| 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 | 57.6 | Low | 61.3 | Low | 208 Ų | 208 | 115.7 Ų | 115.7 | 100% | 1.025 | 56% | 0.558 | S | S | * | * | 0 | -55.3 | 0 | -162.3 | 171.5 | 176.8 | 0 | 0 | 111.7 | V3 R4 C5 | M1-V3 PolarHBondContact O-N 3Å; M1-R4 PolarHBondContact O-N 2.68Å; M1-C5 PolarHBondContact O-N 3.17Å | |||
| 2 | F | 53.9 | Low | 61.1 | Low | 188 Ų | 188 | 107.8 Ų | 107.8 | 83% | 0.825 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -54.3 | -45 | 177.2 | -76.5 | -79.9 | 0 | 0 | 0 | 114.8 | R4 C5 F6 | F2-R4 PolarHBondContact O-N 3.33Å; F2-C5 WeakPolarHBondContact O-CB 3.38Å; F2-C5 PolarHBondContact O-N 2.7Å; F2-C5 VanDerWaalsContact O-N 3.16Å; F2-F6 PolarHBondContact O-N 3.2Å |
| 3 | V | 63.8 | Low | 60.8 | Low | 104 Ų | 104 | 106.8 Ų | 106.8 | 63% | 0.63 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.7 | -41.7 | 178.8 | 177.5 | 0 | 0 | 0 | 0 | 112.1 | M1 C5 F6 H7 | M1-V3 PolarHBondContact O-N 3Å; V3-C5 VanDerWaalsContact C-N 3.34Å; V3-F6 PolarHBondContact O-N 3.01Å; V3-H7 PolarHBondContact O-CD2 3.48Å; V3-H7 PolarHBondContact O-N 2.92Å |
| 4 | R | 57.3 | Low | 60.6 | Low | 202 Ų | 202 | 111 Ų | 111 | 76% | 0.762 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.8 | -40.5 | 174 | -81.6 | -173.6 | 167.4 | -177.2 | -4.4 | 111.6 | M1 F2 F6 H7 I8 | M1-R4 PolarHBondContact O-N 2.68Å; F2-R4 PolarHBondContact O-N 3.33Å; R4-F6 VanDerWaalsContact C-N 3.33Å; R4-H7 PolarHBondContact O-N 2.75Å; R4-I8 WeakPolarHBondContact O-CB 3.5Å; R4-I8 WeakPolarHBondContact O-CD1 3.35Å; R4-I8 WeakPolarHBondContact O-CG1 3.44Å; R4-I8 PolarHBondContact O-N 2.95Å |
| 5 | C | 55.6 | Low | 60.3 | Low | 59 Ų | 59 | 106 Ų | 106 | 40% | 0.399 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 175.7 | -150.2 | 0 | 0 | 0 | 0 | 111 | M1 F2 V3 I8 V9 | M1-C5 PolarHBondContact O-N 3.17Å; F2-C5 WeakPolarHBondContact O-CB 3.38Å; F2-C5 PolarHBondContact O-N 2.7Å; F2-C5 VanDerWaalsContact O-N 3.16Å; V3-C5 VanDerWaalsContact C-N 3.34Å; C5-I8 PolarHBondContact O-N 3.11Å; C5-V9 VanDerWaalsContact O-CG2 3.24Å; C5-V9 WeakPolarHBondContact O-CG2 3.21Å; C5-V9 PolarHBondContact O-N 3.49Å |
| 6 | F | 67.1 | Low | 59.7 | Low | 135 Ų | 135 | 111.1 Ų | 111.1 | 59% | 0.592 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.2 | -44.3 | 175.8 | -172 | -95.7 | 0 | 0 | 0 | 112.1 | F2 V3 R4 I8 V9 T10 | F2-F6 PolarHBondContact O-N 3.2Å; V3-F6 PolarHBondContact O-N 3.01Å; R4-F6 VanDerWaalsContact C-N 3.33Å; F6-I8 PolarHBondContact O-N 3.18Å; F6-V9 WeakPolarHBondContact O-CB 3.29Å; F6-V9 PolarHBondContact O-N 3.46Å; F6-T10 HydrophobicContact CD1-CG2 4.11Å; F6-T10 HydrophobicContact CE1-CG2 3.73Å; F6-T10 HydrophobicContact CZ-CG2 4.09Å; F6-T10 WeakPolarHBondContact O-CG2 3.5Å; F6-T10 PolarHBondContact O-N 3.13Å; F6-T10 PolarHBondContact O-OG1 2.82Å |
| 7 | H | 65.1 | Low | 59.9 | Low | 104 Ų | 104 | 107.5 Ų | 107.5 | 48% | 0.481 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.6 | -44.9 | 175.3 | -92.5 | -81 | 0 | 0 | 0 | 112.5 | V3 R4 V9 T10 E11 | V3-H7 PolarHBondContact O-CD2 3.48Å; V3-H7 PolarHBondContact O-N 2.92Å; R4-H7 PolarHBondContact O-N 2.75Å; H7-V9 VanDerWaalsContact C-N 3.31Å; H7-V9 PolarHBondContact O-N 2.95Å; H7-T10 VanDerWaalsContact CA-OG1 3.31Å; H7-T10 WeakPolarHBondContact CA-OG1 3.12Å; H7-T10 PolarHBondContact O-N 3.27Å; H7-T10 VanDerWaalsContact O-N 3.16Å; H7-T10 PolarHBondContact O-OG1 3.37Å; H7-E11 WeakPolarHBondContact O-CG 3.49Å; H7-E11 PolarHBondContact O-N 3.28Å |
| 8 | I | 63.5 | Low | 60.4 | Low | 61 Ų | 61 | 102.7 Ų | 102.7 | 31% | 0.313 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | 175.6 | -67.6 | 163 | 0 | 0 | 0 | 110.1 | R4 C5 F6 T10 E11 I12 L166 | R4-I8 WeakPolarHBondContact O-CB 3.5Å; R4-I8 WeakPolarHBondContact O-CD1 3.35Å; R4-I8 WeakPolarHBondContact O-CG1 3.44Å; R4-I8 PolarHBondContact O-N 2.95Å; C5-I8 PolarHBondContact O-N 3.11Å; F6-I8 PolarHBondContact O-N 3.18Å; I8-T10 VanDerWaalsContact C-N 3.34Å; I8-T10 PolarHBondContact O-N 2.97Å; I8-E11 PolarHBondContact O-N 2.73Å; I8-I12 HydrophobicContact CG2-CD1 3.7Å; I8-I12 HydrophobicContact CG2-CG1 4.32Å; I8-I12 WeakPolarHBondContact O-CB 3.31Å; I8-I12 WeakPolarHBondContact O-CD1 3.47Å; I8-I12 WeakPolarHBondContact O-CG1 3.42Å; I8-I12 PolarHBondContact O-N 3.32Å; I8-L166 HydrophobicContact CB-CD1 4.33Å; I8-L166 HydrophobicContact CG2-CD1 3.58Å |
| 9 | V | 63.6 | Low | 61.5 | Low | 39 Ų | 39 | 103.5 Ų | 103.5 | 24% | 0.236 | 53% | 0.532 | C | S | . | . | H | α-helix | trans | -60 | -44.9 | 174.8 | 170.4 | 0 | 0 | 0 | 0 | 110.5 | C5 F6 H7 I12 M13 L166 | C5-V9 VanDerWaalsContact O-CG2 3.24Å; C5-V9 WeakPolarHBondContact O-CG2 3.21Å; C5-V9 PolarHBondContact O-N 3.49Å; F6-V9 WeakPolarHBondContact O-CB 3.29Å; F6-V9 PolarHBondContact O-N 3.46Å; H7-V9 VanDerWaalsContact C-N 3.31Å; H7-V9 PolarHBondContact O-N 2.95Å; V9-I12 WeakPolarHBondContact O-CB 3.08Å; V9-I12 PolarHBondContact O-N 3.32Å; V9-M13 HydrophobicContact CG1-SD 4.25Å; V9-M13 WeakPolarHBondContact O-CG 3.14Å; V9-M13 PolarHBondContact O-N 3.44Å; V9-M13 VanDerWaalsContact O-N 3.16Å; V9-L166 HydrophobicContact CG2-CD2 4.09Å |
| 10 | T | 64.5 | Low | 62.6 | Low | 42 Ų | 42 | 100.4 Ų | 100.4 | 26% | 0.258 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.8 | -36.4 | 178.2 | 53 | 0 | 0 | 0 | 0 | 113.3 | F6 H7 I8 M13 Q14 | F6-T10 HydrophobicContact CD1-CG2 4.11Å; F6-T10 HydrophobicContact CE1-CG2 3.73Å; F6-T10 HydrophobicContact CZ-CG2 4.09Å; F6-T10 WeakPolarHBondContact O-CG2 3.5Å; F6-T10 PolarHBondContact O-N 3.13Å; F6-T10 PolarHBondContact O-OG1 2.82Å; H7-T10 VanDerWaalsContact CA-OG1 3.31Å; H7-T10 WeakPolarHBondContact CA-OG1 3.12Å; H7-T10 PolarHBondContact O-N 3.27Å; H7-T10 VanDerWaalsContact O-N 3.16Å; H7-T10 PolarHBondContact O-OG1 3.37Å; I8-T10 VanDerWaalsContact C-N 3.34Å; I8-T10 PolarHBondContact O-N 2.97Å; T10-M13 WeakPolarHBondContact O-CB 3.22Å; T10-M13 PolarHBondContact O-N 3.35Å; T10-M13 VanDerWaalsContact O-N 3.11Å; T10-Q14 WeakPolarHBondContact O-CG 3.37Å |
| 11 | E | 62.5 | Low | 63.7 | Low | 131 Ų | 131 | 95.6 Ų | 95.6 | 61% | 0.612 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66 | -41.7 | 175.3 | -76.5 | 178 | 178 | 0 | 0 | 111.1 | H7 I8 M13 Q14 | H7-E11 WeakPolarHBondContact O-CG 3.49Å; H7-E11 PolarHBondContact O-N 3.28Å; I8-E11 PolarHBondContact O-N 2.73Å; E11-M13 PolarHBondContact O-N 2.85Å; E11-Q14 PolarHBondContact O-N 3.16Å |
| 12 | I | 58.2 | Low | 65.1 | Low | 20 Ų | 20 | 87 Ų | 87 | 10% | 0.103 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -58.8 | -27.6 | 172.6 | -71.1 | 168.4 | 0 | 0 | 0 | 111.3 | I8 V9 T18 F160 H163 L166 | I8-I12 HydrophobicContact CG2-CD1 3.7Å; I8-I12 HydrophobicContact CG2-CG1 4.32Å; I8-I12 WeakPolarHBondContact O-CB 3.31Å; I8-I12 WeakPolarHBondContact O-CD1 3.47Å; I8-I12 WeakPolarHBondContact O-CG1 3.42Å; I8-I12 PolarHBondContact O-N 3.32Å; V9-I12 WeakPolarHBondContact O-CB 3.08Å; V9-I12 PolarHBondContact O-N 3.32Å; I12-T18 WeakPolarHBondContact O-CG2 3.35Å; I12-F160 HydrophobicContact CG2-CD1 3.47Å; I12-F160 VanDerWaalsContact CG2-CD1 3.47Å; I12-F160 HydrophobicContact CG2-CD2 4.31Å; I12-F160 HydrophobicContact CG2-CE1 3.28Å; I12-F160 HydrophobicContact CG2-CE2 4.14Å; I12-F160 HydrophobicContact CG2-CG 3.98Å; I12-F160 HydrophobicContact CG2-CZ 3.63Å; I12-F160 WeakPolarHBondContact O-CE1 3.48Å; I12-H163 HydrophobicContact CD1-CB 3.86Å; I12-L166 HydrophobicContact CD1-CD1 4.43Å; I12-L166 HydrophobicContact CD1-CD2 4.02Å |
| 13 | M | 58.3 | Low | 66.8 | Low | 96 Ų | 96 | 83 Ų | 83 | 47% | 0.473 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | -10.8 | -178.8 | -67.7 | -177.1 | 79 | 0 | 0 | 114.7 | V9 T10 E11 T18 C22 | V9-M13 HydrophobicContact CG1-SD 4.25Å; V9-M13 WeakPolarHBondContact O-CG 3.14Å; V9-M13 PolarHBondContact O-N 3.44Å; V9-M13 VanDerWaalsContact O-N 3.16Å; T10-M13 WeakPolarHBondContact O-CB 3.22Å; T10-M13 PolarHBondContact O-N 3.35Å; T10-M13 VanDerWaalsContact O-N 3.11Å; E11-M13 PolarHBondContact O-N 2.85Å; M13-T18 WeakPolarHBondContact O-CB 3.49Å; M13-T18 PolarHBondContact O-OG1 3.16Å; M13-C22 HydrophobicContact CE-CB 4.33Å; M13-C22 VanDerWaalsContact CG-SG 3.6Å |
| 14 | Q | 57.5 | Low | 68 | Low | 165 Ų | 165 | 78 Ų | 78 | 77% | 0.771 | 41% | 0.41 | S | S | * | . | S | Bend | trans | -96.1 | 1.1 | -166.9 | -79.4 | -179.3 | -23.5 | 0 | 0 | 117.5 | T10 E11 | T10-Q14 WeakPolarHBondContact O-CG 3.37Å; E11-Q14 PolarHBondContact O-N 3.16Å |
| 15 | G | 55.4 | Low | 69.6 | Low | 36 Ų | 36 | 69 Ų | 69 | 37% | 0.371 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -90.3 | 153.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | G17 T18 | G15-G17 PolarHBondContact O-N 2.81Å; G15-T18 PolarHBondContact N-OG1 3.45Å; G15-T18 VanDerWaalsContact O-CB 3.29Å; G15-T18 WeakPolarHBondContact O-CB 3.44Å; G15-T18 WeakPolarHBondContact O-CG2 3.36Å; G15-T18 PolarHBondContact O-N 3.37Å; G15-T18 PolarHBondContact O-OG1 2.91Å |
| 16 | D | 51.2 | Low | 71.4 | Confident | 187 Ų | 187 | 70 Ų | 70 | 100% | 1 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | 107.3 | 177.2 | -72.8 | -37.2 | 0 | 0 | 0 | 111.5 | ||
| 17 | G | 62.9 | Low | 72.5 | Confident | 51 Ų | 51 | 63.6 Ų | 63.6 | 53% | 0.526 | 35% | 0.35 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 111.2 | -8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | G15 I19 | G15-G17 PolarHBondContact O-N 2.81Å; G17-I19 PolarHBondContact O-N 2.84Å |
| 18 | T | 69.8 | Low | 73.8 | Confident | 20 Ų | 20 | 58.7 Ų | 58.7 | 12% | 0.123 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -66.6 | -33.4 | 179.6 | 55.1 | 0 | 0 | 0 | 0 | 112.8 | I12 M13 G15 A20 G21 C22 F160 | I12-T18 WeakPolarHBondContact O-CG2 3.35Å; M13-T18 WeakPolarHBondContact O-CB 3.49Å; M13-T18 PolarHBondContact O-OG1 3.16Å; G15-T18 PolarHBondContact N-OG1 3.45Å; G15-T18 VanDerWaalsContact O-CB 3.29Å; G15-T18 WeakPolarHBondContact O-CB 3.44Å; G15-T18 WeakPolarHBondContact O-CG2 3.36Å; G15-T18 PolarHBondContact O-N 3.37Å; G15-T18 PolarHBondContact O-OG1 2.91Å; T18-A20 VanDerWaalsContact C-N 3.29Å; T18-A20 PolarHBondContact O-N 3.37Å; T18-G21 CarbonylContact O-C 3.47Å; T18-G21 WeakPolarHBondContact O-CA 3.46Å; T18-G21 PolarHBondContact O-N 2.87Å; T18-C22 PolarHBondContact O-N 3.35Å; T18-C22 PolarHBondContact O-SG 3.45Å; T18-F160 HydrophobicContact CG2-CE1 4.23Å |
| 19 | I | 81.4 | Confident | 75.3 | Confident | 119 Ų | 119 | 57.9 Ų | 57.9 | 61% | 0.61 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -55.8 | -46 | -177.9 | -62.4 | 174.5 | 0 | 0 | 0 | 111 | G17 G21 C22 F23 | G17-I19 PolarHBondContact O-N 2.84Å; I19-G21 VanDerWaalsContact C-N 3.33Å; I19-G21 PolarHBondContact O-N 3.41Å; I19-C22 PolarHBondContact O-N 3.14Å; I19-F23 HydrophobicContact CG2-CD2 3.71Å; I19-F23 HydrophobicContact CG2-CE2 3.38Å; I19-F23 HydrophobicContact CG2-CZ 4.45Å; I19-F23 WeakPolarHBondContact O-CD2 3.45Å; I19-F23 PolarHBondContact O-N 3.41Å |
| 20 | A | 82.6 | Confident | 76.7 | Confident | 40 Ų | 40 | 57.7 Ų | 57.7 | 33% | 0.331 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.2 | -37.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | T18 S24 W159 | T18-A20 VanDerWaalsContact C-N 3.29Å; T18-A20 PolarHBondContact O-N 3.37Å; A20-S24 WeakPolarHBondContact O-CB 3.43Å; A20-S24 PolarHBondContact O-N 3.38Å; A20-W159 HydrophobicContact CB-CH2 3.52Å; A20-W159 HydrophobicContact CB-CZ2 4.25Å; A20-W159 HydrophobicContact CB-CZ3 3.94Å |
| 21 | G | 85.2 | Confident | 77.9 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T18 I19 S24 V25 | T18-G21 CarbonylContact O-C 3.47Å; T18-G21 WeakPolarHBondContact O-CA 3.46Å; T18-G21 PolarHBondContact O-N 2.87Å; I19-G21 VanDerWaalsContact C-N 3.33Å; I19-G21 PolarHBondContact O-N 3.41Å; G21-S24 WeakPolarHBondContact O-CB 3.41Å; G21-S24 PolarHBondContact O-N 2.69Å; G21-S24 VanDerWaalsContact O-N 3.14Å; G21-V25 WeakPolarHBondContact O-CG2 3.29Å; G21-V25 PolarHBondContact O-N 3.26Å |
| 22 | C | 86.9 | Confident | 79.4 | Confident | 28 Ų | 28 | 49.5 Ų | 49.5 | 19% | 0.189 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -63 | -44 | 175.8 | -61.4 | 0 | 0 | 0 | 0 | 111.4 | M13 T18 I19 S24 V25 L26 | M13-C22 HydrophobicContact CE-CB 4.33Å; M13-C22 VanDerWaalsContact CG-SG 3.6Å; T18-C22 PolarHBondContact O-N 3.35Å; T18-C22 PolarHBondContact O-SG 3.45Å; I19-C22 PolarHBondContact O-N 3.14Å; C22-S24 VanDerWaalsContact C-N 3.3Å; C22-S24 PolarHBondContact O-N 3.25Å; C22-V25 PolarHBondContact O-N 3.05Å; C22-L26 WeakPolarHBondContact O-CB 3.27Å; C22-L26 PolarHBondContact O-N 2.83Å |
| 23 | F | 89.8 | Confident | 81 | Confident | 104 Ų | 104 | 49.7 Ų | 49.7 | 46% | 0.456 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -60.5 | -40.6 | 172 | -77.1 | -57.6 | 0 | 0 | 0 | 111.6 | I19 L26 G27 L234 | I19-F23 HydrophobicContact CG2-CD2 3.71Å; I19-F23 HydrophobicContact CG2-CE2 3.38Å; I19-F23 HydrophobicContact CG2-CZ 4.45Å; I19-F23 WeakPolarHBondContact O-CD2 3.45Å; I19-F23 PolarHBondContact O-N 3.41Å; F23-L26 PolarHBondContact O-N 3.1Å; F23-G27 PolarHBondContact O-N 3.38Å; F23-L234 HydrophobicContact CB-CD2 4.21Å; F23-L234 HydrophobicContact CD1-CD2 3.77Å; F23-L234 HydrophobicContact CG-CD2 4.27Å; F23-L234 WeakPolarHBondContact O-CB 3.3Å |
| 24 | S | 89.2 | Confident | 82.5 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -63.9 | -45.5 | 176.3 | -169.6 | 0 | 0 | 0 | 0 | 112.4 | A20 G21 C22 L26 G27 G28 W159 L234 L235 R236 | A20-S24 WeakPolarHBondContact O-CB 3.43Å; A20-S24 PolarHBondContact O-N 3.38Å; G21-S24 WeakPolarHBondContact O-CB 3.41Å; G21-S24 PolarHBondContact O-N 2.69Å; G21-S24 VanDerWaalsContact O-N 3.14Å; C22-S24 VanDerWaalsContact C-N 3.3Å; C22-S24 PolarHBondContact O-N 3.25Å; S24-L26 VanDerWaalsContact C-N 3.33Å; S24-L26 PolarHBondContact O-N 2.67Å; S24-G27 WeakPolarHBondContact O-CA 3.4Å; S24-G27 PolarHBondContact O-N 3Å; S24-G27 VanDerWaalsContact O-N 3.13Å; S24-G28 PolarHBondContact O-N 3.03Å; S24-W159 VanDerWaalsContact CB-NE1 3.35Å; S24-W159 PolarHBondContact OG-NE1 2.69Å; S24-L234 WeakPolarHBondContact CA-O 3.35Å; S24-L235 VanDerWaalsContact O-CD1 3.31Å; S24-L235 WeakPolarHBondContact O-CD1 3.26Å; S24-R236 WeakPolarHBondContact CB-O 3.31Å; S24-R236 PolarHBondContact OG-N 3.39Å; S24-R236 PolarHBondContact OG-O 3.28Å |
| 25 | V | 91.7 | Very high | 84.1 | Confident | 12 Ų | 12 | 37.2 Ų | 37.2 | 7% | 0.073 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.4 | -42.1 | 175.6 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | G21 C22 G27 G28 Y29 F160 V167 L170 V171 | G21-V25 WeakPolarHBondContact O-CG2 3.29Å; G21-V25 PolarHBondContact O-N 3.26Å; C22-V25 PolarHBondContact O-N 3.05Å; V25-G27 VanDerWaalsContact C-N 3.34Å; V25-G28 PolarHBondContact O-N 3.29Å; V25-Y29 WeakPolarHBondContact O-CB 3.46Å; V25-Y29 PolarHBondContact O-N 2.85Å; V25-F160 HydrophobicContact CG2-CD2 4.09Å; V25-F160 HydrophobicContact CG2-CE2 3.84Å; V25-V167 HydrophobicContact CG1-CG1 4.31Å; V25-V167 HydrophobicContact CG2-CG1 3.6Å; V25-V167 HydrophobicContact CG2-CG2 4.47Å; V25-L170 HydrophobicContact CG1-CD1 4.38Å; V25-L170 HydrophobicContact CG1-CD2 3.69Å; V25-V171 HydrophobicContact CG1-CG2 4.18Å |
| 26 | L | 93 | Very high | 85.7 | Confident | 81 Ų | 81 | 35.5 Ų | 35.5 | 42% | 0.424 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -62.7 | -41 | 173.5 | -179.6 | 62.4 | 0 | 0 | 0 | 111.6 | C22 F23 S24 Y29 L30 L234 | C22-L26 WeakPolarHBondContact O-CB 3.27Å; C22-L26 PolarHBondContact O-N 2.83Å; F23-L26 PolarHBondContact O-N 3.1Å; S24-L26 VanDerWaalsContact C-N 3.33Å; S24-L26 PolarHBondContact O-N 2.67Å; L26-Y29 WeakPolarHBondContact O-CB 3.46Å; L26-Y29 PolarHBondContact O-N 3.06Å; L26-L30 HydrophobicContact CG-CD1 4.49Å; L26-L30 WeakPolarHBondContact O-CG 3.29Å; L26-L30 PolarHBondContact O-N 3.22Å; L26-L234 HydrophobicContact CD2-CD1 4.15Å; L26-L234 HydrophobicContact CG-CD1 4.22Å |
| 27 | G | 90.9 | Very high | 87.5 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | F23 S24 V25 L30 I31 G231 | F23-G27 PolarHBondContact O-N 3.38Å; S24-G27 WeakPolarHBondContact O-CA 3.4Å; S24-G27 PolarHBondContact O-N 3Å; S24-G27 VanDerWaalsContact O-N 3.13Å; V25-G27 VanDerWaalsContact C-N 3.34Å; G27-L30 PolarHBondContact O-N 2.89Å; G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.3Å; G27-G231 WeakPolarHBondContact CA-O 3.21Å |
| 28 | G | 91.7 | Very high | 88.8 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -62.1 | -41.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S24 V25 I31 H32 | S24-G28 PolarHBondContact O-N 3.03Å; V25-G28 PolarHBondContact O-N 3.29Å; G28-I31 PolarHBondContact O-N 3.29Å; G28-H32 WeakPolarHBondContact O-CB 3.36Å; G28-H32 PolarHBondContact O-N 3.21Å; G28-H32 PolarHBondContact O-ND1 2.86Å |
| 29 | Y | 94.6 | Very high | 89.7 | Confident | 45 Ų | 45 | 28.6 Ų | 28.6 | 18% | 0.176 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -60.1 | -47 | 175.1 | -179.9 | -89.3 | 0 | 0 | 0 | 111.9 | V25 L26 I31 H32 L33 L170 G174 M177 | V25-Y29 WeakPolarHBondContact O-CB 3.46Å; V25-Y29 PolarHBondContact O-N 2.85Å; L26-Y29 WeakPolarHBondContact O-CB 3.46Å; L26-Y29 PolarHBondContact O-N 3.06Å; Y29-I31 PolarHBondContact O-N 2.99Å; Y29-H32 PolarHBondContact O-N 3Å; Y29-L33 WeakPolarHBondContact O-CB 3.48Å; Y29-L33 PolarHBondContact O-N 3.45Å; Y29-L170 HydrophobicContact CD2-CD2 3.92Å; Y29-L170 VanDerWaalsContact CD2-O 3.29Å; Y29-L170 WeakPolarHBondContact CD2-O 3.49Å; Y29-L170 HydrophobicContact CG-CD2 4.47Å; Y29-G174 VanDerWaalsContact CE2-N 3.27Å; Y29-M177 WeakPolarHBondContact OH-CE 3.38Å |
| 30 | L | 92.7 | Very high | 89.9 | Confident | 35 Ų | 35 | 22.9 Ų | 22.9 | 18% | 0.183 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -64.2 | -39.8 | 178.8 | -70.4 | 175.5 | 0 | 0 | 0 | 112.2 | L26 G27 L33 S34 T227 I230 L234 | L26-L30 HydrophobicContact CG-CD1 4.49Å; L26-L30 WeakPolarHBondContact O-CG 3.29Å; L26-L30 PolarHBondContact O-N 3.22Å; G27-L30 PolarHBondContact O-N 2.89Å; L30-L33 HydrophobicContact CD2-CD2 4.43Å; L30-L33 WeakPolarHBondContact O-CB 3.24Å; L30-L33 PolarHBondContact O-N 3.5Å; L30-S34 PolarHBondContact O-N 2.85Å; L30-S34 PolarHBondContact O-OG 2.93Å; L30-T227 HydrophobicContact CB-CG2 4.04Å; L30-T227 HydrophobicContact CD2-CG2 4.14Å; L30-T227 WeakPolarHBondContact O-CG2 3.43Å; L30-I230 HydrophobicContact CD1-CB 4.44Å; L30-I230 HydrophobicContact CD1-CG2 3.72Å; L30-L234 HydrophobicContact CD1-CD1 4.02Å |
| 31 | I | 90.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.1 | -45.5 | 174.8 | -69.2 | 172.5 | 0 | 0 | 0 | 110.5 | G27 G28 Y29 L33 S34 Y35 L96 T152 L235 | G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.3Å; G28-I31 PolarHBondContact O-N 3.29Å; Y29-I31 PolarHBondContact O-N 2.99Å; I31-L33 VanDerWaalsContact C-N 3.35Å; I31-S34 WeakPolarHBondContact O-CB 3.19Å; I31-S34 PolarHBondContact O-N 2.89Å; I31-Y35 HydrophobicContact CG2-CD2 4.15Å; I31-Y35 HydrophobicContact CG2-CE1 3.96Å; I31-Y35 HydrophobicContact CG2-CE2 3.45Å; I31-Y35 VanDerWaalsContact CG2-CE2 3.45Å; I31-Y35 VanDerWaalsContact CG2-OH 3.28Å; I31-Y35 WeakPolarHBondContact CG2-OH 3.27Å; I31-Y35 PolarHBondContact O-N 3.37Å; I31-L96 HydrophobicContact CD1-CD1 4.28Å; I31-L96 HydrophobicContact CD1-CD2 3.8Å; I31-L96 HydrophobicContact CD1-CG 4.31Å; I31-L96 HydrophobicContact CG2-CD1 4.42Å; I31-T152 HydrophobicContact CB-CG2 4.2Å; I31-T152 HydrophobicContact CD1-CG2 4.33Å; I31-T152 HydrophobicContact CG2-CG2 4.1Å; I31-L235 HydrophobicContact CD1-CB 4.48Å; I31-L235 HydrophobicContact CD1-CD2 4.3Å |
| 32 | H | 93 | Very high | 90.1 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -66.3 | -36.2 | 176.6 | -86.3 | 67.4 | 0 | 0 | 0 | 112.5 | G28 Y29 S34 Y35 G36 F149 L153 V171 Y175 | G28-H32 WeakPolarHBondContact O-CB 3.36Å; G28-H32 PolarHBondContact O-N 3.21Å; G28-H32 PolarHBondContact O-ND1 2.86Å; Y29-H32 PolarHBondContact O-N 3Å; H32-S34 VanDerWaalsContact C-N 3.31Å; H32-S34 PolarHBondContact O-N 3.39Å; H32-Y35 PolarHBondContact O-N 3.07Å; H32-Y35 VanDerWaalsContact O-N 3.14Å; H32-G36 PolarHBondContact O-N 3.45Å; H32-F149 AromaticContact CD2-CE2 3.69Å; H32-F149 AromaticContact NE2-CD2 3.62Å; H32-F149 AromaticContact NE2-CE2 3.5Å; H32-F149 AromaticContact NE2-CZ 3.93Å; H32-L153 WeakPolarHBondContact NE2-CG 3.41Å; H32-V171 HydrophobicContact CB-CG1 4.16Å; H32-V171 VanDerWaalsContact CB-O 3.22Å; H32-V171 WeakPolarHBondContact CB-O 3.19Å; H32-V171 VanDerWaalsContact ND1-CG1 3.28Å; H32-V171 WeakPolarHBondContact ND1-CG1 3.46Å; H32-Y175 VanDerWaalsContact O-CA 3.24Å; H32-Y175 WeakPolarHBondContact O-CA 3.27Å |
| 33 | L | 92.7 | Very high | 90.1 | Very high | 24 Ų | 24 | 26.4 Ų | 26.4 | 13% | 0.126 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -55.2 | -49.7 | 171.9 | -175.1 | 71.6 | 0 | 0 | 0 | 110.1 | Y29 L30 I31 Y35 G36 G174 M177 V181 F182 | Y29-L33 WeakPolarHBondContact O-CB 3.48Å; Y29-L33 PolarHBondContact O-N 3.45Å; L30-L33 HydrophobicContact CD2-CD2 4.43Å; L30-L33 WeakPolarHBondContact O-CB 3.24Å; L30-L33 PolarHBondContact O-N 3.5Å; I31-L33 VanDerWaalsContact C-N 3.35Å; L33-Y35 PolarHBondContact O-N 3.02Å; L33-G36 WeakPolarHBondContact O-CA 3.43Å; L33-G36 PolarHBondContact O-N 3.1Å; L33-G36 VanDerWaalsContact O-N 3.08Å; L33-G174 WeakPolarHBondContact CA-O 3.37Å; L33-G174 WeakPolarHBondContact CD1-O 3.41Å; L33-M177 HydrophobicContact CD1-CB 3.87Å; L33-M177 HydrophobicContact CD1-CG 4.16Å; L33-V181 HydrophobicContact CD1-CG2 4.37Å; L33-F182 WeakPolarHBondContact O-CE2 3.14Å |
| 34 | S | 90.1 | Very high | 90 | Very high | 0 Ų | 0 | 21.5 Ų | 21.5 | 0% | 0 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -61.7 | -39.9 | 174.7 | -65.3 | 0 | 0 | 0 | 0 | 113.1 | L30 I31 H32 G36 Y37 T227 | L30-S34 PolarHBondContact O-N 2.85Å; L30-S34 PolarHBondContact O-OG 2.93Å; I31-S34 WeakPolarHBondContact O-CB 3.19Å; I31-S34 PolarHBondContact O-N 2.89Å; H32-S34 VanDerWaalsContact C-N 3.31Å; H32-S34 PolarHBondContact O-N 3.39Å; S34-G36 PolarHBondContact O-N 3.31Å; S34-Y37 WeakPolarHBondContact O-CB 3.44Å; S34-Y37 PolarHBondContact O-N 2.92Å; S34-T227 WeakPolarHBondContact OG-CB 3.45Å; S34-T227 VanDerWaalsContact OG-CG2 3.32Å; S34-T227 WeakPolarHBondContact OG-CG2 3.49Å |
| 35 | Y | 90.6 | Very high | 90 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.8 | -31.3 | 174.3 | -63.7 | -18.7 | 0 | 0 | 0 | 112.1 | I31 H32 L33 Y37 L38 S99 L103 V145 G148 F149 Y175 | I31-Y35 HydrophobicContact CG2-CD2 4.15Å; I31-Y35 HydrophobicContact CG2-CE1 3.96Å; I31-Y35 HydrophobicContact CG2-CE2 3.45Å; I31-Y35 VanDerWaalsContact CG2-CE2 3.45Å; I31-Y35 VanDerWaalsContact CG2-OH 3.28Å; I31-Y35 WeakPolarHBondContact CG2-OH 3.27Å; I31-Y35 PolarHBondContact O-N 3.37Å; H32-Y35 PolarHBondContact O-N 3.07Å; H32-Y35 VanDerWaalsContact O-N 3.14Å; L33-Y35 PolarHBondContact O-N 3.02Å; Y35-Y37 PolarHBondContact O-N 3.36Å; Y35-L38 VanDerWaalsContact O-CB 3.32Å; Y35-L38 WeakPolarHBondContact O-CB 3.48Å; Y35-L38 PolarHBondContact O-N 3.16Å; Y35-S99 PolarHBondContact OH-OG 3.06Å; Y35-L103 HydrophobicContact CD1-CD1 3.9Å; Y35-L103 HydrophobicContact CE1-CD1 3.48Å; Y35-L103 VanDerWaalsContact CE1-CD1 3.48Å; Y35-V145 HydrophobicContact CD1-CB 4.42Å; Y35-V145 HydrophobicContact CD1-CG1 4.47Å; Y35-V145 HydrophobicContact CD1-CG2 3.81Å; Y35-V145 HydrophobicContact CD2-CG1 4.31Å; Y35-V145 HydrophobicContact CG-CB 4.49Å; Y35-V145 HydrophobicContact CG-CG1 4.05Å; Y35-V145 HydrophobicContact CG-CG2 4.1Å; Y35-G148 WeakPolarHBondContact OH-CA 3.37Å; Y35-F149 HydrophobicContact CD2-CD2 4.23Å; Y35-F149 HydrophobicContact CE2-CB 4.48Å; Y35-Y175 VanDerWaalsContact C-CD2 3.47Å; Y35-Y175 VanDerWaalsContact O-CE2 3.28Å; Y35-Y175 WeakPolarHBondContact O-CE2 3.42Å |
