196 HydrophobicContact CB-CG 4.26Å; F192-F196 VanDerWaalsContact O-CB 3.27Å; F192-F196 WeakPolarHBondContact O-CB 3.1Å; F192-F196 PolarHBondContact O-N 3.29Å; V193-F196 PolarHBondContact O-N 2.85Å; E194-F196 VanDerWaalsContact C-N 3.31Å; E194-F196 PolarHBondContact O-N 2.9Å; F196-T199 PolarHBondContact O-N 3.41Å; F196-F200 HydrophobicContact CE1-CB 4.47Å; F196-F200 HydrophobicContact CZ-CD2 4.25Å; F196-F200 WeakPolarHBondContact O-CB 3.45Å; F196-F200 PolarHBondContact O-N 2.98Å |
| 197 | V | 88.3 | Confident | 80.8 | Confident | 59 Ų | 59 | 50.8 Ų | 50.8 | 36% | 0.358 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -66.3 | -45.7 | -175.2 | 170.5 | 0 | 0 | 0 | 0 | 110.6 | V193 E194 F200 L201 | V193-V197 HydrophobicContact CG1-CG2 4.1Å; V193-V197 WeakPolarHBondContact O-CB 3.5Å; V193-V197 VanDerWaalsContact O-CG2 3.24Å; V193-V197 WeakPolarHBondContact O-CG2 3.28Å; V193-V197 PolarHBondContact O-N 3.46Å; E194-V197 PolarHBondContact O-N 2.82Å; V197-F200 PolarHBondContact O-N 3.36Å; V197-L201 HydrophobicContact CG1-CD1 3.66Å; V197-L201 HydrophobicContact CG1-CG 4.16Å; V197-L201 VanDerWaalsContact O-CB 3.28Å; V197-L201 WeakPolarHBondContact O-CB 3.37Å; V197-L201 VanDerWaalsContact O-CG 3.22Å; V197-L201 WeakPolarHBondContact O-CG 3.46Å; V197-L201 PolarHBondContact O-N 3.06Å |
| 198 | L | 86.6 | Confident | 82.4 | Confident | 47 Ų | 47 | 47.4 Ų | 47.4 | 25% | 0.246 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.6 | -46.2 | 177.8 | -70 | -178.3 | 0 | 0 | 0 | 111.5 | I74 M78 E194 A202 | I74-L198 HydrophobicContact CG2-CB 4.44Å; M78-L198 HydrophobicContact CE-CD1 3.51Å; E194-L198 HydrophobicContact CG-CD1 4.14Å; E194-L198 HydrophobicContact CG-CG 4.46Å; E194-L198 WeakPolarHBondContact O-CB 3.23Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å; L198-A202 WeakPolarHBondContact O-CB 3.39Å; L198-A202 PolarHBondContact O-N 2.84Å |
| 199 | T | 88.8 | Confident | 83.9 | Confident | 7 Ų | 7 | 40.7 Ų | 40.7 | 4% | 0.043 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.2 | -47.6 | 177.5 | -54.1 | 0 | 0 | 0 | 0 | 110.3 | A91 A94 L95 A195 F196 L201 A202 E203 | A91-T199 HydrophobicContact CB-CG2 4.28Å; A94-T199 HydrophobicContact CB-CG2 4.03Å; L95-T199 HydrophobicContact CD1-CG2 4.4Å; L95-T199 HydrophobicContact CD2-CG2 3.91Å; L95-T199 HydrophobicContact CG-CG2 3.87Å; A195-T199 WeakPolarHBondContact O-CB 3.23Å; A195-T199 PolarHBondContact O-N 2.96Å; A195-T199 PolarHBondContact O-OG1 3.41Å; F196-T199 PolarHBondContact O-N 3.41Å; T199-L201 PolarHBondContact O-N 3.16Å; T199-A202 PolarHBondContact O-N 3Å; T199-E203 HydrophobicContact CG2-CG 4.12Å; T199-E203 WeakPolarHBondContact O-CB 3.29Å; T199-E203 WeakPolarHBondContact O-CG 3.26Å; T199-E203 PolarHBondContact O-N 3.24Å |
| 200 | F | 87.8 | Confident | 84.7 | Confident | 44 Ų | 44 | 42.6 Ų | 42.6 | 19% | 0.193 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -62.9 | -40.9 | -178.3 | -173.3 | -93.4 | 0 | 0 | 0 | 112.6 | A94 F196 V197 W204 | A94-F200 HydrophobicContact CB-CB 4.01Å; F196-F200 HydrophobicContact CE1-CB 4.47Å; F196-F200 HydrophobicContact CZ-CD2 4.25Å; F196-F200 WeakPolarHBondContact O-CB 3.45Å; F196-F200 PolarHBondContact O-N 2.98Å; V197-F200 PolarHBondContact O-N 3.36Å; F200-W204 HydrophobicContact CD1-CE3 4.23Å; F200-W204 HydrophobicContact CE1-CD2 4.46Å; F200-W204 AromaticContact CE1-CE3 3.44Å; F200-W204 HydrophobicContact CE1-CE3 3.44Å; F200-W204 VanDerWaalsContact CE1-CE3 3.44Å; F200-W204 AromaticContact CE1-CZ3 3.64Å; F200-W204 HydrophobicContact CE1-CZ3 3.64Å; F200-W204 HydrophobicContact CE2-CE3 4.26Å; F200-W204 HydrophobicContact CE2-CZ3 4.19Å; F200-W204 AromaticContact CZ-CE3 3.49Å; F200-W204 HydrophobicContact CZ-CE3 3.49Å; F200-W204 VanDerWaalsContact CZ-CE3 3.49Å; F200-W204 HydrophobicContact CZ-CH2 4.48Å; F200-W204 AromaticContact CZ-CZ3 3.3Å; F200-W204 HydrophobicContact CZ-CZ3 3.3Å; F200-W204 WeakPolarHBondContact O-CB 2.98Å; F200-W204 PolarHBondContact O-N 2.97Å |
| 201 | L | 86.7 | Confident | 85 | Confident | 115 Ų | 115 | 39 Ų | 39 | 60% | 0.602 | 21% | 0.208 | S | C | * | . | H | α-helix | trans | -71.9 | -41.3 | 177.8 | -71.6 | 178 | 0 | 0 | 0 | 112.1 | V197 T199 E203 W204 | V197-L201 HydrophobicContact CG1-CD1 3.66Å; V197-L201 HydrophobicContact CG1-CG 4.16Å; V197-L201 VanDerWaalsContact O-CB 3.28Å; V197-L201 WeakPolarHBondContact O-CB 3.37Å; V197-L201 VanDerWaalsContact O-CG 3.22Å; V197-L201 WeakPolarHBondContact O-CG 3.46Å; V197-L201 PolarHBondContact O-N 3.06Å; T199-L201 PolarHBondContact O-N 3.16Å; L201-E203 VanDerWaalsContact C-N 3.26Å; L201-E203 PolarHBondContact O-N 3.48Å; L201-W204 PolarHBondContact O-N 3.38Å |
| 202 | A | 82.8 | Confident | 85.4 | Confident | 44 Ų | 44 | 37.5 Ų | 37.5 | 36% | 0.364 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -64.2 | -36.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | T71 I74 L198 T199 | T71-A202 HydrophobicContact CG2-CB 3.56Å; I74-A202 HydrophobicContact CD1-CB 4.04Å; L198-A202 WeakPolarHBondContact O-CB 3.39Å; L198-A202 PolarHBondContact O-N 2.84Å; T199-A202 PolarHBondContact O-N 3Å |
| 203 | E | 83.8 | Confident | 85.6 | Confident | 2 Ų | 2 | 38.3 Ų | 38.3 | 1% | 0.009 | 21% | 0.205 | C | C | . | . | S | Bend | trans | -87.6 | -7.7 | -179.6 | -67.3 | -70.7 | -179.4 | 0 | 0 | 114.1 | T71 L95 M98 T199 L201 G205 D206 | T71-E203 WeakPolarHBondContact CB-OE1 3.41Å; T71-E203 HydrophobicContact CG2-CG 3.56Å; T71-E203 WeakPolarHBondContact CG2-OE1 3.46Å; T71-E203 PolarHBondContact OG1-OE1 3.4Å; L95-E203 HydrophobicContact CD2-CG 3.71Å; M98-E203 HydrophobicContact CE-CB 3.37Å; M98-E203 HydrophobicContact CE-CG 4.13Å; M98-E203 WeakPolarHBondContact CE-O 3.01Å; T199-E203 HydrophobicContact CG2-CG 4.12Å; T199-E203 WeakPolarHBondContact O-CB 3.29Å; T199-E203 WeakPolarHBondContact O-CG 3.26Å; T199-E203 PolarHBondContact O-N 3.24Å; L201-E203 VanDerWaalsContact C-N 3.26Å; L201-E203 PolarHBondContact O-N 3.48Å; E203-G205 PolarHBondContact O-N 3.33Å; E203-G205 VanDerWaalsContact O-N 3.07Å; E203-D206 WeakPolarHBondContact O-CB 3.27Å; E203-D206 PolarHBondContact O-N 3.43Å; E203-D206 VanDerWaalsContact O-N 3.1Å |
| 204 | W | 80.1 | Confident | 85.6 | Confident | 152 Ų | 152 | 36 Ų | 36 | 58% | 0.576 | 19% | 0.191 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | 114.5 | -177.3 | -171.9 | -87.2 | 0 | 0 | 0 | 110.4 | F200 L201 | F200-W204 HydrophobicContact CD1-CE3 4.23Å; F200-W204 HydrophobicContact CE1-CD2 4.46Å; F200-W204 AromaticContact CE1-CE3 3.44Å; F200-W204 HydrophobicContact CE1-CE3 3.44Å; F200-W204 VanDerWaalsContact CE1-CE3 3.44Å; F200-W204 AromaticContact CE1-CZ3 3.64Å; F200-W204 HydrophobicContact CE1-CZ3 3.64Å; F200-W204 HydrophobicContact CE2-CE3 4.26Å; F200-W204 HydrophobicContact CE2-CZ3 4.19Å; F200-W204 AromaticContact CZ-CE3 3.49Å; F200-W204 HydrophobicContact CZ-CE3 3.49Å; F200-W204 VanDerWaalsContact CZ-CE3 3.49Å; F200-W204 HydrophobicContact CZ-CH2 4.48Å; F200-W204 AromaticContact CZ-CZ3 3.3Å; F200-W204 HydrophobicContact CZ-CZ3 3.3Å; F200-W204 WeakPolarHBondContact O-CB 2.98Å; F200-W204 PolarHBondContact O-N 2.97Å; L201-W204 PolarHBondContact O-N 3.38Å |
| 205 | G | 76.9 | Confident | 85.7 | Confident | 42 Ų | 42 | 33.8 Ų | 33.8 | 43% | 0.433 | 18% | 0.181 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 78.7 | 18.8 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | E203 | E203-G205 PolarHBondContact O-N 3.33Å; E203-G205 VanDerWaalsContact O-N 3.07Å |