| 36 | G | 89.2 | Confident | 89.8 | Confident | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -13.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | H32 L33 S34 L38 Y39 Y175 | H32-G36 PolarHBondContact O-N 3.45Å; L33-G36 WeakPolarHBondContact O-CA 3.43Å; L33-G36 PolarHBondContact O-N 3.1Å; L33-G36 VanDerWaalsContact O-N 3.08Å; S34-G36 PolarHBondContact O-N 3.31Å; G36-L38 PolarHBondContact O-N 3.13Å; G36-L38 VanDerWaalsContact O-N 3.11Å; G36-Y39 PolarHBondContact O-N 3.31Å; G36-Y39 VanDerWaalsContact O-N 3.1Å; G36-Y175 WeakPolarHBondContact CA-O 3.45Å; G36-Y175 VanDerWaalsContact N-CD2 3.27Å |
| 37 | Y | 89.3 | Confident | 89.6 | Confident | 3 Ų | 3 | 20.5 Ų | 20.5 | 1% | 0.012 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -50 | -30.1 | 163.8 | -178.6 | -95 | 0 | 0 | 0 | 112.6 | S34 Y35 Y39 S40 L41 Y137 F141 F182 Q186 I220 L224 | S34-Y37 WeakPolarHBondContact O-CB 3.44Å; S34-Y37 PolarHBondContact O-N 2.92Å; Y35-Y37 PolarHBondContact O-N 3.36Å; Y37-Y39 PolarHBondContact O-N 3.27Å; Y37-Y39 VanDerWaalsContact O-N 3.11Å; Y37-S40 VanDerWaalsContact CD2-OG 3.28Å; Y37-S40 WeakPolarHBondContact CD2-OG 3.4Å; Y37-S40 WeakPolarHBondContact CE2-OG 3.38Å; Y37-S40 WeakPolarHBondContact O-CA 3.5Å; Y37-S40 WeakPolarHBondContact O-CB 3.32Å; Y37-S40 PolarHBondContact O-N 2.98Å; Y37-S40 PolarHBondContact O-OG 3.33Å; Y37-L41 PolarHBondContact O-N 2.86Å; Y37-Y137 HydrophobicContact CE1-CE2 4.03Å; Y37-Y137 PolarHBondContact OH-OH 3.3Å; Y37-F141 HydrophobicContact CD1-CD2 4.13Å; Y37-F141 AromaticContact CD1-CE2 3.39Å; Y37-F141 HydrophobicContact CD1-CE2 3.39Å; Y37-F141 AromaticContact CD1-CZ 3.65Å; Y37-F141 HydrophobicContact CD1-CZ 3.65Å; Y37-F141 HydrophobicContact CE1-CE2 4.23Å; Y37-F141 HydrophobicContact CG-CE2 4.18Å; Y37-F141 HydrophobicContact CG-CZ 4.3Å; Y37-F182 HydrophobicContact CD2-CB 4.05Å; Y37-F182 HydrophobicContact CD2-CD1 4.34Å; Y37-F182 HydrophobicContact CD2-CD2 4.17Å; Y37-F182 AromaticContact CD2-CG 3.93Å; Y37-F182 HydrophobicContact CD2-CG 3.93Å; Y37-Q186 PolarHBondContact OH-NE2 2.74Å; Y37-I220 HydrophobicContact CD2-CG2 3.9Å; Y37-I220 HydrophobicContact CE2-CB 4.47Å; Y37-I220 HydrophobicContact CE2-CG2 3.18Å; Y37-L224 HydrophobicContact CD1-CD1 4.15Å; Y37-L224 HydrophobicContact CD2-CD1 3.85Å; Y37-L224 HydrophobicContact CD2-CD2 4.22Å; Y37-L224 HydrophobicContact CD2-CG 4.47Å; Y37-L224 HydrophobicContact CE2-CD1 4.24Å; Y37-L224 HydrophobicContact CG-CD1 3.79Å; Y37-L224 HydrophobicContact CG-CD2 4.21Å |
| 38 | L | 89.1 | Confident | 89.5 | Confident | 5 Ų | 5 | 20.5 Ų | 20.5 | 3% | 0.026 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -48.7 | -42 | 176.3 | -176.1 | 56.4 | 0 | 0 | 0 | 112.3 | Y35 G36 S40 L41 T72 F73 Y76 F141 Y175 | Y35-L38 VanDerWaalsContact O-CB 3.32Å; Y35-L38 WeakPolarHBondContact O-CB 3.48Å; Y35-L38 PolarHBondContact O-N 3.16Å; G36-L38 PolarHBondContact O-N 3.13Å; G36-L38 VanDerWaalsContact O-N 3.11Å; L38-S40 VanDerWaalsContact C-N 3.27Å; L38-S40 PolarHBondContact O-N 3.42Å; L38-L41 HydrophobicContact CD1-CD2 4.37Å; L38-L41 WeakPolarHBondContact O-CB 3.3Å; L38-L41 PolarHBondContact O-N 3.44Å; L38-L41 VanDerWaalsContact O-N 3.15Å; L38-T72 HydrophobicContact CD1-CG2 3.18Å; L38-F73 HydrophobicContact CD2-CD1 4.13Å; L38-F73 HydrophobicContact CD2-CE1 3.48Å; L38-F73 VanDerWaalsContact CD2-CE1 3.48Å; L38-F73 HydrophobicContact CD2-CZ 3.96Å; L38-F73 HydrophobicContact CG-CE1 4.26Å; L38-F73 HydrophobicContact CG-CZ 4.24Å; L38-Y76 HydrophobicContact CD2-CD1 4.44Å; L38-F141 HydrophobicContact CB-CE1 3.69Å; L38-F141 HydrophobicContact CB-CZ 4.25Å; L38-F141 HydrophobicContact CD1-CD1 3.98Å; L38-F141 HydrophobicContact CD1-CE1 3.7Å; L38-F141 HydrophobicContact CG-CE1 4.24Å; L38-Y175 WeakPolarHBondContact CD2-OH 3.31Å |
| 39 | Y | 88.4 | Confident | 89.3 | Confident | 104 Ų | 104 | 20.5 Ų | 20.5 | 41% | 0.408 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -73 | -22 | -177.9 | -70 | -54.1 | 0 | 0 | 0 | 113.1 | G36 Y37 L41 T42 Y175 | G36-Y39 PolarHBondContact O-N 3.31Å; G36-Y39 VanDerWaalsContact O-N 3.1Å; Y37-Y39 PolarHBondContact O-N 3.27Å; Y37-Y39 VanDerWaalsContact O-N 3.11Å; Y39-L41 PolarHBondContact O-N 3.28Å; Y39-T42 PolarHBondContact O-OG1 3.02Å; Y39-T42 VanDerWaalsContact O-OG1 3.1Å; Y39-Y175 HydrophobicContact CD2-CD1 4.47Å; Y39-Y175 HydrophobicContact CD2-CE1 4.21Å; Y39-Y175 AromaticContact CE2-CD1 3.51Å; Y39-Y175 HydrophobicContact CE2-CD1 3.51Å; Y39-Y175 AromaticContact CE2-CE1 3.21Å; Y39-Y175 HydrophobicContact CE2-CE1 3.21Å; Y39-Y175 HydrophobicContact CE2-CG 4.32Å; Y39-Y175 AromaticContact CE2-CZ 3.81Å; Y39-Y175 AromaticContact CZ-CE1 3.47Å; Y39-Y175 VanDerWaalsContact CZ-CE1 3.47Å; Y39-Y175 VanDerWaalsContact OH-CE1 3.27Å; Y39-Y175 WeakPolarHBondContact OH-CE1 3.45Å |
| 40 | S | 86.9 | Confident | 89 | Confident | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -77.3 | -9.3 | 172.5 | 79.1 | 0 | 0 | 0 | 0 | 112.9 | Y37 L38 T42 N43 M44 Q186 | Y37-S40 VanDerWaalsContact CD2-OG 3.28Å; Y37-S40 WeakPolarHBondContact CD2-OG 3.4Å; Y37-S40 WeakPolarHBondContact CE2-OG 3.38Å; Y37-S40 WeakPolarHBondContact O-CA 3.5Å; Y37-S40 WeakPolarHBondContact O-CB 3.32Å; Y37-S40 PolarHBondContact O-N 2.98Å; Y37-S40 PolarHBondContact O-OG 3.33Å; L38-S40 VanDerWaalsContact C-N 3.27Å; L38-S40 PolarHBondContact O-N 3.42Å; S40-T42 PolarHBondContact O-N 3.36Å; S40-N43 WeakPolarHBondContact O-CB 3.34Å; S40-N43 PolarHBondContact O-N 3.41Å; S40-M44 PolarHBondContact O-N 3.31Å; S40-Q186 PolarHBondContact OG-NE2 3.31Å |
| 41 | L | 85.9 | Confident | 88.7 | Confident | 6 Ų | 6 | 17.6 Ų | 17.6 | 3% | 0.031 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -51.7 | -42 | 174.3 | 178.1 | 58.6 | 0 | 0 | 0 | 111.5 | Y37 L38 Y39 N43 M44 V45 F68 Y137 | Y37-L41 PolarHBondContact O-N 2.86Å; L38-L41 HydrophobicContact CD1-CD2 4.37Å; L38-L41 WeakPolarHBondContact O-CB 3.3Å; L38-L41 PolarHBondContact O-N 3.44Å; L38-L41 VanDerWaalsContact O-N 3.15Å; Y39-L41 PolarHBondContact O-N 3.28Å; L41-N43 VanDerWaalsContact C-N 3.26Å; L41-N43 PolarHBondContact O-N 3.49Å; L41-M44 PolarHBondContact O-N 3.47Å; L41-V45 HydrophobicContact CD1-CG2 4.15Å; L41-V45 HydrophobicContact CG-CG2 4.25Å; L41-V45 VanDerWaalsContact O-CG2 3.26Å; L41-V45 WeakPolarHBondContact O-CG2 3.35Å; L41-V45 PolarHBondContact O-N 2.87Å; L41-F68 HydrophobicContact CD1-CB 4.45Å; L41-Y137 HydrophobicContact CD1-CD1 3.71Å; L41-Y137 HydrophobicContact CD1-CE1 3.03Å |
| 42 | T | 85.9 | Confident | 88.6 | Confident | 95 Ų | 95 | 17.6 Ų | 17.6 | 58% | 0.583 | 9% | 0.091 | S | C | * | . | H | α-helix | trans | -64.8 | -29.6 | -179.5 | 58.2 | 0 | 0 | 0 | 0 | 113 | Y39 S40 P46 | Y39-T42 PolarHBondContact O-OG1 3.02Å; Y39-T42 VanDerWaalsContact O-OG1 3.1Å; S40-T42 PolarHBondContact O-N 3.36Å; T42-P46 WeakPolarHBondContact O-CD 3.31Å |
| 43 | N | 87.4 | Confident | 88.3 | Confident | 41 Ų | 41 | 19 Ų | 19 | 22% | 0.219 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -73.2 | -35.7 | 173 | -172.3 | 37.6 | 0 | 0 | 0 | 111.5 | S40 L41 P46 Y47 S183 Q186 T187 | S40-N43 WeakPolarHBondContact O-CB 3.34Å; S40-N43 PolarHBondContact O-N 3.41Å; L41-N43 VanDerWaalsContact C-N 3.26Å; L41-N43 PolarHBondContact O-N 3.49Å; N43-P46 WeakPolarHBondContact O-CD 3.49Å; N43-Y47 WeakPolarHBondContact O-CD2 3.46Å; N43-Y47 VanDerWaalsContact O-CE2 3.25Å; N43-Y47 WeakPolarHBondContact O-CE2 3.26Å; N43-S183 PolarHBondContact ND2-O 3.15Å; N43-Q186 PolarHBondContact ND2-OE1 2.91Å; N43-T187 PolarHBondContact ND2-OG1 3.48Å; N43-T187 VanDerWaalsContact ND2-OG1 3.09Å |
| 44 | M | 87.5 | Confident | 88 | Confident | 0 Ų | 0 | 20.8 Ų | 20.8 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -78.2 | -33 | -178.3 | -67.1 | -62.2 | -118.4 | 0 | 0 | 113.7 | S40 L41 Y47 I48 Q186 I190 V216 F217 | S40-M44 PolarHBondContact O-N 3.31Å; L41-M44 PolarHBondContact O-N 3.47Å; M44-Y47 PolarHBondContact O-N 2.86Å; M44-I48 HydrophobicContact CB-CD1 4.09Å; M44-I48 WeakPolarHBondContact O-CG1 3.13Å; M44-I48 PolarHBondContact O-N 3.04Å; M44-Q186 HydrophobicContact CE-CB 4.11Å; M44-Q186 HydrophobicContact CE-CG 3.57Å; M44-Q186 HydrophobicContact CG-CG 4.37Å; M44-Q186 VanDerWaalsContact CG-NE2 3.27Å; M44-Q186 HydrophobicContact SD-CB 3.78Å; M44-Q186 HydrophobicContact SD-CG 3.7Å; M44-I190 HydrophobicContact CE-CD1 3.92Å; M44-I190 HydrophobicContact SD-CD1 3.45Å; M44-I190 WeakPolarHBondContact SD-CD1 3.13Å; M44-V216 HydrophobicContact CE-CG1 3.81Å; M44-F217 HydrophobicContact CE-CE1 4.48Å |
| 45 | V | 88.9 | Confident | 87.8 | Confident | 17 Ų | 17 | 24.7 Ų | 24.7 | 10% | 0.103 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -51.9 | -45.8 | -174 | 163.4 | 0 | 0 | 0 | 0 | 113.6 | L41 Y47 I48 M49 F68 | L41-V45 HydrophobicContact CD1-CG2 4.15Å; L41-V45 HydrophobicContact CG-CG2 4.25Å; L41-V45 VanDerWaalsContact O-CG2 3.26Å; L41-V45 WeakPolarHBondContact O-CG2 3.35Å; L41-V45 PolarHBondContact O-N 2.87Å; V45-Y47 VanDerWaalsContact C-N 3.34Å; V45-Y47 PolarHBondContact O-N 3.07Å; V45-I48 PolarHBondContact O-N 3.47Å; V45-M49 HydrophobicContact CG1-CG 4.26Å; V45-M49 WeakPolarHBondContact O-CB 3.35Å; V45-M49 VanDerWaalsContact O-CG 3.3Å; V45-M49 WeakPolarHBondContact O-CG 3.31Å; V45-M49 PolarHBondContact O-N 3.22Å; V45-F68 HydrophobicContact CG2-CB 3.78Å; V45-F68 HydrophobicContact CG2-CD2 4.19Å; V45-F68 HydrophobicContact CG2-CG 4.07Å |
| 46 | P | 88 | Confident | 87.5 | Confident | 47 Ų | 47 | 27.2 Ų | 27.2 | 31% | 0.305 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -59 | -40.3 | 176.7 | -26.2 | 35.4 | 0 | 0 | 0 | 113.9 | T42 N43 G50 F204 | T42-P46 WeakPolarHBondContact O-CD 3.31Å; N43-P46 WeakPolarHBondContact O-CD 3.49Å; P46-G50 PolarHBondContact O-N 3.43Å; P46-F204 HydrophobicContact CB-CD2 4.18Å; P46-F204 HydrophobicContact CB-CE2 4.15Å |
| 47 | Y | 87.8 | Confident | 87.3 | Confident | 8 Ų | 8 | 30.2 Ų | 30.2 | 3% | 0.031 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -69 | -41.4 | 177.5 | -58.2 | -76.9 | 0 | 0 | 0 | 111.7 | N43 M44 V45 G50 Y51 I190 N191 F204 I209 | N43-Y47 WeakPolarHBondContact O-CD2 3.46Å; N43-Y47 VanDerWaalsContact O-CE2 3.25Å; N43-Y47 WeakPolarHBondContact O-CE2 3.26Å; M44-Y47 PolarHBondContact O-N 2.86Å; V45-Y47 VanDerWaalsContact C-N 3.34Å; V45-Y47 PolarHBondContact O-N 3.07Å; Y47-G50 PolarHBondContact O-N 3.48Å; Y47-Y51 PolarHBondContact O-N 2.93Å; Y47-I190 HydrophobicContact CD1-CB 4.49Å; Y47-I190 HydrophobicContact CD1-CG2 3.38Å; Y47-I190 HydrophobicContact CD2-CD1 3.99Å; Y47-I190 HydrophobicContact CE1-CB 4.4Å; Y47-I190 HydrophobicContact CE1-CG2 3.55Å; Y47-I190 HydrophobicContact CE2-CD1 4.42Å; Y47-I190 HydrophobicContact CG-CD1 4.1Å; Y47-I190 HydrophobicContact CG-CG2 3.91Å; Y47-N191 HydrophobicContact CE1-CB 4.22Å; Y47-F204 HydrophobicContact CD1-CB 4.29Å; Y47-F204 AromaticContact CD1-CD2 3.4Å; Y47-F204 HydrophobicContact CD1-CD2 3.4Å; Y47-F204 AromaticContact CD1-CE2 3.75Å; Y47-F204 HydrophobicContact CD1-CE2 3.75Å; Y47-F204 AromaticContact CD1-CG 3.84Å; Y47-F204 HydrophobicContact CD1-CG 3.84Å; Y47-F204 HydrophobicContact CD1-CZ 4.44Å; Y47-F204 HydrophobicContact CD2-CE2 4.44Å; Y47-F204 HydrophobicContact CE1-CD1 4.03Å; Y47-F204 AromaticContact CE1-CD2 3.36Å; Y47-F204 HydrophobicContact CE1-CD2 3.36Å; Y47-F204 AromaticContact CE1-CE1 3.94Å; Y47-F204 HydrophobicContact CE1-CE1 3.94Å; Y47-F204 AromaticContact CE1-CE2 3.26Å; Y47-F204 HydrophobicContact CE1-CE2 3.26Å; Y47-F204 AromaticContact CE1-CG 3.75Å; Y47-F204 HydrophobicContact CE1-CG 3.75Å; Y47-F204 AromaticContact CE1-CZ 3.56Å; Y47-F204 HydrophobicContact CE1-CZ 3.56Å; Y47-F204 HydrophobicContact CE2-CE2 4.02Å; Y47-F204 HydrophobicContact CG-CD2 4.08Å; Y47-F204 HydrophobicContact CG-CE2 4.32Å; Y47-F204 AromaticContact CZ-CE2 3.42Å; Y47-F204 VanDerWaalsContact CZ-CE2 3.42Å; Y47-F204 AromaticContact CZ-CZ 3.65Å; Y47-F204 WeakPolarHBondContact OH-CZ 3.35Å; Y47-I209 HydrophobicContact CD1-CG2 4Å; Y47-I209 HydrophobicContact CE1-CG2 4.05Å |
| 48 | I | 88 | Confident | 87 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.8 | -46.9 | 177 | -64 | 173.1 | 0 | 0 | 0 | 110.8 | M44 V45 Y51 L52 F68 I126 V133 Y137 L213 F217 | M44-I48 HydrophobicContact CB-CD1 4.09Å; M44-I48 WeakPolarHBondContact O-CG1 3.13Å; M44-I48 PolarHBondContact O-N 3.04Å; V45-I48 PolarHBondContact O-N 3.47Å; I48-Y51 PolarHBondContact O-N 3.25Å; I48-L52 HydrophobicContact CG2-CD1 3.78Å; I48-L52 HydrophobicContact CG2-CG 4.36Å; I48-L52 WeakPolarHBondContact O-CB 3.48Å; I48-L52 VanDerWaalsContact O-CG 3.28Å; I48-L52 WeakPolarHBondContact O-CG 3.32Å; I48-L52 PolarHBondContact O-N 3.4Å; I48-F68 HydrophobicContact CG2-CE1 4.2Å; I48-F68 HydrophobicContact CG2-CE2 4.13Å; I48-F68 HydrophobicContact CG2-CZ 3.59Å; I48-I126 HydrophobicContact CG2-CD1 4.32Å; I48-V133 HydrophobicContact CG2-CG1 4.11Å; I48-Y137 HydrophobicContact CD1-CD1 3.76Å; I48-Y137 HydrophobicContact CD1-CE1 3.38Å; I48-L213 HydrophobicContact CG1-CD1 4.43Å; I48-L213 HydrophobicContact CG1-CD2 4.15Å; I48-F217 HydrophobicContact CD1-CE1 4.15Å; I48-F217 HydrophobicContact CD1-CZ 3.68Å; I48-F217 HydrophobicContact CG1-CZ 3.72Å |
| 49 | M | 88.7 | Confident | 86.9 | Confident | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.005 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -66.6 | -41.2 | 179.4 | -68.3 | -61.9 | -61.8 | 0 | 0 | 112 | V45 Y51 L52 I53 I60 F68 Y130 | V45-M49 HydrophobicContact CG1-CG 4.26Å; V45-M49 WeakPolarHBondContact O-CB 3.35Å; V45-M49 VanDerWaalsContact O-CG 3.3Å; V45-M49 WeakPolarHBondContact O-CG 3.31Å; V45-M49 PolarHBondContact O-N 3.22Å; M49-Y51 VanDerWaalsContact C-N 3.31Å; M49-Y51 PolarHBondContact O-N 3.46Å; M49-L52 PolarHBondContact O-N 2.86Å; M49-I53 HydrophobicContact CE-CD1 4.31Å; M49-I53 WeakPolarHBondContact O-CB 3.36Å; M49-I53 WeakPolarHBondContact O-CG1 3.3Å; M49-I53 PolarHBondContact O-N 3.27Å; M49-I60 HydrophobicContact CE-CG2 3.61Å; M49-F68 HydrophobicContact SD-CD2 4.49Å; M49-F68 HydrophobicContact SD-CE2 3.77Å; M49-Y130 HydrophobicContact CE-CE2 4.47Å; M49-Y130 HydrophobicContact SD-CE2 4.04Å |
| 50 | G | 87.4 | Confident | 86.8 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58 | -43.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | P46 Y47 T54 L210 | P46-G50 PolarHBondContact O-N 3.43Å; Y47-G50 PolarHBondContact O-N 3.48Å; G50-T54 WeakPolarHBondContact O-CB 3.38Å; G50-T54 PolarHBondContact O-N 3.01Å; G50-T54 PolarHBondContact O-OG1 3.38Å; G50-L210 WeakPolarHBondContact O-CD1 3.35Å |
| 51 | Y | 87.6 | Confident | 86.7 | Confident | 18 Ų | 18 | 41.9 Ų | 41.9 | 7% | 0.071 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -63.4 | -47.2 | 176.2 | -173.8 | -78.9 | 0 | 0 | 0 | 112.1 | Y47 I48 M49 T54 F55 I56 I126 L210 L213 P214 | Y47-Y51 PolarHBondContact O-N 2.93Å; I48-Y51 PolarHBondContact O-N 3.25Å; M49-Y51 VanDerWaalsContact C-N 3.31Å; M49-Y51 PolarHBondContact O-N 3.46Å; Y51-T54 PolarHBondContact O-N 3.27Å; Y51-F55 HydrophobicContact CD1-CB 4.45Å; Y51-F55 HydrophobicContact CD1-CD2 4.22Å; Y51-F55 AromaticContact CD2-CD2 3.53Å; Y51-F55 HydrophobicContact CD2-CD2 3.53Å; Y51-F55 AromaticContact CD2-CE2 3.86Å; Y51-F55 HydrophobicContact CD2-CE2 3.86Å; Y51-F55 HydrophobicContact CE1-CB 4.16Å; Y51-F55 HydrophobicContact CE1-CD2 4.23Å; Y51-F55 AromaticContact CE2-CD2 3.56Å; Y51-F55 HydrophobicContact CE2-CD2 3.56Å; Y51-F55 AromaticContact CE2-CE2 3.91Å; Y51-F55 HydrophobicContact CE2-CE2 3.91Å; Y51-F55 HydrophobicContact CE2-CG 4.44Å; Y51-F55 AromaticContact CG-CD2 3.88Å; Y51-F55 HydrophobicContact CG-CD2 3.88Å; Y51-F55 AromaticContact CZ-CD2 3.92Å; Y51-F55 WeakPolarHBondContact O-CB 3.23Å; Y51-F55 PolarHBondContact O-N 3.33Å; Y51-I56 HydrophobicContact CE1-CD1 4.39Å; Y51-I56 HydrophobicContact CE1-CG1 4.36Å; Y51-I126 HydrophobicContact CD1-CD1 3.8Å; Y51-I126 HydrophobicContact CD1-CG1 3.53Å; Y51-I126 HydrophobicContact CE1-CB 4.48Å; Y51-I126 HydrophobicContact CE1-CD1 4.36Å; Y51-I126 HydrophobicContact CE1-CG1 3.81Å; Y51-I126 HydrophobicContact CE1-CG2 4.19Å; Y51-I126 WeakPolarHBondContact CE1-O 3.32Å; Y51-I126 HydrophobicContact CG-CD1 4.07Å; Y51-I126 HydrophobicContact CG-CG1 4.3Å; Y51-L210 HydrophobicContact CD2-CB 4.11Å; Y51-L210 WeakPolarHBondContact CD2-O 3.18Å; Y51-L213 HydrophobicContact CD2-CB 4.42Å; Y51-L213 HydrophobicContact CD2-CD2 4.27Å; Y51-L213 HydrophobicContact CG-CD2 4.04Å; Y51-P214 HydrophobicContact CE2-CG 3.87Å |
| 52 | L | 87.8 | Confident | 86.7 | Confident | 0 Ų | 0 | 44.4 Ų | 44.4 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.1 | -42 | -177.3 | -72 | 173.6 | 0 | 0 | 0 | 112 | I48 M49 I56 D57 I60 F68 I126 Y130 V133 | I48-L52 HydrophobicContact CG2-CD1 3.78Å; I48-L52 HydrophobicContact CG2-CG 4.36Å; I48-L52 WeakPolarHBondContact O-CB 3.48Å; I48-L52 VanDerWaalsContact O-CG 3.28Å; I48-L52 WeakPolarHBondContact O-CG 3.32Å; I48-L52 PolarHBondContact O-N 3.4Å; M49-L52 PolarHBondContact O-N 2.86Å; L52-I56 HydrophobicContact CD2-CB 4.31Å; L52-I56 HydrophobicContact CD2-CG1 3.85Å; L52-I56 WeakPolarHBondContact O-CA 3.17Å; L52-I56 VanDerWaalsContact O-CB 3.3Å; L52-I56 WeakPolarHBondContact O-CB 3.03Å; L52-I56 PolarHBondContact O-N 2.8Å; L52-D57 PolarHBondContact O-N 2.9Å; L52-I60 HydrophobicContact CB-CD1 4.07Å; L52-F68 HydrophobicContact CD1-CZ 4.36Å; L52-I126 HydrophobicContact CD2-CG1 3.97Å; L52-I126 HydrophobicContact CG-CG1 4.4Å; L52-Y130 HydrophobicContact CD1-CD2 3.81Å; L52-V133 HydrophobicContact CD1-CG2 4.31Å; L52-V133 HydrophobicContact CD2-CG2 4.05Å |
| 53 | I | 87.5 | Confident | 86.7 | Confident | 30 Ų | 30 | 46.8 Ų | 46.8 | 15% | 0.154 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -69.7 | -39.7 | 178.5 | -69.2 | 164.3 | 0 | 0 | 0 | 111 | M49 P58 I60 V62 Q203 | M49-I53 HydrophobicContact CE-CD1 4.31Å; M49-I53 WeakPolarHBondContact O-CB 3.36Å; M49-I53 WeakPolarHBondContact O-CG1 3.3Å; M49-I53 PolarHBondContact O-N 3.27Å; I53-P58 WeakPolarHBondContact O-CA 3.46Å; I53-I60 WeakPolarHBondContact CD1-O 3.31Å; I53-I60 HydrophobicContact CG1-CB 4.01Å; I53-I60 HydrophobicContact CG1-CG2 4.35Å; I53-V62 HydrophobicContact CD1-CG2 4.06Å; I53-Q203 VanDerWaalsContact CD1-NE2 3.28Å |
| 54 | T | 86.4 | Confident | 86.7 | Confident | 61 Ų | 61 | 46.6 Ų | 46.6 | 37% | 0.374 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -76.1 | -42.6 | -176.4 | -56.2 | 0 | 0 | 0 | 0 | 112.8 | G50 Y51 L210 | G50-T54 WeakPolarHBondContact O-CB 3.38Å; G50-T54 PolarHBondContact O-N 3.01Å; G50-T54 PolarHBondContact O-OG1 3.38Å; Y51-T54 PolarHBondContact O-N 3.27Å; T54-L210 HydrophobicContact CG2-CD1 4.13Å; T54-L210 WeakPolarHBondContact OG1-CD1 3.18Å |
| 55 | F | 85.8 | Confident | 86.7 | Confident | 82 Ų | 82 | 47.8 Ų | 47.8 | 36% | 0.36 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -108.1 | -20.1 | -169.5 | -66.4 | -64.1 | 0 | 0 | 0 | 115.3 | Y51 P207 L210 | Y51-F55 HydrophobicContact CD1-CB 4.45Å; Y51-F55 HydrophobicContact CD1-CD2 4.22Å; Y51-F55 AromaticContact CD2-CD2 3.53Å; Y51-F55 HydrophobicContact CD2-CD2 3.53Å; Y51-F55 AromaticContact CD2-CE2 3.86Å; Y51-F55 HydrophobicContact CD2-CE2 3.86Å; Y51-F55 HydrophobicContact CE1-CB 4.16Å; Y51-F55 HydrophobicContact CE1-CD2 4.23Å; Y51-F55 AromaticContact CE2-CD2 3.56Å; Y51-F55 HydrophobicContact CE2-CD2 3.56Å; Y51-F55 AromaticContact CE2-CE2 3.91Å; Y51-F55 HydrophobicContact CE2-CE2 3.91Å; Y51-F55 HydrophobicContact CE2-CG 4.44Å; Y51-F55 AromaticContact CG-CD2 3.88Å; Y51-F55 HydrophobicContact CG-CD2 3.88Å; Y51-F55 AromaticContact CZ-CD2 3.92Å; Y51-F55 WeakPolarHBondContact O-CB 3.23Å; Y51-F55 PolarHBondContact O-N 3.33Å; F55-P207 HydrophobicContact CZ-CB 4.44Å; F55-L210 HydrophobicContact CD2-CB 4.37Å; F55-L210 HydrophobicContact CE2-CB 3.56Å; F55-L210 HydrophobicContact CE2-CD1 4.2Å; F55-L210 HydrophobicContact CZ-CB 4.42Å |
| 56 | I | 84.5 | Confident | 86.7 | Confident | 53 Ų | 53 | 51.8 Ų | 51.8 | 27% | 0.272 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.4 | -61.3 | -171.8 | -52.8 | -58.7 | 0 | 0 | 0 | 111.3 | Y51 L52 I126 | Y51-I56 HydrophobicContact CE1-CD1 4.39Å; Y51-I56 HydrophobicContact CE1-CG1 4.36Å; L52-I56 HydrophobicContact CD2-CB 4.31Å; L52-I56 HydrophobicContact CD2-CG1 3.85Å; L52-I56 WeakPolarHBondContact O-CA 3.17Å; L52-I56 VanDerWaalsContact O-CB 3.3Å; L52-I56 WeakPolarHBondContact O-CB 3.03Å; L52-I56 PolarHBondContact O-N 2.8Å; I56-I126 VanDerWaalsContact CD1-O 3.28Å; I56-I126 WeakPolarHBondContact CD1-O 3.39Å; I56-I126 VanDerWaalsContact CG1-O 3.3Å; I56-I126 WeakPolarHBondContact CG1-O 3.46Å |
| 57 | D | 83.7 | Confident | 86.9 | Confident | 63 Ų | 63 | 57 Ų | 57 | 34% | 0.337 | 30% | 0.297 | S | S | . | . | trans | -150.2 | 105.9 | -175.9 | -176.5 | 1 | 0 | 0 | 0 | 111 | L52 H59 I60 | L52-D57 PolarHBondContact O-N 2.9Å; D57-H59 PolarHBondContact O-N 2.91Å; D57-H59 VanDerWaalsContact O-N 3.13Å; D57-H59 VanDerWaalsContact OD1-CB 3.27Å; D57-H59 WeakPolarHBondContact OD1-CB 3.39Å; D57-H59 IonicContact OD1-CD2 3.31Å; D57-H59 PolarHBondContact OD1-CD2 3.3Å; D57-H59 VanDerWaalsContact OD1-CD2 3.31Å; D57-H59 IonicContact OD1-CG 3.62Å; D57-H59 PolarHBondContact OD1-N 2.6Å; D57-I60 HydrophobicContact CB-CD1 3.8Å; D57-I60 HydrophobicContact CB-CG1 3.9Å; D57-I60 WeakPolarHBondContact O-CG1 3.21Å; D57-I60 PolarHBondContact O-N 3.21Å | ||
| 58 | P | 84.1 | Confident | 86.9 | Confident | 96 Ų | 96 | 56.6 Ų | 56.6 | 62% | 0.623 | 30% | 0.296 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -15.1 | 176.7 | -22.9 | 34 | 0 | 0 | 0 | 114.5 | I53 I60 | I53-P58 WeakPolarHBondContact O-CA 3.46Å; P58-I60 VanDerWaalsContact C-N 3.3Å |
| 59 | H | 86.5 | Confident | 87 | Confident | 165 Ų | 165 | 58 Ų | 58 | 76% | 0.764 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.2 | -4.2 | -179.9 | -59.5 | -69.1 | 0 | 0 | 0 | 113.5 | D57 C61 | D57-H59 PolarHBondContact O-N 2.91Å; D57-H59 VanDerWaalsContact O-N 3.13Å; D57-H59 VanDerWaalsContact OD1-CB 3.27Å; D57-H59 WeakPolarHBondContact OD1-CB 3.39Å; D57-H59 IonicContact OD1-CD2 3.31Å; D57-H59 PolarHBondContact OD1-CD2 3.3Å; D57-H59 VanDerWaalsContact OD1-CD2 3.31Å; D57-H59 IonicContact OD1-CG 3.62Å; D57-H59 PolarHBondContact OD1-N 2.6Å; H59-C61 PolarHBondContact O-N 3.22Å |
| 60 | I | 85.5 | Confident | 87.2 | Confident | 23 Ų | 23 | 60.2 Ų | 60.2 | 12% | 0.118 | 32% | 0.324 | C | S | . | . | trans | -68.5 | 117.9 | 178 | -64.3 | 167.3 | 0 | 0 | 0 | 110.1 | M49 L52 I53 D57 P58 Y130 | M49-I60 HydrophobicContact CE-CG2 3.61Å; L52-I60 HydrophobicContact CB-CD1 4.07Å; I53-I60 WeakPolarHBondContact CD1-O 3.31Å; I53-I60 HydrophobicContact CG1-CB 4.01Å; I53-I60 HydrophobicContact CG1-CG2 4.35Å; D57-I60 HydrophobicContact CB-CD1 3.8Å; D57-I60 HydrophobicContact CB-CG1 3.9Å; D57-I60 WeakPolarHBondContact O-CG1 3.21Å; D57-I60 PolarHBondContact O-N 3.21Å; P58-I60 VanDerWaalsContact C-N 3.3Å; I60-Y130 HydrophobicContact CD1-CD2 4.28Å; I60-Y130 HydrophobicContact CD1-CG 4.32Å; I60-Y130 HydrophobicContact CG2-CD2 4.18Å; I60-Y130 HydrophobicContact CG2-CE2 4.4Å | ||
| 61 | C | 86.3 | Confident | 87.4 | Confident | 74 Ų | 74 | 61.7 Ų | 61.7 | 50% | 0.5 | 33% | 0.333 | S | S | . | . | trans | -69.4 | 134 | 174.2 | -65.1 | 0 | 0 | 0 | 0 | 111.6 | H59 Q63 T64 | H59-C61 PolarHBondContact O-N 3.22Å; C61-Q63 PolarHBondContact O-N 2.93Å; C61-Q63 VanDerWaalsContact O-N 3.11Å; C61-T64 HydrophobicContact CB-CG2 4.2Å; C61-T64 WeakPolarHBondContact O-CB 3.45Å; C61-T64 WeakPolarHBondContact O-CG2 3.39Å; C61-T64 PolarHBondContact O-N 3.38Å; C61-T64 PolarHBondContact O-OG1 2.78Å | ||