| 206 | D | 82.8 | Confident | 85.7 | Confident | 17 Ų | 17 | 34 Ų | 34 | 9% | 0.091 | 18% | 0.182 | C | C | . | . | trans | -72.2 | 179.3 | -179.8 | 105.2 | -47.8 | 0 | 0 | 0 | 113.3 | E203 S208 Q209 I210 | E203-D206 WeakPolarHBondContact O-CB 3.27Å; E203-D206 PolarHBondContact O-N 3.43Å; E203-D206 VanDerWaalsContact O-N 3.1Å; D206-S208 VanDerWaalsContact C-N 3.31Å; D206-S208 PolarHBondContact O-N 2.92Å; D206-S208 WeakPolarHBondContact OD1-CA 3.33Å; D206-S208 PolarHBondContact OD1-N 2.92Å; D206-S208 PolarHBondContact OD1-OG 3.13Å; D206-S208 WeakPolarHBondContact OD2-CB 3.3Å; D206-S208 PolarHBondContact OD2-N 3.31Å; D206-S208 PolarHBondContact OD2-OG 3.28Å; D206-Q209 WeakPolarHBondContact OD1-CB 3.43Å; D206-Q209 PolarHBondContact OD1-N 2.83Å; D206-I210 PolarHBondContact O-N 2.83Å | ||
| 207 | R | 82.3 | Confident | 85.3 | Confident | 10 Ų | 10 | 32.2 Ų | 32.2 | 4% | 0.038 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -45.8 | -54.7 | 171.6 | -16.6 | -153.2 | -164.5 | 155.6 | -4.5 | 112.4 | S65 D69 F128 T211 F263 | S65-R207 PolarHBondContact O-NE 3.31Å; S65-R207 PolarHBondContact O-NH1 2.86Å; S65-R207 PolarHBondContact O-NH2 3.35Å; D69-R207 VanDerWaalsContact CB-NH2 3.35Å; D69-R207 IonicContact OD1-CZ 3.18Å; D69-R207 VanDerWaalsContact OD1-CZ 3.26Å; D69-R207 IonicContact OD1-NE 3.27Å; D69-R207 PolarHBondContact OD1-NE 3.26Å; D69-R207 IonicContact OD1-NH2 2.75Å; D69-R207 PolarHBondContact OD1-NH2 2.96Å; F128-R207 HydrophobicContact CD1-CB 4.2Å; F128-R207 HydrophobicContact CE1-CB 3.18Å; F128-R207 HydrophobicContact CE1-CG 3.67Å; F128-R207 HydrophobicContact CE2-CB 4.08Å; F128-R207 HydrophobicContact CE2-CG 4.31Å; F128-R207 HydrophobicContact CZ-CB 3.15Å; F128-R207 HydrophobicContact CZ-CG 3.27Å; R207-T211 WeakPolarHBondContact O-CB 3.3Å; R207-T211 PolarHBondContact O-N 3.17Å; R207-T211 VanDerWaalsContact O-N 3.1Å; R207-T211 PolarHBondContact O-OG1 3.07Å; R207-F263 HydrophobicContact CB-CE2 4.38Å; R207-F263 HydrophobicContact CB-CZ 4.37Å |
| 208 | S | 86.6 | Confident | 84.8 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -79.4 | -33.7 | -161.2 | 90.9 | 0 | 0 | 0 | 0 | 108.9 | I62 E66 D206 T212 | I62-S208 VanDerWaalsContact CD1-CB 3.5Å; E66-S208 WeakPolarHBondContact OE1-CB 3.43Å; E66-S208 PolarHBondContact OE1-OG 3.23Å; D206-S208 VanDerWaalsContact C-N 3.31Å; D206-S208 PolarHBondContact O-N 2.92Å; D206-S208 WeakPolarHBondContact OD1-CA 3.33Å; D206-S208 PolarHBondContact OD1-N 2.92Å; D206-S208 PolarHBondContact OD1-OG 3.13Å; D206-S208 WeakPolarHBondContact OD2-CB 3.3Å; D206-S208 PolarHBondContact OD2-N 3.31Å; D206-S208 PolarHBondContact OD2-OG 3.28Å; S208-T212 VanDerWaalsContact O-CB 3.23Å; S208-T212 WeakPolarHBondContact O-CB 3.39Å; S208-T212 PolarHBondContact O-N 3.46Å; S208-T212 PolarHBondContact O-OG1 3.08Å |
| 209 | Q | 89 | Confident | 84.5 | Confident | 16 Ų | 16 | 30.9 Ų | 30.9 | 8% | 0.075 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -58.9 | -57.9 | 170.6 | -160.8 | -174.6 | 42.3 | 0 | 0 | 112 | M98 S102 D206 T211 T212 I213 | M98-Q209 HydrophobicContact CE-CB 4.16Å; M98-Q209 HydrophobicContact CE-CG 4.49Å; M98-Q209 HydrophobicContact CG-CG 4.06Å; M98-Q209 HydrophobicContact SD-CB 3.77Å; M98-Q209 HydrophobicContact SD-CG 3.65Å; S102-Q209 WeakPolarHBondContact OG-CG 3.45Å; D206-Q209 WeakPolarHBondContact OD1-CB 3.43Å; D206-Q209 PolarHBondContact OD1-N 2.83Å; Q209-T211 VanDerWaalsContact C-N 3.28Å; Q209-T211 PolarHBondContact O-N 3.26Å; Q209-T212 WeakPolarHBondContact O-CB 3.33Å; Q209-T212 PolarHBondContact O-N 3.28Å; Q209-T212 VanDerWaalsContact O-N 3.13Å; Q209-I213 WeakPolarHBondContact O-CG1 3.35Å; Q209-I213 PolarHBondContact O-N 3.44Å |
| 210 | I | 86.5 | Confident | 84.4 | Confident | 56 Ų | 56 | 32 Ų | 32 | 29% | 0.287 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -61.5 | -42.1 | -178.5 | -63.3 | 173.5 | 0 | 0 | 0 | 110 | L124 D206 T212 I213 V214 | L124-I210 HydrophobicContact CB-CG2 4.5Å; L124-I210 HydrophobicContact CD1-CG2 3.98Å; L124-I210 HydrophobicContact CD2-CG2 4.38Å; D206-I210 PolarHBondContact O-N 2.83Å; I210-T212 VanDerWaalsContact C-N 3.3Å; I210-T212 PolarHBondContact O-N 2.99Å; I210-I213 WeakPolarHBondContact O-CB 3.34Å; I210-I213 PolarHBondContact O-N 3.42Å; I210-V214 WeakPolarHBondContact O-CG2 3.15Å; I210-V214 PolarHBondContact O-N 3.13Å; I210-V214 VanDerWaalsContact O-N 3.07Å |
| 211 | T | 85.3 | Confident | 84.4 | Confident | 2 Ų | 2 | 30.9 Ų | 30.9 | 1% | 0.012 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.2 | -41.3 | 177.3 | -54.5 | 0 | 0 | 0 | 0 | 111.9 | V61 F125 R207 Q209 V214 L215 F263 | V61-T211 HydrophobicContact CB-CG2 4.1Å; V61-T211 HydrophobicContact CG1-CG2 3.25Å; V61-T211 HydrophobicContact CG2-CG2 3.87Å; F125-T211 HydrophobicContact CE1-CG2 3.38Å; F125-T211 HydrophobicContact CZ-CG2 3.65Å; R207-T211 WeakPolarHBondContact O-CB 3.3Å; R207-T211 PolarHBondContact O-N 3.17Å; R207-T211 VanDerWaalsContact O-N 3.1Å; R207-T211 PolarHBondContact O-OG1 3.07Å; Q209-T211 VanDerWaalsContact C-N 3.28Å; Q209-T211 PolarHBondContact O-N 3.26Å; T211-V214 PolarHBondContact O-N 3.37Å; T211-L215 HydrophobicContact CG2-CD1 4.18Å; T211-L215 WeakPolarHBondContact O-CB 3.5Å; T211-L215 PolarHBondContact O-N 3.33Å; T211-F263 HydrophobicContact CG2-CE1 4.23Å; T211-F263 WeakPolarHBondContact OG1-CE1 3.28Å; T211-F263 WeakPolarHBondContact OG1-CZ 3.32Å |
| 212 | T | 89.9 | Confident | 84.6 | Confident | 3 Ų | 3 | 31.4 Ų | 31.4 | 2% | 0.018 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63.8 | -40.8 | 178 | -64.3 | 0 | 0 | 0 | 0 | 111.3 | T99 S208 Q209 I210 V214 L215 A216 V224 | T99-T212 HydrophobicContact CG2-CG2 4.24Å; S208-T212 VanDerWaalsContact O-CB 3.23Å; S208-T212 WeakPolarHBondContact O-CB 3.39Å; S208-T212 PolarHBondContact O-N 3.46Å; S208-T212 PolarHBondContact O-OG1 3.08Å; Q209-T212 WeakPolarHBondContact O-CB 3.33Å; Q209-T212 PolarHBondContact O-N 3.28Å; Q209-T212 VanDerWaalsContact O-N 3.13Å; I210-T212 VanDerWaalsContact C-N 3.3Å; I210-T212 PolarHBondContact O-N 2.99Å; T212-V214 VanDerWaalsContact C-N 3.34Å; T212-V214 PolarHBondContact O-N 2.85Å; T212-L215 PolarHBondContact O-N 3.46Å; T212-A216 WeakPolarHBondContact O-CB 3.39Å; T212-A216 PolarHBondContact O-N 2.92Å; T212-V224 HydrophobicContact CG2-CG1 3.86Å |
| 213 | I | 87.6 | Confident | 85 | Confident | 39 Ų | 39 | 29.3 Ų | 29.3 | 20% | 0.2 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.4 | -49.7 | 173.6 | -66 | 167.2 | 0 | 0 | 0 | 110 | S102 L105 G106 Q209 I210 A216 A217 | S102-I213 VanDerWaalsContact O-CG1 3.32Å; S102-I213 WeakPolarHBondContact O-CG1 3.35Å; L105-I213 HydrophobicContact CB-CG1 4.33Å; L105-I213 HydrophobicContact CD1-CD1 4.39Å; G106-I213 VanDerWaalsContact CA-O 3.23Å; G106-I213 WeakPolarHBondContact CA-O 3.23Å; Q209-I213 WeakPolarHBondContact O-CG1 3.35Å; Q209-I213 PolarHBondContact O-N 3.44Å; I210-I213 WeakPolarHBondContact O-CB 3.34Å; I210-I213 PolarHBondContact O-N 3.42Å; I213-A216 PolarHBondContact O-N 3.42Å; I213-A217 WeakPolarHBondContact O-CB 3.49Å; I213-A217 PolarHBondContact O-N 2.9Å |