| 62 | V | 84.6 | Confident | 87.5 | Confident | 58 Ų | 58 | 60.9 Ų | 60.9 | 35% | 0.352 | 33% | 0.33 | S | S | . | . | G | 310 helix | trans | -57.3 | -29.4 | 178.1 | -174.6 | 0 | 0 | 0 | 0 | 112.6 | I53 T64 S65 Q203 | I53-V62 HydrophobicContact CD1-CG2 4.06Å; V62-T64 PolarHBondContact O-N 3.42Å; V62-S65 WeakPolarHBondContact O-CB 3.37Å; V62-S65 PolarHBondContact O-N 2.89Å; V62-S65 VanDerWaalsContact O-N 3.11Å; V62-S65 PolarHBondContact O-OG 3.48Å; V62-Q203 HydrophobicContact CG1-CG 4.5Å; V62-Q203 HydrophobicContact CG2-CG 4.5Å |
| 63 | Q | 85.9 | Confident | 87.7 | Confident | 145 Ų | 145 | 65.4 Ų | 65.4 | 68% | 0.678 | 35% | 0.35 | S | S | * | . | G | 310 helix | trans | -63.4 | -22.9 | 178.3 | -63 | 79.8 | -0.1 | 0 | 0 | 112.7 | C61 S65 V66 | C61-Q63 PolarHBondContact O-N 2.93Å; C61-Q63 VanDerWaalsContact O-N 3.11Å; Q63-S65 PolarHBondContact O-N 3.43Å; Q63-V66 WeakPolarHBondContact O-CG2 3.29Å; Q63-V66 PolarHBondContact O-N 3.23Å |
| 64 | T | 87.8 | Confident | 88 | Confident | 37 Ų | 37 | 66.6 Ų | 66.6 | 23% | 0.227 | 36% | 0.364 | C | S | . | . | G | 310 helix | trans | -67.9 | -19 | 177.4 | 64 | 0 | 0 | 0 | 0 | 112 | C61 V62 V66 W67 Y130 | C61-T64 HydrophobicContact CB-CG2 4.2Å; C61-T64 WeakPolarHBondContact O-CB 3.45Å; C61-T64 WeakPolarHBondContact O-CG2 3.39Å; C61-T64 PolarHBondContact O-N 3.38Å; C61-T64 PolarHBondContact O-OG1 2.78Å; V62-T64 PolarHBondContact O-N 3.42Å; T64-V66 PolarHBondContact O-N 3.5Å; T64-W67 VanDerWaalsContact O-CB 3.31Å; T64-W67 WeakPolarHBondContact O-CB 3.44Å; T64-W67 VanDerWaalsContact O-CD1 3.25Å; T64-W67 PolarHBondContact O-N 3.4Å; T64-Y130 VanDerWaalsContact C-OH 3.27Å; T64-Y130 VanDerWaalsContact CB-OH 3.22Å; T64-Y130 WeakPolarHBondContact CB-OH 3.16Å; T64-Y130 PolarHBondContact O-OH 3.4Å; T64-Y130 PolarHBondContact OG1-OH 3.37Å |
| 65 | S | 87.6 | Confident | 88.3 | Confident | 25 Ų | 25 | 64.2 Ų | 64.2 | 18% | 0.175 | 35% | 0.349 | C | S | . | . | G | 310 helix | trans | -54.4 | -26.1 | 177 | 68.1 | 0 | 0 | 0 | 0 | 114.8 | V62 Q63 W67 F68 | V62-S65 WeakPolarHBondContact O-CB 3.37Å; V62-S65 PolarHBondContact O-N 2.89Å; V62-S65 VanDerWaalsContact O-N 3.11Å; V62-S65 PolarHBondContact O-OG 3.48Å; Q63-S65 PolarHBondContact O-N 3.43Å; S65-W67 PolarHBondContact O-N 2.95Å; S65-F68 WeakPolarHBondContact O-CB 3.42Å; S65-F68 WeakPolarHBondContact O-CD2 3.4Å; S65-F68 PolarHBondContact O-N 3.47Å; S65-F68 VanDerWaalsContact O-N 3.15Å |
| 66 | V | 89.9 | Confident | 88.5 | Confident | 101 Ų | 101 | 61.9 Ų | 61.9 | 61% | 0.612 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -58.6 | -29.7 | 175.1 | 179.3 | 0 | 0 | 0 | 0 | 112.1 | Q63 T64 F68 S69 A70 | Q63-V66 WeakPolarHBondContact O-CG2 3.29Å; Q63-V66 PolarHBondContact O-N 3.23Å; T64-V66 PolarHBondContact O-N 3.5Å; V66-F68 PolarHBondContact O-N 3.04Å; V66-S69 PolarHBondContact O-N 3.12Å; V66-A70 WeakPolarHBondContact O-CB 3.38Å; V66-A70 PolarHBondContact O-N 3.01Å; V66-A70 VanDerWaalsContact O-N 3.08Å |
| 67 | W | 90.7 | Very high | 88.9 | Confident | 157 Ų | 157 | 61.5 Ų | 61.5 | 60% | 0.595 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -64.2 | -25.8 | 179.3 | -73.1 | 105.3 | 0 | 0 | 0 | 113.3 | T64 S65 V71 I134 | T64-W67 VanDerWaalsContact O-CB 3.31Å; T64-W67 WeakPolarHBondContact O-CB 3.44Å; T64-W67 VanDerWaalsContact O-CD1 3.25Å; T64-W67 PolarHBondContact O-N 3.4Å; S65-W67 PolarHBondContact O-N 2.95Å; W67-V71 HydrophobicContact CE3-CG2 4.12Å; W67-V71 VanDerWaalsContact O-CB 3.31Å; W67-V71 WeakPolarHBondContact O-CB 3.28Å; W67-V71 VanDerWaalsContact O-CG2 3.26Å; W67-V71 WeakPolarHBondContact O-CG2 3.26Å; W67-V71 PolarHBondContact O-N 3.35Å; W67-I134 HydrophobicContact CB-CD1 4.02Å |
| 68 | F | 88.3 | Confident | 89.3 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -58.4 | -54.5 | 176.2 | -79.8 | -76.1 | 0 | 0 | 0 | 111.1 | L41 V45 I48 M49 L52 S65 V66 T72 Y130 V133 I134 Y137 S138 | L41-F68 HydrophobicContact CD1-CB 4.45Å; V45-F68 HydrophobicContact CG2-CB 3.78Å; V45-F68 HydrophobicContact CG2-CD2 4.19Å; V45-F68 HydrophobicContact CG2-CG 4.07Å; I48-F68 HydrophobicContact CG2-CE1 4.2Å; I48-F68 HydrophobicContact CG2-CE2 4.13Å; I48-F68 HydrophobicContact CG2-CZ 3.59Å; M49-F68 HydrophobicContact SD-CD2 4.49Å; M49-F68 HydrophobicContact SD-CE2 3.77Å; L52-F68 HydrophobicContact CD1-CZ 4.36Å; S65-F68 WeakPolarHBondContact O-CB 3.42Å; S65-F68 WeakPolarHBondContact O-CD2 3.4Å; S65-F68 PolarHBondContact O-N 3.47Å; S65-F68 VanDerWaalsContact O-N 3.15Å; V66-F68 PolarHBondContact O-N 3.04Å; F68-T72 PolarHBondContact O-N 2.81Å; F68-T72 PolarHBondContact O-OG1 3.06Å; F68-Y130 HydrophobicContact CE2-CE2 4.09Å; F68-Y130 HydrophobicContact CZ-CE2 4.46Å; F68-V133 HydrophobicContact CE1-CB 4.3Å; F68-V133 HydrophobicContact CE1-CG1 3.76Å; F68-V133 HydrophobicContact CZ-CB 4.35Å; F68-V133 HydrophobicContact CZ-CG1 4.03Å; F68-I134 HydrophobicContact CD1-CG1 4.33Å; F68-I134 HydrophobicContact CE1-CG1 4.06Å; F68-I134 HydrophobicContact CZ-CG1 4.22Å; F68-Y137 AromaticContact CD1-CD1 3.95Å; F68-Y137 HydrophobicContact CD1-CD1 3.95Å; F68-Y137 HydrophobicContact CE1-CD1 4.15Å; F68-S138 VanDerWaalsContact CA-OG 3.29Å; F68-S138 WeakPolarHBondContact CA-OG 3.41Å; F68-S138 WeakPolarHBondContact CD1-OG 3.33Å; F68-S138 WeakPolarHBondContact O-CB 3.35Å; F68-S138 PolarHBondContact O-OG 3.04Å |
| 69 | S | 90.1 | Very high | 89.6 | Confident | 30 Ų | 30 | 61.7 Ų | 61.7 | 21% | 0.21 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -71.1 | -42.4 | 179.5 | -57.7 | 0 | 0 | 0 | 0 | 111.7 | V66 V71 T72 F73 | V66-S69 PolarHBondContact O-N 3.12Å; S69-V71 PolarHBondContact O-N 3.37Å; S69-T72 PolarHBondContact O-N 3.16Å; S69-F73 WeakPolarHBondContact O-CD2 3.33Å; S69-F73 PolarHBondContact O-N 3.48Å |
| 70 | A | 92.5 | Very high | 89.7 | Confident | 47 Ų | 47 | 57.3 Ų | 57.3 | 39% | 0.388 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.3 | -46.5 | -177 | 0 | 0 | 0 | 0 | 0 | 112.1 | V66 A74 | V66-A70 WeakPolarHBondContact O-CB 3.38Å; V66-A70 PolarHBondContact O-N 3.01Å; V66-A70 VanDerWaalsContact O-N 3.08Å; A70-A74 WeakPolarHBondContact O-CB 3.22Å; A70-A74 PolarHBondContact O-N 2.88Å |
| 71 | V | 91.6 | Very high | 89.9 | Confident | 30 Ų | 30 | 60.6 Ų | 60.6 | 18% | 0.182 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -64.9 | -44.4 | 177 | 173 | 0 | 0 | 0 | 0 | 110.5 | W67 S69 F73 A74 V75 I134 F139 | W67-V71 HydrophobicContact CE3-CG2 4.12Å; W67-V71 VanDerWaalsContact O-CB 3.31Å; W67-V71 WeakPolarHBondContact O-CB 3.28Å; W67-V71 VanDerWaalsContact O-CG2 3.26Å; W67-V71 WeakPolarHBondContact O-CG2 3.26Å; W67-V71 PolarHBondContact O-N 3.35Å; S69-V71 PolarHBondContact O-N 3.37Å; V71-F73 PolarHBondContact O-N 3.42Å; V71-A74 PolarHBondContact O-N 3.43Å; V71-V75 HydrophobicContact CG1-CG2 4.02Å; V71-V75 WeakPolarHBondContact O-CB 3.23Å; V71-V75 WeakPolarHBondContact O-CG2 3.45Å; V71-V75 PolarHBondContact O-N 2.93Å; V71-I134 HydrophobicContact CB-CG2 4.06Å; V71-I134 HydrophobicContact CG1-CG2 4.03Å; V71-I134 HydrophobicContact CG2-CG2 3.83Å; V71-F139 HydrophobicContact CG1-CB 4.11Å |
| 72 | T | 89.7 | Confident | 90 | Very high | 1 Ų | 1 | 60.9 Ų | 60.9 | 1% | 0.006 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -61.5 | -46.2 | -179.3 | -53.9 | 0 | 0 | 0 | 0 | 112.3 | L38 F68 S69 Y76 S138 F141 | L38-T72 HydrophobicContact CD1-CG2 3.18Å; F68-T72 PolarHBondContact O-N 2.81Å; F68-T72 PolarHBondContact O-OG1 3.06Å; S69-T72 PolarHBondContact O-N 3.16Å; T72-Y76 WeakPolarHBondContact O-CB 3.28Å; T72-Y76 PolarHBondContact O-N 3.47Å; T72-S138 WeakPolarHBondContact OG1-CA 3.4Å; T72-S138 WeakPolarHBondContact OG1-CB 3.27Å; T72-S138 PolarHBondContact OG1-O 2.59Å; T72-S138 PolarHBondContact OG1-OG 3.16Å; T72-F141 HydrophobicContact CG2-CD1 3.9Å |
| 73 | F | 92.4 | Very high | 89.9 | Confident | 95 Ų | 95 | 58.1 Ų | 58.1 | 42% | 0.417 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -70.4 | -37.2 | 179.1 | -74.7 | -64.7 | 0 | 0 | 0 | 112.9 | L38 S69 V71 Y76 G77 | L38-F73 HydrophobicContact CD2-CD1 4.13Å; L38-F73 HydrophobicContact CD2-CE1 3.48Å; L38-F73 VanDerWaalsContact CD2-CE1 3.48Å; L38-F73 HydrophobicContact CD2-CZ 3.96Å; L38-F73 HydrophobicContact CG-CE1 4.26Å; L38-F73 HydrophobicContact CG-CZ 4.24Å; S69-F73 WeakPolarHBondContact O-CD2 3.33Å; S69-F73 PolarHBondContact O-N 3.48Å; V71-F73 PolarHBondContact O-N 3.42Å; F73-Y76 HydrophobicContact CD1-CD1 4.33Å; F73-Y76 PolarHBondContact O-N 3.26Å; F73-G77 PolarHBondContact O-N 2.87Å |
| 74 | A | 94.3 | Very high | 89.7 | Confident | 56 Ų | 56 | 52.2 Ų | 52.2 | 46% | 0.463 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.3 | -48.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | A70 V71 G77 I78 | A70-A74 WeakPolarHBondContact O-CB 3.22Å; A70-A74 PolarHBondContact O-N 2.88Å; V71-A74 PolarHBondContact O-N 3.43Å; A74-G77 PolarHBondContact O-N 3.01Å; A74-I78 VanDerWaalsContact O-CG1 3.31Å; A74-I78 WeakPolarHBondContact O-CG1 3.37Å; A74-I78 PolarHBondContact O-N 3.47Å; A74-I78 VanDerWaalsContact O-N 3.08Å |
| 75 | V | 91.7 | Very high | 89.6 | Confident | 10 Ų | 10 | 55.8 Ų | 55.8 | 6% | 0.061 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 177.3 | 177 | 0 | 0 | 0 | 0 | 110.5 | V71 G77 I78 F79 F139 T143 | V71-V75 HydrophobicContact CG1-CG2 4.02Å; V71-V75 WeakPolarHBondContact O-CB 3.23Å; V71-V75 WeakPolarHBondContact O-CG2 3.45Å; V71-V75 PolarHBondContact O-N 2.93Å; V75-G77 VanDerWaalsContact C-N 3.33Å; V75-G77 PolarHBondContact O-N 3.47Å; V75-I78 PolarHBondContact O-N 3.4Å; V75-F79 HydrophobicContact CG1-CD2 3.61Å; V75-F79 HydrophobicContact CG1-CE2 3.84Å; V75-F79 WeakPolarHBondContact O-CB 3.37Å; V75-F79 VanDerWaalsContact O-CD2 3.28Å; V75-F79 WeakPolarHBondContact O-CD2 3.44Å; V75-F79 PolarHBondContact O-N 2.98Å; V75-F139 HydrophobicContact CB-CD2 4.48Å; V75-F139 HydrophobicContact CG1-CD2 4.23Å; V75-F139 HydrophobicContact CG1-CE2 4.37Å; V75-F139 HydrophobicContact CG2-CB 4.42Å; V75-F139 HydrophobicContact CG2-CD2 3.39Å; V75-F139 HydrophobicContact CG2-CE2 3.9Å; V75-F139 HydrophobicContact CG2-CG 4.13Å; V75-T143 HydrophobicContact CG1-CG2 3.41Å; V75-T143 VanDerWaalsContact CG1-CG2 3.41Å |
| 76 | Y | 91.1 | Very high | 89.4 | Confident | 33 Ų | 33 | 56.6 Ų | 56.6 | 13% | 0.129 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -54.8 | -48.6 | 174.8 | 173.5 | -147.3 | 0 | 0 | 0 | 111.6 | L38 T72 F73 I78 F79 M80 V145 G146 F149 | L38-Y76 HydrophobicContact CD2-CD1 4.44Å; T72-Y76 WeakPolarHBondContact O-CB 3.28Å; T72-Y76 PolarHBondContact O-N 3.47Å; F73-Y76 HydrophobicContact CD1-CD1 4.33Å; F73-Y76 PolarHBondContact O-N 3.26Å; Y76-I78 VanDerWaalsContact C-N 3.35Å; Y76-I78 PolarHBondContact O-N 3.32Å; Y76-F79 PolarHBondContact O-N 3.44Å; Y76-M80 HydrophobicContact CD2-CB 4.44Å; Y76-M80 HydrophobicContact CE2-CB 4.18Å; Y76-M80 HydrophobicContact CE2-CG 4.5Å; Y76-M80 WeakPolarHBondContact O-CB 3.32Å; Y76-M80 PolarHBondContact O-N 2.99Å; Y76-V145 HydrophobicContact CD2-CG1 4.08Å; Y76-V145 HydrophobicContact CE2-CG1 3.93Å; Y76-G146 VanDerWaalsContact CD2-CA 3.45Å; Y76-F149 HydrophobicContact CE2-CB 4.14Å; Y76-F149 HydrophobicContact CE2-CG 4.34Å; Y76-F149 WeakPolarHBondContact OH-CD1 3.3Å; Y76-F149 WeakPolarHBondContact OH-CD2 3.38Å; Y76-F149 VanDerWaalsContact OH-CG 3.3Å; Y76-F149 WeakPolarHBondContact OH-CG 3.41Å |
| 77 | G | 91.9 | Very high | 89 | Confident | 45 Ų | 45 | 53.1 Ų | 53.1 | 46% | 0.464 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -62.1 | -37.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | F73 A74 V75 P81 | F73-G77 PolarHBondContact O-N 2.87Å; A74-G77 PolarHBondContact O-N 3.01Å; V75-G77 VanDerWaalsContact C-N 3.33Å; V75-G77 PolarHBondContact O-N 3.47Å; G77-P81 WeakPolarHBondContact O-CD 3.47Å |
| 78 | I | 92.7 | Very high | 88.4 | Confident | 119 Ų | 119 | 52.7 Ų | 52.7 | 61% | 0.61 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -71.5 | -42.5 | 177.6 | -67.4 | 164.6 | 0 | 0 | 0 | 111.4 | A74 V75 Y76 | A74-I78 VanDerWaalsContact O-CG1 3.31Å; A74-I78 WeakPolarHBondContact O-CG1 3.37Å; A74-I78 PolarHBondContact O-N 3.47Å; A74-I78 VanDerWaalsContact O-N 3.08Å; V75-I78 PolarHBondContact O-N 3.4Å; Y76-I78 VanDerWaalsContact C-N 3.35Å; Y76-I78 PolarHBondContact O-N 3.32Å |
| 79 | F | 90.4 | Very high | 88.1 | Confident | 44 Ų | 44 | 59.5 Ų | 59.5 | 19% | 0.193 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -83.5 | -16.8 | -173.7 | -80.9 | -100.6 | 0 | 0 | 0 | 113.4 | V75 Y76 L82 G83 T143 G146 L147 | V75-F79 HydrophobicContact CG1-CD2 3.61Å; V75-F79 HydrophobicContact CG1-CE2 3.84Å; V75-F79 WeakPolarHBondContact O-CB 3.37Å; V75-F79 VanDerWaalsContact O-CD2 3.28Å; V75-F79 WeakPolarHBondContact O-CD2 3.44Å; V75-F79 PolarHBondContact O-N 2.98Å; Y76-F79 PolarHBondContact O-N 3.44Å; F79-L82 HydrophobicContact CD1-CD2 3.95Å; F79-L82 HydrophobicContact CE1-CD2 4.04Å; F79-L82 PolarHBondContact O-N 3.18Å; F79-G83 PolarHBondContact O-N 2.97Å; F79-T143 HydrophobicContact CD1-CG2 4.06Å; F79-T143 HydrophobicContact CD2-CG2 3.89Å; F79-T143 HydrophobicContact CE1-CG2 3.8Å; F79-T143 HydrophobicContact CE2-CG2 3.61Å; F79-T143 HydrophobicContact CG-CG2 4.1Å; F79-T143 HydrophobicContact CZ-CG2 3.56Å; F79-G146 CarbonylContact O-C 3.22Å; F79-L147 HydrophobicContact CB-CG 4.47Å; F79-L147 HydrophobicContact CD1-CD1 4.32Å; F79-L147 HydrophobicContact CD1-CD2 3.94Å; F79-L147 HydrophobicContact CD1-CG 3.95Å |
| 80 | M | 88.8 | Confident | 87.5 | Confident | 74 Ų | 74 | 62.7 Ų | 62.7 | 37% | 0.365 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.4 | -49.9 | 178 | -179.8 | -167.3 | 173.3 | 0 | 0 | 113.8 | Y76 L82 G83 G84 G146 F149 S150 | Y76-M80 HydrophobicContact CD2-CB 4.44Å; Y76-M80 HydrophobicContact CE2-CB 4.18Å; Y76-M80 HydrophobicContact CE2-CG 4.5Å; Y76-M80 WeakPolarHBondContact O-CB 3.32Å; Y76-M80 PolarHBondContact O-N 2.99Å; M80-L82 VanDerWaalsContact C-N 3.29Å; M80-L82 PolarHBondContact O-N 3.21Å; M80-G83 PolarHBondContact O-N 3.28Å; M80-G84 PolarHBondContact O-N 2.87Å; M80-G146 VanDerWaalsContact CA-O 3.31Å; M80-G146 WeakPolarHBondContact CA-O 3.08Å; M80-F149 HydrophobicContact CE-CD1 4.26Å; M80-S150 PolarHBondContact O-OG 3.38Å |
| 81 | P | 90 | Very high | 86.6 | Confident | 91 Ų | 91 | 60.9 Ų | 60.9 | 59% | 0.591 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -62.3 | -38 | 171.9 | -22.6 | 33.2 | 0 | 0 | 0 | 112.3 | G77 G83 G84 F85 | G77-P81 WeakPolarHBondContact O-CD 3.47Å; P81-G83 PolarHBondContact O-N 3.49Å; P81-G84 PolarHBondContact O-N 3.3Å; P81-F85 PolarHBondContact O-N 3.11Å |
| 82 | L | 88.9 | Confident | 86 | Confident | 80 Ų | 80 | 60.3 Ų | 60.3 | 42% | 0.419 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | -179.9 | -172.7 | 62 | 0 | 0 | 0 | 111.8 | F79 M80 F85 L86 L147 | F79-L82 HydrophobicContact CD1-CD2 3.95Å; F79-L82 HydrophobicContact CE1-CD2 4.04Å; F79-L82 PolarHBondContact O-N 3.18Å; M80-L82 VanDerWaalsContact C-N 3.29Å; M80-L82 PolarHBondContact O-N 3.21Å; L82-F85 PolarHBondContact O-N 2.93Å; L82-L86 VanDerWaalsContact O-CB 3.26Å; L82-L86 WeakPolarHBondContact O-CB 3.47Å; L82-L86 PolarHBondContact O-N 2.91Å; L82-L147 HydrophobicContact CG-CD2 4.38Å |
| 83 | G | 81 | Confident | 85.4 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | F79 M80 P81 L86 S87 L147 V151 | F79-G83 PolarHBondContact O-N 2.97Å; M80-G83 PolarHBondContact O-N 3.28Å; P81-G83 PolarHBondContact O-N 3.49Å; G83-L86 PolarHBondContact O-N 2.76Å; G83-S87 WeakPolarHBondContact O-CB 3.49Å; G83-S87 PolarHBondContact O-N 3.47Å; G83-L147 WeakPolarHBondContact CA-O 3.46Å; G83-V151 WeakPolarHBondContact O-CG2 3.46Å |
| 84 | G | 82.5 | Confident | 84.7 | Confident | 22 Ų | 22 | 66 Ų | 66 | 23% | 0.227 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.2 | -47.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | M80 P81 S87 R88 | M80-G84 PolarHBondContact O-N 2.87Å; P81-G84 PolarHBondContact O-N 3.3Å; G84-S87 PolarHBondContact O-N 2.91Å; G84-S87 PolarHBondContact O-OG 2.88Å; G84-R88 PolarHBondContact O-N 3.4Å |
| 85 | F | 86.3 | Confident | 84 | Confident | 112 Ų | 112 | 63.4 Ų | 63.4 | 49% | 0.491 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.5 | -44.6 | 177 | -178.8 | -101.2 | 0 | 0 | 0 | 112.7 | P81 L82 S87 R88 K89 | P81-F85 PolarHBondContact O-N 3.11Å; L82-F85 PolarHBondContact O-N 2.93Å; F85-S87 VanDerWaalsContact C-N 3.28Å; F85-S87 PolarHBondContact O-N 3.36Å; F85-R88 PolarHBondContact O-N 3.42Å; F85-K89 HydrophobicContact CE1-CD 3.9Å; F85-K89 HydrophobicContact CZ-CD 4.09Å |
| 86 | L | 82.9 | Confident | 83.5 | Confident | 41 Ų | 41 | 63 Ų | 63 | 22% | 0.215 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.8 | -35.1 | -179.9 | -163.3 | 64.5 | 0 | 0 | 0 | 111.5 | L82 G83 R88 K89 I90 V95 L98 | L82-L86 VanDerWaalsContact O-CB 3.26Å; L82-L86 WeakPolarHBondContact O-CB 3.47Å; L82-L86 PolarHBondContact O-N 2.91Å; G83-L86 PolarHBondContact O-N 2.76Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.32Å; L86-K89 PolarHBondContact O-N 2.95Å; L86-K89 VanDerWaalsContact O-N 3.12Å; L86-I90 HydrophobicContact CD1-CD1 3.4Å; L86-I90 VanDerWaalsContact CD1-CD1 3.4Å; L86-I90 HydrophobicContact CD1-CG1 4Å; L86-I90 HydrophobicContact CD2-CD1 4.49Å; L86-I90 HydrophobicContact CG-CD1 3.85Å; L86-I90 HydrophobicContact CG-CG1 4.32Å; L86-I90 PolarHBondContact O-N 2.76Å; L86-V95 HydrophobicContact CB-CG2 3.93Å; L86-V95 HydrophobicContact CD2-CG1 4.47Å; L86-V95 HydrophobicContact CD2-CG2 3.91Å; L86-V95 HydrophobicContact CG-CG2 3.67Å; L86-L98 HydrophobicContact CD2-CD2 4.33Å |
| 87 | S | 81.5 | Confident | 83 | Confident | 28 Ų | 28 | 63.8 Ų | 63.8 | 20% | 0.196 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.8 | -26.2 | 178.9 | 74.6 | 0 | 0 | 0 | 0 | 113.7 | G83 G84 F85 G91 | G83-S87 WeakPolarHBondContact O-CB 3.49Å; G83-S87 PolarHBondContact O-N 3.47Å; G84-S87 PolarHBondContact O-N 2.91Å; G84-S87 PolarHBondContact O-OG 2.88Å; F85-S87 VanDerWaalsContact C-N 3.28Å; F85-S87 PolarHBondContact O-N 3.36Å; S87-G91 CarbonylContact O-C 3.58Å; S87-G91 VanDerWaalsContact O-C 3.3Å; S87-G91 WeakPolarHBondContact O-CA 3.47Å; S87-G91 PolarHBondContact O-N 3.47Å |
| 88 | R | 78.8 | Confident | 82.5 | Confident | 149 Ų | 149 | 64.4 Ų | 64.4 | 56% | 0.562 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -76.4 | -23.3 | 174.1 | -65.4 | -179.2 | -175.9 | -176.7 | -2.4 | 113 | G84 F85 L86 | G84-R88 PolarHBondContact O-N 3.4Å; F85-R88 PolarHBondContact O-N 3.42Å; L86-R88 VanDerWaalsContact C-N 3.26Å; L86-R88 PolarHBondContact O-N 3.32Å |
| 89 | K | 81.9 | Confident | 81.7 | Confident | 142 Ų | 142 | 58.8 Ų | 58.8 | 62% | 0.617 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -97.8 | -36 | -175.2 | -77.5 | -167.5 | 171.7 | -172.7 | 0 | 114.6 | F85 L86 | F85-K89 HydrophobicContact CE1-CD 3.9Å; F85-K89 HydrophobicContact CZ-CD 4.09Å; L86-K89 PolarHBondContact O-N 2.95Å; L86-K89 VanDerWaalsContact O-N 3.12Å |
| 90 | I | 77.2 | Confident | 80.9 | Confident | 97 Ų | 97 | 56.9 Ų | 56.9 | 50% | 0.497 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -115.3 | 0.1 | -174.3 | -38.3 | -177.1 | 0 | 0 | 0 | 110.6 | L86 P94 | L86-I90 HydrophobicContact CD1-CD1 3.4Å; L86-I90 VanDerWaalsContact CD1-CD1 3.4Å; L86-I90 HydrophobicContact CD1-CG1 4Å; L86-I90 HydrophobicContact CD2-CD1 4.49Å; L86-I90 HydrophobicContact CG-CD1 3.85Å; L86-I90 HydrophobicContact CG-CG1 4.32Å; L86-I90 PolarHBondContact O-N 2.76Å; I90-P94 HydrophobicContact CB-CG 4.06Å; I90-P94 HydrophobicContact CG2-CB 4.22Å; I90-P94 HydrophobicContact CG2-CG 3.56Å; I90-P94 WeakPolarHBondContact O-CG 3.18Å |
| 91 | G | 73.2 | Confident | 80 | Confident | 9 Ų | 9 | 57.9 Ų | 57.9 | 9% | 0.093 | 30% | 0.296 | C | S | . | . | trans | 77.4 | 168.9 | -168.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | S87 V95 | S87-G91 CarbonylContact O-C 3.58Å; S87-G91 VanDerWaalsContact O-C 3.3Å; S87-G91 WeakPolarHBondContact O-CA 3.47Å; S87-G91 PolarHBondContact O-N 3.47Å; G91-V95 WeakPolarHBondContact O-CG2 3.32Å | ||
| 92 | Y | 78.7 | Confident | 78.9 | Confident | 19 Ų | 19 | 55.7 Ų | 55.7 | 8% | 0.075 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -74.8 | -33 | -173.3 | 72.8 | -86.8 | 0 | 0 | 0 | 113.9 | V95 L96 V155 S237 I250 | Y92-V95 PolarHBondContact O-N 3.39Å; Y92-L96 VanDerWaalsContact O-CB 3.31Å; Y92-L96 WeakPolarHBondContact O-CB 3.41Å; Y92-L96 PolarHBondContact O-N 3.26Å; Y92-V155 HydrophobicContact CD1-CG2 4.36Å; Y92-V155 HydrophobicContact CD2-CG1 4.41Å; Y92-V155 HydrophobicContact CD2-CG2 3.6Å; Y92-V155 HydrophobicContact CE2-CG1 4.28Å; Y92-V155 HydrophobicContact CE2-CG2 4.25Å; Y92-V155 HydrophobicContact CG-CG2 3.66Å; Y92-S237 WeakPolarHBondContact CE1-OG 3.31Å; Y92-S237 WeakPolarHBondContact OH-CB 3.47Å; Y92-S237 PolarHBondContact OH-N 3.49Å; Y92-S237 PolarHBondContact OH-OG 3.47Å; Y92-I250 HydrophobicContact CE1-CG2 4.45Å |
| 93 | R | 76.8 | Confident | 77.4 | Confident | 156 Ų | 156 | 52 Ų | 52 | 59% | 0.589 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -64.3 | -51.5 | -173.3 | -60.6 | -176.2 | 84.5 | 158.8 | 4.6 | 113.2 | V95 L96 A97 | R93-V95 VanDerWaalsContact C-N 3.32Å; R93-V95 PolarHBondContact O-N 3.05Å; R93-L96 PolarHBondContact O-N 3.36Å; R93-A97 WeakPolarHBondContact O-CB 3.46Å; R93-A97 PolarHBondContact O-N 2.96Å |
| 94 | P | 78.1 | Confident | 76.3 | Confident | 59 Ų | 59 | 55.7 Ų | 55.7 | 38% | 0.383 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -68 | -33 | 179.3 | 24.7 | -31.8 | 0 | 0 | 0 | 112 | I90 A97 L98 | I90-P94 HydrophobicContact CB-CG 4.06Å; I90-P94 HydrophobicContact CG2-CB 4.22Å; I90-P94 HydrophobicContact CG2-CG 3.56Å; I90-P94 WeakPolarHBondContact O-CG 3.18Å; P94-A97 PolarHBondContact O-N 3.41Å; P94-L98 WeakPolarHBondContact O-CB 3.45Å; P94-L98 PolarHBondContact O-N 3.47Å |
| 95 | V | 80.3 | Confident | 75 | Confident | 1 Ų | 1 | 58 Ų | 58 | 1% | 0.006 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.7 | -43 | 176.5 | 179 | 0 | 0 | 0 | 0 | 111.3 | L86 G91 Y92 R93 L98 S99 V151 | L86-V95 HydrophobicContact CB-CG2 3.93Å; L86-V95 HydrophobicContact CD2-CG1 4.47Å; L86-V95 HydrophobicContact CD2-CG2 3.91Å; L86-V95 HydrophobicContact CG-CG2 3.67Å; G91-V95 WeakPolarHBondContact O-CG2 3.32Å; Y92-V95 PolarHBondContact O-N 3.39Å; R93-V95 VanDerWaalsContact C-N 3.32Å; R93-V95 PolarHBondContact O-N 3.05Å; V95-L98 PolarHBondContact O-N 3.45Å; V95-S99 WeakPolarHBondContact O-CB 3.23Å; V95-S99 PolarHBondContact O-N 3.47Å; V95-V151 HydrophobicContact CG1-CG2 3.92Å |
| 96 | L | 80 | Confident | 73.1 | Confident | 3 Ų | 3 | 55.6 Ų | 55.6 | 2% | 0.016 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -70.9 | -37 | 177.3 | -168.8 | 60.5 | 0 | 0 | 0 | 112.2 | I31 Y92 R93 L98 S99 C100 T152 L232 L235 | I31-L96 HydrophobicContact CD1-CD1 4.28Å; I31-L96 HydrophobicContact CD1-CD2 3.8Å; I31-L96 HydrophobicContact CD1-CG 4.31Å; I31-L96 HydrophobicContact CG2-CD1 4.42Å; Y92-L96 VanDerWaalsContact O-CB 3.31Å; Y92-L96 WeakPolarHBondContact O-CB 3.41Å; Y92-L96 PolarHBondContact O-N 3.26Å; R93-L96 PolarHBondContact O-N 3.36Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-S99 WeakPolarHBondContact O-CB 3.21Å; L96-S99 PolarHBondContact O-N 3.2Å; L96-C100 WeakPolarHBondContact O-CB 3.4Å; L96-C100 PolarHBondContact O-N 2.96Å; L96-C100 PolarHBondContact O-SG 3.37Å; L96-T152 WeakPolarHBondContact CD1-OG1 3.49Å; L96-L232 HydrophobicContact CB-CD2 4.07Å; L96-L232 HydrophobicContact CD2-CD2 3.59Å; L96-L232 HydrophobicContact CG-CD2 3.49Å; L96-L232 VanDerWaalsContact CG-CD2 3.49Å; L96-L235 HydrophobicContact CD2-CD2 3.2Å |
| 97 | A | 80.2 | Confident | 70.8 | Confident | 48 Ų | 48 | 63.3 Ų | 63.3 | 40% | 0.397 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | R93 P94 C100 L101 | R93-A97 WeakPolarHBondContact O-CB 3.46Å; R93-A97 PolarHBondContact O-N 2.96Å; P94-A97 PolarHBondContact O-N 3.41Å; A97-C100 PolarHBondContact O-N 3.26Å; A97-L101 VanDerWaalsContact O-CB 3.23Å; A97-L101 WeakPolarHBondContact O-CB 3.28Å; A97-L101 PolarHBondContact O-N 3.45Å |
| 98 | L | 81.5 | Confident | 68.8 | Low | 59 Ų | 59 | 67.2 Ų | 67.2 | 31% | 0.309 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -65.5 | -43.4 | 176.6 | -179.4 | 62.5 | 0 | 0 | 0 | 111.6 | L86 P94 V95 L96 L101 F102 L147 | L86-L98 HydrophobicContact CD2-CD2 4.33Å; P94-L98 WeakPolarHBondContact O-CB 3.45Å; P94-L98 PolarHBondContact O-N 3.47Å; V95-L98 PolarHBondContact O-N 3.45Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L98-L101 WeakPolarHBondContact O-CB 3.28Å; L98-L101 PolarHBondContact O-N 2.91Å; L98-F102 HydrophobicContact CD1-CD2 3.95Å; L98-F102 HydrophobicContact CD1-CE2 3.47Å; L98-F102 VanDerWaalsContact CD1-CE2 3.47Å; L98-F102 HydrophobicContact CD1-CZ 4.12Å; L98-F102 HydrophobicContact CD2-CE2 4.03Å; L98-F102 HydrophobicContact CG-CD2 3.86Å; L98-F102 HydrophobicContact CG-CE2 3.52Å; L98-F102 WeakPolarHBondContact O-CD2 3.45Å; L98-F102 PolarHBondContact O-N 3.05Å; L98-L147 HydrophobicContact CD2-CD1 4.21Å; L98-L147 HydrophobicContact CG-CD1 4.35Å |
| 99 | S | 77.7 | Confident | 66.8 | Low | 0 Ų | 0 | 66.5 Ų | 66.5 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -55.5 | -51.4 | 172.4 | 163 | 0 | 0 | 0 | 0 | 111.2 | Y35 V95 L96 L101 F102 L103 G144 G148 | Y35-S99 PolarHBondContact OH-OG 3.06Å; V95-S99 WeakPolarHBondContact O-CB 3.23Å; V95-S99 PolarHBondContact O-N 3.47Å; L96-S99 WeakPolarHBondContact O-CB 3.21Å; L96-S99 PolarHBondContact O-N 3.2Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.19Å; S99-F102 PolarHBondContact O-N 3.46Å; S99-L103 WeakPolarHBondContact O-CD1 3.5Å; S99-L103 PolarHBondContact O-N 3.01Å; S99-G144 VanDerWaalsContact CB-O 3.32Å; S99-G144 WeakPolarHBondContact CB-O 3.21Å; S99-G144 WeakPolarHBondContact O-CA 3.13Å; S99-G144 PolarHBondContact OG-O 3.33Å; S99-G148 WeakPolarHBondContact OG-CA 3.28Å; S99-G148 PolarHBondContact OG-N 3.03Å |
| 100 | C | 73.2 | Confident | 64.4 | Low | 5 Ų | 5 | 67.8 Ų | 67.8 | 3% | 0.034 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.9 | -34.7 | 177 | -65.3 | 0 | 0 | 0 | 0 | 112 | L96 A97 L103 R104 Q228 L232 | L96-C100 WeakPolarHBondContact O-CB 3.4Å; L96-C100 PolarHBondContact O-N 2.96Å; L96-C100 PolarHBondContact O-SG 3.37Å; A97-C100 PolarHBondContact O-N 3.26Å; C100-L103 CarbonylContact O-C 3.11Å; C100-L103 PolarHBondContact O-N 3.14Å; C100-R104 WeakPolarHBondContact O-CB 3.37Å; C100-R104 PolarHBondContact O-N 3.37Å; C100-Q228 HydrophobicContact CB-CB 4.45Å; C100-L232 HydrophobicContact CB-CD1 3.8Å |
| 101 | L | 68.4 | Low | 62.6 | Low | 94 Ų | 94 | 69.5 Ų | 69.5 | 49% | 0.492 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -65.9 | -40.6 | 176.7 | -172.1 | 71.1 | 0 | 0 | 0 | 111.6 | A97 L98 S99 L103 R104 | A97-L101 VanDerWaalsContact O-CB 3.23Å; A97-L101 WeakPolarHBondContact O-CB 3.28Å; A97-L101 PolarHBondContact O-N 3.45Å; L98-L101 WeakPolarHBondContact O-CB 3.28Å; L98-L101 PolarHBondContact O-N 2.91Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.19Å; L101-L103 PolarHBondContact O-N 3.42Å; L101-R104 PolarHBondContact O-N 3.21Å |
| 102 | F | 67.5 | Low | 60.8 | Low | 45 Ų | 45 | 76.3 Ų | 76.3 | 20% | 0.197 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -61.9 | -30.8 | 174 | -81.6 | -63.3 | 0 | 0 | 0 | 112.5 | L98 S99 G118 L140 L147 | L98-F102 HydrophobicContact CD1-CD2 3.95Å; L98-F102 HydrophobicContact CD1-CE2 3.47Å; L98-F102 VanDerWaalsContact CD1-CE2 3.47Å; L98-F102 HydrophobicContact CD1-CZ 4.12Å; L98-F102 HydrophobicContact CD2-CE2 4.03Å; L98-F102 HydrophobicContact CG-CD2 3.86Å; L98-F102 HydrophobicContact CG-CE2 3.52Å; L98-F102 WeakPolarHBondContact O-CD2 3.45Å; L98-F102 PolarHBondContact O-N 3.05Å; S99-F102 PolarHBondContact O-N 3.46Å; F102-G118 PolarHBondContact O-N 3.16Å; F102-L140 HydrophobicContact CD1-CD2 3.98Å; F102-L140 HydrophobicContact CE1-CD2 4.27Å; F102-L147 HydrophobicContact CD2-CD1 3.85Å; F102-L147 HydrophobicContact CE2-CD1 3.75Å |
| 103 | L | 58.7 | Low | 58.9 | Low | 4 Ų | 4 | 81.8 Ų | 81.8 | 2% | 0.021 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -81.8 | -28.6 | 176.4 | -76.3 | 148 | 0 | 0 | 0 | 113.3 | Y35 S99 C100 L101 F141 V145 | Y35-L103 HydrophobicContact CD1-CD1 3.9Å; Y35-L103 HydrophobicContact CE1-CD1 3.48Å; Y35-L103 VanDerWaalsContact CE1-CD1 3.48Å; S99-L103 WeakPolarHBondContact O-CD1 3.5Å; S99-L103 PolarHBondContact O-N 3.01Å; C100-L103 CarbonylContact O-C 3.11Å; C100-L103 PolarHBondContact O-N 3.14Å; L101-L103 PolarHBondContact O-N 3.42Å; L103-F141 HydrophobicContact CD2-CD2 3.24Å; L103-F141 HydrophobicContact CD2-CE2 3.23Å; L103-F141 HydrophobicContact CD2-CG 4.04Å; L103-F141 HydrophobicContact CD2-CZ 4.05Å; L103-V145 HydrophobicContact CD1-CG2 4.46Å; L103-V145 HydrophobicContact CD2-CG2 4.36Å |
| 104 | R | 57.4 | Low | 56.8 | Low | 76 Ų | 76 | 83.2 Ų | 83.2 | 29% | 0.287 | 44% | 0.438 | S | S | . | . | trans | -102.7 | 127.2 | -171.6 | 174.3 | 171.7 | 179.2 | -162.6 | 0.3 | 111.8 | C100 L101 S225 I229 | C100-R104 WeakPolarHBondContact O-CB 3.37Å; C100-R104 PolarHBondContact O-N 3.37Å; L101-R104 PolarHBondContact O-N 3.21Å; R104-S225 WeakPolarHBondContact CG-OG 3.36Å; R104-I229 VanDerWaalsContact NH1-CD1 3.25Å; R104-I229 VanDerWaalsContact NH1-CG1 3.27Å | ||
| 105 | L | 55 | Low | 54.8 | Low | 72 Ų | 72 | 88 Ų | 88 | 38% | 0.377 | 46% | 0.459 | S | S | . | . | trans | -129.4 | 127.6 | 132.7 | -67.9 | -173.3 | 0 | 0 | 0 | 108 | L120 L121 | L105-L120 HydrophobicContact CB-CB 3.92Å; L105-L120 HydrophobicContact CB-CD1 4.28Å; L105-L120 HydrophobicContact CB-CG 4.17Å; L105-L120 WeakPolarHBondContact O-CD1 3.21Å; L105-L120 WeakPolarHBondContact O-CG 3.45Å; L105-L121 HydrophobicContact CD1-CD1 3.67Å | ||
| 106 | I | 45.8 | Very low | 52.6 | Low | 61 Ų | 61 | 90.2 Ų | 90.2 | 31% | 0.313 | 47% | 0.474 | S | S | . | . | trans | -153.9 | 127.9 | 141.5 | -93 | 125 | 0 | 0 | 0 | 102.7 | T108 L120 V222 | I106-T108 PolarHBondContact O-N 2.94Å; I106-L120 HydrophobicContact CD1-CD1 4.15Å; I106-L120 HydrophobicContact CD1-CD2 4.08Å; I106-L120 HydrophobicContact CD1-CG 4.19Å; I106-L120 HydrophobicContact CG1-CD2 4.48Å; I106-L120 HydrophobicContact CG1-CG 4.36Å; I106-V222 VanDerWaalsContact CD1-CA 3.5Å; I106-V222 HydrophobicContact CD1-CB 3.9Å; I106-V222 HydrophobicContact CD1-CG2 3.24Å; I106-V222 VanDerWaalsContact CD1-N 3.26Å; I106-V222 HydrophobicContact CG1-CG2 4.07Å | ||
| 107 | K | 35.6 | Very low | 51 | Low | 203 Ų | 203 | 90 Ų | 90 | 88% | 0.883 | 47% | 0.474 | S | S | * | . | trans | -26.2 | 124.4 | 172.8 | -79.4 | -173.4 | 168.3 | -176.8 | 0 | 112.5 | ||||
| 108 | T | 38.9 | Very low | 49.6 | Very low | 109 Ų | 109 | 87.8 Ų | 87.8 | 67% | 0.669 | 46% | 0.455 | S | S | * | . | trans | -144 | 116.6 | 140 | -47 | 0 | 0 | 0 | 0 | 107.5 | I106 | I106-T108 PolarHBondContact O-N 2.94Š| ||
| 109 | T | 35.9 | Very low | 48.5 | Very low | 134 Ų | 134 | 85 Ų | 85 | 82% | 0.822 | 44% | 0.44 | S | S | * | . | S | Bend | trans | 82.9 | 144 | 164.1 | -6.8 | 0 | 0 | 0 | 0 | 118.4 | ||
| 110 | Q | 33 | Very low | 47.5 | Very low | 169 Ų | 169 | 85.5 Ų | 85.5 | 79% | 0.79 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -56.1 | 152.9 | -178.5 | -67.1 | -124.2 | -68.4 | 0 | 0 | 113.9 | ||
| 111 | I | 39.3 | Very low | 46.7 | Very low | 134 Ų | 134 | 88 Ų | 88 | 69% | 0.687 | 46% | 0.456 | S | S | * | . | S | Bend | trans | 75.4 | 116.7 | 160.3 | -61 | 152 | 0 | 0 | 0 | 114.6 | ||
| 112 | D | 34.4 | Very low | 46.2 | Very low | 151 Ų | 151 | 83.5 Ų | 83.5 | 81% | 0.807 | 43% | 0.432 | S | S | * | . | trans | 66.2 | 98.9 | 163.5 | -50 | -28.8 | 0 | 0 | 0 | 118.7 | ||||
| 113 | C | 38.2 | Very low | 45.9 | Very low | 134 Ų | 134 | 84.3 Ų | 84.3 | 91% | 0.905 | 43% | 0.434 | S | S | * | . | -176.2 | 139.2 | 110.5 | -156.5 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 114 | K | 34.3 | Very low | 46 | Very low | 186 Ų | 186 | 90.4 Ų | 90.4 | 81% | 0.809 | 46% | 0.461 | S | S | * | . | trans | -80.4 | 145 | 176.7 | -69.4 | 165.4 | 173.5 | 172.1 | 0 | 109.8 | ||||
| 115 | I | 35.4 | Very low | 46.1 | Very low | 161 Ų | 161 | 87.9 Ų | 87.9 | 83% | 0.826 | 45% | 0.454 | S | S | * | . | S | Bend | trans | 81.6 | 116.2 | 152.9 | -66.7 | 159.1 | 0 | 0 | 0 | 118.1 | ||
| 116 | S | 35.2 | Very low | 46.4 | Very low | 46 Ų | 46 | 84.4 Ų | 84.4 | 32% | 0.322 | 44% | 0.436 | S | S | . | . | trans | 92.5 | 123 | 154.9 | -124 | 0 | 0 | 0 | 0 | 119.8 | L140 | S116-L140 VanDerWaalsContact OG-CD2 3.31Å; S116-L140 WeakPolarHBondContact OG-CD2 3.2Å | ||
| 117 | G | 45.8 | Very low | 47.1 | Very low | 0 Ų | 0 | 85.9 Ų | 85.9 | 0% | 0 | 44% | 0.441 | C | S | . | . | trans | -174.1 | 135.2 | 165.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | L121 L140 | G117-L121 VanDerWaalsContact O-CB 3.25Å; G117-L121 WeakPolarHBondContact O-CB 2.74Å; G117-L121 VanDerWaalsContact O-CD1 3.26Å; G117-L121 WeakPolarHBondContact O-CD1 3.09Å; G117-L140 WeakPolarHBondContact O-CD1 2.88Å | ||
| 118 | G | 51.1 | Low | 48.7 | Very low | 0 Ų | 0 | 84.3 Ų | 84.3 | 0% | 0 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -79.4 | -64.8 | -160 | 0 | 0 | 0 | 0 | 0 | 117.4 | F102 L120 L121 S122 T136 | F102-G118 PolarHBondContact O-N 3.16Å; G118-L120 PolarHBondContact O-N 3.22Å; G118-L121 PolarHBondContact O-N 2.65Å; G118-S122 PolarHBondContact O-N 3.21Å; G118-S122 PolarHBondContact O-OG 2.69Å; G118-S122 VanDerWaalsContact O-OG 3.07Å; G118-T136 CarbonylContact C-O 3.56Å; G118-T136 WeakPolarHBondContact CA-O 3.38Å; G118-T136 CarbonylContact O-C 3.34Å; G118-T136 WeakPolarHBondContact O-CB 3.44Å; G118-T136 VanDerWaalsContact O-O 3.07Å |
| 119 | V | 56.8 | Low | 50.5 | Low | 1 Ų | 1 | 82.2 Ų | 82.2 | 1% | 0.006 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -73.9 | -29 | -165.9 | -177.6 | 0 | 0 | 0 | 0 | 112.6 | S122 Y137 F141 F217 | V119-S122 WeakPolarHBondContact O-CB 3.38Å; V119-S122 PolarHBondContact O-N 2.9Å; V119-S122 PolarHBondContact O-OG 3.46Å; V119-Y137 HydrophobicContact CG1-CD2 4.4Å; V119-Y137 HydrophobicContact CG1-CE2 4.23Å; V119-Y137 HydrophobicContact CG2-CD2 4.36Å; V119-Y137 HydrophobicContact CG2-CE2 4.44Å; V119-F141 HydrophobicContact CG2-CD2 3.91Å; V119-F217 HydrophobicContact CG1-CD1 4.22Å |
| 120 | L | 57.4 | Low | 52.6 | Low | 11 Ų | 11 | 77.5 Ų | 77.5 | 6% | 0.058 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -85.3 | -27.1 | 176.8 | -76.5 | 80.2 | 0 | 0 | 0 | 113.7 | L105 I106 G118 S122 Y123 L218 | L105-L120 HydrophobicContact CB-CB 3.92Å; L105-L120 HydrophobicContact CB-CD1 4.28Å; L105-L120 HydrophobicContact CB-CG 4.17Å; L105-L120 WeakPolarHBondContact O-CD1 3.21Å; L105-L120 WeakPolarHBondContact O-CG 3.45Å; I106-L120 HydrophobicContact CD1-CD1 4.15Å; I106-L120 HydrophobicContact CD1-CD2 4.08Å; I106-L120 HydrophobicContact CD1-CG 4.19Å; I106-L120 HydrophobicContact CG1-CD2 4.48Å; I106-L120 HydrophobicContact CG1-CG 4.36Å; G118-L120 PolarHBondContact O-N 3.22Å; L120-S122 PolarHBondContact O-N 3.5Å; L120-Y123 WeakPolarHBondContact O-CB 3.37Å; L120-Y123 PolarHBondContact O-N 3.02Å; L120-Y123 VanDerWaalsContact O-N 3.15Å; L120-L218 HydrophobicContact CD2-CB 4.44Å; L120-L218 HydrophobicContact CD2-CD2 3.55Å; L120-L218 HydrophobicContact CD2-CG 4.29Å |
| 121 | L | 57 | Low | 54.9 | Low | 57 Ų | 57 | 73.6 Ų | 73.6 | 30% | 0.298 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.7 | -26.2 | 166.7 | -101.4 | 65.3 | 0 | 0 | 0 | 110.3 | L105 G117 G118 Y123 F124 T125 T136 | L105-L121 HydrophobicContact CD1-CD1 3.67Å; G117-L121 VanDerWaalsContact O-CB 3.25Å; G117-L121 WeakPolarHBondContact O-CB 2.74Å; G117-L121 VanDerWaalsContact O-CD1 3.26Å; G117-L121 WeakPolarHBondContact O-CD1 3.09Å; G118-L121 PolarHBondContact O-N 2.65Å; L121-Y123 PolarHBondContact O-N 3.21Å; L121-F124 PolarHBondContact O-N 2.85Å; L121-T125 VanDerWaalsContact O-CB 3.25Å; L121-T125 WeakPolarHBondContact O-CB 3.41Å; L121-T125 PolarHBondContact O-N 3.41Å; L121-T125 PolarHBondContact O-OG1 3.31Å; L121-T136 HydrophobicContact CB-CG2 3.55Å; L121-T136 HydrophobicContact CD2-CG2 3.87Å; L121-T136 HydrophobicContact CG-CG2 4.32Å |
| 122 | S | 56.8 | Low | 56.8 | Low | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -59.3 | -30.4 | 173.8 | -47.6 | 0 | 0 | 0 | 0 | 112.3 | G118 V119 L120 F124 T125 I126 T136 Y137 | G118-S122 PolarHBondContact O-N 3.21Å; G118-S122 PolarHBondContact O-OG 2.69Å; G118-S122 VanDerWaalsContact O-OG 3.07Å; V119-S122 WeakPolarHBondContact O-CB 3.38Å; V119-S122 PolarHBondContact O-N 2.9Å; V119-S122 PolarHBondContact O-OG 3.46Å; L120-S122 PolarHBondContact O-N 3.5Å; S122-F124 PolarHBondContact O-N 3.2Å; S122-T125 PolarHBondContact O-N 3.22Å; S122-I126 WeakPolarHBondContact O-CB 3.48Å; S122-I126 VanDerWaalsContact O-CG2 3.23Å; S122-I126 WeakPolarHBondContact O-CG2 3.47Å; S122-I126 PolarHBondContact O-N 2.97Å; S122-T136 PolarHBondContact OG-OG1 2.97Å; S122-Y137 WeakPolarHBondContact OG-CA 3.44Å; S122-Y137 WeakPolarHBondContact OG-CB 3.32Å; S122-Y137 PolarHBondContact OG-N 3.47Å |
| 123 | Y | 60.9 | Low | 59.1 | Low | 61 Ų | 61 | 60.5 Ų | 60.5 | 24% | 0.239 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -57.9 | -47.4 | 170.8 | 176.6 | -93.1 | 0 | 0 | 0 | 112.1 | L120 L121 P214 L218 | L120-Y123 WeakPolarHBondContact O-CB 3.37Å; L120-Y123 PolarHBondContact O-N 3.02Å; L120-Y123 VanDerWaalsContact O-N 3.15Å; L121-Y123 PolarHBondContact O-N 3.21Å; Y123-P214 HydrophobicContact CD2-CB 3.49Å; Y123-P214 VanDerWaalsContact CD2-CB 3.49Å; Y123-P214 WeakPolarHBondContact CD2-O 3.06Å; Y123-P214 HydrophobicContact CE2-CB 3.51Å; Y123-L218 HydrophobicContact CD2-CD1 3.75Å; Y123-L218 HydrophobicContact CD2-CG 4.05Å; Y123-L218 HydrophobicContact CE2-CD1 3.85Å; Y123-L218 HydrophobicContact CG-CD1 4.36Å; Y123-L218 HydrophobicContact CG-CG 4.41Å |
| 124 | F | 61.4 | Low | 61.2 | Low | 132 Ų | 132 | 55 Ų | 55 | 58% | 0.579 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -76.2 | -28.5 | 179.6 | -76.3 | -74.8 | 0 | 0 | 0 | 112.8 | L121 S122 | L121-F124 PolarHBondContact O-N 2.85Å; S122-F124 PolarHBondContact O-N 3.2Å |
| 125 | T | 60.2 | Low | 63.5 | Low | 23 Ų | 23 | 50.6 Ų | 50.6 | 14% | 0.141 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -93.2 | -27.7 | -168.5 | -47.8 | 0 | 0 | 0 | 0 | 112.2 | L121 S122 Q127 K128 T129 G132 T136 | L121-T125 VanDerWaalsContact O-CB 3.25Å; L121-T125 WeakPolarHBondContact O-CB 3.41Å; L121-T125 PolarHBondContact O-N 3.41Å; L121-T125 PolarHBondContact O-OG1 3.31Å; S122-T125 PolarHBondContact O-N 3.22Å; T125-Q127 PolarHBondContact O-N 3.3Å; T125-K128 PolarHBondContact O-N 2.56Å; T125-T129 HydrophobicContact CG2-CG2 4.49Å; T125-T129 PolarHBondContact O-N 3.41Å; T125-G132 WeakPolarHBondContact CG2-O 3.4Å; T125-T136 HydrophobicContact CG2-CG2 4.39Å |
| 126 | I | 61.4 | Low | 65.6 | Low | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 22% | 0.22 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -23.2 | 171.3 | -157.4 | 165.9 | 0 | 0 | 0 | 112.1 | I48 Y51 L52 I56 S122 K128 V133 L213 P214 F217 | I48-I126 HydrophobicContact CG2-CD1 4.32Å; Y51-I126 HydrophobicContact CD1-CD1 3.8Å; Y51-I126 HydrophobicContact CD1-CG1 3.53Å; Y51-I126 HydrophobicContact CE1-CB 4.48Å; Y51-I126 HydrophobicContact CE1-CD1 4.36Å; Y51-I126 HydrophobicContact CE1-CG1 3.81Å; Y51-I126 HydrophobicContact CE1-CG2 4.19Å; Y51-I126 WeakPolarHBondContact CE1-O 3.32Å; Y51-I126 HydrophobicContact CG-CD1 4.07Å; Y51-I126 HydrophobicContact CG-CG1 4.3Å; L52-I126 HydrophobicContact CD2-CG1 3.97Å; L52-I126 HydrophobicContact CG-CG1 4.4Å; I56-I126 VanDerWaalsContact CD1-O 3.28Å; I56-I126 WeakPolarHBondContact CD1-O 3.39Å; I56-I126 VanDerWaalsContact CG1-O 3.3Å; I56-I126 WeakPolarHBondContact CG1-O 3.46Å; S122-I126 WeakPolarHBondContact O-CB 3.48Å; S122-I126 VanDerWaalsContact O-CG2 3.23Å; S122-I126 WeakPolarHBondContact O-CG2 3.47Å; S122-I126 PolarHBondContact O-N 2.97Å; I126-K128 VanDerWaalsContact C-N 3.32Å; I126-V133 VanDerWaalsContact CA-CG2 3.46Å; I126-V133 HydrophobicContact CB-CG2 4Å; I126-V133 HydrophobicContact CG1-CG2 4.09Å; I126-L213 HydrophobicContact CD1-CD2 3.45Å; I126-L213 VanDerWaalsContact CD1-CD2 3.45Å; I126-L213 HydrophobicContact CD1-CG 4.22Å; I126-P214 HydrophobicContact CG2-CG 4.34Å; I126-F217 HydrophobicContact CD1-CE2 3.69Å; I126-F217 HydrophobicContact CD1-CZ 4.39Å |
| 127 | Q | 60.4 | Low | 67.8 | Low | 92 Ų | 92 | 41.4 Ų | 41.4 | 43% | 0.43 | 21% | 0.206 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -82.2 | -3.7 | 175.9 | -64.4 | -175.4 | -18 | 0 | 0 | 114.3 | T125 | T125-Q127 PolarHBondContact O-N 3.3Š|
| 128 | K | 68.6 | Low | 69.7 | Low | 169 Ų | 169 | 41.4 Ų | 41.4 | 74% | 0.735 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -126.1 | -51 | -171.4 | -66.1 | -168 | 178 | -173.4 | 0 | 114.7 | T125 I126 | T125-K128 PolarHBondContact O-N 2.56Å; I126-K128 VanDerWaalsContact C-N 3.32Å |
| 129 | T | 77.7 | Confident | 71.4 | Confident | 65 Ų | 65 | 45.1 Ų | 45.1 | 40% | 0.399 | 22% | 0.222 | S | C | . | . | trans | -159.5 | 140 | -171.7 | 177.1 | 0 | 0 | 0 | 0 | 112.8 | T125 V131 G132 V133 | T125-T129 HydrophobicContact CG2-CG2 4.49Å; T125-T129 PolarHBondContact O-N 3.41Å; T129-V131 VanDerWaalsContact C-N 3.34Å; T129-V131 PolarHBondContact O-N 2.86Å; T129-V131 PolarHBondContact OG1-N 3.42Å; T129-G132 PolarHBondContact O-N 3.35Å; T129-V133 WeakPolarHBondContact O-CG2 3.15Å; T129-V133 PolarHBondContact O-N 2.7Å | ||
| 130 | Y | 79.3 | Confident | 72.7 | Confident | 36 Ų | 36 | 45.7 Ų | 45.7 | 14% | 0.141 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -51.2 | -48.8 | 172.8 | 172.2 | -99.7 | 0 | 0 | 0 | 113.1 | M49 L52 I60 T64 F68 G132 V133 I134 | M49-Y130 HydrophobicContact CE-CE2 4.47Å; M49-Y130 HydrophobicContact SD-CE2 4.04Å; L52-Y130 HydrophobicContact CD1-CD2 3.81Å; I60-Y130 HydrophobicContact CD1-CD2 4.28Å; I60-Y130 HydrophobicContact CD1-CG 4.32Å; I60-Y130 HydrophobicContact CG2-CD2 4.18Å; I60-Y130 HydrophobicContact CG2-CE2 4.4Å; T64-Y130 VanDerWaalsContact C-OH 3.27Å; T64-Y130 VanDerWaalsContact CB-OH 3.22Å; T64-Y130 WeakPolarHBondContact CB-OH 3.16Å; T64-Y130 PolarHBondContact O-OH 3.4Å; T64-Y130 PolarHBondContact OG1-OH 3.37Å; F68-Y130 HydrophobicContact CE2-CE2 4.09Å; F68-Y130 HydrophobicContact CZ-CE2 4.46Å; Y130-G132 VanDerWaalsContact C-N 3.26Å; Y130-G132 PolarHBondContact O-N 2.97Å; Y130-V133 PolarHBondContact O-N 3.44Å; Y130-V133 VanDerWaalsContact O-N 3.08Å; Y130-I134 HydrophobicContact CD1-CD1 4.01Å; Y130-I134 HydrophobicContact CE1-CD1 3.27Å; Y130-I134 HydrophobicContact CE1-CG1 4.4Å; Y130-I134 HydrophobicContact CE2-CD1 4.15Å; Y130-I134 PolarHBondContact O-N 3.35Å; Y130-I134 WeakPolarHBondContact OH-CD1 3.26Å |
| 131 | V | 81.6 | Confident | 74 | Confident | 86 Ų | 86 | 45.5 Ų | 45.5 | 52% | 0.521 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.6 | -39.4 | -176.8 | 177.3 | 0 | 0 | 0 | 0 | 110.9 | T129 V133 I134 L135 | T129-V131 VanDerWaalsContact C-N 3.34Å; T129-V131 PolarHBondContact O-N 2.86Å; T129-V131 PolarHBondContact OG1-N 3.42Å; V131-V133 VanDerWaalsContact C-N 3.35Å; V131-V133 PolarHBondContact O-N 3.26Å; V131-I134 PolarHBondContact O-N 2.9Å; V131-L135 HydrophobicContact CG1-CD1 4.16Å; V131-L135 HydrophobicContact CG1-CG 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.44Å; V131-L135 PolarHBondContact O-N 2.83Å |
| 132 | G | 79.7 | Confident | 75.4 | Confident | 11 Ų | 11 | 42.8 Ų | 42.8 | 11% | 0.113 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -68.6 | -33.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | T125 T129 Y130 I134 L135 T136 | T125-G132 WeakPolarHBondContact CG2-O 3.4Å; T129-G132 PolarHBondContact O-N 3.35Å; Y130-G132 VanDerWaalsContact C-N 3.26Å; Y130-G132 PolarHBondContact O-N 2.97Å; G132-I134 VanDerWaalsContact C-N 3.33Å; G132-L135 PolarHBondContact O-N 3.43Å; G132-T136 WeakPolarHBondContact O-CB 3.47Å; G132-T136 VanDerWaalsContact O-CG2 3.26Å; G132-T136 WeakPolarHBondContact O-CG2 3.21Å; G132-T136 PolarHBondContact O-N 2.96Å; G132-T136 PolarHBondContact O-OG1 3.34Å |
| 133 | V | 80.9 | Confident | 76.8 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.1 | -42.5 | 174.1 | -169.6 | 0 | 0 | 0 | 0 | 109.8 | I48 L52 F68 I126 T129 Y130 V131 L135 T136 Y137 | I48-V133 HydrophobicContact CG2-CG1 4.11Å; L52-V133 HydrophobicContact CD1-CG2 4.31Å; L52-V133 HydrophobicContact CD2-CG2 4.05Å; F68-V133 HydrophobicContact CE1-CB 4.3Å; F68-V133 HydrophobicContact CE1-CG1 3.76Å; F68-V133 HydrophobicContact CZ-CB 4.35Å; F68-V133 HydrophobicContact CZ-CG1 4.03Å; I126-V133 VanDerWaalsContact CA-CG2 3.46Å; I126-V133 HydrophobicContact CB-CG2 4Å; I126-V133 HydrophobicContact CG1-CG2 4.09Å; T129-V133 WeakPolarHBondContact O-CG2 3.15Å; T129-V133 PolarHBondContact O-N 2.7Å; Y130-V133 PolarHBondContact O-N 3.44Å; Y130-V133 VanDerWaalsContact O-N 3.08Å; V131-V133 VanDerWaalsContact C-N 3.35Å; V131-V133 PolarHBondContact O-N 3.26Å; V133-L135 PolarHBondContact O-N 3.16Å; V133-T136 PolarHBondContact O-N 3.31Å; V133-T136 PolarHBondContact O-OG1 3.02Å; V133-Y137 WeakPolarHBondContact O-CA 3.22Å; V133-Y137 WeakPolarHBondContact O-CB 3.2Å; V133-Y137 PolarHBondContact O-N 3.46Å |
| 134 | I | 83.5 | Confident | 78 | Confident | 19 Ų | 19 | 40 Ų | 40 | 10% | 0.097 | 20% | 0.199 | C | C | . | . | I | π-helix | trans | -60 | -47.8 | 174.1 | -68 | 167.9 | 0 | 0 | 0 | 111.2 | W67 F68 V71 Y130 V131 G132 T136 S138 F139 | W67-I134 HydrophobicContact CB-CD1 4.02Å; F68-I134 HydrophobicContact CD1-CG1 4.33Å; F68-I134 HydrophobicContact CE1-CG1 4.06Å; F68-I134 HydrophobicContact CZ-CG1 4.22Å; V71-I134 HydrophobicContact CB-CG2 4.06Å; V71-I134 HydrophobicContact CG1-CG2 4.03Å; V71-I134 HydrophobicContact CG2-CG2 3.83Å; Y130-I134 HydrophobicContact CD1-CD1 4.01Å; Y130-I134 HydrophobicContact CE1-CD1 3.27Å; Y130-I134 HydrophobicContact CE1-CG1 4.4Å; Y130-I134 HydrophobicContact CE2-CD1 4.15Å; Y130-I134 PolarHBondContact O-N 3.35Å; Y130-I134 WeakPolarHBondContact OH-CD1 3.26Å; V131-I134 PolarHBondContact O-N 2.9Å; G132-I134 VanDerWaalsContact C-N 3.33Å; I134-T136 VanDerWaalsContact C-N 3.27Å; I134-T136 PolarHBondContact O-N 3.46Å; I134-S138 WeakPolarHBondContact O-CA 3.45Å; I134-S138 WeakPolarHBondContact O-CB 3.04Å; I134-S138 PolarHBondContact O-N 2.86Å; I134-F139 PolarHBondContact O-N 3.31Å |
| 135 | L | 82.3 | Confident | 79.2 | Confident | 93 Ų | 93 | 33.7 Ų | 33.7 | 49% | 0.487 | 17% | 0.171 | S | C | . | . | I | π-helix | trans | -63.1 | -36 | -178.3 | -70.9 | 175.2 | 0 | 0 | 0 | 112.2 | V131 G132 V133 F139 L140 | V131-L135 HydrophobicContact CG1-CD1 4.16Å; V131-L135 HydrophobicContact CG1-CG 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.44Å; V131-L135 PolarHBondContact O-N 2.83Å; G132-L135 PolarHBondContact O-N 3.43Å; V133-L135 PolarHBondContact O-N 3.16Å; L135-F139 VanDerWaalsContact O-CB 3.32Å; L135-F139 WeakPolarHBondContact O-CB 3.15Å; L135-L140 PolarHBondContact O-N 3.38Å |