| 214 | V | 85.7 | Confident | 85.3 | Confident | 9 Ų | 9 | 29.2 Ų | 29.2 | 6% | 0.055 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.4 | -44.2 | -178.8 | 167.2 | 0 | 0 | 0 | 0 | 112.2 | S121 L124 F125 I210 T211 T212 A217 T218 | S121-V214 WeakPolarHBondContact OG-CG1 3.36Å; L124-V214 HydrophobicContact CD1-CG2 3.92Å; F125-V214 HydrophobicContact CE2-CG1 4.08Å; F125-V214 HydrophobicContact CZ-CB 4.47Å; F125-V214 HydrophobicContact CZ-CG1 3.93Å; I210-V214 WeakPolarHBondContact O-CG2 3.15Å; I210-V214 PolarHBondContact O-N 3.13Å; I210-V214 VanDerWaalsContact O-N 3.07Å; T211-V214 PolarHBondContact O-N 3.37Å; T212-V214 VanDerWaalsContact C-N 3.34Å; T212-V214 PolarHBondContact O-N 2.85Å; V214-A217 PolarHBondContact O-N 3.43Å; V214-T218 PolarHBondContact O-N 2.88Å; V214-T218 PolarHBondContact O-OG1 2.87Å |
| 215 | L | 85.7 | Confident | 85.9 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -64.3 | -42.2 | 176.2 | -111.5 | 60.2 | 0 | 0 | 0 | 111.4 | F20 S57 S58 V61 F125 T211 T212 A217 T218 K219 V224 | F20-L215 HydrophobicContact CE2-CD1 3.87Å; S57-L215 WeakPolarHBondContact OG-CD2 3.31Å; S58-L215 VanDerWaalsContact CA-CD2 3.47Å; V61-L215 HydrophobicContact CG2-CD2 4.49Å; F125-L215 HydrophobicContact CZ-CD1 4.26Å; T211-L215 HydrophobicContact CG2-CD1 4.18Å; T211-L215 WeakPolarHBondContact O-CB 3.5Å; T211-L215 PolarHBondContact O-N 3.33Å; T212-L215 PolarHBondContact O-N 3.46Å; L215-A217 VanDerWaalsContact C-N 3.25Å; L215-A217 PolarHBondContact O-N 3.48Å; L215-T218 PolarHBondContact O-N 3.33Å; L215-T218 PolarHBondContact O-OG1 3.2Å; L215-K219 WeakPolarHBondContact O-CA 3.25Å; L215-K219 WeakPolarHBondContact O-CB 3.33Å; L215-K219 PolarHBondContact O-N 3.18Å; L215-V224 HydrophobicContact CB-CG1 3.99Å; L215-V224 HydrophobicContact CB-CG2 3.83Å; L215-V224 HydrophobicContact CD2-CG2 4.41Å; L215-V224 HydrophobicContact CG-CG2 4.37Å |
| 216 | A | 86.4 | Confident | 86.7 | Confident | 3 Ų | 3 | 24 Ų | 24 | 3% | 0.025 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -68.6 | -24.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | A103 T212 I213 A221 V224 | A103-A216 HydrophobicContact CB-CB 4.07Å; T212-A216 WeakPolarHBondContact O-CB 3.39Å; T212-A216 PolarHBondContact O-N 2.92Å; I213-A216 PolarHBondContact O-N 3.42Å; A216-A221 HydrophobicContact CB-CB 4.35Å; A216-V224 HydrophobicContact CB-CG1 4.33Å |
| 217 | A | 81.6 | Confident | 87.2 | Confident | 10 Ų | 10 | 23.2 Ų | 23.2 | 8% | 0.083 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -77.6 | -22.9 | 174 | 0 | 0 | 0 | 0 | 0 | 113.4 | G106 T117 I213 V214 L215 | G106-A217 WeakPolarHBondContact O-CA 3.26Å; G106-A217 WeakPolarHBondContact O-CB 3.13Å; T117-A217 HydrophobicContact CG2-CB 3.85Å; I213-A217 WeakPolarHBondContact O-CB 3.49Å; I213-A217 PolarHBondContact O-N 2.9Å; V214-A217 PolarHBondContact O-N 3.43Å; L215-A217 VanDerWaalsContact C-N 3.25Å; L215-A217 PolarHBondContact O-N 3.48Å |
| 218 | T | 77.6 | Confident | 87.7 | Confident | 44 Ų | 44 | 22.7 Ų | 22.7 | 27% | 0.27 | 13% | 0.129 | S | C | . | . | H | α-helix | trans | -112.8 | -27.5 | -172.9 | 54.4 | 0 | 0 | 0 | 0 | 114.2 | T117 L118 V214 L215 | T117-T218 HydrophobicContact CG2-CG2 3.97Å; L118-T218 HydrophobicContact CD2-CG2 4.39Å; V214-T218 PolarHBondContact O-N 2.88Å; V214-T218 PolarHBondContact O-OG1 2.87Å; L215-T218 PolarHBondContact O-N 3.33Å; L215-T218 PolarHBondContact O-OG1 3.2Å |
| 219 | K | 81.9 | Confident | 88.1 | Confident | 33 Ų | 33 | 24.3 Ų | 24.3 | 14% | 0.143 | 14% | 0.139 | C | C | . | . | S | Bend | trans | -119.6 | -177.2 | -179.1 | -68.6 | -178.8 | 171.3 | 142 | 0 | 110.6 | F20 S57 L215 A221 V224 | F20-K219 VanDerWaalsContact CD2-NZ 3.27Å; S57-K219 PolarHBondContact OG-NZ 3.42Å; L215-K219 WeakPolarHBondContact O-CA 3.25Å; L215-K219 WeakPolarHBondContact O-CB 3.33Å; L215-K219 PolarHBondContact O-N 3.18Å; K219-A221 PolarHBondContact O-N 2.93Å; K219-V224 HydrophobicContact CB-CG2 4.23Å |
| 220 | S | 85.5 | Confident | 88.4 | Confident | 30 Ų | 30 | 26.6 Ų | 26.6 | 21% | 0.21 | 15% | 0.153 | C | C | . | . | trans | -65.1 | 114.2 | 177.2 | 60.2 | 0 | 0 | 0 | 0 | 110.9 | L50 F51 L222 G223 V224 | L50-S220 WeakPolarHBondContact O-CB 3.16Å; L50-S220 PolarHBondContact O-OG 3.11Å; F51-S220 VanDerWaalsContact CA-OG 3.31Å; F51-S220 WeakPolarHBondContact CA-OG 3.46Å; S220-L222 PolarHBondContact O-N 2.86Å; S220-G223 PolarHBondContact O-N 3.43Å; S220-V224 WeakPolarHBondContact O-CG2 3.33Å; S220-V224 PolarHBondContact O-N 3.42Å | ||
| 221 | A | 87.7 | Confident | 88.7 | Confident | 22 Ų | 22 | 23.9 Ų | 23.9 | 18% | 0.182 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -54.9 | -40.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A216 K219 V224 I225 | A216-A221 HydrophobicContact CB-CB 4.35Å; K219-A221 PolarHBondContact O-N 2.93Å; A221-V224 PolarHBondContact O-N 2.86Å; A221-I225 WeakPolarHBondContact O-CB 3.39Å; A221-I225 WeakPolarHBondContact O-CD1 3.45Å; A221-I225 WeakPolarHBondContact O-CG1 3.24Å; A221-I225 PolarHBondContact O-N 2.89Å |
| 222 | L | 90.9 | Very high | 89.1 | Confident | 125 Ų | 125 | 23.9 Ų | 23.9 | 65% | 0.654 | 14% | 0.139 | S | C | * | . | H | α-helix | trans | -65.2 | -41.3 | 176.1 | -67.3 | -176.2 | 0 | 0 | 0 | 113.1 | F51 S220 V224 I225 V226 | F51-L222 HydrophobicContact CE2-CB 4.45Å; S220-L222 PolarHBondContact O-N 2.86Å; L222-V224 VanDerWaalsContact C-N 3.33Å; L222-I225 HydrophobicContact CD2-CD1 4.49Å; L222-I225 PolarHBondContact O-N 3.48Å; L222-V226 WeakPolarHBondContact O-CG2 3.4Å; L222-V226 PolarHBondContact O-N 2.92Å |
| 223 | G | 90.6 | Very high | 89.3 | Confident | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -60.4 | -48.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | F51 F55 S220 I225 V226 G227 | F51-G223 VanDerWaalsContact CE2-CA 3.49Å; F55-G223 WeakPolarHBondContact CA-O 3.1Å; F55-G223 PolarHBondContact N-O 3.36Å; S220-G223 PolarHBondContact O-N 3.43Å; G223-I225 PolarHBondContact O-N 3.44Å; G223-V226 PolarHBondContact O-N 3.3Å; G223-G227 PolarHBondContact O-N 2.8Å |
| 224 | V | 90 | Very high | 89.6 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -57.3 | -47.9 | 179.1 | 170.9 | 0 | 0 | 0 | 0 | 111.6 | S58 T212 L215 A216 K219 S220 A221 L222 G228 | S58-V224 VanDerWaalsContact CB-O 3.27Å; S58-V224 WeakPolarHBondContact CB-O 3.42Å; S58-V224 WeakPolarHBondContact OG-CA 3.43Å; S58-V224 PolarHBondContact OG-O 2.84Å; T212-V224 HydrophobicContact CG2-CG1 3.86Å; L215-V224 HydrophobicContact CB-CG1 3.99Å; L215-V224 HydrophobicContact CB-CG2 3.83Å; L215-V224 HydrophobicContact CD2-CG2 4.41Å; L215-V224 HydrophobicContact CG-CG2 4.37Å; A216-V224 HydrophobicContact CB-CG1 4.33Å; K219-V224 HydrophobicContact CB-CG2 4.23Å; S220-V224 WeakPolarHBondContact O-CG2 3.33Å; S220-V224 PolarHBondContact O-N 3.42Å; A221-V224 PolarHBondContact O-N 2.86Å; L222-V224 VanDerWaalsContact C-N 3.33Å; V224-G228 PolarHBondContact O-N 2.87Å |
| 225 | I | 93.7 | Very high | 89.8 | Confident | 22 Ų | 22 | 26.6 Ų | 26.6 | 11% | 0.113 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -58.4 | -52.9 | 177.5 | -73.5 | 163.3 | 0 | 0 | 0 | 111.4 | M100 A103 A221 L222 G223 G227 G228 V229 | M100-I225 HydrophobicContact CE-CB 4.5Å; M100-I225 HydrophobicContact CE-CG2 3.11Å; M100-I225 HydrophobicContact SD-CD1 3.87Å; M100-I225 HydrophobicContact SD-CG1 4.2Å; M100-I225 HydrophobicContact SD-CG2 3.63Å; A103-I225 HydrophobicContact CB-CD1 3.57Å; A103-I225 HydrophobicContact CB-CG1 3.29Å; A221-I225 WeakPolarHBondContact O-CB 3.39Å; A221-I225 WeakPolarHBondContact O-CD1 3.45Å; A221-I225 WeakPolarHBondContact O-CG1 3.24Å; A221-I225 PolarHBondContact O-N 2.89Å; L222-I225 HydrophobicContact CD2-CD1 4.49Å; L222-I225 PolarHBondContact O-N 3.48Å; G223-I225 PolarHBondContact O-N 3.44Å; I225-G227 PolarHBondContact O-N 3.29Å; I225-G228 PolarHBondContact O-N 3.42Å; I225-V229 HydrophobicContact CG2-CG2 4.5Å; I225-V229 WeakPolarHBondContact O-CB 3.36Å; I225-V229 VanDerWaalsContact O-CG2 3.3Å; I225-V229 WeakPolarHBondContact O-CG2 3.44Å; I225-V229 PolarHBondContact O-N 2.91Å |