| 136 | T | 79.6 | Confident | 80.5 | Confident | 10 Ų | 10 | 32.6 Ų | 32.6 | 6% | 0.061 | 17% | 0.165 | C | C | . | . | I | π-helix | trans | -87.1 | -47.4 | -176.5 | 56.7 | 0 | 0 | 0 | 0 | 111.6 | G118 L121 S122 T125 G132 V133 I134 L140 | G118-T136 CarbonylContact C-O 3.56Å; G118-T136 WeakPolarHBondContact CA-O 3.38Å; G118-T136 CarbonylContact O-C 3.34Å; G118-T136 WeakPolarHBondContact O-CB 3.44Å; G118-T136 VanDerWaalsContact O-O 3.07Å; L121-T136 HydrophobicContact CB-CG2 3.55Å; L121-T136 HydrophobicContact CD2-CG2 3.87Å; L121-T136 HydrophobicContact CG-CG2 4.32Å; S122-T136 PolarHBondContact OG-OG1 2.97Å; T125-T136 HydrophobicContact CG2-CG2 4.39Å; G132-T136 WeakPolarHBondContact O-CB 3.47Å; G132-T136 VanDerWaalsContact O-CG2 3.26Å; G132-T136 WeakPolarHBondContact O-CG2 3.21Å; G132-T136 PolarHBondContact O-N 2.96Å; G132-T136 PolarHBondContact O-OG1 3.34Å; V133-T136 PolarHBondContact O-N 3.31Å; V133-T136 PolarHBondContact O-OG1 3.02Å; I134-T136 VanDerWaalsContact C-N 3.27Å; I134-T136 PolarHBondContact O-N 3.46Å; T136-L140 WeakPolarHBondContact O-CB 3.25Å |
| 137 | Y | 82.1 | Confident | 81.8 | Confident | 3 Ų | 3 | 32.9 Ų | 32.9 | 1% | 0.012 | 17% | 0.166 | C | C | . | . | I | π-helix | trans | -79.9 | -40.8 | -176.5 | -166.6 | -127.1 | 0 | 0 | 0 | 112.9 | Y37 L41 I48 F68 V119 S122 V133 F141 F217 | Y37-Y137 HydrophobicContact CE1-CE2 4.03Å; Y37-Y137 PolarHBondContact OH-OH 3.3Å; L41-Y137 HydrophobicContact CD1-CD1 3.71Å; L41-Y137 HydrophobicContact CD1-CE1 3.03Å; I48-Y137 HydrophobicContact CD1-CD1 3.76Å; I48-Y137 HydrophobicContact CD1-CE1 3.38Å; F68-Y137 AromaticContact CD1-CD1 3.95Å; F68-Y137 HydrophobicContact CD1-CD1 3.95Å; F68-Y137 HydrophobicContact CE1-CD1 4.15Å; V119-Y137 HydrophobicContact CG1-CD2 4.4Å; V119-Y137 HydrophobicContact CG1-CE2 4.23Å; V119-Y137 HydrophobicContact CG2-CD2 4.36Å; V119-Y137 HydrophobicContact CG2-CE2 4.44Å; S122-Y137 WeakPolarHBondContact OG-CA 3.44Å; S122-Y137 WeakPolarHBondContact OG-CB 3.32Å; S122-Y137 PolarHBondContact OG-N 3.47Å; V133-Y137 WeakPolarHBondContact O-CA 3.22Å; V133-Y137 WeakPolarHBondContact O-CB 3.2Å; V133-Y137 PolarHBondContact O-N 3.46Å; Y137-F141 WeakPolarHBondContact O-CB 3.47Å; Y137-F217 HydrophobicContact CD2-CE1 4.01Å; Y137-F217 HydrophobicContact CE2-CD1 4.15Å; Y137-F217 AromaticContact CE2-CE1 3.64Å; Y137-F217 HydrophobicContact CE2-CE1 3.64Å; Y137-F217 AromaticContact CZ-CE1 3.94Å |
| 138 | S | 84.9 | Confident | 83 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 15% | 0.145 | C | C | . | . | I | π-helix | trans | -94.5 | -51.4 | -175.7 | -67.9 | 0 | 0 | 0 | 0 | 113.2 | F68 T72 I134 G142 | F68-S138 VanDerWaalsContact CA-OG 3.29Å; F68-S138 WeakPolarHBondContact CA-OG 3.41Å; F68-S138 WeakPolarHBondContact CD1-OG 3.33Å; F68-S138 WeakPolarHBondContact O-CB 3.35Å; F68-S138 PolarHBondContact O-OG 3.04Å; T72-S138 WeakPolarHBondContact OG1-CA 3.4Å; T72-S138 WeakPolarHBondContact OG1-CB 3.27Å; T72-S138 PolarHBondContact OG1-O 2.59Å; T72-S138 PolarHBondContact OG1-OG 3.16Å; I134-S138 WeakPolarHBondContact O-CA 3.45Å; I134-S138 WeakPolarHBondContact O-CB 3.04Å; I134-S138 PolarHBondContact O-N 2.86Å; S138-G142 PolarHBondContact O-N 2.99Å |
| 139 | F | 86.9 | Confident | 83.9 | Confident | 78 Ų | 78 | 21.5 Ų | 21.5 | 34% | 0.342 | 12% | 0.115 | S | C | . | . | I | π-helix | trans | -69.3 | -53.7 | -175.3 | 177.5 | -79.9 | 0 | 0 | 0 | 111.2 | V71 V75 I134 L135 F141 G142 T143 | V71-F139 HydrophobicContact CG1-CB 4.11Å; V75-F139 HydrophobicContact CB-CD2 4.48Å; V75-F139 HydrophobicContact CG1-CD2 4.23Å; V75-F139 HydrophobicContact CG1-CE2 4.37Å; V75-F139 HydrophobicContact CG2-CB 4.42Å; V75-F139 HydrophobicContact CG2-CD2 3.39Å; V75-F139 HydrophobicContact CG2-CE2 3.9Å; V75-F139 HydrophobicContact CG2-CG 4.13Å; I134-F139 PolarHBondContact O-N 3.31Å; L135-F139 VanDerWaalsContact O-CB 3.32Å; L135-F139 WeakPolarHBondContact O-CB 3.15Å; F139-F141 VanDerWaalsContact C-N 3.33Å; F139-F141 PolarHBondContact O-N 3.47Å; F139-G142 PolarHBondContact O-N 3.29Å; F139-G142 VanDerWaalsContact O-N 3.13Å; F139-T143 HydrophobicContact CD1-CG2 4.02Å; F139-T143 HydrophobicContact CE1-CG2 3.69Å; F139-T143 HydrophobicContact CZ-CG2 4.05Å; F139-T143 WeakPolarHBondContact O-CG2 3.14Å; F139-T143 PolarHBondContact O-N 3.04Å |
| 140 | L | 84.2 | Confident | 84.4 | Confident | 14 Ų | 14 | 19.7 Ų | 19.7 | 7% | 0.073 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -66.4 | -32.8 | -179.1 | -65.7 | 176.3 | 0 | 0 | 0 | 113.4 | F102 S116 G117 L135 T136 T143 G144 | F102-L140 HydrophobicContact CD1-CD2 3.98Å; F102-L140 HydrophobicContact CE1-CD2 4.27Å; S116-L140 VanDerWaalsContact OG-CD2 3.31Å; S116-L140 WeakPolarHBondContact OG-CD2 3.2Å; G117-L140 WeakPolarHBondContact O-CD1 2.88Å; L135-L140 PolarHBondContact O-N 3.38Å; T136-L140 WeakPolarHBondContact O-CB 3.25Å; L140-T143 WeakPolarHBondContact CA-OG1 3.4Å; L140-T143 PolarHBondContact O-OG1 3.1Å; L140-G144 PolarHBondContact O-N 3.44Å; L140-G144 VanDerWaalsContact O-N 3.09Å |
| 141 | F | 84.6 | Confident | 84.8 | Confident | 6 Ų | 6 | 18.1 Ų | 18.1 | 3% | 0.026 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -66.1 | -44.6 | 171.7 | -173 | -87.4 | 0 | 0 | 0 | 111.1 | Y37 L38 T72 L103 V119 Y137 F139 T143 G144 V145 | Y37-F141 HydrophobicContact CD1-CD2 4.13Å; Y37-F141 AromaticContact CD1-CE2 3.39Å; Y37-F141 HydrophobicContact CD1-CE2 3.39Å; Y37-F141 AromaticContact CD1-CZ 3.65Å; Y37-F141 HydrophobicContact CD1-CZ 3.65Å; Y37-F141 HydrophobicContact CE1-CE2 4.23Å; Y37-F141 HydrophobicContact CG-CE2 4.18Å; Y37-F141 HydrophobicContact CG-CZ 4.3Å; L38-F141 HydrophobicContact CB-CE1 3.69Å; L38-F141 HydrophobicContact CB-CZ 4.25Å; L38-F141 HydrophobicContact CD1-CD1 3.98Å; L38-F141 HydrophobicContact CD1-CE1 3.7Å; L38-F141 HydrophobicContact CG-CE1 4.24Å; T72-F141 HydrophobicContact CG2-CD1 3.9Å; L103-F141 HydrophobicContact CD2-CD2 3.24Å; L103-F141 HydrophobicContact CD2-CE2 3.23Å; L103-F141 HydrophobicContact CD2-CG 4.04Å; L103-F141 HydrophobicContact CD2-CZ 4.05Å; V119-F141 HydrophobicContact CG2-CD2 3.91Å; Y137-F141 WeakPolarHBondContact O-CB 3.47Å; F139-F141 VanDerWaalsContact C-N 3.33Å; F139-F141 PolarHBondContact O-N 3.47Å; F141-T143 PolarHBondContact O-N 3.42Å; F141-G144 PolarHBondContact O-N 2.96Å; F141-V145 HydrophobicContact CD1-CG2 4.02Å; F141-V145 HydrophobicContact CE1-CG2 3.49Å; F141-V145 VanDerWaalsContact CE1-CG2 3.49Å; F141-V145 HydrophobicContact CE2-CG2 4.48Å; F141-V145 HydrophobicContact CZ-CG2 3.74Å; F141-V145 WeakPolarHBondContact O-CG2 3.28Å; F141-V145 PolarHBondContact O-N 3.38Å |
| 142 | G | 86 | Confident | 85.1 | Confident | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -61.4 | -40.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | S138 F139 G146 | S138-G142 PolarHBondContact O-N 2.99Å; F139-G142 PolarHBondContact O-N 3.29Å; F139-G142 VanDerWaalsContact O-N 3.13Å; G142-G146 PolarHBondContact O-N 2.92Å |
| 143 | T | 87.4 | Confident | 85.6 | Confident | 2 Ų | 2 | 14.7 Ų | 14.7 | 1% | 0.012 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -65.8 | -43.9 | 175.9 | 59 | 0 | 0 | 0 | 0 | 111.3 | V75 F79 F139 L140 F141 G146 L147 | V75-T143 HydrophobicContact CG1-CG2 3.41Å; V75-T143 VanDerWaalsContact CG1-CG2 3.41Å; F79-T143 HydrophobicContact CD1-CG2 4.06Å; F79-T143 HydrophobicContact CD2-CG2 3.89Å; F79-T143 HydrophobicContact CE1-CG2 3.8Å; F79-T143 HydrophobicContact CE2-CG2 3.61Å; F79-T143 HydrophobicContact CG-CG2 4.1Å; F79-T143 HydrophobicContact CZ-CG2 3.56Å; F139-T143 HydrophobicContact CD1-CG2 4.02Å; F139-T143 HydrophobicContact CE1-CG2 3.69Å; F139-T143 HydrophobicContact CZ-CG2 4.05Å; F139-T143 WeakPolarHBondContact O-CG2 3.14Å; F139-T143 PolarHBondContact O-N 3.04Å; L140-T143 WeakPolarHBondContact CA-OG1 3.4Å; L140-T143 PolarHBondContact O-OG1 3.1Å; F141-T143 PolarHBondContact O-N 3.42Å; T143-G146 PolarHBondContact O-N 3.46Å; T143-L147 WeakPolarHBondContact O-CB 3.24Å; T143-L147 WeakPolarHBondContact O-CG 3.32Å; T143-L147 PolarHBondContact O-N 3.33Å |
| 144 | G | 84.5 | Confident | 85.9 | Confident | 0 Ų | 0 | 17.5 Ų | 17.5 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -58.2 | -54.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S99 L140 F141 G146 L147 G148 | S99-G144 VanDerWaalsContact CB-O 3.32Å; S99-G144 WeakPolarHBondContact CB-O 3.21Å; S99-G144 WeakPolarHBondContact O-CA 3.13Å; S99-G144 PolarHBondContact OG-O 3.33Å; L140-G144 PolarHBondContact O-N 3.44Å; L140-G144 VanDerWaalsContact O-N 3.09Å; F141-G144 PolarHBondContact O-N 2.96Å; G144-G146 PolarHBondContact O-N 3.14Å; G144-L147 PolarHBondContact O-N 3.06Å; G144-G148 PolarHBondContact O-N 3.17Å |
| 145 | V | 87.5 | Confident | 86.1 | Confident | 1 Ų | 1 | 16.8 Ų | 16.8 | 1% | 0.006 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -61.7 | -44.5 | 178.9 | 178.4 | 0 | 0 | 0 | 0 | 111.1 | Y35 Y76 L103 F141 L147 G148 F149 | Y35-V145 HydrophobicContact CD1-CB 4.42Å; Y35-V145 HydrophobicContact CD1-CG1 4.47Å; Y35-V145 HydrophobicContact CD1-CG2 3.81Å; Y35-V145 HydrophobicContact CD2-CG1 4.31Å; Y35-V145 HydrophobicContact CG-CB 4.49Å; Y35-V145 HydrophobicContact CG-CG1 4.05Å; Y35-V145 HydrophobicContact CG-CG2 4.1Å; Y76-V145 HydrophobicContact CD2-CG1 4.08Å; Y76-V145 HydrophobicContact CE2-CG1 3.93Å; L103-V145 HydrophobicContact CD1-CG2 4.46Å; L103-V145 HydrophobicContact CD2-CG2 4.36Å; F141-V145 HydrophobicContact CD1-CG2 4.02Å; F141-V145 HydrophobicContact CE1-CG2 3.49Å; F141-V145 VanDerWaalsContact CE1-CG2 3.49Å; F141-V145 HydrophobicContact CE2-CG2 4.48Å; F141-V145 HydrophobicContact CZ-CG2 3.74Å; F141-V145 WeakPolarHBondContact O-CG2 3.28Å; F141-V145 PolarHBondContact O-N 3.38Å; V145-L147 PolarHBondContact O-N 3.08Å; V145-G148 PolarHBondContact O-N 2.85Å; V145-F149 VanDerWaalsContact O-CB 3.24Å; V145-F149 WeakPolarHBondContact O-CB 3.4Å; V145-F149 PolarHBondContact O-N 3.06Å |
| 146 | G | 87.7 | Confident | 86.3 | Confident | 0 Ų | 0 | 12.4 Ų | 12.4 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -57.9 | -48.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y76 F79 M80 G142 T143 G144 G148 | Y76-G146 VanDerWaalsContact CD2-CA 3.45Å; F79-G146 CarbonylContact O-C 3.22Å; M80-G146 VanDerWaalsContact CA-O 3.31Å; M80-G146 WeakPolarHBondContact CA-O 3.08Å; G142-G146 PolarHBondContact O-N 2.92Å; T143-G146 PolarHBondContact O-N 3.46Å; G144-G146 PolarHBondContact O-N 3.14Å; G146-G148 VanDerWaalsContact C-N 3.29Å; G146-G148 PolarHBondContact O-N 3.27Å |
| 147 | L | 87.6 | Confident | 86.7 | Confident | 5 Ų | 5 | 12.5 Ų | 12.5 | 3% | 0.026 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -64.2 | -33.9 | -177.7 | -71.7 | 174 | 0 | 0 | 0 | 113.3 | F79 L82 G83 L98 F102 T143 G144 V145 V151 | F79-L147 HydrophobicContact CB-CG 4.47Å; F79-L147 HydrophobicContact CD1-CD1 4.32Å; F79-L147 HydrophobicContact CD1-CD2 3.94Å; F79-L147 HydrophobicContact CD1-CG 3.95Å; L82-L147 HydrophobicContact CG-CD2 4.38Å; G83-L147 WeakPolarHBondContact CA-O 3.46Å; L98-L147 HydrophobicContact CD2-CD1 4.21Å; L98-L147 HydrophobicContact CG-CD1 4.35Å; F102-L147 HydrophobicContact CD2-CD1 3.85Å; F102-L147 HydrophobicContact CE2-CD1 3.75Å; T143-L147 WeakPolarHBondContact O-CB 3.24Å; T143-L147 WeakPolarHBondContact O-CG 3.32Å; T143-L147 PolarHBondContact O-N 3.33Å; G144-L147 PolarHBondContact O-N 3.06Å; V145-L147 PolarHBondContact O-N 3.08Å; L147-V151 WeakPolarHBondContact O-CG2 3.32Å |
| 148 | G | 85.6 | Confident | 86.8 | Confident | 0 Ų | 0 | 14.4 Ų | 14.4 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -100.2 | -21.1 | -171 | 0 | 0 | 0 | 0 | 0 | 115.7 | Y35 S99 G144 V145 G146 T152 | Y35-G148 WeakPolarHBondContact OH-CA 3.37Å; S99-G148 WeakPolarHBondContact OG-CA 3.28Å; S99-G148 PolarHBondContact OG-N 3.03Å; G144-G148 PolarHBondContact O-N 3.17Å; V145-G148 PolarHBondContact O-N 2.85Å; G146-G148 VanDerWaalsContact C-N 3.29Å; G146-G148 PolarHBondContact O-N 3.27Å; G148-T152 WeakPolarHBondContact O-CB 3.32Å; G148-T152 PolarHBondContact O-N 3.33Å; G148-T152 PolarHBondContact O-OG1 3.45Å |
| 149 | F | 88.8 | Confident | 86.7 | Confident | 23 Ų | 23 | 15.8 Ų | 15.8 | 10% | 0.101 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -59.3 | -57 | -173.7 | -174.4 | -87.1 | 0 | 0 | 0 | 112.1 | H32 Y35 Y76 M80 V145 V151 T152 L153 Y175 | H32-F149 AromaticContact CD2-CE2 3.69Å; H32-F149 AromaticContact NE2-CD2 3.62Å; H32-F149 AromaticContact NE2-CE2 3.5Å; H32-F149 AromaticContact NE2-CZ 3.93Å; Y35-F149 HydrophobicContact CD2-CD2 4.23Å; Y35-F149 HydrophobicContact CE2-CB 4.48Å; Y76-F149 HydrophobicContact CE2-CB 4.14Å; Y76-F149 HydrophobicContact CE2-CG 4.34Å; Y76-F149 WeakPolarHBondContact OH-CD1 3.3Å; Y76-F149 WeakPolarHBondContact OH-CD2 3.38Å; Y76-F149 VanDerWaalsContact OH-CG 3.3Å; Y76-F149 WeakPolarHBondContact OH-CG 3.41Å; M80-F149 HydrophobicContact CE-CD1 4.26Å; V145-F149 VanDerWaalsContact O-CB 3.24Å; V145-F149 WeakPolarHBondContact O-CB 3.4Å; V145-F149 PolarHBondContact O-N 3.06Å; F149-V151 PolarHBondContact O-N 3.5Å; F149-T152 PolarHBondContact O-N 3.25Å; F149-L153 HydrophobicContact CD1-CD1 3.83Å; F149-L153 HydrophobicContact CE1-CD1 3.37Å; F149-L153 HydrophobicContact CZ-CD1 3.88Å; F149-L153 PolarHBondContact O-N 3.14Å; F149-Y175 HydrophobicContact CE2-CD1 4.44Å; F149-Y175 HydrophobicContact CE2-CD2 4.37Å; F149-Y175 HydrophobicContact CE2-CG 4.35Å |
| 150 | S | 87.8 | Confident | 86.6 | Confident | 26 Ų | 26 | 13.2 Ų | 13.2 | 18% | 0.182 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -64.1 | -41.3 | -178.3 | 54.5 | 0 | 0 | 0 | 0 | 112.2 | M80 L153 A154 | M80-S150 PolarHBondContact O-OG 3.38Å; S150-L153 PolarHBondContact O-N 3.18Å; S150-A154 WeakPolarHBondContact O-CB 3.39Å; S150-A154 PolarHBondContact O-N 2.95Å |
| 151 | V | 87.6 | Confident | 86.4 | Confident | 3 Ų | 3 | 15.6 Ų | 15.6 | 2% | 0.018 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -64.2 | -45.1 | -179.3 | -176.7 | 0 | 0 | 0 | 0 | 111.5 | G83 V95 L147 F149 L153 A154 V155 | G83-V151 WeakPolarHBondContact O-CG2 3.46Å; V95-V151 HydrophobicContact CG1-CG2 3.92Å; L147-V151 WeakPolarHBondContact O-CG2 3.32Å; F149-V151 PolarHBondContact O-N 3.5Å; V151-L153 PolarHBondContact O-N 2.92Å; V151-A154 PolarHBondContact O-N 3.33Å; V151-V155 VanDerWaalsContact O-CG2 3.3Å; V151-V155 WeakPolarHBondContact O-CG2 3.24Å; V151-V155 PolarHBondContact O-N 3.45Å |
| 152 | T | 88.1 | Confident | 86.4 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -63.6 | -42.9 | -179.8 | -55.2 | 0 | 0 | 0 | 0 | 111.2 | I31 L96 G148 F149 V155 A156 L235 | I31-T152 HydrophobicContact CB-CG2 4.2Å; I31-T152 HydrophobicContact CD1-CG2 4.33Å; I31-T152 HydrophobicContact CG2-CG2 4.1Å; L96-T152 WeakPolarHBondContact CD1-OG1 3.49Å; G148-T152 WeakPolarHBondContact O-CB 3.32Å; G148-T152 PolarHBondContact O-N 3.33Å; G148-T152 PolarHBondContact O-OG1 3.45Å; F149-T152 PolarHBondContact O-N 3.25Å; T152-V155 PolarHBondContact O-N 2.91Å; T152-A156 WeakPolarHBondContact O-CB 3.4Å; T152-A156 PolarHBondContact O-N 3.1Å; T152-L235 HydrophobicContact CG2-CD1 4.46Å; T152-L235 HydrophobicContact CG2-CD2 4.25Å |
| 153 | L | 90.2 | Very high | 86.3 | Confident | 26 Ų | 26 | 27 Ų | 27 | 14% | 0.136 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -63.3 | -44.6 | 176.7 | -71.8 | 172.2 | 0 | 0 | 0 | 112 | H32 F149 S150 V151 V155 A156 A157 V168 V171 V172 | H32-L153 WeakPolarHBondContact NE2-CG 3.41Å; F149-L153 HydrophobicContact CD1-CD1 3.83Å; F149-L153 HydrophobicContact CE1-CD1 3.37Å; F149-L153 HydrophobicContact CZ-CD1 3.88Å; F149-L153 PolarHBondContact O-N 3.14Å; S150-L153 PolarHBondContact O-N 3.18Å; V151-L153 PolarHBondContact O-N 2.92Å; L153-V155 PolarHBondContact O-N 3.39Å; L153-A156 PolarHBondContact O-N 3.44Å; L153-A157 VanDerWaalsContact O-CB 3.3Å; L153-A157 WeakPolarHBondContact O-CB 3.22Å; L153-A157 PolarHBondContact O-N 3.4Å; L153-V168 HydrophobicContact CD2-CG1 4.22Å; L153-V171 HydrophobicContact CD2-CB 4.06Å; L153-V171 HydrophobicContact CD2-CG1 3.66Å; L153-V172 HydrophobicContact CD1-CG2 4.17Å; L153-V172 HydrophobicContact CD2-CG2 3.62Å |
| 154 | A | 87.9 | Confident | 86.2 | Confident | 58 Ų | 58 | 33.2 Ų | 33.2 | 48% | 0.479 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -59.3 | -48.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | S150 V151 A157 T158 | S150-A154 WeakPolarHBondContact O-CB 3.39Å; S150-A154 PolarHBondContact O-N 2.95Å; V151-A154 PolarHBondContact O-N 3.33Å; A154-A157 PolarHBondContact O-N 3.41Å; A154-T158 VanDerWaalsContact O-CG2 3.26Å; A154-T158 WeakPolarHBondContact O-CG2 3.46Å; A154-T158 PolarHBondContact O-N 3.09Å |
| 155 | V | 86.7 | Confident | 86.4 | Confident | 5 Ų | 5 | 36.1 Ų | 36.1 | 3% | 0.03 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.6 | -46.3 | 179.9 | 175.1 | 0 | 0 | 0 | 0 | 111.5 | Y92 V151 T152 L153 A157 T158 L235 | Y92-V155 HydrophobicContact CD1-CG2 4.36Å; Y92-V155 HydrophobicContact CD2-CG1 4.41Å; Y92-V155 HydrophobicContact CD2-CG2 3.6Å; Y92-V155 HydrophobicContact CE2-CG1 4.28Å; Y92-V155 HydrophobicContact CE2-CG2 4.25Å; Y92-V155 HydrophobicContact CG-CG2 3.66Å; V151-V155 VanDerWaalsContact O-CG2 3.3Å; V151-V155 WeakPolarHBondContact O-CG2 3.24Å; V151-V155 PolarHBondContact O-N 3.45Å; T152-V155 PolarHBondContact O-N 2.91Å; L153-V155 PolarHBondContact O-N 3.39Å; V155-A157 VanDerWaalsContact C-N 3.32Å; V155-A157 PolarHBondContact O-N 2.91Å; V155-T158 PolarHBondContact O-N 3.29Å; V155-T158 PolarHBondContact O-OG1 2.92Å; V155-L235 HydrophobicContact CB-CD1 4.46Å; V155-L235 HydrophobicContact CB-CD2 4.24Å; V155-L235 HydrophobicContact CB-CG 4.48Å; V155-L235 HydrophobicContact CG1-CD1 4.01Å; V155-L235 HydrophobicContact CG1-CD2 4.04Å; V155-L235 HydrophobicContact CG1-CG 3.84Å |
| 156 | A | 86.6 | Confident | 86.5 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.4 | -40.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | T152 L153 T158 W159 V167 V171 | T152-A156 WeakPolarHBondContact O-CB 3.4Å; T152-A156 PolarHBondContact O-N 3.1Å; L153-A156 PolarHBondContact O-N 3.44Å; A156-T158 PolarHBondContact O-N 3.41Å; A156-W159 PolarHBondContact O-N 3.45Å; A156-V167 HydrophobicContact CB-CG1 4.2Å; A156-V171 HydrophobicContact CB-CG2 3.88Å |
| 157 | A | 87.2 | Confident | 86.6 | Confident | 13 Ų | 13 | 38.3 Ų | 38.3 | 11% | 0.107 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66 | -22.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L153 A154 V155 W159 R164 V168 | L153-A157 VanDerWaalsContact O-CB 3.3Å; L153-A157 WeakPolarHBondContact O-CB 3.22Å; L153-A157 PolarHBondContact O-N 3.4Å; A154-A157 PolarHBondContact O-N 3.41Å; V155-A157 VanDerWaalsContact C-N 3.32Å; V155-A157 PolarHBondContact O-N 2.91Å; A157-W159 VanDerWaalsContact C-N 3.29Å; A157-W159 PolarHBondContact O-N 3.43Å; A157-R164 HydrophobicContact CB-CG 4.33Å; A157-V168 HydrophobicContact CB-CG2 3.98Å |
| 158 | T | 85.2 | Confident | 86.8 | Confident | 43 Ų | 43 | 40.3 Ų | 40.3 | 26% | 0.264 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -24.7 | 179.5 | 65.9 | 0 | 0 | 0 | 0 | 114.2 | A154 V155 A156 L251 | A154-T158 VanDerWaalsContact O-CG2 3.26Å; A154-T158 WeakPolarHBondContact O-CG2 3.46Å; A154-T158 PolarHBondContact O-N 3.09Å; V155-T158 PolarHBondContact O-N 3.29Å; V155-T158 PolarHBondContact O-OG1 2.92Å; A156-T158 PolarHBondContact O-N 3.41Å; T158-L251 HydrophobicContact CG2-CD1 4.49Å |
| 159 | W | 81.8 | Confident | 87.1 | Confident | 29 Ų | 29 | 42.2 Ų | 42.2 | 11% | 0.11 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.7 | -38.8 | -177.1 | -80.8 | 92.2 | 0 | 0 | 0 | 113.1 | A20 S24 A156 A157 P161 R236 K238 | A20-W159 HydrophobicContact CB-CH2 3.52Å; A20-W159 HydrophobicContact CB-CZ2 4.25Å; A20-W159 HydrophobicContact CB-CZ3 3.94Å; S24-W159 VanDerWaalsContact CB-NE1 3.35Å; S24-W159 PolarHBondContact OG-NE1 2.69Å; A156-W159 PolarHBondContact O-N 3.45Å; A157-W159 VanDerWaalsContact C-N 3.29Å; A157-W159 PolarHBondContact O-N 3.43Å; W159-P161 WeakPolarHBondContact O-CD 3.31Å; W159-R236 HydrophobicContact CZ2-CB 4.43Å; W159-R236 PolarHBondContact NE1-O 3.44Å; W159-K238 HydrophobicContact CD2-CB 3.87Å; W159-K238 HydrophobicContact CD2-CG 4.32Å; W159-K238 HydrophobicContact CE3-CB 4.15Å; W159-K238 HydrophobicContact CE3-CD 4.45Å; W159-K238 HydrophobicContact CE3-CG 4.09Å; W159-K238 HydrophobicContact CG-CB 4.27Å; W159-K238 HydrophobicContact CZ2-CB 4.31Å; W159-K238 HydrophobicContact CZ3-CG 4.27Å |
| 160 | F | 84.9 | Confident | 87.3 | Confident | 23 Ų | 23 | 43.9 Ų | 43.9 | 10% | 0.101 | 26% | 0.256 | C | S | . | . | trans | -126.6 | 75.4 | -173.5 | -56.7 | -77.1 | 0 | 0 | 0 | 110.7 | I12 T18 V25 E162 H163 R164 V167 | I12-F160 HydrophobicContact CG2-CD1 3.47Å; I12-F160 VanDerWaalsContact CG2-CD1 3.47Å; I12-F160 HydrophobicContact CG2-CD2 4.31Å; I12-F160 HydrophobicContact CG2-CE1 3.28Å; I12-F160 HydrophobicContact CG2-CE2 4.14Å; I12-F160 HydrophobicContact CG2-CG 3.98Å; I12-F160 HydrophobicContact CG2-CZ 3.63Å; I12-F160 WeakPolarHBondContact O-CE1 3.48Å; T18-F160 HydrophobicContact CG2-CE1 4.23Å; V25-F160 HydrophobicContact CG2-CD2 4.09Å; V25-F160 HydrophobicContact CG2-CE2 3.84Å; F160-E162 VanDerWaalsContact C-N 3.29Å; F160-E162 PolarHBondContact O-N 2.95Å; F160-H163 HydrophobicContact CB-CB 4.39Å; F160-H163 CarbonylContact O-C 3.3Å; F160-H163 PolarHBondContact O-N 2.99Å; F160-H163 VanDerWaalsContact O-N 3.1Å; F160-R164 PolarHBondContact O-N 3.31Å; F160-V167 HydrophobicContact CB-CG2 3.83Å; F160-V167 HydrophobicContact CD2-CG2 3.7Å; F160-V167 HydrophobicContact CG-CG2 4.09Å | ||
| 161 | P | 81.8 | Confident | 87.6 | Confident | 65 Ų | 65 | 42.7 Ų | 42.7 | 42% | 0.422 | 25% | 0.247 | S | C | . | . | G | 310 helix | trans | -60.5 | -34.8 | -175.7 | 23.2 | -33.5 | 0 | 0 | 0 | 113.7 | W159 H163 R164 | W159-P161 WeakPolarHBondContact O-CD 3.31Å; P161-H163 VanDerWaalsContact C-N 3.29Å; P161-H163 PolarHBondContact O-N 3.39Å; P161-R164 WeakPolarHBondContact O-CD 3.49Å; P161-R164 VanDerWaalsContact O-CG 3.27Å; P161-R164 WeakPolarHBondContact O-CG 3.33Å |
| 162 | E | 84.1 | Confident | 87.9 | Confident | 174 Ų | 174 | 45 Ų | 45 | 81% | 0.813 | 26% | 0.261 | S | S | * | . | G | 310 helix | trans | -70.6 | -25.9 | 177.9 | -64.2 | -179.5 | 166.6 | 0 | 0 | 112.8 | F160 | F160-E162 VanDerWaalsContact C-N 3.29Å; F160-E162 PolarHBondContact O-N 2.95Å |
| 163 | H | 84 | Confident | 88.2 | Confident | 71 Ų | 71 | 47.8 Ų | 47.8 | 33% | 0.329 | 28% | 0.281 | S | S | . | . | G | 310 helix | trans | -120.1 | 28.5 | -174.5 | -59.1 | 90.2 | 0 | 0 | 0 | 112.1 | I12 F160 P161 G165 L166 V167 | I12-H163 HydrophobicContact CD1-CB 3.86Å; F160-H163 HydrophobicContact CB-CB 4.39Å; F160-H163 CarbonylContact O-C 3.3Å; F160-H163 PolarHBondContact O-N 2.99Å; F160-H163 VanDerWaalsContact O-N 3.1Å; P161-H163 VanDerWaalsContact C-N 3.29Å; P161-H163 PolarHBondContact O-N 3.39Å; H163-G165 PolarHBondContact O-N 3.5Å; H163-G165 VanDerWaalsContact O-N 3.16Å; H163-L166 PolarHBondContact O-N 3.31Å; H163-V167 PolarHBondContact O-N 2.99Å; H163-V167 VanDerWaalsContact O-N 3.07Å |
| 164 | R | 84.8 | Confident | 88.3 | Confident | 132 Ų | 132 | 46.5 Ų | 46.5 | 50% | 0.498 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -49.3 | -44.9 | -177.3 | -78 | 170.5 | 178.7 | -177.2 | 5.9 | 112.3 | A157 F160 P161 L166 V167 V168 | A157-R164 HydrophobicContact CB-CG 4.33Å; F160-R164 PolarHBondContact O-N 3.31Å; P161-R164 WeakPolarHBondContact O-CD 3.49Å; P161-R164 VanDerWaalsContact O-CG 3.27Å; P161-R164 WeakPolarHBondContact O-CG 3.33Å; R164-L166 PolarHBondContact O-N 2.83Å; R164-V167 PolarHBondContact O-N 3.29Å; R164-V168 WeakPolarHBondContact O-CB 3.34Å; R164-V168 VanDerWaalsContact O-CG2 3.27Å; R164-V168 WeakPolarHBondContact O-CG2 3.47Å; R164-V168 PolarHBondContact O-N 3.27Å |