| 226 | V | 94.7 | Very high | 90 | Very high | 63 Ų | 63 | 27 Ų | 27 | 38% | 0.382 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -65.6 | -43.4 | -175.9 | 175.8 | 0 | 0 | 0 | 0 | 110.5 | F51 F55 L222 G223 G228 V229 V230 | F51-V226 HydrophobicContact CE2-CG2 4.38Å; F51-V226 HydrophobicContact CZ-CB 4.2Å; F51-V226 HydrophobicContact CZ-CG1 4.36Å; F51-V226 HydrophobicContact CZ-CG2 4.33Å; F55-V226 HydrophobicContact CD2-CB 4.27Å; F55-V226 HydrophobicContact CD2-CG1 3.93Å; F55-V226 HydrophobicContact CE2-CG1 4Å; L222-V226 WeakPolarHBondContact O-CG2 3.4Å; L222-V226 PolarHBondContact O-N 2.92Å; G223-V226 PolarHBondContact O-N 3.3Å; V226-G228 VanDerWaalsContact C-N 3.32Å; V226-G228 PolarHBondContact O-N 3.23Å; V226-V229 PolarHBondContact O-N 3.46Å; V226-V230 HydrophobicContact CG1-CG2 4.47Å; V226-V230 WeakPolarHBondContact O-CB 3.45Å; V226-V230 VanDerWaalsContact O-CG2 3.25Å; V226-V230 WeakPolarHBondContact O-CG2 3.36Å; V226-V230 PolarHBondContact O-N 3.43Å |
| 227 | G | 92.6 | Very high | 90.2 | Very high | 0 Ų | 0 | 28.1 Ų | 28.1 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.2 | -40.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | F55 S58 F59 G223 I225 G231 | F55-G227 WeakPolarHBondContact O-CA 3.42Å; S58-G227 WeakPolarHBondContact OG-CA 3.47Å; F59-G227 WeakPolarHBondContact CA-O 3.4Å; G223-G227 PolarHBondContact O-N 2.8Å; I225-G227 PolarHBondContact O-N 3.29Å; G227-G231 PolarHBondContact O-N 2.97Å |
| 228 | G | 93 | Very high | 90.5 | Very high | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -67.2 | -48 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112 | S58 V224 I225 V226 V230 G231 H232 | S58-G228 PolarHBondContact OG-N 3.32Å; S58-G228 VanDerWaalsContact OG-N 3.14Å; V224-G228 PolarHBondContact O-N 2.87Å; I225-G228 PolarHBondContact O-N 3.42Å; V226-G228 VanDerWaalsContact C-N 3.32Å; V226-G228 PolarHBondContact O-N 3.23Å; G228-V230 VanDerWaalsContact C-N 3.33Å; G228-V230 PolarHBondContact O-N 3.47Å; G228-G231 PolarHBondContact O-N 3.41Å; G228-G231 VanDerWaalsContact O-N 3.13Å; G228-H232 PolarHBondContact O-CD2 2.96Å; G228-H232 PolarHBondContact O-N 2.95Å |
| 229 | V | 94.8 | Very high | 90.9 | Very high | 34 Ų | 34 | 28.5 Ų | 28.5 | 21% | 0.206 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.5 | -41.5 | 177 | 172 | 0 | 0 | 0 | 0 | 111.6 | M92 T96 T99 I225 V226 H232 A233 | M92-V229 HydrophobicContact CE-CG1 4.22Å; T96-V229 HydrophobicContact CG2-CG2 3.99Å; T99-V229 HydrophobicContact CG2-CG2 4.36Å; I225-V229 HydrophobicContact CG2-CG2 4.5Å; I225-V229 WeakPolarHBondContact O-CB 3.36Å; I225-V229 VanDerWaalsContact O-CG2 3.3Å; I225-V229 WeakPolarHBondContact O-CG2 3.44Å; I225-V229 PolarHBondContact O-N 2.91Å; V226-V229 PolarHBondContact O-N 3.46Å; V229-H232 PolarHBondContact O-N 3.35Å; V229-A233 VanDerWaalsContact O-CB 3.28Å; V229-A233 WeakPolarHBondContact O-CB 3.32Å; V229-A233 PolarHBondContact O-N 3.31Å |
| 230 | V | 95.8 | Very high | 91.2 | Very high | 63 Ų | 63 | 27.6 Ų | 27.6 | 38% | 0.382 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -66.1 | -39.8 | 176 | 172.3 | 0 | 0 | 0 | 0 | 111.1 | F55 F59 V226 G228 A233 L234 | F55-V230 HydrophobicContact CE2-CB 4.45Å; F55-V230 HydrophobicContact CE2-CG2 4.31Å; F59-V230 HydrophobicContact CD2-CB 4.42Å; F59-V230 HydrophobicContact CD2-CG1 4.04Å; F59-V230 HydrophobicContact CE2-CG1 3.92Å; V226-V230 HydrophobicContact CG1-CG2 4.47Å; V226-V230 WeakPolarHBondContact O-CB 3.45Å; V226-V230 VanDerWaalsContact O-CG2 3.25Å; V226-V230 WeakPolarHBondContact O-CG2 3.36Å; V226-V230 PolarHBondContact O-N 3.43Å; G228-V230 VanDerWaalsContact C-N 3.33Å; G228-V230 PolarHBondContact O-N 3.47Å; V230-A233 PolarHBondContact O-N 3.48Å; V230-L234 PolarHBondContact O-N 3.35Å |
| 231 | G | 92.4 | Very high | 91.1 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.2 | -51.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112 | I63 G227 G228 A233 L234 C235 | I63-G231 WeakPolarHBondContact CD1-O 3.34Å; G227-G231 PolarHBondContact O-N 2.97Å; G228-G231 PolarHBondContact O-N 3.41Å; G228-G231 VanDerWaalsContact O-N 3.13Å; G231-A233 VanDerWaalsContact C-N 3.32Å; G231-A233 PolarHBondContact O-N 2.78Å; G231-L234 PolarHBondContact O-N 3.21Å; G231-L234 VanDerWaalsContact O-N 3.15Å; G231-C235 PolarHBondContact O-N 3.01Å |
| 232 | H | 93 | Very high | 90.6 | Very high | 1 Ų | 1 | 30.8 Ų | 30.8 | 1% | 0.005 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.1 | -41.2 | 176.4 | -74 | -60.3 | 0 | 0 | 0 | 111.9 | I62 E66 M92 L95 T99 G228 V229 L234 C235 T236 | I62-H232 HydrophobicContact CG2-CB 4.5Å; E66-H232 IonicContact OE1-CE1 3.81Å; E66-H232 PolarHBondContact OE1-CE1 3.46Å; E66-H232 VanDerWaalsContact OE1-CE1 3.27Å; E66-H232 IonicContact OE1-ND1 3.36Å; M92-H232 HydrophobicContact SD-CB 4.49Å; L95-H232 HydrophobicContact CB-CB 4.08Å; L95-H232 HydrophobicContact CD1-CB 3.91Å; T99-H232 PolarHBondContact OG1-CD2 3.45Å; T99-H232 PolarHBondContact OG1-NE2 3.27Å; G228-H232 PolarHBondContact O-CD2 2.96Å; G228-H232 PolarHBondContact O-N 2.95Å; V229-H232 PolarHBondContact O-N 3.35Å; H232-L234 VanDerWaalsContact C-N 3.3Å; H232-L234 PolarHBondContact O-N 3.38Å; H232-C235 PolarHBondContact O-N 3.37Å; H232-T236 WeakPolarHBondContact O-CB 3.04Å; H232-T236 PolarHBondContact O-N 2.85Å; H232-T236 PolarHBondContact O-OG1 2.88Å |
| 233 | A | 94.1 | Very high | 89.6 | Confident | 24 Ų | 24 | 25.3 Ų | 25.3 | 20% | 0.198 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.2 | -42.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | M92 V229 V230 G231 G237 | M92-A233 HydrophobicContact CE-CB 3.66Å; M92-A233 WeakPolarHBondContact SD-CA 3.2Å; M92-A233 HydrophobicContact SD-CB 3.99Å; V229-A233 VanDerWaalsContact O-CB 3.28Å; V229-A233 WeakPolarHBondContact O-CB 3.32Å; V229-A233 PolarHBondContact O-N 3.31Å; V230-A233 PolarHBondContact O-N 3.48Å; G231-A233 VanDerWaalsContact C-N 3.32Å; G231-A233 PolarHBondContact O-N 2.78Å; A233-G237 WeakPolarHBondContact O-CA 3.32Å; A233-G237 PolarHBondContact O-N 3.39Å |
| 234 | L | 92.9 | Very high | 88.3 | Confident | 79 Ų | 79 | 33.4 Ų | 33.4 | 41% | 0.414 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -68.1 | -49.6 | 178.1 | -168.1 | 152.1 | 0 | 0 | 0 | 111.1 | F59 I63 V230 G231 H232 G237 L238 | F59-L234 HydrophobicContact CZ-CD1 4.39Å; I63-L234 HydrophobicContact CD1-CB 4.06Å; I63-L234 HydrophobicContact CD1-CD2 3.75Å; I63-L234 HydrophobicContact CD1-CG 4.34Å; V230-L234 PolarHBondContact O-N 3.35Å; G231-L234 PolarHBondContact O-N 3.21Å; G231-L234 VanDerWaalsContact O-N 3.15Å; H232-L234 VanDerWaalsContact C-N 3.3Å; H232-L234 PolarHBondContact O-N 3.38Å; L234-G237 PolarHBondContact O-N 2.95Å; L234-L238 HydrophobicContact CD2-CD1 3.55Å; L234-L238 HydrophobicContact CD2-CG 4.16Å; L234-L238 WeakPolarHBondContact O-CB 3.34Å; L234-L238 WeakPolarHBondContact O-CG 3.19Å; L234-L238 PolarHBondContact O-N 3.28Å |
| 235 | C | 89.9 | Confident | 87 | Confident | 5 Ų | 5 | 40.5 Ų | 40.5 | 3% | 0.034 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.4 | -47.5 | 179.3 | -73.8 | 0 | 0 | 0 | 0 | 112.2 | I63 E66 F72 G231 H232 L238 A239 | I63-C235 WeakPolarHBondContact CD1-SG 3.23Å; E66-C235 HydrophobicContact CB-CB 4Å; F72-C235 WeakPolarHBondContact CE2-O 3.29Å; G231-C235 PolarHBondContact O-N 3.01Å; H232-C235 PolarHBondContact O-N 3.37Å; C235-L238 WeakPolarHBondContact O-CB 3.42Å; C235-L238 PolarHBondContact O-N 3.36Å; C235-A239 PolarHBondContact O-N 2.88Å |
| 236 | T | 90.3 | Very high | 85.5 | Confident | 10 Ų | 10 | 42 Ų | 42 | 6% | 0.061 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -65 | -41.7 | 178.1 | -51.9 | 0 | 0 | 0 | 0 | 111 | Y88 A91 L95 H232 L238 A239 V240 | Y88-T236 HydrophobicContact CD2-CG2 3.83Å; Y88-T236 HydrophobicContact CE2-CG2 4.28Å; A91-T236 HydrophobicContact CB-CG2 3.8Å; L95-T236 VanDerWaalsContact CD1-OG1 3.23Å; L95-T236 WeakPolarHBondContact CD1-OG1 3.41Å; H232-T236 WeakPolarHBondContact O-CB 3.04Å; H232-T236 PolarHBondContact O-N 2.85Å; H232-T236 PolarHBondContact O-OG1 2.88Å; T236-L238 VanDerWaalsContact C-N 3.33Å; T236-L238 PolarHBondContact O-N 2.85Å; T236-A239 WeakPolarHBondContact O-CB 3.3Å; T236-A239 PolarHBondContact O-N 2.71Å; T236-V240 WeakPolarHBondContact O-CB 3.31Å; T236-V240 VanDerWaalsContact O-CG2 3.29Å; T236-V240 WeakPolarHBondContact O-CG2 3.31Å; T236-V240 PolarHBondContact O-N 3.04Å |
| 237 | G | 90.4 | Very high | 83.2 | Confident | 26 Ų | 26 | 42.7 Ų | 42.7 | 27% | 0.268 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61.5 | -41.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | A233 L234 L241 | A233-G237 WeakPolarHBondContact O-CA 3.32Å; A233-G237 PolarHBondContact O-N 3.39Å; L234-G237 PolarHBondContact O-N 2.95Å; G237-L241 VanDerWaalsContact O-CB 3.32Å; G237-L241 WeakPolarHBondContact O-CB 3.43Å; G237-L241 PolarHBondContact O-N 3.12Å |
| 238 | L | 88.1 | Confident | 81.3 | Confident | 62 Ų | 62 | 49 Ų | 49 | 33% | 0.325 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63.9 | -46 | 172.7 | -75.6 | 178.9 | 0 | 0 | 0 | 111.5 | F72 L234 C235 T236 V240 L241 M242 | F72-L238 HydrophobicContact CE2-CB 4.04Å; L234-L238 HydrophobicContact CD2-CD1 3.55Å; L234-L238 HydrophobicContact CD2-CG 4.16Å; L234-L238 WeakPolarHBondContact O-CB 3.34Å; L234-L238 WeakPolarHBondContact O-CG 3.19Å; L234-L238 PolarHBondContact O-N 3.28Å; C235-L238 WeakPolarHBondContact O-CB 3.42Å; C235-L238 PolarHBondContact O-N 3.36Å; T236-L238 VanDerWaalsContact C-N 3.33Å; T236-L238 PolarHBondContact O-N 2.85Å; L238-V240 VanDerWaalsContact C-N 3.34Å; L238-V240 PolarHBondContact O-N 3.45Å; L238-L241 CarbonylContact O-C 3.58Å; L238-L241 PolarHBondContact O-N 3.2Å; L238-L241 VanDerWaalsContact O-N 3.17Å; L238-M242 HydrophobicContact CD2-CE 4.42Å; L238-M242 VanDerWaalsContact O-CB 3.3Å; L238-M242 WeakPolarHBondContact O-CB 3.11Å; L238-M242 WeakPolarHBondContact O-CG 3.02Å; L238-M242 PolarHBondContact O-N 2.9Å |
| 239 | A | 87 | Confident | 79.6 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -55.2 | -50.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | F72 A75 A76 C235 T236 L241 M242 G243 | F72-A239 HydrophobicContact CD1-CB 4.41Å; F72-A239 HydrophobicContact CD2-CB 3.63Å; F72-A239 HydrophobicContact CE1-CB 4.46Å; F72-A239 HydrophobicContact CE2-CB 3.69Å; F72-A239 HydrophobicContact CG-CB 4Å; F72-A239 HydrophobicContact CZ-CB 4.11Å; F72-A239 WeakPolarHBondContact O-CB 3.43Å; A75-A239 HydrophobicContact CB-CB 3.79Å; A76-A239 WeakPolarHBondContact CA-O 3.29Å; A76-A239 HydrophobicContact CB-CB 4.29Å; A76-A239 VanDerWaalsContact CB-O 3.3Å; A76-A239 WeakPolarHBondContact CB-O 3.27Å; C235-A239 PolarHBondContact O-N 2.88Å; T236-A239 WeakPolarHBondContact O-CB 3.3Å; T236-A239 PolarHBondContact O-N 2.71Å; A239-L241 VanDerWaalsContact C-N 3.31Å; A239-L241 PolarHBondContact O-N 3.17Å; A239-M242 PolarHBondContact O-N 2.98Å; A239-G243 PolarHBondContact O-N 2.92Å |
| 240 | V | 86.7 | Confident | 77.9 | Confident | 13 Ų | 13 | 60.7 Ų | 60.7 | 8% | 0.079 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65 | -33.7 | 179.7 | 170.9 | 0 | 0 | 0 | 0 | 112.2 | S79 R84 T236 L238 | S79-V240 PolarHBondContact OG-O 3.22Å; R84-V240 HydrophobicContact CB-CG1 3.52Å; T236-V240 WeakPolarHBondContact O-CB 3.31Å; T236-V240 VanDerWaalsContact O-CG2 3.29Å; T236-V240 WeakPolarHBondContact O-CG2 3.31Å; T236-V240 PolarHBondContact O-N 3.04Å; L238-V240 VanDerWaalsContact C-N 3.34Å; L238-V240 PolarHBondContact O-N 3.45Å |
| 241 | L | 84.6 | Confident | 76.4 | Confident | 75 Ų | 75 | 59.9 Ų | 59.9 | 39% | 0.393 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -73.3 | -40.4 | 173.6 | -177.2 | 61.4 | 0 | 0 | 0 | 111.7 | G237 L238 A239 G243 R244 F245 | G237-L241 VanDerWaalsContact O-CB 3.32Å; G237-L241 WeakPolarHBondContact O-CB 3.43Å; G237-L241 PolarHBondContact O-N 3.12Å; L238-L241 CarbonylContact O-C 3.58Å; L238-L241 PolarHBondContact O-N 3.2Å; L238-L241 VanDerWaalsContact O-N 3.17Å; A239-L241 VanDerWaalsContact C-N 3.31Å; A239-L241 PolarHBondContact O-N 3.17Å; L241-G243 VanDerWaalsContact C-N 3.28Å; L241-G243 PolarHBondContact O-N 3.34Å; L241-R244 VanDerWaalsContact O-CB 3.23Å; L241-R244 WeakPolarHBondContact O-CB 3.19Å; L241-R244 WeakPolarHBondContact O-CG 3.27Å; L241-R244 PolarHBondContact O-N 3.28Å; L241-F245 HydrophobicContact CD1-CE2 4.31Å; L241-F245 HydrophobicContact CG-CE2 4.41Å |
| 242 | M | 78 | Confident | 75.3 | Confident | 44 Ų | 44 | 60.4 Ų | 60.4 | 22% | 0.217 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -65.4 | -31.6 | 178 | -72.3 | -57.4 | 148.8 | 0 | 0 | 111.2 | F72 L238 A239 R244 F245 V246 | F72-M242 HydrophobicContact CZ-CB 4.45Å; F72-M242 HydrophobicContact CZ-CG 4.15Å; L238-M242 HydrophobicContact CD2-CE 4.42Å; L238-M242 VanDerWaalsContact O-CB 3.3Å; L238-M242 WeakPolarHBondContact O-CB 3.11Å; L238-M242 WeakPolarHBondContact O-CG 3.02Å; L238-M242 PolarHBondContact O-N 2.9Å; A239-M242 PolarHBondContact O-N 2.98Å; M242-R244 PolarHBondContact O-N 3.4Å; M242-F245 CarbonylContact O-C 3.6Å; M242-F245 WeakPolarHBondContact O-CA 3.4Å; M242-F245 PolarHBondContact O-N 2.98Å; M242-V246 HydrophobicContact CB-CG2 3.98Å; M242-V246 WeakPolarHBondContact O-CB 3.47Å; M242-V246 WeakPolarHBondContact O-CG2 3.47Å; M242-V246 PolarHBondContact O-N 3.19Å |
| 243 | G | 69.1 | Low | 74.7 | Confident | 10 Ų | 10 | 63.9 Ų | 63.9 | 10% | 0.103 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -50.8 | -25.3 | 168.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | M80 A239 L241 | M80-G243 VanDerWaalsContact CE-O 3.24Å; M80-G243 WeakPolarHBondContact CE-O 3.15Å; M80-G243 WeakPolarHBondContact CG-O 3.43Å; A239-G243 PolarHBondContact O-N 2.92Å; L241-G243 VanDerWaalsContact C-N 3.28Å; L241-G243 PolarHBondContact O-N 3.34Å |
| 244 | R | 62.8 | Low | 74 | Confident | 170 Ų | 170 | 69.7 Ų | 69.7 | 64% | 0.642 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -24.8 | 173.2 | -54.3 | -175.4 | 68.4 | 176.7 | 1.4 | 114.4 | R84 L241 M242 | R84-R244 VanDerWaalsContact NH1-NH1 3.18Å; L241-R244 VanDerWaalsContact O-CB 3.23Å; L241-R244 WeakPolarHBondContact O-CB 3.19Å; L241-R244 WeakPolarHBondContact O-CG 3.27Å; L241-R244 PolarHBondContact O-N 3.28Å; M242-R244 PolarHBondContact O-N 3.4Å |