| 165 | G | 89.4 | Confident | 88.5 | Confident | 61 Ų | 61 | 44.4 Ų | 44.4 | 63% | 0.629 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -62.5 | -40.5 | -180 | 0 | 0 | 0 | 0 | 0 | 113.7 | H163 G169 | H163-G165 PolarHBondContact O-N 3.5Å; H163-G165 VanDerWaalsContact O-N 3.16Å; G165-G169 PolarHBondContact O-N 3.34Å |
| 166 | L | 88.9 | Confident | 88.6 | Confident | 44 Ų | 44 | 46 Ų | 46 | 23% | 0.23 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -70.3 | -40.8 | 178.7 | -176.7 | 152.6 | 0 | 0 | 0 | 111.4 | I8 V9 I12 H163 R164 G169 L170 | I8-L166 HydrophobicContact CB-CD1 4.33Å; I8-L166 HydrophobicContact CG2-CD1 3.58Å; V9-L166 HydrophobicContact CG2-CD2 4.09Å; I12-L166 HydrophobicContact CD1-CD1 4.43Å; I12-L166 HydrophobicContact CD1-CD2 4.02Å; H163-L166 PolarHBondContact O-N 3.31Å; R164-L166 PolarHBondContact O-N 2.83Å; L166-G169 PolarHBondContact O-N 3.47Å; L166-L170 WeakPolarHBondContact O-CB 3.46Å; L166-L170 PolarHBondContact O-N 2.96Å |
| 167 | V | 89 | Confident | 88.9 | Confident | 4 Ų | 4 | 49.9 Ų | 49.9 | 2% | 0.024 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.3 | -46.8 | 177.9 | 172.7 | 0 | 0 | 0 | 0 | 112 | V25 A156 F160 H163 R164 G169 L170 V171 | V25-V167 HydrophobicContact CG1-CG1 4.31Å; V25-V167 HydrophobicContact CG2-CG1 3.6Å; V25-V167 HydrophobicContact CG2-CG2 4.47Å; A156-V167 HydrophobicContact CB-CG1 4.2Å; F160-V167 HydrophobicContact CB-CG2 3.83Å; F160-V167 HydrophobicContact CD2-CG2 3.7Å; F160-V167 HydrophobicContact CG-CG2 4.09Å; H163-V167 PolarHBondContact O-N 2.99Å; H163-V167 VanDerWaalsContact O-N 3.07Å; R164-V167 PolarHBondContact O-N 3.29Å; V167-G169 VanDerWaalsContact C-N 3.32Å; V167-G169 PolarHBondContact O-N 3.43Å; V167-L170 PolarHBondContact O-N 3.34Å; V167-V171 WeakPolarHBondContact O-CG2 3.14Å; V167-V171 PolarHBondContact O-N 3.34Å |
| 168 | V | 91.5 | Very high | 89 | Confident | 47 Ų | 47 | 49.2 Ų | 49.2 | 29% | 0.285 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -59.2 | -46 | 174.5 | 165.9 | 0 | 0 | 0 | 0 | 110 | L153 A157 R164 L170 V171 V172 | L153-V168 HydrophobicContact CD2-CG1 4.22Å; A157-V168 HydrophobicContact CB-CG2 3.98Å; R164-V168 WeakPolarHBondContact O-CB 3.34Å; R164-V168 VanDerWaalsContact O-CG2 3.27Å; R164-V168 WeakPolarHBondContact O-CG2 3.47Å; R164-V168 PolarHBondContact O-N 3.27Å; V168-L170 VanDerWaalsContact C-N 3.34Å; V168-L170 PolarHBondContact O-N 3.4Å; V168-V171 PolarHBondContact O-N 3.37Å; V168-V172 HydrophobicContact CG1-CG2 4.25Å; V168-V172 WeakPolarHBondContact O-CB 3.26Å; V168-V172 VanDerWaalsContact O-CG2 3.26Å; V168-V172 WeakPolarHBondContact O-CG2 3.25Å; V168-V172 PolarHBondContact O-N 3.49Å |
| 169 | G | 93.1 | Very high | 89.2 | Confident | 40 Ų | 40 | 48.6 Ų | 48.6 | 41% | 0.412 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | G165 L166 V167 S173 | G165-G169 PolarHBondContact O-N 3.34Å; L166-G169 PolarHBondContact O-N 3.47Å; V167-G169 VanDerWaalsContact C-N 3.32Å; V167-G169 PolarHBondContact O-N 3.43Å; G169-S173 WeakPolarHBondContact O-CB 3.44Å; G169-S173 PolarHBondContact O-N 3.46Å |
| 170 | L | 93.2 | Very high | 89.7 | Confident | 58 Ų | 58 | 53.1 Ų | 53.1 | 30% | 0.304 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -62.5 | -50 | 176.1 | -171 | 161.1 | 0 | 0 | 0 | 110.6 | V25 Y29 L166 V167 V168 V172 S173 | V25-L170 HydrophobicContact CG1-CD1 4.38Å; V25-L170 HydrophobicContact CG1-CD2 3.69Å; Y29-L170 HydrophobicContact CD2-CD2 3.92Å; Y29-L170 VanDerWaalsContact CD2-O 3.29Å; Y29-L170 WeakPolarHBondContact CD2-O 3.49Å; Y29-L170 HydrophobicContact CG-CD2 4.47Å; L166-L170 WeakPolarHBondContact O-CB 3.46Å; L166-L170 PolarHBondContact O-N 2.96Å; V167-L170 PolarHBondContact O-N 3.34Å; V168-L170 VanDerWaalsContact C-N 3.34Å; V168-L170 PolarHBondContact O-N 3.4Å; L170-V172 PolarHBondContact O-N 3.15Å; L170-S173 WeakPolarHBondContact O-CB 3.38Å; L170-S173 PolarHBondContact O-N 3.33Å; L170-S173 VanDerWaalsContact O-N 3.16Å; L170-S173 PolarHBondContact O-OG 3.48Å |
| 171 | V | 92.9 | Very high | 90.1 | Very high | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.2 | -46.6 | 178.9 | 171.4 | 0 | 0 | 0 | 0 | 111.6 | V25 H32 L153 A156 V167 V168 S173 G174 | V25-V171 HydrophobicContact CG1-CG2 4.18Å; H32-V171 HydrophobicContact CB-CG1 4.16Å; H32-V171 VanDerWaalsContact CB-O 3.22Å; H32-V171 WeakPolarHBondContact CB-O 3.19Å; H32-V171 VanDerWaalsContact ND1-CG1 3.28Å; H32-V171 WeakPolarHBondContact ND1-CG1 3.46Å; L153-V171 HydrophobicContact CD2-CB 4.06Å; L153-V171 HydrophobicContact CD2-CG1 3.66Å; A156-V171 HydrophobicContact CB-CG2 3.88Å; V167-V171 WeakPolarHBondContact O-CG2 3.14Å; V167-V171 PolarHBondContact O-N 3.34Å; V168-V171 PolarHBondContact O-N 3.37Å; V171-S173 VanDerWaalsContact C-N 3.25Å; V171-S173 PolarHBondContact O-N 3.19Å; V171-G174 PolarHBondContact O-N 2.79Å; V171-G174 VanDerWaalsContact O-N 3.11Å |
| 172 | V | 94 | Very high | 90.4 | Very high | 52 Ų | 52 | 51.8 Ų | 51.8 | 32% | 0.315 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -64.8 | -29.1 | 177.1 | 175.4 | 0 | 0 | 0 | 0 | 111.8 | L153 V168 L170 G174 Y175 G176 | L153-V172 HydrophobicContact CD1-CG2 4.17Å; L153-V172 HydrophobicContact CD2-CG2 3.62Å; V168-V172 HydrophobicContact CG1-CG2 4.25Å; V168-V172 WeakPolarHBondContact O-CB 3.26Å; V168-V172 VanDerWaalsContact O-CG2 3.26Å; V168-V172 WeakPolarHBondContact O-CG2 3.25Å; V168-V172 PolarHBondContact O-N 3.49Å; L170-V172 PolarHBondContact O-N 3.15Å; V172-G174 PolarHBondContact O-N 3.43Å; V172-Y175 WeakPolarHBondContact O-CA 3.38Å; V172-Y175 WeakPolarHBondContact O-CB 3.48Å; V172-Y175 PolarHBondContact O-N 3.35Å; V172-G176 PolarHBondContact O-N 2.87Å |
| 173 | S | 94.4 | Very high | 90.7 | Very high | 58 Ų | 58 | 44.9 Ų | 44.9 | 41% | 0.406 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60.9 | -28.8 | 175 | 79.3 | 0 | 0 | 0 | 0 | 112.5 | G169 L170 V171 Y175 G176 M177 | G169-S173 WeakPolarHBondContact O-CB 3.44Å; G169-S173 PolarHBondContact O-N 3.46Å; L170-S173 WeakPolarHBondContact O-CB 3.38Å; L170-S173 PolarHBondContact O-N 3.33Å; L170-S173 VanDerWaalsContact O-N 3.16Å; L170-S173 PolarHBondContact O-OG 3.48Å; V171-S173 VanDerWaalsContact C-N 3.25Å; V171-S173 PolarHBondContact O-N 3.19Å; S173-Y175 VanDerWaalsContact C-N 3.31Å; S173-Y175 PolarHBondContact O-N 2.89Å; S173-G176 PolarHBondContact O-N 3.41Å; S173-M177 WeakPolarHBondContact O-CB 3.46Å; S173-M177 PolarHBondContact O-N 2.63Å |
| 174 | G | 92.2 | Very high | 91.1 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.8 | -40.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y29 L33 V171 V172 G176 M177 G178 | Y29-G174 VanDerWaalsContact CE2-N 3.27Å; L33-G174 WeakPolarHBondContact CA-O 3.37Å; L33-G174 WeakPolarHBondContact CD1-O 3.41Å; V171-G174 PolarHBondContact O-N 2.79Å; V171-G174 VanDerWaalsContact O-N 3.11Å; V172-G174 PolarHBondContact O-N 3.43Å; G174-G176 PolarHBondContact O-N 2.99Å; G174-M177 PolarHBondContact O-N 2.95Å; G174-M177 VanDerWaalsContact O-N 3.16Å; G174-G178 PolarHBondContact O-N 3.31Å |
| 175 | Y | 92.2 | Very high | 91.4 | Very high | 14 Ų | 14 | 41.5 Ų | 41.5 | 6% | 0.055 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61 | -41.6 | 176.6 | -171.8 | -112.5 | 0 | 0 | 0 | 112.7 | H32 Y35 G36 L38 Y39 F149 V172 S173 G178 | H32-Y175 VanDerWaalsContact O-CA 3.24Å; H32-Y175 WeakPolarHBondContact O-CA 3.27Å; Y35-Y175 VanDerWaalsContact C-CD2 3.47Å; Y35-Y175 VanDerWaalsContact O-CE2 3.28Å; Y35-Y175 WeakPolarHBondContact O-CE2 3.42Å; G36-Y175 WeakPolarHBondContact CA-O 3.45Å; G36-Y175 VanDerWaalsContact N-CD2 3.27Å; L38-Y175 WeakPolarHBondContact CD2-OH 3.31Å; Y39-Y175 HydrophobicContact CD2-CD1 4.47Å; Y39-Y175 HydrophobicContact CD2-CE1 4.21Å; Y39-Y175 AromaticContact CE2-CD1 3.51Å; Y39-Y175 HydrophobicContact CE2-CD1 3.51Å; Y39-Y175 AromaticContact CE2-CE1 3.21Å; Y39-Y175 HydrophobicContact CE2-CE1 3.21Å; Y39-Y175 HydrophobicContact CE2-CG 4.32Å; Y39-Y175 AromaticContact CE2-CZ 3.81Å; Y39-Y175 AromaticContact CZ-CE1 3.47Å; Y39-Y175 VanDerWaalsContact CZ-CE1 3.47Å; Y39-Y175 VanDerWaalsContact OH-CE1 3.27Å; Y39-Y175 WeakPolarHBondContact OH-CE1 3.45Å; F149-Y175 HydrophobicContact CE2-CD1 4.44Å; F149-Y175 HydrophobicContact CE2-CD2 4.37Å; F149-Y175 HydrophobicContact CE2-CG 4.35Å; V172-Y175 WeakPolarHBondContact O-CA 3.38Å; V172-Y175 WeakPolarHBondContact O-CB 3.48Å; V172-Y175 PolarHBondContact O-N 3.35Å; S173-Y175 VanDerWaalsContact C-N 3.31Å; S173-Y175 PolarHBondContact O-N 2.89Å; Y175-G178 PolarHBondContact O-N 2.9Å |
| 176 | G | 90.4 | Very high | 91.3 | Very high | 38 Ų | 38 | 38.6 Ų | 38.6 | 39% | 0.392 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67.8 | -38.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V172 S173 G174 G178 S179 | V172-G176 PolarHBondContact O-N 2.87Å; S173-G176 PolarHBondContact O-N 3.41Å; G174-G176 PolarHBondContact O-N 2.99Å; G176-G178 PolarHBondContact O-N 3.1Å; G176-S179 PolarHBondContact O-OG 3.19Å |
| 177 | M | 92.6 | Very high | 91.3 | Very high | 81 Ų | 81 | 38.1 Ų | 38.1 | 40% | 0.399 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67 | -25.2 | 178.1 | -162.1 | 86.1 | 76.2 | 0 | 0 | 112.6 | Y29 L33 S173 G174 S179 L180 V181 | Y29-M177 WeakPolarHBondContact OH-CE 3.38Å; L33-M177 HydrophobicContact CD1-CB 3.87Å; L33-M177 HydrophobicContact CD1-CG 4.16Å; S173-M177 WeakPolarHBondContact O-CB 3.46Å; S173-M177 PolarHBondContact O-N 2.63Å; G174-M177 PolarHBondContact O-N 2.95Å; G174-M177 VanDerWaalsContact O-N 3.16Å; M177-S179 VanDerWaalsContact C-N 3.34Å; M177-S179 PolarHBondContact O-N 2.71Å; M177-L180 WeakPolarHBondContact O-CB 2.99Å; M177-L180 PolarHBondContact O-N 2.88Å; M177-L180 HydrophobicContact SD-CD1 4.33Å; M177-V181 HydrophobicContact CG-CG2 4.21Å; M177-V181 PolarHBondContact O-N 2.88Å; M177-V181 VanDerWaalsContact O-N 3.1Å |
| 178 | G | 89.6 | Confident | 91.4 | Very high | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -55.7 | -42.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | G174 Y175 G176 L180 V181 F182 | G174-G178 PolarHBondContact O-N 3.31Å; Y175-G178 PolarHBondContact O-N 2.9Å; G176-G178 PolarHBondContact O-N 3.1Å; G178-L180 VanDerWaalsContact C-N 3.34Å; G178-L180 PolarHBondContact O-N 2.63Å; G178-V181 PolarHBondContact O-N 3.42Å; G178-F182 WeakPolarHBondContact O-CB 3.37Å; G178-F182 WeakPolarHBondContact O-CD2 3.45Å; G178-F182 PolarHBondContact O-N 3.11Å |
| 179 | S | 88 | Confident | 91.3 | Very high | 30 Ų | 30 | 45.4 Ų | 45.4 | 21% | 0.21 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -64.2 | -39.3 | 176.2 | 58.4 | 0 | 0 | 0 | 0 | 112.6 | G176 M177 V181 S183 | G176-S179 PolarHBondContact O-OG 3.19Å; M177-S179 VanDerWaalsContact C-N 3.34Å; M177-S179 PolarHBondContact O-N 2.71Å; S179-V181 VanDerWaalsContact C-N 3.25Å; S179-V181 PolarHBondContact O-N 3.45Å; S179-S183 WeakPolarHBondContact O-CB 3.37Å; S179-S183 PolarHBondContact O-N 3.1Å; S179-S183 PolarHBondContact O-OG 3.05Å |
| 180 | L | 92.3 | Very high | 91.1 | Very high | 124 Ų | 124 | 43.6 Ų | 43.6 | 65% | 0.649 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -65.9 | -30.4 | -179.9 | -60.7 | 177.7 | 0 | 0 | 0 | 112 | M177 G178 P184 | M177-L180 WeakPolarHBondContact O-CB 2.99Å; M177-L180 PolarHBondContact O-N 2.88Å; M177-L180 HydrophobicContact SD-CD1 4.33Å; G178-L180 VanDerWaalsContact C-N 3.34Å; G178-L180 PolarHBondContact O-N 2.63Å; L180-P184 WeakPolarHBondContact O-CD 3.36Å; L180-P184 WeakPolarHBondContact O-CG 3.12Å |
| 181 | V | 92.8 | Very high | 90.9 | Very high | 56 Ų | 56 | 41 Ų | 41 | 34% | 0.339 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -83.8 | -51.2 | 176.3 | 177.2 | 0 | 0 | 0 | 0 | 111 | L33 M177 G178 S179 P184 I185 | L33-V181 HydrophobicContact CD1-CG2 4.37Å; M177-V181 HydrophobicContact CG-CG2 4.21Å; M177-V181 PolarHBondContact O-N 2.88Å; M177-V181 VanDerWaalsContact O-N 3.1Å; G178-V181 PolarHBondContact O-N 3.42Å; S179-V181 VanDerWaalsContact C-N 3.25Å; S179-V181 PolarHBondContact O-N 3.45Å; V181-P184 WeakPolarHBondContact O-CD 3.42Å; V181-P184 WeakPolarHBondContact O-CG 3.49Å; V181-I185 HydrophobicContact CG1-CD1 3.82Å; V181-I185 VanDerWaalsContact O-CD1 3.22Å; V181-I185 WeakPolarHBondContact O-CD1 3.37Å; V181-I185 WeakPolarHBondContact O-CG1 3.42Å |
| 182 | F | 89.9 | Confident | 90.6 | Very high | 3 Ų | 3 | 43.6 Ų | 43.6 | 1% | 0.013 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -77.6 | -35.1 | -170.4 | -67.8 | -61.3 | 0 | 0 | 0 | 113.7 | L33 Y37 G178 I185 Q186 I220 I223 L224 | L33-F182 WeakPolarHBondContact O-CE2 3.14Å; Y37-F182 HydrophobicContact CD2-CB 4.05Å; Y37-F182 HydrophobicContact CD2-CD1 4.34Å; Y37-F182 HydrophobicContact CD2-CD2 4.17Å; Y37-F182 AromaticContact CD2-CG 3.93Å; Y37-F182 HydrophobicContact CD2-CG 3.93Å; G178-F182 WeakPolarHBondContact O-CB 3.37Å; G178-F182 WeakPolarHBondContact O-CD2 3.45Å; G178-F182 PolarHBondContact O-N 3.11Å; F182-I185 PolarHBondContact O-N 3.02Å; F182-Q186 WeakPolarHBondContact O-CB 3.45Å; F182-Q186 WeakPolarHBondContact O-CG 3.46Å; F182-Q186 PolarHBondContact O-N 2.78Å; F182-I220 HydrophobicContact CD1-CD1 4.45Å; F182-I223 HydrophobicContact CE1-CG2 3.91Å; F182-L224 HydrophobicContact CD1-CD2 4.46Å; F182-L224 HydrophobicContact CD2-CD2 4.45Å; F182-L224 HydrophobicContact CE1-CD2 3.74Å; F182-L224 HydrophobicContact CE1-CG 4.43Å; F182-L224 HydrophobicContact CE2-CD2 3.75Å; F182-L224 HydrophobicContact CZ-CD2 3.36Å; F182-L224 HydrophobicContact CZ-CG 4.46Å |
| 183 | S | 89.8 | Confident | 90.2 | Very high | 30 Ų | 30 | 47 Ų | 47 | 21% | 0.21 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.1 | -49.8 | -178 | -48 | 0 | 0 | 0 | 0 | 113.2 | N43 S179 I185 Q186 T187 | N43-S183 PolarHBondContact ND2-O 3.15Å; S179-S183 WeakPolarHBondContact O-CB 3.37Å; S179-S183 PolarHBondContact O-N 3.1Å; S179-S183 PolarHBondContact O-OG 3.05Å; S183-I185 VanDerWaalsContact C-N 3.34Å; S183-I185 PolarHBondContact O-N 3.17Å; S183-Q186 PolarHBondContact O-N 3.42Å; S183-T187 PolarHBondContact O-N 3.07Å; S183-T187 PolarHBondContact O-OG1 3.11Å; S183-T187 VanDerWaalsContact O-OG1 3.1Å |
| 184 | P | 91.3 | Very high | 89.8 | Confident | 74 Ų | 74 | 50.1 Ų | 50.1 | 48% | 0.481 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.3 | -35.1 | 176.8 | 25.8 | -34.1 | 0 | 0 | 0 | 112.5 | L180 V181 T187 F188 | L180-P184 WeakPolarHBondContact O-CD 3.36Å; L180-P184 WeakPolarHBondContact O-CG 3.12Å; V181-P184 WeakPolarHBondContact O-CD 3.42Å; V181-P184 WeakPolarHBondContact O-CG 3.49Å; P184-T187 PolarHBondContact O-N 2.94Å; P184-F188 VanDerWaalsContact O-CB 3.25Å; P184-F188 WeakPolarHBondContact O-CB 3.42Å; P184-F188 PolarHBondContact O-N 2.87Å |
| 185 | I | 91 | Very high | 89.5 | Confident | 57 Ų | 57 | 52.2 Ų | 52.2 | 29% | 0.292 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.4 | -46.6 | 175.5 | -67 | 170.7 | 0 | 0 | 0 | 110.3 | V181 F182 S183 F188 L189 I220 I223 | V181-I185 HydrophobicContact CG1-CD1 3.82Å; V181-I185 VanDerWaalsContact O-CD1 3.22Å; V181-I185 WeakPolarHBondContact O-CD1 3.37Å; V181-I185 WeakPolarHBondContact O-CG1 3.42Å; F182-I185 PolarHBondContact O-N 3.02Å; S183-I185 VanDerWaalsContact C-N 3.34Å; S183-I185 PolarHBondContact O-N 3.17Å; I185-F188 PolarHBondContact O-N 3.23Å; I185-L189 HydrophobicContact CG2-CD1 3.84Å; I185-L189 HydrophobicContact CG2-CG 4.48Å; I185-L189 WeakPolarHBondContact O-CB 3.42Å; I185-L189 WeakPolarHBondContact O-CG 2.94Å; I185-L189 PolarHBondContact O-N 3.29Å; I185-I220 HydrophobicContact CG2-CD1 3.97Å; I185-I223 HydrophobicContact CG2-CD1 4.45Å |
| 186 | Q | 88.6 | Confident | 89 | Confident | 0 Ų | 0 | 56.7 Ų | 56.7 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -61.3 | -49.5 | 177 | -71.3 | 165.5 | -22.5 | 0 | 0 | 111.7 | Y37 S40 N43 M44 F182 S183 F188 L189 I190 I220 | Y37-Q186 PolarHBondContact OH-NE2 2.74Å; S40-Q186 PolarHBondContact OG-NE2 3.31Å; N43-Q186 PolarHBondContact ND2-OE1 2.91Å; M44-Q186 HydrophobicContact CE-CB 4.11Å; M44-Q186 HydrophobicContact CE-CG 3.57Å; M44-Q186 HydrophobicContact CG-CG 4.37Å; M44-Q186 VanDerWaalsContact CG-NE2 3.27Å; M44-Q186 HydrophobicContact SD-CB 3.78Å; M44-Q186 HydrophobicContact SD-CG 3.7Å; F182-Q186 WeakPolarHBondContact O-CB 3.45Å; F182-Q186 WeakPolarHBondContact O-CG 3.46Å; F182-Q186 PolarHBondContact O-N 2.78Å; S183-Q186 PolarHBondContact O-N 3.42Å; Q186-F188 VanDerWaalsContact C-N 3.31Å; Q186-F188 PolarHBondContact O-N 2.86Å; Q186-L189 PolarHBondContact O-N 2.98Å; Q186-I190 WeakPolarHBondContact O-CB 3.48Å; Q186-I190 VanDerWaalsContact O-CG1 3.31Å; Q186-I190 WeakPolarHBondContact O-CG1 3.28Å; Q186-I190 PolarHBondContact O-N 2.92Å; Q186-I220 HydrophobicContact CG-CD1 3.89Å; Q186-I220 HydrophobicContact CG-CG1 4.17Å |
| 187 | T | 88.5 | Confident | 88.7 | Confident | 35 Ų | 35 | 57.4 Ų | 57.4 | 22% | 0.215 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -62.8 | -40.3 | -178.8 | -58.1 | 0 | 0 | 0 | 0 | 111 | N43 S183 P184 L189 I190 N191 | N43-T187 PolarHBondContact ND2-OG1 3.48Å; N43-T187 VanDerWaalsContact ND2-OG1 3.09Å; S183-T187 PolarHBondContact O-N 3.07Å; S183-T187 PolarHBondContact O-OG1 3.11Å; S183-T187 VanDerWaalsContact O-OG1 3.1Å; P184-T187 PolarHBondContact O-N 2.94Å; T187-L189 PolarHBondContact O-N 3.35Å; T187-I190 PolarHBondContact O-N 3.13Å; T187-N191 CarbonylContact O-C 3.36Å; T187-N191 WeakPolarHBondContact O-CA 3.01Å; T187-N191 PolarHBondContact O-N 3.37Å |
| 188 | F | 90.8 | Very high | 88.2 | Confident | 150 Ų | 150 | 56.6 Ų | 56.6 | 66% | 0.658 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -64 | -39.2 | 175.4 | -178.5 | -100.8 | 0 | 0 | 0 | 112.7 | P184 I185 Q186 | P184-F188 VanDerWaalsContact O-CB 3.25Å; P184-F188 WeakPolarHBondContact O-CB 3.42Å; P184-F188 PolarHBondContact O-N 2.87Å; I185-F188 PolarHBondContact O-N 3.23Å; Q186-F188 VanDerWaalsContact C-N 3.31Å; Q186-F188 PolarHBondContact O-N 2.86Å |
| 189 | L | 89.1 | Confident | 87.7 | Confident | 54 Ų | 54 | 64 Ų | 64 | 28% | 0.283 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -72.3 | -38.1 | 178.4 | -70.7 | 170.8 | 0 | 0 | 0 | 112.9 | I185 Q186 T187 V216 V219 | I185-L189 HydrophobicContact CG2-CD1 3.84Å; I185-L189 HydrophobicContact CG2-CG 4.48Å; I185-L189 WeakPolarHBondContact O-CB 3.42Å; I185-L189 WeakPolarHBondContact O-CG 2.94Å; I185-L189 PolarHBondContact O-N 3.29Å; Q186-L189 PolarHBondContact O-N 2.98Å; T187-L189 PolarHBondContact O-N 3.35Å; L189-V216 HydrophobicContact CB-CB 4.46Å; L189-V216 HydrophobicContact CB-CG1 4.03Å; L189-V216 HydrophobicContact CB-CG2 3.66Å; L189-V216 HydrophobicContact CD1-CG1 4.1Å; L189-V219 HydrophobicContact CD1-CB 4.19Å; L189-V219 HydrophobicContact CD1-CG1 3.71Å |
| 190 | I | 88.9 | Confident | 87.3 | Confident | 1 Ų | 1 | 68.7 Ų | 68.7 | 1% | 0.005 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -85.6 | -50.8 | -176.3 | -61.8 | 172.2 | 0 | 0 | 0 | 111.4 | M44 Y47 Q186 T187 P192 I209 R212 L213 V216 | M44-I190 HydrophobicContact CE-CD1 3.92Å; M44-I190 HydrophobicContact SD-CD1 3.45Å; M44-I190 WeakPolarHBondContact SD-CD1 3.13Å; Y47-I190 HydrophobicContact CD1-CB 4.49Å; Y47-I190 HydrophobicContact CD1-CG2 3.38Å; Y47-I190 HydrophobicContact CD2-CD1 3.99Å; Y47-I190 HydrophobicContact CE1-CB 4.4Å; Y47-I190 HydrophobicContact CE1-CG2 3.55Å; Y47-I190 HydrophobicContact CE2-CD1 4.42Å; Y47-I190 HydrophobicContact CG-CD1 4.1Å; Y47-I190 HydrophobicContact CG-CG2 3.91Å; Q186-I190 WeakPolarHBondContact O-CB 3.48Å; Q186-I190 VanDerWaalsContact O-CG1 3.31Å; Q186-I190 WeakPolarHBondContact O-CG1 3.28Å; Q186-I190 PolarHBondContact O-N 2.92Å; T187-I190 PolarHBondContact O-N 3.13Å; I190-P192 WeakPolarHBondContact O-CD 3.25Å; I190-I209 HydrophobicContact CG2-CG2 3.47Å; I190-I209 VanDerWaalsContact CG2-CG2 3.47Å; I190-R212 WeakPolarHBondContact O-CD 3.16Å; I190-L213 HydrophobicContact CD1-CD1 3.9Å; I190-V216 HydrophobicContact CB-CG2 4.45Å; I190-V216 HydrophobicContact CD1-CB 4.38Å; I190-V216 HydrophobicContact CD1-CG1 4.11Å; I190-V216 HydrophobicContact CD1-CG2 4.42Å; I190-V216 HydrophobicContact CG1-CB 3.88Å; I190-V216 HydrophobicContact CG1-CG1 3.87Å; I190-V216 HydrophobicContact CG1-CG2 3.43Å; I190-V216 VanDerWaalsContact CG1-CG2 3.43Å |
| 191 | N | 88.8 | Confident | 86.5 | Confident | 5 Ų | 5 | 65.5 Ų | 65.5 | 3% | 0.027 | 37% | 0.371 | C | S | . | . | trans | -129.5 | 68.5 | -170.7 | -172.1 | 8.8 | 0 | 0 | 0 | 111.2 | Y47 T187 N193 N194 V195 I209 | Y47-N191 HydrophobicContact CE1-CB 4.22Å; T187-N191 CarbonylContact O-C 3.36Å; T187-N191 WeakPolarHBondContact O-CA 3.01Å; T187-N191 PolarHBondContact O-N 3.37Å; N191-N193 PolarHBondContact O-N 3.22Å; N191-N194 PolarHBondContact O-N 3.46Å; N191-N194 VanDerWaalsContact O-N 3.12Å; N191-N194 WeakPolarHBondContact OD1-CA 3.17Å; N191-N194 PolarHBondContact OD1-N 3.05Å; N191-N194 VanDerWaalsContact OD1-N 3.14Å; N191-V195 PolarHBondContact ND2-N 2.68Å; N191-V195 VanDerWaalsContact ND2-N 3.2Å; N191-V195 PolarHBondContact ND2-O 3.41Å; N191-V195 PolarHBondContact OD1-N 3.31Å; N191-I209 HydrophobicContact CB-CG2 4.33Å | ||
| 192 | P | 87.6 | Confident | 85.8 | Confident | 54 Ų | 54 | 72.7 Ų | 72.7 | 35% | 0.351 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -27.3 | -177.8 | 26.3 | -35.5 | 0 | 0 | 0 | 113.1 | I190 N194 R212 | I190-P192 WeakPolarHBondContact O-CD 3.25Å; P192-N194 VanDerWaalsContact C-N 3.3Å; P192-R212 VanDerWaalsContact CG-NH1 3.33Å |
| 193 | N | 86.1 | Confident | 85.1 | Confident | 122 Ų | 122 | 73 Ų | 73 | 65% | 0.652 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.8 | 3.3 | -179.3 | -63.7 | -30.2 | 0 | 0 | 0 | 112.8 | N191 V195 | N191-N193 PolarHBondContact O-N 3.22Å; N193-V195 HydrophobicContact CB-CG2 4.1Å; N193-V195 PolarHBondContact O-N 3.39Å; N193-V195 VanDerWaalsContact O-N 3.17Å |
| 194 | N | 85 | Confident | 84.8 | Confident | 124 Ų | 124 | 72.4 Ų | 72.4 | 66% | 0.663 | 39% | 0.387 | S | S | * | . | trans | 47.5 | 42.5 | -177.4 | -163.2 | 39.5 | 0 | 0 | 0 | 113.1 | N191 P192 | N191-N194 PolarHBondContact O-N 3.46Å; N191-N194 VanDerWaalsContact O-N 3.12Å; N191-N194 WeakPolarHBondContact OD1-CA 3.17Å; N191-N194 PolarHBondContact OD1-N 3.05Å; N191-N194 VanDerWaalsContact OD1-N 3.14Å; P192-N194 VanDerWaalsContact C-N 3.3Å | ||
| 195 | V | 86.2 | Confident | 84.2 | Confident | 44 Ų | 44 | 71.3 Ų | 71.3 | 27% | 0.267 | 38% | 0.377 | S | S | . | . | P | Polyproline II helix | trans | -56.6 | 129.2 | 177.2 | 179.7 | 0 | 0 | 0 | 0 | 108.2 | N191 N193 F204 I209 | N191-V195 PolarHBondContact ND2-N 2.68Å; N191-V195 VanDerWaalsContact ND2-N 3.2Å; N191-V195 PolarHBondContact ND2-O 3.41Å; N191-V195 PolarHBondContact OD1-N 3.31Å; N193-V195 HydrophobicContact CB-CG2 4.1Å; N193-V195 PolarHBondContact O-N 3.39Å; N193-V195 VanDerWaalsContact O-N 3.17Å; V195-F204 WeakPolarHBondContact O-CE1 3.26Å; V195-I209 HydrophobicContact CB-CD1 3.57Å; V195-I209 HydrophobicContact CG1-CD1 3.96Å; V195-I209 HydrophobicContact CG2-CD1 3.88Å |
| 196 | P | 82.7 | Confident | 83.9 | Confident | 108 Ų | 108 | 71.2 Ų | 71.2 | 70% | 0.701 | 38% | 0.377 | S | S | * | . | P | Polyproline II helix | trans | -69.1 | 152.1 | -178 | 28.5 | -34.7 | 0 | 0 | 0 | 111.3 | ||
| 197 | V | 83.2 | Confident | 83.6 | Confident | 54 Ų | 54 | 74.7 Ų | 74.7 | 33% | 0.327 | 40% | 0.4 | S | S | . | . | P | Polyproline II helix | trans | -60.5 | 144 | 170.9 | 178.3 | 0 | 0 | 0 | 0 | 109.6 | N199 R202 Q203 F204 | V197-N199 PolarHBondContact O-N 2.83Å; V197-R202 WeakPolarHBondContact CG1-O 3.46Å; V197-Q203 WeakPolarHBondContact CG1-O 3.49Å; V197-F204 HydrophobicContact CG2-CD1 4.2Å; V197-F204 HydrophobicContact CG2-CD2 4.32Å; V197-F204 HydrophobicContact CG2-CE1 3.64Å; V197-F204 HydrophobicContact CG2-CE2 3.77Å; V197-F204 HydrophobicContact CG2-CZ 3.41Å; V197-F204 VanDerWaalsContact CG2-CZ 3.41Å |