| 245 | F | 63.6 | Low | 73.2 | Confident | 149 Ų | 149 | 66.7 Ų | 66.7 | 65% | 0.654 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -112.5 | -14.7 | -172.1 | -69.7 | -72.2 | 0 | 0 | 0 | 114 | L241 M242 A247 | L241-F245 HydrophobicContact CD1-CE2 4.31Å; L241-F245 HydrophobicContact CG-CE2 4.41Å; M242-F245 CarbonylContact O-C 3.6Å; M242-F245 WeakPolarHBondContact O-CA 3.4Å; M242-F245 PolarHBondContact O-N 2.98Å; F245-A247 VanDerWaalsContact C-N 3.33Å; F245-A247 PolarHBondContact O-N 3.36Å |
| 246 | V | 61.6 | Low | 72.8 | Confident | 54 Ų | 54 | 66.5 Ų | 66.5 | 33% | 0.327 | 33% | 0.325 | S | S | . | . | trans | -64.7 | 91.8 | -167.6 | 157.7 | 0 | 0 | 0 | 0 | 111.2 | M80 M242 | M80-V246 HydrophobicContact CE-CB 3.68Å; M80-V246 HydrophobicContact CE-CG1 3.81Å; M242-V246 HydrophobicContact CB-CG2 3.98Å; M242-V246 WeakPolarHBondContact O-CB 3.47Å; M242-V246 WeakPolarHBondContact O-CG2 3.47Å; M242-V246 PolarHBondContact O-N 3.19Å | ||
| 247 | A | 46.2 | Very low | 72.6 | Confident | 78 Ų | 78 | 70.4 Ų | 70.4 | 65% | 0.645 | 34% | 0.341 | S | S | * | . | trans | -95 | 84.3 | 153.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | F245 R249 | F245-A247 VanDerWaalsContact C-N 3.33Å; F245-A247 PolarHBondContact O-N 3.36Å; A247-R249 VanDerWaalsContact C-N 3.33Å; A247-R249 WeakPolarHBondContact O-CB 3.44Å; A247-R249 WeakPolarHBondContact O-CG 3.23Å; A247-R249 PolarHBondContact O-N 2.99Å | ||
| 248 | Q | 52.7 | Low | 72.3 | Confident | 131 Ų | 131 | 70.7 Ų | 70.7 | 61% | 0.612 | 34% | 0.336 | S | S | * | . | S | Bend | trans | 30.1 | 37.3 | 150.8 | -59.7 | -177.5 | -4.4 | 0 | 0 | 120.8 | ||
| 249 | R | 56.6 | Low | 72 | Confident | 224 Ų | 224 | 67.8 Ų | 67.8 | 85% | 0.845 | 32% | 0.32 | S | S | * | . | trans | -131.1 | 11.2 | -174.4 | -69.5 | -75.2 | -169.8 | 111.6 | 2.9 | 116.1 | A247 P251 | A247-R249 VanDerWaalsContact C-N 3.33Å; A247-R249 WeakPolarHBondContact O-CB 3.44Å; A247-R249 WeakPolarHBondContact O-CG 3.23Å; A247-R249 PolarHBondContact O-N 2.99Å; R249-P251 VanDerWaalsContact O-CD 3.24Å; R249-P251 WeakPolarHBondContact O-CD 3.47Å | ||
| 250 | I | 60.5 | Low | 72 | Confident | 56 Ų | 56 | 67.8 Ų | 67.8 | 29% | 0.287 | 32% | 0.32 | S | S | . | . | trans | -91.4 | 112.5 | 177.6 | -57.6 | -175 | 0 | 0 | 0 | 109.4 | V252 I255 | I250-V252 PolarHBondContact O-N 3.06Å; I250-I255 HydrophobicContact CG2-CD1 3.88Å | ||
| 251 | P | 63.6 | Low | 72.2 | Confident | 47 Ų | 47 | 69.6 Ų | 69.6 | 31% | 0.305 | 33% | 0.332 | S | S | . | . | trans | -75 | 98.2 | 175.4 | 32 | -35.2 | 0 | 0 | 0 | 109.9 | R249 Q253 W254 | R249-P251 VanDerWaalsContact O-CD 3.24Å; R249-P251 WeakPolarHBondContact O-CD 3.47Å; P251-Q253 PolarHBondContact O-N 2.81Å; P251-Q253 VanDerWaalsContact O-N 3.14Å; P251-W254 PolarHBondContact O-N 2.97Å | ||
| 252 | V | 70.5 | Confident | 72.2 | Confident | 10 Ų | 10 | 66.2 Ų | 66.2 | 6% | 0.061 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -53.9 | -30.8 | 177.2 | -60.7 | 0 | 0 | 0 | 0 | 113.3 | F73 M139 A144 I250 W254 I255 T256 | F73-V252 HydrophobicContact CD2-CG1 4.12Å; F73-V252 HydrophobicContact CE1-CG1 4.02Å; F73-V252 HydrophobicContact CE2-CB 4.2Å; F73-V252 HydrophobicContact CE2-CG1 3.08Å; F73-V252 HydrophobicContact CZ-CB 4.43Å; F73-V252 HydrophobicContact CZ-CG1 3.04Å; M139-V252 HydrophobicContact SD-CG2 4.49Å; A144-V252 HydrophobicContact CB-CG1 3.75Å; A144-V252 HydrophobicContact CB-CG2 4.09Å; I250-V252 PolarHBondContact O-N 3.06Å; V252-W254 VanDerWaalsContact C-N 3.31Å; V252-W254 PolarHBondContact O-N 3.32Å; V252-I255 PolarHBondContact O-N 3.19Å; V252-T256 PolarHBondContact O-N 3.44Å; V252-T256 VanDerWaalsContact O-N 3.07Å; V252-T256 PolarHBondContact O-OG1 3.2Å |
| 253 | Q | 79 | Confident | 72.6 | Confident | 74 Ų | 74 | 64.2 Ų | 64.2 | 35% | 0.346 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -52.6 | -46.3 | -178.9 | -162.9 | -174.5 | 0.2 | 0 | 0 | 112.8 | A136 P251 I255 F257 | A136-Q253 WeakPolarHBondContact O-CG 3.17Å; A136-Q253 PolarHBondContact O-NE2 3.36Å; P251-Q253 PolarHBondContact O-N 2.81Å; P251-Q253 VanDerWaalsContact O-N 3.14Å; Q253-I255 VanDerWaalsContact C-N 3.3Å; Q253-I255 PolarHBondContact O-N 3.04Å; Q253-F257 WeakPolarHBondContact O-CB 3.44Å; Q253-F257 PolarHBondContact O-N 3.3Å |
| 254 | W | 80.1 | Confident | 73.7 | Confident | 146 Ų | 146 | 65 Ų | 65 | 55% | 0.553 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -67.6 | -34.2 | -178.7 | -69.8 | 104.3 | 0 | 0 | 0 | 112.1 | P251 V252 F257 I258 | P251-W254 PolarHBondContact O-N 2.97Å; V252-W254 VanDerWaalsContact C-N 3.31Å; V252-W254 PolarHBondContact O-N 3.32Å; W254-F257 PolarHBondContact O-N 2.99Å; W254-I258 WeakPolarHBondContact O-CD1 3.41Å; W254-I258 WeakPolarHBondContact O-CG1 3.36Å; W254-I258 PolarHBondContact O-N 2.86Å |
| 255 | I | 74.9 | Confident | 74.9 | Confident | 17 Ų | 17 | 59.7 Ų | 59.7 | 9% | 0.087 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -71.9 | -45.7 | -177.6 | -53.4 | 174.5 | 0 | 0 | 0 | 110 | I67 I250 V252 Q253 F257 I258 G259 | I67-I255 HydrophobicContact CB-CG2 4.33Å; I67-I255 HydrophobicContact CG1-CG2 4.41Å; I67-I255 HydrophobicContact CG2-CG2 3.57Å; I67-I255 WeakPolarHBondContact O-CG2 3.34Å; I250-I255 HydrophobicContact CG2-CD1 3.88Å; V252-I255 PolarHBondContact O-N 3.19Å; Q253-I255 VanDerWaalsContact C-N 3.3Å; Q253-I255 PolarHBondContact O-N 3.04Å; I255-F257 VanDerWaalsContact C-N 3.31Å; I255-F257 PolarHBondContact O-N 2.71Å; I255-I258 PolarHBondContact O-N 3.49Å; I255-G259 PolarHBondContact O-N 3.22Å |
| 256 | T | 81.8 | Confident | 75.9 | Confident | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.006 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -61.3 | -40 | 172.7 | -49.9 | 0 | 0 | 0 | 0 | 111.3 | M132 E135 A136 M139 V252 I258 G259 G260 | M132-T256 HydrophobicContact CB-CG2 4.46Å; M132-T256 HydrophobicContact CE-CG2 3.88Å; M132-T256 WeakPolarHBondContact CE-O 3.48Å; E135-T256 HydrophobicContact CG-CG2 4.45Å; A136-T256 HydrophobicContact CB-CG2 3.97Å; M139-T256 HydrophobicContact SD-CG2 4.42Å; V252-T256 PolarHBondContact O-N 3.44Å; V252-T256 VanDerWaalsContact O-N 3.07Å; V252-T256 PolarHBondContact O-OG1 3.2Å; T256-I258 PolarHBondContact O-N 3.32Å; T256-G259 PolarHBondContact O-N 3.45Å; T256-G260 PolarHBondContact O-N 2.87Å |
| 257 | F | 86.5 | Confident | 77.1 | Confident | 92 Ų | 92 | 50.2 Ų | 50.2 | 40% | 0.404 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -59.1 | -48.5 | 175.4 | 178.7 | -91 | 0 | 0 | 0 | 112 | L133 A136 Q253 W254 I255 G260 V261 | L133-F257 HydrophobicContact CD1-CD2 3.34Å; L133-F257 HydrophobicContact CD1-CE2 3.39Å; L133-F257 HydrophobicContact CD1-CG 4.12Å; L133-F257 HydrophobicContact CD1-CZ 4.2Å; L133-F257 HydrophobicContact CG-CD2 4.48Å; L133-F257 HydrophobicContact CG-CE2 4.44Å; A136-F257 HydrophobicContact CB-CB 3.93Å; Q253-F257 WeakPolarHBondContact O-CB 3.44Å; Q253-F257 PolarHBondContact O-N 3.3Å; W254-F257 PolarHBondContact O-N 2.99Å; I255-F257 VanDerWaalsContact C-N 3.31Å; I255-F257 PolarHBondContact O-N 2.71Å; F257-G260 PolarHBondContact O-N 2.91Å; F257-V261 HydrophobicContact CD1-CG2 4.21Å; F257-V261 HydrophobicContact CE1-CG2 3.8Å; F257-V261 HydrophobicContact CZ-CG2 3.98Å; F257-V261 WeakPolarHBondContact O-CG2 3.31Å; F257-V261 PolarHBondContact O-N 3.48Å |
| 258 | I | 83.5 | Confident | 79.1 | Confident | 32 Ų | 32 | 51.8 Ų | 51.8 | 16% | 0.164 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 180 | -69.6 | 164.3 | 0 | 0 | 0 | 111 | L9 L13 W254 I255 T256 G260 V261 T262 | L9-I258 HydrophobicContact CD1-CD1 3.81Å; L13-I258 HydrophobicContact CD1-CG2 3.73Å; W254-I258 WeakPolarHBondContact O-CD1 3.41Å; W254-I258 WeakPolarHBondContact O-CG1 3.36Å; W254-I258 PolarHBondContact O-N 2.86Å; I255-I258 PolarHBondContact O-N 3.49Å; T256-I258 PolarHBondContact O-N 3.32Å; I258-G260 VanDerWaalsContact C-N 3.31Å; I258-G260 PolarHBondContact O-N 3.15Å; I258-V261 PolarHBondContact O-N 3.5Å; I258-T262 PolarHBondContact O-N 3.47Å; I258-T262 PolarHBondContact O-OG1 3.33Å |
| 259 | G | 82.9 | Confident | 80.6 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.1 | -44.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I255 T256 V261 T262 F263 | I255-G259 PolarHBondContact O-N 3.22Å; T256-G259 PolarHBondContact O-N 3.45Å; G259-V261 PolarHBondContact O-N 2.95Å; G259-T262 VanDerWaalsContact O-CB 3.29Å; G259-T262 WeakPolarHBondContact O-CB 3.45Å; G259-T262 PolarHBondContact O-N 3.09Å; G259-T262 VanDerWaalsContact O-N 3.16Å; G259-F263 WeakPolarHBondContact O-CD2 3.41Å; G259-F263 PolarHBondContact O-N 3.17Å |
| 260 | G | 87.8 | Confident | 81.7 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60.5 | -45.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | G129 T256 F257 I258 T262 F263 I264 | G129-G260 WeakPolarHBondContact CA-O 3.12Å; G129-G260 WeakPolarHBondContact O-CA 3.22Å; T256-G260 PolarHBondContact O-N 2.87Å; F257-G260 PolarHBondContact O-N 2.91Å; I258-G260 VanDerWaalsContact C-N 3.31Å; I258-G260 PolarHBondContact O-N 3.15Å; G260-T262 VanDerWaalsContact C-N 3.3Å; G260-T262 PolarHBondContact O-N 3.31Å; G260-F263 PolarHBondContact O-N 2.89Å; G260-I264 WeakPolarHBondContact O-CG1 3.1Å; G260-I264 PolarHBondContact O-N 3.48Å |
| 261 | V | 90 | Very high | 82.7 | Confident | 52 Ų | 52 | 37.6 Ų | 37.6 | 32% | 0.315 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.7 | -39.5 | 175.2 | 170.3 | 0 | 0 | 0 | 0 | 111.6 | L133 F257 I258 G259 I264 I265 | L133-V261 HydrophobicContact CD1-CG2 4.07Å; F257-V261 HydrophobicContact CD1-CG2 4.21Å; F257-V261 HydrophobicContact CE1-CG2 3.8Å; F257-V261 HydrophobicContact CZ-CG2 3.98Å; F257-V261 WeakPolarHBondContact O-CG2 3.31Å; F257-V261 PolarHBondContact O-N 3.48Å; I258-V261 PolarHBondContact O-N 3.5Å; G259-V261 PolarHBondContact O-N 2.95Å; V261-I264 PolarHBondContact O-N 3.24Å; V261-I265 HydrophobicContact CG1-CD1 4.03Å; V261-I265 WeakPolarHBondContact O-CG1 3.49Å; V261-I265 PolarHBondContact O-N 3.31Å |
| 262 | T | 84.2 | Confident | 83.5 | Confident | 3 Ų | 3 | 42.5 Ų | 42.5 | 2% | 0.018 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.7 | -47.2 | 178 | -50.4 | 0 | 0 | 0 | 0 | 111.9 | L13 I64 I258 G259 G260 I264 I265 F266 | L13-T262 HydrophobicContact CD2-CG2 3.38Å; L13-T262 WeakPolarHBondContact CD2-OG1 3.2Å; I64-T262 HydrophobicContact CD1-CG2 4.12Å; I64-T262 HydrophobicContact CG2-CG2 4.11Å; I258-T262 PolarHBondContact O-N 3.47Å; I258-T262 PolarHBondContact O-OG1 3.33Å; G259-T262 VanDerWaalsContact O-CB 3.29Å; G259-T262 WeakPolarHBondContact O-CB 3.45Å; G259-T262 PolarHBondContact O-N 3.09Å; G259-T262 VanDerWaalsContact O-N 3.16Å; G260-T262 VanDerWaalsContact C-N 3.3Å; G260-T262 PolarHBondContact O-N 3.31Å; T262-I264 VanDerWaalsContact C-N 3.31Å; T262-I264 PolarHBondContact O-N 3.01Å; T262-I265 WeakPolarHBondContact O-CB 3.47Å; T262-I265 PolarHBondContact O-N 3.03Å; T262-I265 VanDerWaalsContact O-N 3.15Å; T262-F266 HydrophobicContact CG2-CD2 4.12Å; T262-F266 HydrophobicContact CG2-CE2 3.6Å; T262-F266 HydrophobicContact CG2-CZ 3.84Å; T262-F266 PolarHBondContact O-N 3.39Å |
| 263 | F | 87.2 | Confident | 83.4 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.009 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.4 | -40.2 | 177.4 | -82.7 | -64.4 | 0 | 0 | 0 | 112 | V61 S65 F125 F128 M132 R207 T211 G259 G260 I265 F266 A267 | V61-F263 HydrophobicContact CG1-CE1 4.5Å; V61-F263 HydrophobicContact CG1-CZ 4.27Å; S65-F263 VanDerWaalsContact OG-CE2 3.24Å; S65-F263 WeakPolarHBondContact OG-CE2 3.43Å; S65-F263 WeakPolarHBondContact OG-CZ 3.49Å; F125-F263 HydrophobicContact CB-CD1 4.46Å; F125-F263 WeakPolarHBondContact CB-O 3.42Å; F125-F263 AromaticContact CD1-CD1 3.43Å; F125-F263 HydrophobicContact CD1-CD1 3.43Å; F125-F263 VanDerWaalsContact CD1-CD1 3.43Å; F125-F263 AromaticContact CD1-CE1 3.72Å; F125-F263 HydrophobicContact CD1-CE1 3.72Å; F125-F263 AromaticContact CE1-CD1 3.97Å; F125-F263 HydrophobicContact CE1-CD1 3.97Å; F125-F263 AromaticContact CE1-CE1 3.8Å; F125-F263 HydrophobicContact CE1-CE1 3.8Å; F125-F263 HydrophobicContact CG-CD1 4.22Å; F128-F263 HydrophobicContact CD1-CD1 4.33Å; F128-F263 AromaticContact CD1-CD2 3.77Å; F128-F263 HydrophobicContact CD1-CD2 3.77Å; F128-F263 HydrophobicContact CD1-CE1 4.4Å; F128-F263 AromaticContact CD1-CE2 3.85Å; F128-F263 HydrophobicContact CD1-CE2 3.85Å; F128-F263 HydrophobicContact CD1-CG 4.02Å; F128-F263 HydrophobicContact CD1-CZ 4.16Å; F128-F263 HydrophobicContact CE1-CD2 4.01Å; F128-F263 AromaticContact CE1-CE2 3.79Å; F128-F263 HydrophobicContact CE1-CE2 3.79Å; F128-F263 HydrophobicContact CE1-CZ 4.28Å; M132-F263 HydrophobicContact SD-CD2 3.58Å; M132-F263 VanDerWaalsContact SD-CD2 3.58Å; M132-F263 HydrophobicContact SD-CE2 3.78Å; R207-F263 HydrophobicContact CB-CE2 4.38Å; R207-F263 HydrophobicContact CB-CZ 4.37Å; T211-F263 HydrophobicContact CG2-CE1 4.23Å; T211-F263 WeakPolarHBondContact OG1-CE1 3.28Å; T211-F263 WeakPolarHBondContact OG1-CZ 3.32Å; G259-F263 WeakPolarHBondContact O-CD2 3.41Å; G259-F263 PolarHBondContact O-N 3.17Å; G260-F263 PolarHBondContact O-N 2.89Å; F263-I265 VanDerWaalsContact C-N 3.34Å; F263-I265 PolarHBondContact O-N 3.07Å; F263-F266 PolarHBondContact O-N 3.01Å; F263-A267 PolarHBondContact O-N 2.89Å |
| 264 | I | 91.5 | Very high | 82.5 | Confident | 27 Ų | 27 | 40.9 Ų | 40.9 | 14% | 0.138 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.3 | -43.6 | 173.4 | -69.6 | 175 | 0 | 0 | 0 | 110.8 | L130 L133 G260 V261 T262 A267 F268 | L130-I264 HydrophobicContact CD2-CD1 4.01Å; L130-I264 HydrophobicContact CG-CD1 4.45Å; L133-I264 HydrophobicContact CD2-CD1 4.23Å; G260-I264 WeakPolarHBondContact O-CG1 3.1Å; G260-I264 PolarHBondContact O-N 3.48Å; V261-I264 PolarHBondContact O-N 3.24Å; T262-I264 VanDerWaalsContact C-N 3.31Å; T262-I264 PolarHBondContact O-N 3.01Å; I264-A267 WeakPolarHBondContact O-CB 3.36Å; I264-A267 PolarHBondContact O-N 3.03Å; I264-F268 HydrophobicContact CG2-CD2 3.65Å; I264-F268 HydrophobicContact CG2-CE2 3.4Å; I264-F268 WeakPolarHBondContact O-CD2 3.48Å; I264-F268 PolarHBondContact O-N 3.11Å |
| 265 | I | 88.6 | Confident | 81.2 | Confident | 59 Ų | 59 | 38.1 Ų | 38.1 | 30% | 0.303 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -60.6 | -47.3 | 176.1 | -69.6 | 164.9 | 0 | 0 | 0 | 110.9 | I17 V261 T262 F263 A267 F268 S269 | I17-I265 HydrophobicContact CD1-CD1 4.24Å; I17-I265 HydrophobicContact CD1-CG2 3.82Å; I17-I265 HydrophobicContact CG1-CG2 3.94Å; V261-I265 HydrophobicContact CG1-CD1 4.03Å; V261-I265 WeakPolarHBondContact O-CG1 3.49Å; V261-I265 PolarHBondContact O-N 3.31Å; T262-I265 WeakPolarHBondContact O-CB 3.47Å; T262-I265 PolarHBondContact O-N 3.03Å; T262-I265 VanDerWaalsContact O-N 3.15Å; F263-I265 VanDerWaalsContact C-N 3.34Å; F263-I265 PolarHBondContact O-N 3.07Å; I265-A267 VanDerWaalsContact C-N 3.28Å; I265-A267 PolarHBondContact O-N 3.48Å; I265-F268 PolarHBondContact O-N 2.95Å; I265-F268 VanDerWaalsContact O-N 3.16Å; I265-S269 PolarHBondContact O-N 2.89Å; I265-S269 PolarHBondContact O-OG 2.85Å |