| 198 | N | 81.9 | Confident | 83.5 | Confident | 64 Ų | 64 | 78.1 Ų | 78.1 | 34% | 0.342 | 41% | 0.413 | S | S | . | . | P | Polyproline II helix | trans | -63.3 | 123.2 | 173.9 | 178.1 | -13.4 | 0 | 0 | 0 | 110 | V200 T201 R202 Q203 D205 | N198-V200 PolarHBondContact O-N 3.33Å; N198-V200 VanDerWaalsContact O-N 3.12Å; N198-V200 PolarHBondContact OD1-N 2.76Å; N198-T201 WeakPolarHBondContact CB-OG1 3.45Å; N198-T201 PolarHBondContact ND2-OG1 2.83Å; N198-R202 VanDerWaalsContact O-CA 3.24Å; N198-R202 WeakPolarHBondContact O-CA 3.32Å; N198-R202 PolarHBondContact O-N 3.33Å; N198-Q203 WeakPolarHBondContact CB-O 3.39Å; N198-Q203 PolarHBondContact N-O 3.27Å; N198-D205 WeakPolarHBondContact CB-OD2 3.31Å; N198-D205 PolarHBondContact ND2-OD2 3.28Å |
| 199 | N | 80.1 | Confident | 83.4 | Confident | 154 Ų | 154 | 71.3 Ų | 71.3 | 82% | 0.824 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -21.9 | -175.6 | -71.2 | -30.1 | 0 | 0 | 0 | 113.9 | V197 | V197-N199 PolarHBondContact O-N 2.83Š|
| 200 | V | 78.6 | Confident | 83.3 | Confident | 129 Ų | 129 | 68.7 Ų | 68.7 | 78% | 0.782 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89 | -56.6 | -178.9 | -175.3 | 0 | 0 | 0 | 0 | 111 | N198 R202 | N198-V200 PolarHBondContact O-N 3.33Å; N198-V200 VanDerWaalsContact O-N 3.12Å; N198-V200 PolarHBondContact OD1-N 2.76Å; V200-R202 VanDerWaalsContact C-N 3.31Å; V200-R202 PolarHBondContact O-N 3.25Å |
| 201 | T | 74.9 | Confident | 83.1 | Confident | 58 Ų | 58 | 72.9 Ų | 72.9 | 36% | 0.356 | 39% | 0.392 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | -18.5 | -176.2 | 57.6 | 0 | 0 | 0 | 0 | 112.4 | N198 Q203 D205 | N198-T201 WeakPolarHBondContact CB-OG1 3.45Å; N198-T201 PolarHBondContact ND2-OG1 2.83Å; T201-Q203 PolarHBondContact O-N 3.17Å; T201-Q203 PolarHBondContact OG1-N 2.85Å; T201-D205 PolarHBondContact OG1-OD1 3.35Å; T201-D205 PolarHBondContact OG1-OD2 2.92Å |
| 202 | R | 78.1 | Confident | 83.1 | Confident | 206 Ų | 206 | 76.6 Ų | 76.6 | 78% | 0.777 | 41% | 0.406 | S | S | * | . | S | Bend | trans | 55.6 | 30 | -169.4 | -58.6 | -175.1 | 177.2 | 171.8 | -0.6 | 112.4 | V197 N198 V200 | V197-R202 WeakPolarHBondContact CG1-O 3.46Å; N198-R202 VanDerWaalsContact O-CA 3.24Å; N198-R202 WeakPolarHBondContact O-CA 3.32Å; N198-R202 PolarHBondContact O-N 3.33Å; V200-R202 VanDerWaalsContact C-N 3.31Å; V200-R202 PolarHBondContact O-N 3.25Å |
| 203 | Q | 76 | Confident | 83.1 | Confident | 9 Ų | 9 | 74 Ų | 74 | 4% | 0.042 | 39% | 0.389 | C | S | . | . | S | Bend | trans | -130.4 | 162.6 | -180 | -66.7 | -176.5 | -50.5 | 0 | 0 | 111.9 | I53 V62 V197 N198 T201 | I53-Q203 VanDerWaalsContact CD1-NE2 3.28Å; V62-Q203 HydrophobicContact CG1-CG 4.5Å; V62-Q203 HydrophobicContact CG2-CG 4.5Å; V197-Q203 WeakPolarHBondContact CG1-O 3.49Å; N198-Q203 WeakPolarHBondContact CB-O 3.39Å; N198-Q203 PolarHBondContact N-O 3.27Å; T201-Q203 PolarHBondContact O-N 3.17Å; T201-Q203 PolarHBondContact OG1-N 2.85Å |
| 204 | F | 82.3 | Confident | 82.9 | Confident | 19 Ų | 19 | 68.5 Ų | 68.5 | 8% | 0.083 | 36% | 0.36 | C | S | . | . | trans | -83.5 | 110.1 | 169.6 | -65.7 | -79 | 0 | 0 | 0 | 107.6 | P46 Y47 V195 V197 I209 L210 | P46-F204 HydrophobicContact CB-CD2 4.18Å; P46-F204 HydrophobicContact CB-CE2 4.15Å; Y47-F204 HydrophobicContact CD1-CB 4.29Å; Y47-F204 AromaticContact CD1-CD2 3.4Å; Y47-F204 HydrophobicContact CD1-CD2 3.4Å; Y47-F204 AromaticContact CD1-CE2 3.75Å; Y47-F204 HydrophobicContact CD1-CE2 3.75Å; Y47-F204 AromaticContact CD1-CG 3.84Å; Y47-F204 HydrophobicContact CD1-CG 3.84Å; Y47-F204 HydrophobicContact CD1-CZ 4.44Å; Y47-F204 HydrophobicContact CD2-CE2 4.44Å; Y47-F204 HydrophobicContact CE1-CD1 4.03Å; Y47-F204 AromaticContact CE1-CD2 3.36Å; Y47-F204 HydrophobicContact CE1-CD2 3.36Å; Y47-F204 AromaticContact CE1-CE1 3.94Å; Y47-F204 HydrophobicContact CE1-CE1 3.94Å; Y47-F204 AromaticContact CE1-CE2 3.26Å; Y47-F204 HydrophobicContact CE1-CE2 3.26Å; Y47-F204 AromaticContact CE1-CG 3.75Å; Y47-F204 HydrophobicContact CE1-CG 3.75Å; Y47-F204 AromaticContact CE1-CZ 3.56Å; Y47-F204 HydrophobicContact CE1-CZ 3.56Å; Y47-F204 HydrophobicContact CE2-CE2 4.02Å; Y47-F204 HydrophobicContact CG-CD2 4.08Å; Y47-F204 HydrophobicContact CG-CE2 4.32Å; Y47-F204 AromaticContact CZ-CE2 3.42Å; Y47-F204 VanDerWaalsContact CZ-CE2 3.42Å; Y47-F204 AromaticContact CZ-CZ 3.65Å; Y47-F204 WeakPolarHBondContact OH-CZ 3.35Å; V195-F204 WeakPolarHBondContact O-CE1 3.26Å; V197-F204 HydrophobicContact CG2-CD1 4.2Å; V197-F204 HydrophobicContact CG2-CD2 4.32Å; V197-F204 HydrophobicContact CG2-CE1 3.64Å; V197-F204 HydrophobicContact CG2-CE2 3.77Å; V197-F204 HydrophobicContact CG2-CZ 3.41Å; V197-F204 VanDerWaalsContact CG2-CZ 3.41Å; F204-I209 HydrophobicContact CD1-CD1 4.3Å; F204-L210 HydrophobicContact CB-CD2 4.42Å; F204-L210 WeakPolarHBondContact O-CD1 3.26Å; F204-L210 WeakPolarHBondContact O-CD2 3.38Å | ||
| 205 | D | 80 | Confident | 82.8 | Confident | 51 Ų | 51 | 68.1 Ų | 68.1 | 27% | 0.273 | 35% | 0.354 | S | S | . | . | trans | -105.9 | -1.8 | -177.4 | -53.4 | -25.8 | 0 | 0 | 0 | 111.8 | N198 T201 P207 | N198-D205 WeakPolarHBondContact CB-OD2 3.31Å; N198-D205 PolarHBondContact ND2-OD2 3.28Å; T201-D205 PolarHBondContact OG1-OD1 3.35Å; T201-D205 PolarHBondContact OG1-OD2 2.92Å; D205-P207 WeakPolarHBondContact O-CD 3.39Å | ||
| 206 | D | 84 | Confident | 82.8 | Confident | 54 Ų | 54 | 66.2 Ų | 66.2 | 29% | 0.289 | 34% | 0.343 | S | S | . | . | trans | -70.4 | 116.2 | -179 | -171.8 | -27.5 | 0 | 0 | 0 | 110.2 | E208 I209 L210 | D206-E208 PolarHBondContact O-N 3.24Å; D206-E208 VanDerWaalsContact O-N 3.15Å; D206-E208 WeakPolarHBondContact OD1-CB 3.25Å; D206-E208 PolarHBondContact OD1-N 3.2Å; D206-I209 HydrophobicContact CB-CB 4.33Å; D206-I209 HydrophobicContact CB-CD1 3.72Å; D206-I209 HydrophobicContact CB-CG1 3.91Å; D206-I209 PolarHBondContact O-N 2.94Å; D206-I209 VanDerWaalsContact O-N 3.15Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.09Å; D206-L210 VanDerWaalsContact O-N 3.13Å | ||
| 207 | P | 83.4 | Confident | 82.9 | Confident | 74 Ų | 74 | 61.1 Ų | 61.1 | 48% | 0.481 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -61.1 | -25.6 | -177.8 | 25.8 | -35 | 0 | 0 | 0 | 112.8 | F55 D205 N211 | F55-P207 HydrophobicContact CZ-CB 4.44Å; D205-P207 WeakPolarHBondContact O-CD 3.39Å; P207-N211 WeakPolarHBondContact O-CB 3.34Å; P207-N211 PolarHBondContact O-N 3.14Å; P207-N211 PolarHBondContact O-ND2 3.12Å |
| 208 | E | 86 | Confident | 82.9 | Confident | 106 Ų | 106 | 61.4 Ų | 61.4 | 50% | 0.495 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -68.9 | -41.9 | 178.1 | -166.6 | -175.4 | 157.1 | 0 | 0 | 111.5 | D206 R212 | D206-E208 PolarHBondContact O-N 3.24Å; D206-E208 VanDerWaalsContact O-N 3.15Å; D206-E208 WeakPolarHBondContact OD1-CB 3.25Å; D206-E208 PolarHBondContact OD1-N 3.2Å; E208-R212 WeakPolarHBondContact O-CD 3.23Å; E208-R212 WeakPolarHBondContact O-CG 3.35Å; E208-R212 IonicContact OE1-CZ 3.69Å; E208-R212 IonicContact OE1-NE 3.91Å; E208-R212 IonicContact OE1-NH2 2.71Å; E208-R212 PolarHBondContact OE1-NH2 3.19Å |
| 209 | I | 87.7 | Confident | 83.1 | Confident | 7 Ų | 7 | 61.3 Ų | 61.3 | 4% | 0.036 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -68.1 | -45.4 | 178.6 | -59.2 | 176.4 | 0 | 0 | 0 | 109.8 | Y47 I190 N191 V195 F204 D206 R212 | Y47-I209 HydrophobicContact CD1-CG2 4Å; Y47-I209 HydrophobicContact CE1-CG2 4.05Å; I190-I209 HydrophobicContact CG2-CG2 3.47Å; I190-I209 VanDerWaalsContact CG2-CG2 3.47Å; N191-I209 HydrophobicContact CB-CG2 4.33Å; V195-I209 HydrophobicContact CB-CD1 3.57Å; V195-I209 HydrophobicContact CG1-CD1 3.96Å; V195-I209 HydrophobicContact CG2-CD1 3.88Å; F204-I209 HydrophobicContact CD1-CD1 4.3Å; D206-I209 HydrophobicContact CB-CB 4.33Å; D206-I209 HydrophobicContact CB-CD1 3.72Å; D206-I209 HydrophobicContact CB-CG1 3.91Å; D206-I209 PolarHBondContact O-N 2.94Å; D206-I209 VanDerWaalsContact O-N 3.15Å; I209-R212 WeakPolarHBondContact O-CB 3.09Å; I209-R212 PolarHBondContact O-N 3.34Å |
| 210 | L | 86.7 | Confident | 83.5 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -68 | -38.9 | -176.1 | -62.9 | -179.7 | 0 | 0 | 0 | 111.8 | G50 Y51 T54 F55 F204 D206 R212 L213 | G50-L210 WeakPolarHBondContact O-CD1 3.35Å; Y51-L210 HydrophobicContact CD2-CB 4.11Å; Y51-L210 WeakPolarHBondContact CD2-O 3.18Å; T54-L210 HydrophobicContact CG2-CD1 4.13Å; T54-L210 WeakPolarHBondContact OG1-CD1 3.18Å; F55-L210 HydrophobicContact CD2-CB 4.37Å; F55-L210 HydrophobicContact CE2-CB 3.56Å; F55-L210 HydrophobicContact CE2-CD1 4.2Å; F55-L210 HydrophobicContact CZ-CB 4.42Å; F204-L210 HydrophobicContact CB-CD2 4.42Å; F204-L210 WeakPolarHBondContact O-CD1 3.26Å; F204-L210 WeakPolarHBondContact O-CD2 3.38Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.09Å; D206-L210 VanDerWaalsContact O-N 3.13Å; L210-R212 PolarHBondContact O-N 3.15Å; L210-R212 VanDerWaalsContact O-N 3.17Å; L210-L213 VanDerWaalsContact O-CB 3.26Å; L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 3.34Å |
| 211 | N | 86.5 | Confident | 83.7 | Confident | 88 Ų | 88 | 47.9 Ų | 47.9 | 47% | 0.471 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.8 | -21 | 176.1 | -82.3 | -52.6 | 0 | 0 | 0 | 114 | P207 | P207-N211 WeakPolarHBondContact O-CB 3.34Å; P207-N211 PolarHBondContact O-N 3.14Å; P207-N211 PolarHBondContact O-ND2 3.12Å |
| 212 | R | 87.8 | Confident | 84.2 | Confident | 83 Ų | 83 | 48.1 Ų | 48.1 | 31% | 0.313 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -76.9 | -25.5 | 174.7 | -65.2 | 165.2 | -176.9 | -126.8 | 6.5 | 112.3 | I190 P192 E208 I209 L210 H215 V216 | I190-R212 WeakPolarHBondContact O-CD 3.16Å; P192-R212 VanDerWaalsContact CG-NH1 3.33Å; E208-R212 WeakPolarHBondContact O-CD 3.23Å; E208-R212 WeakPolarHBondContact O-CG 3.35Å; E208-R212 IonicContact OE1-CZ 3.69Å; E208-R212 IonicContact OE1-NE 3.91Å; E208-R212 IonicContact OE1-NH2 2.71Å; E208-R212 PolarHBondContact OE1-NH2 3.19Å; I209-R212 WeakPolarHBondContact O-CB 3.09Å; I209-R212 PolarHBondContact O-N 3.34Å; L210-R212 PolarHBondContact O-N 3.15Å; L210-R212 VanDerWaalsContact O-N 3.17Å; R212-H215 WeakPolarHBondContact O-CB 3.47Å; R212-H215 PolarHBondContact O-N 3.07Å; R212-V216 WeakPolarHBondContact O-CG2 3.16Å; R212-V216 PolarHBondContact O-N 3.22Å; R212-V216 VanDerWaalsContact O-N 3.14Å |
| 213 | L | 86.8 | Confident | 84.6 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -54.2 | -46.9 | -172.8 | 178.2 | 68.8 | 0 | 0 | 0 | 114.1 | I48 Y51 I126 I190 L210 H215 V216 F217 | I48-L213 HydrophobicContact CG1-CD1 4.43Å; I48-L213 HydrophobicContact CG1-CD2 4.15Å; Y51-L213 HydrophobicContact CD2-CB 4.42Å; Y51-L213 HydrophobicContact CD2-CD2 4.27Å; Y51-L213 HydrophobicContact CG-CD2 4.04Å; I126-L213 HydrophobicContact CD1-CD2 3.45Å; I126-L213 VanDerWaalsContact CD1-CD2 3.45Å; I126-L213 HydrophobicContact CD1-CG 4.22Å; I190-L213 HydrophobicContact CD1-CD1 3.9Å; L210-L213 VanDerWaalsContact O-CB 3.26Å; L210-L213 WeakPolarHBondContact O-CB 3.5Å; L210-L213 PolarHBondContact O-N 3.34Å; L213-H215 VanDerWaalsContact C-N 3.27Å; L213-H215 PolarHBondContact O-N 3.01Å; L213-V216 PolarHBondContact O-N 2.97Å; L213-V216 VanDerWaalsContact O-N 3.1Å; L213-F217 HydrophobicContact CD1-CE2 3.97Å; L213-F217 HydrophobicContact CD1-CZ 4.06Å; L213-F217 HydrophobicContact CD2-CE2 4.2Å; L213-F217 HydrophobicContact CG-CD2 4.38Å; L213-F217 HydrophobicContact CG-CE2 3.76Å; L213-F217 HydrophobicContact CG-CZ 4.3Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 3.06Å |
| 214 | P | 83.2 | Confident | 85.2 | Confident | 6 Ų | 6 | 40.8 Ų | 40.8 | 4% | 0.039 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.8 | -39.5 | 177 | -25 | 35.5 | 0 | 0 | 0 | 112.8 | Y51 Y123 I126 V216 F217 L218 | Y51-P214 HydrophobicContact CE2-CG 3.87Å; Y123-P214 HydrophobicContact CD2-CB 3.49Å; Y123-P214 VanDerWaalsContact CD2-CB 3.49Å; Y123-P214 WeakPolarHBondContact CD2-O 3.06Å; Y123-P214 HydrophobicContact CE2-CB 3.51Å; I126-P214 HydrophobicContact CG2-CG 4.34Å; P214-V216 VanDerWaalsContact C-N 3.32Å; P214-V216 PolarHBondContact O-N 3.48Å; P214-F217 PolarHBondContact O-N 3.13Å; P214-L218 PolarHBondContact O-N 3.28Å |
| 215 | H | 83.2 | Confident | 85.2 | Confident | 116 Ų | 116 | 40.1 Ų | 40.1 | 54% | 0.537 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -66.4 | -35.3 | 178.2 | -66 | 85.7 | 0 | 0 | 0 | 111.8 | R212 L213 F217 L218 V219 | R212-H215 WeakPolarHBondContact O-CB 3.47Å; R212-H215 PolarHBondContact O-N 3.07Å; L213-H215 VanDerWaalsContact C-N 3.27Å; L213-H215 PolarHBondContact O-N 3.01Å; H215-F217 PolarHBondContact O-N 3Å; H215-L218 WeakPolarHBondContact O-CB 3.29Å; H215-L218 PolarHBondContact O-N 3.1Å; H215-V219 WeakPolarHBondContact O-CG2 3.33Å; H215-V219 PolarHBondContact O-N 3.21Å |
| 216 | V | 86.5 | Confident | 85.6 | Confident | 5 Ų | 5 | 41.1 Ų | 41.1 | 3% | 0.03 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66.5 | -38.1 | 178.4 | -177.3 | 0 | 0 | 0 | 0 | 111.7 | M44 L189 I190 R212 L213 P214 L218 V219 I220 | M44-V216 HydrophobicContact CE-CG1 3.81Å; L189-V216 HydrophobicContact CB-CB 4.46Å; L189-V216 HydrophobicContact CB-CG1 4.03Å; L189-V216 HydrophobicContact CB-CG2 3.66Å; L189-V216 HydrophobicContact CD1-CG1 4.1Å; I190-V216 HydrophobicContact CB-CG2 4.45Å; I190-V216 HydrophobicContact CD1-CB 4.38Å; I190-V216 HydrophobicContact CD1-CG1 4.11Å; I190-V216 HydrophobicContact CD1-CG2 4.42Å; I190-V216 HydrophobicContact CG1-CB 3.88Å; I190-V216 HydrophobicContact CG1-CG1 3.87Å; I190-V216 HydrophobicContact CG1-CG2 3.43Å; I190-V216 VanDerWaalsContact CG1-CG2 3.43Å; R212-V216 WeakPolarHBondContact O-CG2 3.16Å; R212-V216 PolarHBondContact O-N 3.22Å; R212-V216 VanDerWaalsContact O-N 3.14Å; L213-V216 PolarHBondContact O-N 2.97Å; L213-V216 VanDerWaalsContact O-N 3.1Å; P214-V216 VanDerWaalsContact C-N 3.32Å; P214-V216 PolarHBondContact O-N 3.48Å; V216-L218 PolarHBondContact O-N 3.15Å; V216-V219 PolarHBondContact O-N 3.31Å; V216-I220 HydrophobicContact CG1-CG1 3.9Å; V216-I220 VanDerWaalsContact O-CB 3.32Å; V216-I220 WeakPolarHBondContact O-CB 3.18Å; V216-I220 VanDerWaalsContact O-CG1 3.32Å; V216-I220 WeakPolarHBondContact O-CG1 3.31Å; V216-I220 PolarHBondContact O-N 2.83Å |
| 217 | F | 84 | Confident | 85.8 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.4 | -38.3 | 172.6 | -70.4 | -55 | 0 | 0 | 0 | 112.7 | M44 I48 V119 I126 Y137 L213 P214 H215 G221 | M44-F217 HydrophobicContact CE-CE1 4.48Å; I48-F217 HydrophobicContact CD1-CE1 4.15Å; I48-F217 HydrophobicContact CD1-CZ 3.68Å; I48-F217 HydrophobicContact CG1-CZ 3.72Å; V119-F217 HydrophobicContact CG1-CD1 4.22Å; I126-F217 HydrophobicContact CD1-CE2 3.69Å; I126-F217 HydrophobicContact CD1-CZ 4.39Å; Y137-F217 HydrophobicContact CD2-CE1 4.01Å; Y137-F217 HydrophobicContact CE2-CD1 4.15Å; Y137-F217 AromaticContact CE2-CE1 3.64Å; Y137-F217 HydrophobicContact CE2-CE1 3.64Å; Y137-F217 AromaticContact CZ-CE1 3.94Å; L213-F217 HydrophobicContact CD1-CE2 3.97Å; L213-F217 HydrophobicContact CD1-CZ 4.06Å; L213-F217 HydrophobicContact CD2-CE2 4.2Å; L213-F217 HydrophobicContact CG-CD2 4.38Å; L213-F217 HydrophobicContact CG-CE2 3.76Å; L213-F217 HydrophobicContact CG-CZ 4.3Å; L213-F217 WeakPolarHBondContact O-CD2 3.48Å; L213-F217 PolarHBondContact O-N 3.06Å; P214-F217 PolarHBondContact O-N 3.13Å; H215-F217 PolarHBondContact O-N 3Å; F217-G221 PolarHBondContact O-N 2.94Å |
| 218 | L | 83.3 | Confident | 86 | Confident | 61 Ų | 61 | 36.2 Ų | 36.2 | 32% | 0.319 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -64.4 | -51.9 | 175.6 | -70.3 | 165.1 | 0 | 0 | 0 | 111.2 | L120 Y123 P214 H215 V216 I220 G221 V222 | L120-L218 HydrophobicContact CD2-CB 4.44Å; L120-L218 HydrophobicContact CD2-CD2 3.55Å; L120-L218 HydrophobicContact CD2-CG 4.29Å; Y123-L218 HydrophobicContact CD2-CD1 3.75Å; Y123-L218 HydrophobicContact CD2-CG 4.05Å; Y123-L218 HydrophobicContact CE2-CD1 3.85Å; Y123-L218 HydrophobicContact CG-CD1 4.36Å; Y123-L218 HydrophobicContact CG-CG 4.41Å; P214-L218 PolarHBondContact O-N 3.28Å; H215-L218 WeakPolarHBondContact O-CB 3.29Å; H215-L218 PolarHBondContact O-N 3.1Å; V216-L218 PolarHBondContact O-N 3.15Å; L218-I220 PolarHBondContact O-N 3.05Å; L218-G221 PolarHBondContact O-N 2.86Å; L218-V222 WeakPolarHBondContact O-CG2 3.48Å; L218-V222 PolarHBondContact O-N 2.92Å |
| 219 | V | 86.7 | Confident | 86 | Confident | 61 Ų | 61 | 33.6 Ų | 33.6 | 37% | 0.37 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -61.4 | -48.3 | -177.3 | 174.9 | 0 | 0 | 0 | 0 | 111.5 | L189 H215 V216 G221 V222 I223 | L189-V219 HydrophobicContact CD1-CB 4.19Å; L189-V219 HydrophobicContact CD1-CG1 3.71Å; H215-V219 WeakPolarHBondContact O-CG2 3.33Å; H215-V219 PolarHBondContact O-N 3.21Å; V216-V219 PolarHBondContact O-N 3.31Å; V219-G221 VanDerWaalsContact C-N 3.32Å; V219-G221 PolarHBondContact O-N 2.74Å; V219-V222 WeakPolarHBondContact O-CB 3.28Å; V219-V222 PolarHBondContact O-N 3.46Å; V219-I223 HydrophobicContact CG1-CD1 3.96Å; V219-I223 WeakPolarHBondContact O-CG1 3.32Å; V219-I223 PolarHBondContact O-N 3.4Å |
| 220 | I | 87 | Confident | 86.1 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62 | -42.4 | 176.4 | -69.9 | -62.2 | 0 | 0 | 0 | 110.8 | Y37 F182 I185 Q186 V216 L218 V222 I223 L224 | Y37-I220 HydrophobicContact CD2-CG2 3.9Å; Y37-I220 HydrophobicContact CE2-CB 4.47Å; Y37-I220 HydrophobicContact CE2-CG2 3.18Å; F182-I220 HydrophobicContact CD1-CD1 4.45Å; I185-I220 HydrophobicContact CG2-CD1 3.97Å; Q186-I220 HydrophobicContact CG-CD1 3.89Å; Q186-I220 HydrophobicContact CG-CG1 4.17Å; V216-I220 HydrophobicContact CG1-CG1 3.9Å; V216-I220 VanDerWaalsContact O-CB 3.32Å; V216-I220 WeakPolarHBondContact O-CB 3.18Å; V216-I220 VanDerWaalsContact O-CG1 3.32Å; V216-I220 WeakPolarHBondContact O-CG1 3.31Å; V216-I220 PolarHBondContact O-N 2.83Å; L218-I220 PolarHBondContact O-N 3.05Å; I220-V222 VanDerWaalsContact C-N 3.3Å; I220-V222 PolarHBondContact O-N 3.02Å; I220-I223 PolarHBondContact O-N 2.95Å; I220-L224 HydrophobicContact CG2-CD1 3.71Å; I220-L224 HydrophobicContact CG2-CG 4.17Å; I220-L224 WeakPolarHBondContact O-CB 3.15Å; I220-L224 VanDerWaalsContact O-CG 3.28Å; I220-L224 WeakPolarHBondContact O-CG 3.33Å; I220-L224 PolarHBondContact O-N 3.28Å |
| 221 | G | 82.9 | Confident | 86.1 | Confident | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.01 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -56.6 | -41.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F217 L218 V219 S225 | F217-G221 PolarHBondContact O-N 2.94Å; L218-G221 PolarHBondContact O-N 2.86Å; V219-G221 VanDerWaalsContact C-N 3.32Å; V219-G221 PolarHBondContact O-N 2.74Å; G221-S225 VanDerWaalsContact O-CB 3.23Å; G221-S225 WeakPolarHBondContact O-CB 3.39Å; G221-S225 PolarHBondContact O-N 3.19Å; G221-S225 PolarHBondContact O-OG 3.45Å |
| 222 | V | 85.3 | Confident | 86.1 | Confident | 63 Ų | 63 | 35.2 Ų | 35.2 | 38% | 0.382 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -61.9 | -52.2 | 173.9 | 179.1 | 0 | 0 | 0 | 0 | 110.4 | I106 L218 V219 I220 L224 S225 V226 | I106-V222 VanDerWaalsContact CD1-CA 3.5Å; I106-V222 HydrophobicContact CD1-CB 3.9Å; I106-V222 HydrophobicContact CD1-CG2 3.24Å; I106-V222 VanDerWaalsContact CD1-N 3.26Å; I106-V222 HydrophobicContact CG1-CG2 4.07Å; L218-V222 WeakPolarHBondContact O-CG2 3.48Å; L218-V222 PolarHBondContact O-N 2.92Å; V219-V222 WeakPolarHBondContact O-CB 3.28Å; V219-V222 PolarHBondContact O-N 3.46Å; I220-V222 VanDerWaalsContact C-N 3.3Å; I220-V222 PolarHBondContact O-N 3.02Å; V222-L224 PolarHBondContact O-N 2.86Å; V222-S225 WeakPolarHBondContact O-CB 3.3Å; V222-S225 PolarHBondContact O-N 2.91Å; V222-S225 VanDerWaalsContact O-N 3.16Å; V222-V226 HydrophobicContact CG1-CG2 4.12Å; V222-V226 WeakPolarHBondContact O-CG2 3.38Å; V222-V226 PolarHBondContact O-N 3.22Å |
| 223 | I | 88.4 | Confident | 85.9 | Confident | 59 Ų | 59 | 36.5 Ų | 36.5 | 30% | 0.303 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.6 | -46.1 | -175 | -65.1 | 166.7 | 0 | 0 | 0 | 110.7 | F182 I185 V219 I220 S225 V226 T227 | F182-I223 HydrophobicContact CE1-CG2 3.91Å; I185-I223 HydrophobicContact CG2-CD1 4.45Å; V219-I223 HydrophobicContact CG1-CD1 3.96Å; V219-I223 WeakPolarHBondContact O-CG1 3.32Å; V219-I223 PolarHBondContact O-N 3.4Å; I220-I223 PolarHBondContact O-N 2.95Å; I223-S225 VanDerWaalsContact C-N 3.34Å; I223-S225 PolarHBondContact O-N 3.08Å; I223-V226 PolarHBondContact O-N 3.34Å; I223-T227 WeakPolarHBondContact O-CB 3.49Å; I223-T227 PolarHBondContact O-N 3.48Å; I223-T227 PolarHBondContact O-OG1 3.31Å |
| 224 | L | 88 | Confident | 86 | Confident | 3 Ų | 3 | 38.2 Ų | 38.2 | 2% | 0.016 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 176.8 | -67.7 | 173.6 | 0 | 0 | 0 | 111.3 | Y37 F182 I220 V222 T227 Q228 | Y37-L224 HydrophobicContact CD1-CD1 4.15Å; Y37-L224 HydrophobicContact CD2-CD1 3.85Å; Y37-L224 HydrophobicContact CD2-CD2 4.22Å; Y37-L224 HydrophobicContact CD2-CG 4.47Å; Y37-L224 HydrophobicContact CE2-CD1 4.24Å; Y37-L224 HydrophobicContact CG-CD1 3.79Å; Y37-L224 HydrophobicContact CG-CD2 4.21Å; F182-L224 HydrophobicContact CD1-CD2 4.46Å; F182-L224 HydrophobicContact CD2-CD2 4.45Å; F182-L224 HydrophobicContact CE1-CD2 3.74Å; F182-L224 HydrophobicContact CE1-CG 4.43Å; F182-L224 HydrophobicContact CE2-CD2 3.75Å; F182-L224 HydrophobicContact CZ-CD2 3.36Å; F182-L224 HydrophobicContact CZ-CG 4.46Å; I220-L224 HydrophobicContact CG2-CD1 3.71Å; I220-L224 HydrophobicContact CG2-CG 4.17Å; I220-L224 WeakPolarHBondContact O-CB 3.15Å; I220-L224 VanDerWaalsContact O-CG 3.28Å; I220-L224 WeakPolarHBondContact O-CG 3.33Å; I220-L224 PolarHBondContact O-N 3.28Å; V222-L224 PolarHBondContact O-N 2.86Å; L224-T227 PolarHBondContact O-N 3.34Å; L224-Q228 WeakPolarHBondContact O-CB 3.39Å; L224-Q228 WeakPolarHBondContact O-CG 3.39Å; L224-Q228 PolarHBondContact O-N 3.18Å |
| 225 | S | 82.5 | Confident | 86.1 | Confident | 5 Ų | 5 | 38.1 Ų | 38.1 | 4% | 0.035 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.4 | -46.8 | 179.6 | -61.7 | 0 | 0 | 0 | 0 | 111.9 | R104 G221 V222 I223 T227 Q228 I229 | R104-S225 WeakPolarHBondContact CG-OG 3.36Å; G221-S225 VanDerWaalsContact O-CB 3.23Å; G221-S225 WeakPolarHBondContact O-CB 3.39Å; G221-S225 PolarHBondContact O-N 3.19Å; G221-S225 PolarHBondContact O-OG 3.45Å; V222-S225 WeakPolarHBondContact O-CB 3.3Å; V222-S225 PolarHBondContact O-N 2.91Å; V222-S225 VanDerWaalsContact O-N 3.16Å; I223-S225 VanDerWaalsContact C-N 3.34Å; I223-S225 PolarHBondContact O-N 3.08Å; S225-T227 VanDerWaalsContact C-N 3.35Å; S225-T227 PolarHBondContact O-N 2.98Å; S225-Q228 PolarHBondContact O-N 3.4Å; S225-I229 WeakPolarHBondContact O-CD1 3.49Å; S225-I229 WeakPolarHBondContact O-CG1 3.48Å; S225-I229 PolarHBondContact O-N 3.25Å |
| 226 | V | 87.4 | Confident | 85.9 | Confident | 71 Ų | 71 | 39.9 Ų | 39.9 | 43% | 0.43 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -60.9 | -46.9 | 178.1 | 170.7 | 0 | 0 | 0 | 0 | 110.2 | V222 I223 Q228 I229 I230 | V222-V226 HydrophobicContact CG1-CG2 4.12Å; V222-V226 WeakPolarHBondContact O-CG2 3.38Å; V222-V226 PolarHBondContact O-N 3.22Å; I223-V226 PolarHBondContact O-N 3.34Å; V226-Q228 VanDerWaalsContact C-N 3.32Å; V226-Q228 PolarHBondContact O-N 3.19Å; V226-I229 PolarHBondContact O-N 3.02Å; V226-I230 HydrophobicContact CG1-CD1 3.77Å; V226-I230 VanDerWaalsContact O-CG1 3.29Å; V226-I230 WeakPolarHBondContact O-CG1 3.44Å; V226-I230 PolarHBondContact O-N 2.98Å |
| 227 | T | 88.5 | Confident | 85.4 | Confident | 24 Ų | 24 | 40.5 Ų | 40.5 | 15% | 0.147 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.9 | -40.6 | 179.5 | -53.8 | 0 | 0 | 0 | 0 | 111.5 | L30 S34 I223 L224 S225 G231 | L30-T227 HydrophobicContact CB-CG2 4.04Å; L30-T227 HydrophobicContact CD2-CG2 4.14Å; L30-T227 WeakPolarHBondContact O-CG2 3.43Å; S34-T227 WeakPolarHBondContact OG-CB 3.45Å; S34-T227 VanDerWaalsContact OG-CG2 3.32Å; S34-T227 WeakPolarHBondContact OG-CG2 3.49Å; I223-T227 WeakPolarHBondContact O-CB 3.49Å; I223-T227 PolarHBondContact O-N 3.48Å; I223-T227 PolarHBondContact O-OG1 3.31Å; L224-T227 PolarHBondContact O-N 3.34Å; S225-T227 VanDerWaalsContact C-N 3.35Å; S225-T227 PolarHBondContact O-N 2.98Å; T227-G231 PolarHBondContact O-N 2.98Å |
| 228 | Q | 87.6 | Confident | 84.9 | Confident | 2 Ų | 2 | 44.8 Ų | 44.8 | 1% | 0.009 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -68.4 | -40.4 | 176.1 | -75.3 | 168.2 | -6.1 | 0 | 0 | 113.1 | C100 L224 S225 V226 G231 L232 | C100-Q228 HydrophobicContact CB-CB 4.45Å; L224-Q228 WeakPolarHBondContact O-CB 3.39Å; L224-Q228 WeakPolarHBondContact O-CG 3.39Å; L224-Q228 PolarHBondContact O-N 3.18Å; S225-Q228 PolarHBondContact O-N 3.4Å; V226-Q228 VanDerWaalsContact C-N 3.32Å; V226-Q228 PolarHBondContact O-N 3.19Å; Q228-G231 PolarHBondContact O-N 2.91Å; Q228-L232 WeakPolarHBondContact O-CB 3.48Å; Q228-L232 WeakPolarHBondContact O-CG 3.3Å; Q228-L232 PolarHBondContact O-N 3.5Å |
| 229 | I | 86.2 | Confident | 83.9 | Confident | 51 Ų | 51 | 45 Ų | 45 | 26% | 0.262 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.7 | -47.4 | 176.9 | -67.7 | 159.1 | 0 | 0 | 0 | 110.2 | R104 S225 V226 G231 L232 I233 | R104-I229 VanDerWaalsContact NH1-CD1 3.25Å; R104-I229 VanDerWaalsContact NH1-CG1 3.27Å; S225-I229 WeakPolarHBondContact O-CD1 3.49Å; S225-I229 WeakPolarHBondContact O-CG1 3.48Å; S225-I229 PolarHBondContact O-N 3.25Å; V226-I229 PolarHBondContact O-N 3.02Å; I229-G231 VanDerWaalsContact C-N 3.3Å; I229-G231 PolarHBondContact O-N 3.39Å; I229-L232 PolarHBondContact O-N 3.08Å; I229-I233 HydrophobicContact CG2-CD1 3.86Å; I229-I233 VanDerWaalsContact O-CG1 3.29Å; I229-I233 WeakPolarHBondContact O-CG1 3.43Å; I229-I233 PolarHBondContact O-N 2.9Å |
| 230 | I | 88.8 | Confident | 82.4 | Confident | 80 Ų | 80 | 47.1 Ų | 47.1 | 41% | 0.41 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.2 | -46.4 | 176.5 | -64.8 | 167.2 | 0 | 0 | 0 | 109.2 | L30 V226 L232 I233 L234 | L30-I230 HydrophobicContact CD1-CB 4.44Å; L30-I230 HydrophobicContact CD1-CG2 3.72Å; V226-I230 HydrophobicContact CG1-CD1 3.77Å; V226-I230 VanDerWaalsContact O-CG1 3.29Å; V226-I230 WeakPolarHBondContact O-CG1 3.44Å; V226-I230 PolarHBondContact O-N 2.98Å; I230-L232 PolarHBondContact O-N 3.43Å; I230-I233 PolarHBondContact O-N 3.33Å; I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CB 3.45Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.42Å; I230-L234 PolarHBondContact O-N 3.42Å |
| 231 | G | 86.7 | Confident | 79.9 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.7 | -43.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G27 T227 Q228 I229 L234 L235 | G27-G231 WeakPolarHBondContact CA-O 3.21Å; T227-G231 PolarHBondContact O-N 2.98Å; Q228-G231 PolarHBondContact O-N 2.91Å; I229-G231 VanDerWaalsContact C-N 3.3Å; I229-G231 PolarHBondContact O-N 3.39Å; G231-L234 PolarHBondContact O-N 3.21Å; G231-L235 VanDerWaalsContact O-CB 3.27Å; G231-L235 WeakPolarHBondContact O-CB 3.28Å; G231-L235 PolarHBondContact O-N 3.08Å |
| 232 | L | 86.4 | Confident | 77.6 | Confident | 48 Ų | 48 | 58.3 Ų | 58.3 | 25% | 0.251 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64 | -38.7 | 176.9 | -84.9 | 171.3 | 0 | 0 | 0 | 113.3 | L96 C100 Q228 I229 I230 L234 | L96-L232 HydrophobicContact CB-CD2 4.07Å; L96-L232 HydrophobicContact CD2-CD2 3.59Å; L96-L232 HydrophobicContact CG-CD2 3.49Å; L96-L232 VanDerWaalsContact CG-CD2 3.49Å; C100-L232 HydrophobicContact CB-CD1 3.8Å; Q228-L232 WeakPolarHBondContact O-CB 3.48Å; Q228-L232 WeakPolarHBondContact O-CG 3.3Å; Q228-L232 PolarHBondContact O-N 3.5Å; I229-L232 PolarHBondContact O-N 3.08Å; I230-L232 PolarHBondContact O-N 3.43Å; L232-L234 VanDerWaalsContact C-N 3.35Å |
| 233 | I | 85.6 | Confident | 75.3 | Confident | 110 Ų | 110 | 61.5 Ų | 61.5 | 56% | 0.564 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -69.5 | -38.6 | 178.7 | -69 | 166.2 | 0 | 0 | 0 | 110.5 | I229 I230 | I229-I233 HydrophobicContact CG2-CD1 3.86Å; I229-I233 VanDerWaalsContact O-CG1 3.29Å; I229-I233 WeakPolarHBondContact O-CG1 3.43Å; I229-I233 PolarHBondContact O-N 2.9Å; I230-I233 PolarHBondContact O-N 3.33Å |
| 234 | L | 87.4 | Confident | 73.1 | Confident | 36 Ų | 36 | 67.3 Ų | 67.3 | 19% | 0.188 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -76.4 | -37.3 | -179.7 | -70.6 | -180 | 0 | 0 | 0 | 112.7 | F23 S24 L26 L30 I230 G231 L232 R236 | F23-L234 HydrophobicContact CB-CD2 4.21Å; F23-L234 HydrophobicContact CD1-CD2 3.77Å; F23-L234 HydrophobicContact CG-CD2 4.27Å; F23-L234 WeakPolarHBondContact O-CB 3.3Å; S24-L234 WeakPolarHBondContact CA-O 3.35Å; L26-L234 HydrophobicContact CD2-CD1 4.15Å; L26-L234 HydrophobicContact CG-CD1 4.22Å; L30-L234 HydrophobicContact CD1-CD1 4.02Å; I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CB 3.45Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.42Å; I230-L234 PolarHBondContact O-N 3.42Å; G231-L234 PolarHBondContact O-N 3.21Å; L232-L234 VanDerWaalsContact C-N 3.35Å; L234-R236 PolarHBondContact O-N 3.15Å; L234-R236 VanDerWaalsContact O-N 3.1Å |
| 235 | L | 84.9 | Confident | 70.8 | Confident | 4 Ų | 4 | 72 Ų | 72 | 2% | 0.021 | 36% | 0.359 | C | S | . | . | trans | -70 | 107.4 | 180 | -168.4 | 81.7 | 0 | 0 | 0 | 110.6 | S24 I31 L96 T152 V155 G231 | S24-L235 VanDerWaalsContact O-CD1 3.31Å; S24-L235 WeakPolarHBondContact O-CD1 3.26Å; I31-L235 HydrophobicContact CD1-CB 4.48Å; I31-L235 HydrophobicContact CD1-CD2 4.3Å; L96-L235 HydrophobicContact CD2-CD2 3.2Å; T152-L235 HydrophobicContact CG2-CD1 4.46Å; T152-L235 HydrophobicContact CG2-CD2 4.25Å; V155-L235 HydrophobicContact CB-CD1 4.46Å; V155-L235 HydrophobicContact CB-CD2 4.24Å; V155-L235 HydrophobicContact CB-CG 4.48Å; V155-L235 HydrophobicContact CG1-CD1 4.01Å; V155-L235 HydrophobicContact CG1-CD2 4.04Å; V155-L235 HydrophobicContact CG1-CG 3.84Å; G231-L235 VanDerWaalsContact O-CB 3.27Å; G231-L235 WeakPolarHBondContact O-CB 3.28Å; G231-L235 PolarHBondContact O-N 3.08Å | ||
| 236 | R | 80.2 | Confident | 68.8 | Low | 154 Ų | 154 | 79.1 Ų | 79.1 | 58% | 0.581 | 40% | 0.396 | S | S | * | . | trans | -120.3 | 146.1 | 174.1 | -63.4 | -177.2 | -178.8 | -167.8 | 0 | 109 | S24 W159 L234 | S24-R236 WeakPolarHBondContact CB-O 3.31Å; S24-R236 PolarHBondContact OG-N 3.39Å; S24-R236 PolarHBondContact OG-O 3.28Å; W159-R236 HydrophobicContact CZ2-CB 4.43Å; W159-R236 PolarHBondContact NE1-O 3.44Å; L234-R236 PolarHBondContact O-N 3.15Å; L234-R236 VanDerWaalsContact O-N 3.1Å | ||
| 237 | S | 76.2 | Confident | 66 | Low | 17 Ų | 17 | 82.4 Ų | 82.4 | 12% | 0.119 | 41% | 0.405 | C | S | . | . | P | Polyproline II helix | trans | -74.4 | 147.8 | 167.3 | 54.9 | 0 | 0 | 0 | 0 | 110.4 | Y92 | Y92-S237 WeakPolarHBondContact CE1-OG 3.31Å; Y92-S237 WeakPolarHBondContact OH-CB 3.47Å; Y92-S237 PolarHBondContact OH-N 3.49Å; Y92-S237 PolarHBondContact OH-OG 3.47Å |
| 238 | K | 73.1 | Confident | 63.4 | Low | 90 Ų | 90 | 86.9 Ų | 86.9 | 39% | 0.391 | 43% | 0.427 | S | S | . | . | P | Polyproline II helix | trans | -63.8 | 128.7 | 167.4 | -172.5 | 177.3 | -177.3 | 171.8 | 0 | 108.4 | W159 K240 | W159-K238 HydrophobicContact CD2-CB 3.87Å; W159-K238 HydrophobicContact CD2-CG 4.32Å; W159-K238 HydrophobicContact CE3-CB 4.15Å; W159-K238 HydrophobicContact CE3-CD 4.45Å; W159-K238 HydrophobicContact CE3-CG 4.09Å; W159-K238 HydrophobicContact CG-CB 4.27Å; W159-K238 HydrophobicContact CZ2-CB 4.31Å; W159-K238 HydrophobicContact CZ3-CG 4.27Å; K238-K240 PolarHBondContact O-N 3.25Å |
| 239 | P | 62.1 | Low | 61.1 | Low | 65 Ų | 65 | 92.2 Ų | 92.2 | 42% | 0.422 | 45% | 0.452 | S | S | . | . | P | Polyproline II helix | trans | -64.5 | 126.2 | 171 | 25.7 | -30.7 | 0 | 0 | 0 | 108.6 | I248 | P239-I248 HydrophobicContact CB-CG2 4.24Š|
| 240 | K | 55.2 | Low | 59 | Low | 106 Ų | 106 | 95.2 Ų | 95.2 | 46% | 0.461 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85 | 130.1 | 167.1 | -74.6 | -173.5 | 175 | -177.5 | 0 | 107.7 | K238 L251 | K238-K240 PolarHBondContact O-N 3.25Å; K240-L251 HydrophobicContact CD-CD2 4.12Å |
| 241 | W | 34.5 | Very low | 57 | Low | 186 Ų | 186 | 93.5 Ų | 93.5 | 71% | 0.705 | 46% | 0.458 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -88 | 113.7 | 167.4 | -82.1 | 82.5 | 0 | 0 | 0 | 107.6 | ||
| 242 | N | 35.2 | Very low | 54.5 | Low | 51 Ų | 51 | 98.6 Ų | 98.6 | 27% | 0.273 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 113.5 | 164.1 | -79.7 | -1.1 | 0 | 0 | 0 | 107.6 | E244 E249 | N242-E244 PolarHBondContact O-N 2.9Å; N242-E249 PolarHBondContact ND2-OE2 3.42Å |
| 243 | C | 36.3 | Very low | 52.5 | Low | 130 Ų | 130 | 98.9 Ų | 98.9 | 88% | 0.878 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | -9.6 | 175.5 | -66 | 0 | 0 | 0 | 0 | 113.3 | ||
| 244 | E | 42.1 | Very low | 49.9 | Very low | 181 Ų | 181 | 99.1 Ų | 99.1 | 85% | 0.846 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -13.3 | -174.6 | -70.5 | 178.2 | 140.6 | 0 | 0 | 114.1 | N242 | N242-E244 PolarHBondContact O-N 2.9Š|
| 245 | D | 40.7 | Very low | 47.5 | Very low | 102 Ų | 102 | 99.8 Ų | 99.8 | 55% | 0.545 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -139.3 | 2 | -172 | -86.4 | -43.9 | 0 | 0 | 0 | 116.6 | K247 | D245-K247 HydrophobicContact CB-CB 4.34Å; D245-K247 HydrophobicContact CB-CD 4.45Å; D245-K247 WeakPolarHBondContact O-CG 3.19Å; D245-K247 PolarHBondContact O-N 3.29Å |
| 246 | D | 39 | Very low | 45.3 | Very low | 153 Ų | 153 | 101.8 Ų | 101.8 | 82% | 0.818 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.1 | 30.8 | -174.8 | -102.8 | -9.1 | 0 | 0 | 0 | 113.1 | ||
| 247 | K | 29.4 | Very low | 43.4 | Very low | 140 Ų | 140 | 96.6 Ų | 96.6 | 61% | 0.609 | 52% | 0.517 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 137.7 | -177.8 | -75.9 | 172.2 | -170.9 | 170.1 | 0 | 111.1 | D245 E249 | D245-K247 HydrophobicContact CB-CB 4.34Å; D245-K247 HydrophobicContact CB-CD 4.45Å; D245-K247 WeakPolarHBondContact O-CG 3.19Å; D245-K247 PolarHBondContact O-N 3.29Å; K247-E249 PolarHBondContact O-N 2.95Å |
| 248 | I | 33.4 | Very low | 41.5 | Very low | 118 Ų | 118 | 101.9 Ų | 101.9 | 61% | 0.605 | 54% | 0.543 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 101.6 | 173.5 | -59.5 | 169.6 | 0 | 0 | 0 | 107.8 | P239 | P239-I248 HydrophobicContact CB-CG2 4.24Å |
| 249 | E | 39.3 | Very low | 39.8 | Very low | 114 Ų | 114 | 101 Ų | 101 | 53% | 0.533 | 55% | 0.548 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 117.4 | 171.1 | -83.9 | -170.6 | 158.9 | 0 | 0 | 110.9 | N242 K247 | N242-E249 PolarHBondContact ND2-OE2 3.42Å; K247-E249 PolarHBondContact O-N 2.95Å |
| 250 | I | 42.1 | Very low | 38.9 | Very low | 114 Ų | 114 | 104.1 Ų | 104.1 | 59% | 0.585 | 56% | 0.557 | S | S | * | * | trans | -82.5 | 114.1 | 166.2 | -58.8 | 173.6 | 0 | 0 | 0 | 106.1 | Y92 D252 | Y92-I250 HydrophobicContact CE1-CG2 4.45Å; I250-D252 PolarHBondContact O-N 2.74Å | ||
| 251 | L | 46.1 | Very low | 38.3 | Very low | 44 Ų | 44 | 104.6 Ų | 104.6 | 23% | 0.23 | 56% | 0.563 | C | S | . | * | trans | -25.3 | 99.6 | -179.9 | -66.9 | 166 | 0 | 0 | 0 | 115.2 | T158 K240 | T158-L251 HydrophobicContact CG2-CD1 4.49Å; K240-L251 HydrophobicContact CD-CD2 4.12Å | ||
| 252 | D | 34.4 | Very low | 38.6 | Very low | 108 Ų | 108 | 101.7 Ų | 101.7 | 58% | 0.578 | 56% | 0.559 | S | S | * | * | trans | -110 | 89.6 | 142.2 | -98.8 | -13.6 | 0 | 0 | 0 | 105.9 | I250 S254 | I250-D252 PolarHBondContact O-N 2.74Å; D252-S254 VanDerWaalsContact C-N 3.26Å; D252-S254 PolarHBondContact O-N 3Å | ||
| 253 | D | 44.9 | Very low | 39.3 | Very low | 53 Ų | 53 | 104 Ų | 104 | 28% | 0.283 | 57% | 0.571 | S | S | . | * | trans | -81.7 | 75.7 | 178.5 | -169.8 | 13.7 | 0 | 0 | 0 | 109.9 | G255 S256 | D253-G255 PolarHBondContact O-N 2.96Å; D253-S256 VanDerWaalsContact OD1-CB 3.31Å; D253-S256 WeakPolarHBondContact OD1-CB 3.3Å; D253-S256 PolarHBondContact OD1-N 2.94Å; D253-S256 PolarHBondContact OD1-OG 3.46Å; D253-S256 PolarHBondContact OD2-OG 3.31Å | ||
| 254 | S | 31.4 | Very low | 40.2 | Very low | 115 Ų | 115 | 102.4 Ų | 102.4 | 80% | 0.804 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -86.6 | 88.1 | 158 | 58 | 0 | 0 | 0 | 0 | 109 | D252 | D252-S254 VanDerWaalsContact C-N 3.26Å; D252-S254 PolarHBondContact O-N 3Å |
| 255 | G | 36.4 | Very low | 40.9 | Very low | 51 Ų | 51 | 97.2 Ų | 97.2 | 53% | 0.526 | 54% | 0.535 | S | S | . | . | S | Bend | trans | 118.3 | 3.4 | 154.8 | 0 | 0 | 0 | 0 | 0 | 118.9 | D253 | D253-G255 PolarHBondContact O-N 2.96Š|
| 256 | S | 40.2 | Very low | 41.4 | Very low | 45 Ų | 45 | 94.6 Ų | 94.6 | 32% | 0.315 | 52% | 0.524 | S | S | . | . | trans | -87 | -15.3 | -175.6 | 73.1 | 0 | 0 | 0 | 0 | 115.4 | D253 D258 C259 E260 | D253-S256 VanDerWaalsContact OD1-CB 3.31Å; D253-S256 WeakPolarHBondContact OD1-CB 3.3Å; D253-S256 PolarHBondContact OD1-N 2.94Å; D253-S256 PolarHBondContact OD1-OG 3.46Å; D253-S256 PolarHBondContact OD2-OG 3.31Å; S256-D258 PolarHBondContact O-N 3.05Å; S256-C259 PolarHBondContact O-N 2.9Å; S256-E260 PolarHBondContact O-N 3.38Å | ||
| 257 | S | 40.1 | Very low | 42.6 | Very low | 46 Ų | 46 | 93.6 Ų | 93.6 | 32% | 0.322 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.6 | -24.2 | 178.1 | -41.1 | 0 | 0 | 0 | 0 | 113.7 | I261 | S257-I261 WeakPolarHBondContact O-CD1 3.46Å; S257-I261 WeakPolarHBondContact O-CG1 3.32Å |
| 258 | D | 36.5 | Very low | 44.1 | Very low | 127 Ų | 127 | 91.3 Ų | 91.3 | 68% | 0.679 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -85.2 | -20.6 | 178.3 | -65 | -29.3 | 0 | 0 | 0 | 112.1 | S256 M262 | S256-D258 PolarHBondContact O-N 3.05Å; D258-M262 WeakPolarHBondContact O-CB 3.46Å; D258-M262 PolarHBondContact O-N 3.32Å |
| 259 | C | 36.3 | Very low | 45.4 | Very low | 73 Ų | 73 | 91 Ų | 91 | 49% | 0.493 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -81.7 | -42.7 | 176.5 | -87.8 | 0 | 0 | 0 | 0 | 113.2 | S256 I261 M262 D263 | S256-C259 PolarHBondContact O-N 2.9Å; C259-I261 PolarHBondContact O-N 3.24Å; C259-M262 PolarHBondContact O-N 2.95Å; C259-D263 PolarHBondContact O-N 3.49Å |
| 260 | E | 43.4 | Very low | 46.5 | Very low | 130 Ų | 130 | 92.2 Ų | 92.2 | 61% | 0.607 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.6 | -36.7 | 179.7 | -91.8 | -175.5 | 148.8 | 0 | 0 | 112.3 | S256 D264 | S256-E260 PolarHBondContact O-N 3.38Å; E260-D264 PolarHBondContact O-N 3.26Å; E260-D264 VanDerWaalsContact O-N 3.14Å |
| 261 | I | 41.8 | Very low | 47 | Very low | 116 Ų | 116 | 92.8 Ų | 92.8 | 60% | 0.595 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -70.1 | -36.9 | 175.5 | -62.7 | 174 | 0 | 0 | 0 | 110.5 | S257 C259 V265 | S257-I261 WeakPolarHBondContact O-CD1 3.46Å; S257-I261 WeakPolarHBondContact O-CG1 3.32Å; C259-I261 PolarHBondContact O-N 3.24Å; I261-V265 HydrophobicContact CG2-CG2 4.42Å; I261-V265 WeakPolarHBondContact O-CB 3.44Å; I261-V265 WeakPolarHBondContact O-CG2 3.34Å; I261-V265 PolarHBondContact O-N 2.99Å |
| 262 | M | 40.9 | Very low | 47.4 | Very low | 125 Ų | 125 | 98.1 Ų | 98.1 | 62% | 0.616 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -71.8 | -32.9 | 179.1 | -165.6 | 167 | 65.5 | 0 | 0 | 112.4 | D258 C259 S266 | D258-M262 WeakPolarHBondContact O-CB 3.46Å; D258-M262 PolarHBondContact O-N 3.32Å; C259-M262 PolarHBondContact O-N 2.95Å; M262-S266 WeakPolarHBondContact O-CB 3.36Å; M262-S266 PolarHBondContact O-N 3.43Å |
| 263 | D | 50.6 | Low | 48.5 | Very low | 99 Ų | 99 | 101.5 Ų | 101.5 | 53% | 0.529 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -71.5 | -39.4 | 174.6 | -87.2 | -17.5 | 0 | 0 | 0 | 113 | C259 S266 K267 | C259-D263 PolarHBondContact O-N 3.49Å; D263-S266 PolarHBondContact O-N 3.01Å; D263-K267 WeakPolarHBondContact O-CB 3.48Å; D263-K267 WeakPolarHBondContact O-CG 3.39Å; D263-K267 PolarHBondContact O-N 2.71Å |
| 264 | D | 55.6 | Low | 48.6 | Very low | 96 Ų | 96 | 103.9 Ų | 103.9 | 51% | 0.513 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.8 | -39.7 | 174.6 | -86.7 | -15.2 | 0 | 0 | 0 | 111.7 | E260 S266 K267 I268 | E260-D264 PolarHBondContact O-N 3.26Å; E260-D264 VanDerWaalsContact O-N 3.14Å; D264-S266 VanDerWaalsContact C-N 3.33Å; D264-S266 PolarHBondContact O-N 3.11Å; D264-K267 PolarHBondContact O-N 3.21Å; D264-I268 WeakPolarHBondContact O-CB 3.4Å; D264-I268 VanDerWaalsContact O-CG1 3.23Å; D264-I268 WeakPolarHBondContact O-CG1 3.24Å; D264-I268 PolarHBondContact O-N 2.64Å |
| 265 | V | 55.4 | Low | 49.5 | Very low | 73 Ų | 73 | 103.1 Ų | 103.1 | 44% | 0.442 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.6 | -39.7 | 172.6 | 172.7 | 0 | 0 | 0 | 0 | 111 | I261 I268 L269 | I261-V265 HydrophobicContact CG2-CG2 4.42Å; I261-V265 WeakPolarHBondContact O-CB 3.44Å; I261-V265 WeakPolarHBondContact O-CG2 3.34Å; I261-V265 PolarHBondContact O-N 2.99Å; V265-I268 PolarHBondContact O-N 3.31Å; V265-L269 HydrophobicContact CG1-CD1 3.86Å; V265-L269 HydrophobicContact CG1-CG 4.41Å; V265-L269 WeakPolarHBondContact O-CB 3.13Å; V265-L269 VanDerWaalsContact O-CG 3.28Å; V265-L269 WeakPolarHBondContact O-CG 3.5Å; V265-L269 PolarHBondContact O-N 3.13Å |
| 266 | S | 52.8 | Low | 50.2 | Low | 46 Ų | 46 | 103.5 Ų | 103.5 | 32% | 0.322 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.1 | -40.7 | 176.1 | -172.7 | 0 | 0 | 0 | 0 | 112.5 | M262 D263 D264 L269 K270 | M262-S266 WeakPolarHBondContact O-CB 3.36Å; M262-S266 PolarHBondContact O-N 3.43Å; D263-S266 PolarHBondContact O-N 3.01Å; D264-S266 VanDerWaalsContact C-N 3.33Å; D264-S266 PolarHBondContact O-N 3.11Å; S266-L269 PolarHBondContact O-N 3.24Å; S266-K270 WeakPolarHBondContact O-CB 3.48Å; S266-K270 VanDerWaalsContact O-CG 3.32Å; S266-K270 WeakPolarHBondContact O-CG 3.22Å; S266-K270 PolarHBondContact O-N 2.78Å |
| 267 | K | 63.8 | Low | 50.5 | Low | 133 Ų | 133 | 109.3 Ų | 109.3 | 58% | 0.578 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.4 | -43.3 | 173.2 | -79.2 | 175.3 | -175.9 | 166.2 | 0 | 112 | D263 D264 K270 L271 | D263-K267 WeakPolarHBondContact O-CB 3.48Å; D263-K267 WeakPolarHBondContact O-CG 3.39Å; D263-K267 PolarHBondContact O-N 2.71Å; D264-K267 PolarHBondContact O-N 3.21Å; K267-K270 PolarHBondContact O-N 2.92Å; K267-L271 WeakPolarHBondContact O-CG 3.34Å; K267-L271 PolarHBondContact O-N 3.12Å |
| 268 | I | 61.1 | Low | 50.7 | Low | 92 Ų | 92 | 114.5 Ų | 114.5 | 47% | 0.472 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -62.6 | -46 | 176 | -69.8 | 167.2 | 0 | 0 | 0 | 110.4 | D264 V265 K270 L271 F272 | D264-I268 WeakPolarHBondContact O-CB 3.4Å; D264-I268 VanDerWaalsContact O-CG1 3.23Å; D264-I268 WeakPolarHBondContact O-CG1 3.24Å; D264-I268 PolarHBondContact O-N 2.64Å; V265-I268 PolarHBondContact O-N 3.31Å; I268-K270 VanDerWaalsContact C-N 3.32Å; I268-K270 PolarHBondContact O-N 2.89Å; I268-L271 PolarHBondContact O-N 2.75Å; I268-F272 HydrophobicContact CG2-CD2 3.84Å; I268-F272 HydrophobicContact CG2-CE2 3.89Å; I268-F272 WeakPolarHBondContact O-CD2 3.27Å; I268-F272 PolarHBondContact O-N 3.5Å |
| 269 | L | 59.9 | Low | 50.8 | Low | 110 Ų | 110 | 118.2 Ų | 118.2 | 58% | 0.576 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -62.2 | -37.6 | 177 | -76.7 | 167.3 | 0 | 0 | 0 | 112.5 | V265 S266 F272 K273 | V265-L269 HydrophobicContact CG1-CD1 3.86Å; V265-L269 HydrophobicContact CG1-CG 4.41Å; V265-L269 WeakPolarHBondContact O-CB 3.13Å; V265-L269 VanDerWaalsContact O-CG 3.28Å; V265-L269 WeakPolarHBondContact O-CG 3.5Å; V265-L269 PolarHBondContact O-N 3.13Å; S266-L269 PolarHBondContact O-N 3.24Å; L269-F272 PolarHBondContact O-N 2.85Å; L269-K273 PolarHBondContact O-N 2.75Å |
| 270 | K | 62.1 | Low | 51.6 | Low | 141 Ų | 141 | 120.5 Ų | 120.5 | 61% | 0.613 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -66.2 | -39.6 | 173.8 | -76.5 | 175.8 | -177.8 | 176.9 | 0 | 112.2 | S266 K267 I268 K273 C274 | S266-K270 WeakPolarHBondContact O-CB 3.48Å; S266-K270 VanDerWaalsContact O-CG 3.32Å; S266-K270 WeakPolarHBondContact O-CG 3.22Å; S266-K270 PolarHBondContact O-N 2.78Å; K267-K270 PolarHBondContact O-N 2.92Å; I268-K270 VanDerWaalsContact C-N 3.32Å; I268-K270 PolarHBondContact O-N 2.89Å; K270-K273 PolarHBondContact O-N 3.47Å; K270-C274 PolarHBondContact O-N 2.96Å |
| 271 | L | 52.8 | Low | 52 | Low | 126 Ų | 126 | 120 Ų | 120 | 66% | 0.66 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -64 | -41.3 | 175 | -73.5 | 168.2 | 0 | 0 | 0 | 112 | K267 I268 C274 S275 | K267-L271 WeakPolarHBondContact O-CG 3.34Å; K267-L271 PolarHBondContact O-N 3.12Å; I268-L271 PolarHBondContact O-N 2.75Å; L271-C274 PolarHBondContact O-N 3.49Å; L271-S275 WeakPolarHBondContact O-CB 3.43Å; L271-S275 PolarHBondContact O-N 3.11Å |
| 272 | F | 55.6 | Low | 52.6 | Low | 156 Ų | 156 | 120.2 Ų | 120.2 | 68% | 0.684 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -66 | -37.2 | 174.5 | -88.7 | -79.9 | 0 | 0 | 0 | 112.9 | I268 L269 G276 | I268-F272 HydrophobicContact CG2-CD2 3.84Å; I268-F272 HydrophobicContact CG2-CE2 3.89Å; I268-F272 WeakPolarHBondContact O-CD2 3.27Å; I268-F272 PolarHBondContact O-N 3.5Å; L269-F272 PolarHBondContact O-N 2.85Å; F272-G276 PolarHBondContact O-N 3.23Å |
| 273 | K | 58 | Low | 53.3 | Low | 178 Ų | 178 | 119.9 Ų | 119.9 | 77% | 0.774 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -69.5 | -34.8 | 176.2 | -113.5 | 176.4 | 177.6 | 178.2 | 0 | 113.4 | L269 K270 | L269-K273 PolarHBondContact O-N 2.75Å; K270-K273 PolarHBondContact O-N 3.47Å |
| 274 | C | 46.4 | Very low | 53.4 | Low | 103 Ų | 103 | 121.3 Ų | 121.3 | 70% | 0.696 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -78.9 | -26.6 | 177.6 | -74.7 | 0 | 0 | 0 | 0 | 113.3 | K270 L271 | K270-C274 PolarHBondContact O-N 2.96Å; L271-C274 PolarHBondContact O-N 3.49Å |
| 275 | S | 50.9 | Low | 53.3 | Low | 100 Ų | 100 | 122.9 Ų | 122.9 | 70% | 0.699 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -83 | -12.7 | 178.6 | -161.4 | 0 | 0 | 0 | 0 | 114 | L271 | L271-S275 WeakPolarHBondContact O-CB 3.43Å; L271-S275 PolarHBondContact O-N 3.11Å |
| 276 | G | 49.6 | Very low | 53.1 | Low | 58 Ų | 58 | 126.5 Ų | 126.5 | 60% | 0.598 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | 8.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | F272 | F272-G276 PolarHBondContact O-N 3.23Š|
| 277 | H | 47.9 | Very low | 53.1 | Low | 167 Ų | 167 | 132.7 Ų | 132.7 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -120.3 | 10.5 | -174.8 | -134.1 | -28.6 | 0 | 0 | 0 | 115.1 | ||
| 278 | N | 42.9 | Very low | 52.3 | Low | 156 Ų | 156 | 132.7 Ų | 132.7 | 83% | 0.834 | 72% | 0.72 | S | S | * | * | trans | -121.3 | 30.8 | -177.9 | -88.7 | -7.5 | 0 | 0 | 0 | 114.3 | ||||
| 279 | T | 40.1 | Very low | 51.5 | Low | 205 Ų | 205 | 136.4 Ų | 136.4 | 100% | 1.258 | 74% | 0.742 | S | S | * | * | trans | -132.5 | 0 | 167.3 | 46.7 | 0 | 0 | 0 | 0 | 110.3 |
Retrieved 279 of 279 residues in 122.7 ms
(Link to these results)