| 266 | F | 84.6 | Confident | 80.2 | Confident | 4 Ų | 4 | 41 Ų | 41 | 2% | 0.018 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60 | -39 | 176.9 | -69.1 | -28.3 | 0 | 0 | 0 | 112.4 | I17 F20 V61 F125 T262 F263 S269 V270 | I17-F266 HydrophobicContact CG1-CE1 4.2Å; F20-F266 HydrophobicContact CB-CD1 4.23Å; F20-F266 HydrophobicContact CB-CE1 3.92Å; F20-F266 HydrophobicContact CD1-CD1 4.04Å; F20-F266 HydrophobicContact CD2-CD1 4.4Å; F20-F266 HydrophobicContact CD2-CE1 4.46Å; F20-F266 AromaticContact CG-CD1 3.96Å; F20-F266 HydrophobicContact CG-CD1 3.96Å; F20-F266 HydrophobicContact CG-CE1 4.07Å; V61-F266 HydrophobicContact CG2-CD2 4.44Å; V61-F266 HydrophobicContact CG2-CE2 3.7Å; V61-F266 HydrophobicContact CG2-CZ 4.4Å; F125-F266 HydrophobicContact CD2-CB 3.97Å; F125-F266 HydrophobicContact CE2-CB 4.34Å; F125-F266 HydrophobicContact CG-CB 4.34Å; T262-F266 HydrophobicContact CG2-CD2 4.12Å; T262-F266 HydrophobicContact CG2-CE2 3.6Å; T262-F266 HydrophobicContact CG2-CZ 3.84Å; T262-F266 PolarHBondContact O-N 3.39Å; F263-F266 PolarHBondContact O-N 3.01Å; F266-S269 PolarHBondContact O-N 2.97Å; F266-V270 WeakPolarHBondContact O-CG2 3.48Å; F266-V270 PolarHBondContact O-N 3.2Å |
| 267 | A | 87.1 | Confident | 78.8 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -58.8 | -48.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G122 F125 F126 F263 I264 I265 S269 V270 F271 | G122-A267 VanDerWaalsContact O-CB 3.25Å; G122-A267 WeakPolarHBondContact O-CB 3.12Å; F125-A267 HydrophobicContact CB-CB 3.85Å; F126-A267 HydrophobicContact CB-CB 3.7Å; F126-A267 HydrophobicContact CD2-CB 4.33Å; F263-A267 PolarHBondContact O-N 2.89Å; I264-A267 WeakPolarHBondContact O-CB 3.36Å; I264-A267 PolarHBondContact O-N 3.03Å; I265-A267 VanDerWaalsContact C-N 3.28Å; I265-A267 PolarHBondContact O-N 3.48Å; A267-S269 PolarHBondContact O-N 3.47Å; A267-V270 PolarHBondContact O-N 2.75Å; A267-F271 HydrophobicContact CB-CE2 4.4Å; A267-F271 WeakPolarHBondContact O-CD2 3.21Å; A267-F271 WeakPolarHBondContact O-CG 3.43Å; A267-F271 PolarHBondContact O-N 2.99Å |
| 268 | F | 88.4 | Confident | 76.9 | Confident | 110 Ų | 110 | 48 Ų | 48 | 48% | 0.482 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 176.7 | -77 | -67.1 | 0 | 0 | 0 | 112.2 | F126 I264 I265 V270 F271 L272 | F126-F268 HydrophobicContact CE2-CE2 4.41Å; F126-F268 HydrophobicContact CE2-CZ 4.28Å; I264-F268 HydrophobicContact CG2-CD2 3.65Å; I264-F268 HydrophobicContact CG2-CE2 3.4Å; I264-F268 WeakPolarHBondContact O-CD2 3.48Å; I264-F268 PolarHBondContact O-N 3.11Å; I265-F268 PolarHBondContact O-N 2.95Å; I265-F268 VanDerWaalsContact O-N 3.16Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3.36Å; F268-F271 PolarHBondContact O-N 2.61Å; F268-L272 WeakPolarHBondContact O-CB 3.31Å; F268-L272 VanDerWaalsContact O-CG 3.31Å; F268-L272 WeakPolarHBondContact O-CG 3.39Å; F268-L272 PolarHBondContact O-N 2.93Å |
| 269 | S | 82.8 | Confident | 74.9 | Confident | 39 Ų | 39 | 53.7 Ų | 53.7 | 27% | 0.273 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -59.7 | -40.8 | 174.6 | -63.6 | 0 | 0 | 0 | 0 | 112.2 | I265 F266 A267 G273 | I265-S269 PolarHBondContact O-N 2.89Å; I265-S269 PolarHBondContact O-OG 2.85Å; F266-S269 PolarHBondContact O-N 2.97Å; A267-S269 PolarHBondContact O-N 3.47Å; S269-G273 PolarHBondContact O-N 2.75Å |
| 270 | V | 79.4 | Confident | 74.5 | Confident | 2 Ų | 2 | 56.4 Ų | 56.4 | 1% | 0.012 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -66.8 | -41.1 | 175.9 | 174.3 | 0 | 0 | 0 | 0 | 111.6 | F20 L118 F266 A267 F268 | F20-V270 HydrophobicContact CE1-CG2 3.68Å; F20-V270 HydrophobicContact CZ-CG2 3.83Å; L118-V270 HydrophobicContact CB-CG1 4.38Å; L118-V270 WeakPolarHBondContact O-CG1 3.48Å; F266-V270 WeakPolarHBondContact O-CG2 3.48Å; F266-V270 PolarHBondContact O-N 3.2Å; A267-V270 PolarHBondContact O-N 2.75Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3.36Å |
| 271 | F | 82.7 | Confident | 73.8 | Confident | 72 Ų | 72 | 59.4 Ų | 59.4 | 32% | 0.316 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -68.4 | -40.5 | 178.3 | -68.9 | -48.7 | 0 | 0 | 0 | 112.8 | Y119 A267 F268 | Y119-F271 HydrophobicContact CD1-CD1 4.49Å; Y119-F271 HydrophobicContact CD1-CE1 4.25Å; A267-F271 HydrophobicContact CB-CE2 4.4Å; A267-F271 WeakPolarHBondContact O-CD2 3.21Å; A267-F271 WeakPolarHBondContact O-CG 3.43Å; A267-F271 PolarHBondContact O-N 2.99Å; F268-F271 PolarHBondContact O-N 2.61Å |
| 272 | L | 80.7 | Confident | 72.9 | Confident | 150 Ų | 150 | 59.8 Ų | 59.8 | 79% | 0.785 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -72.4 | -30.7 | 177.8 | -67.4 | 176.6 | 0 | 0 | 0 | 112.8 | F268 N274 | F268-L272 WeakPolarHBondContact O-CB 3.31Å; F268-L272 VanDerWaalsContact O-CG 3.31Å; F268-L272 WeakPolarHBondContact O-CG 3.39Å; F268-L272 PolarHBondContact O-N 2.93Å; L272-N274 VanDerWaalsContact C-N 3.26Å; L272-N274 PolarHBondContact O-N 3.39Å |
| 273 | G | 67.1 | Low | 72.2 | Confident | 43 Ų | 43 | 63.1 Ų | 63.1 | 44% | 0.443 | 37% | 0.366 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | S269 P275 | S269-G273 PolarHBondContact O-N 2.75Å; G273-P275 WeakPolarHBondContact O-CD 3.24Å |
| 274 | N | 60.8 | Low | 71.3 | Confident | 7 Ų | 7 | 66.9 Ų | 66.9 | 4% | 0.037 | 39% | 0.388 | C | S | . | . | trans | -86.8 | 103.4 | 176.4 | -100.8 | -43.3 | 0 | 0 | 0 | 110.6 | L118 L272 D276 T277 | L118-N274 WeakPolarHBondContact CD1-OD1 3.21Å; L272-N274 VanDerWaalsContact C-N 3.26Å; L272-N274 PolarHBondContact O-N 3.39Å; N274-D276 PolarHBondContact O-N 3.13Å; N274-T277 PolarHBondContact O-N 2.74Å; N274-T277 PolarHBondContact O-OG1 3.35Å; N274-T277 VanDerWaalsContact O-OG1 3.06Å | ||
| 275 | P | 52.2 | Low | 69.9 | Low | 88 Ų | 88 | 69.6 Ų | 69.6 | 57% | 0.571 | 41% | 0.405 | S | S | * | . | G | 310 helix | trans | -67.1 | -14.9 | 178 | 28.6 | -35.8 | 0 | 0 | 0 | 113.6 | G273 T277 N278 | G273-P275 WeakPolarHBondContact O-CD 3.24Å; P275-T277 PolarHBondContact O-N 3.31Å; P275-T277 VanDerWaalsContact O-N 3.07Å; P275-N278 PolarHBondContact O-N 2.87Å |
| 276 | D | 54.6 | Low | 68.6 | Low | 77 Ų | 77 | 70.4 Ų | 70.4 | 41% | 0.412 | 41% | 0.412 | S | S | . | . | G | 310 helix | trans | -65.4 | -9.7 | 178.9 | -57.6 | -9.2 | 0 | 0 | 0 | 113 | N274 N278 | N274-D276 PolarHBondContact O-N 3.13Å; D276-N278 VanDerWaalsContact C-N 3.3Å |
| 277 | T | 52.1 | Low | 67.3 | Low | 87 Ų | 87 | 75.5 Ų | 75.5 | 53% | 0.534 | 44% | 0.443 | S | S | . | . | G | 310 helix | trans | -82 | -6.8 | 172.6 | 54.1 | 0 | 0 | 0 | 0 | 113.6 | N274 P275 | N274-T277 PolarHBondContact O-N 2.74Å; N274-T277 PolarHBondContact O-OG1 3.35Å; N274-T277 VanDerWaalsContact O-OG1 3.06Å; P275-T277 PolarHBondContact O-N 3.31Å; P275-T277 VanDerWaalsContact O-N 3.07Å |
| 278 | N | 47.4 | Very low | 65.7 | Low | 153 Ų | 153 | 81.8 Ų | 81.8 | 82% | 0.818 | 48% | 0.48 | S | S | * | . | G | 310 helix | trans | -112.8 | 18.7 | 177.1 | -67.5 | -42.7 | 0 | 0 | 0 | 114 | P275 D276 | P275-N278 PolarHBondContact O-N 2.87Å; D276-N278 VanDerWaalsContact C-N 3.3Å |
| 279 | S | 40 | Very low | 63.6 | Low | 153 Ų | 153 | 79.2 Ų | 79.2 | 100% | 1.07 | 48% | 0.479 | S | S | * | . | trans | -137.4 | 0 | 166.9 | 64.8 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 279 of 279 residues in 62 ms
(Link to these results)